data_7182
#######################
# Entry information #
#######################
save_entry_information
_Saveframe_category entry_information
_Entry_title
;
NMR Structure of YcgL, a Conserved Protein from Escherichia coli Representing the DUF709 Family with a Novel a/b/a Sandwich Fold
;
_BMRB_accession_number 7182
_BMRB_flat_file_name bmr7182.str
_Entry_type original
_Submission_date 2006-06-21
_Accession_date 2006-07-14
_Entry_origination author
_NMR_STAR_version 2.1.1
_Experimental_method NMR
_Details .
loop_
_Author_ordinal
_Author_family_name
_Author_given_name
_Author_middle_initials
_Author_family_title
1 Minailiuc O. M. .
2 Vavelyuk O. . .
3 Ekiel I. . .
4 Hung M.-Ni. . .
5 Cygler M. . .
6 Gandhi S. . .
stop_
loop_
_Saveframe_category_type
_Saveframe_category_type_count
assigned_chemical_shifts 1
stop_
loop_
_Data_type
_Data_type_count
"1H chemical shifts" 504
"13C chemical shifts" 422
"15N chemical shifts" 99
stop_
loop_
_Revision_date
_Revision_keyword
_Revision_author
_Revision_detail
2007-03-05 original author .
stop_
_Original_release_date 2007-03-05
save_
#############################
# Citation for this entry #
#############################
save_entry_citation
_Saveframe_category entry_citation
_Citation_full .
_Citation_title 'NMR structure of YcgL, a conserved protein from Escherichia coli representing the DUF709 family, with a novel alpha/beta/alpha sandwich fold'
_Citation_status published
_Citation_type journal
_CAS_abstract_code .
_MEDLINE_UI_code .
_PubMed_ID 17221885
loop_
_Author_ordinal
_Author_family_name
_Author_given_name
_Author_middle_initials
_Author_family_title
1 Minailiuc O. M. .
2 Vavelyuk O. . .
3 Gandhi S. . .
4 Hung M-N . .
5 Cygler M. . .
6 Ekiel I. . .
stop_
_Journal_abbreviation Proteins
_Journal_volume 66
_Journal_issue 4
_Journal_CSD .
_Book_chapter_title .
_Book_volume .
_Book_series .
_Book_ISBN .
_Conference_state_province .
_Conference_abstract_number .
_Page_first 1004
_Page_last 1007
_Year 2007
_Details .
loop_
_Keyword
'3-layer (alpha/beta/alpha) sandwich'
'beta-Sheet Layer Antiparallel 3124 topology'
BSGI
'Mixed ALPHA/BETA/ALPHA Sandwich Structure'
'Montreal-Kingston Bacterial Structural Genomics Initiative'
'Structural Genomics'
stop_
save_
##################################
# Molecular system description #
##################################
save_system
_Saveframe_category molecular_system
_Mol_system_name 'Hypothetical protein ycgL'
_Abbreviation_common 'Hypothetical protein ycgL'
_Enzyme_commission_number .
loop_
_Mol_system_component_name
_Mol_label
'Hypothetical protein ycgL' $ycgL
stop_
_System_molecular_weight .
_System_physical_state native
_System_oligomer_state monomer
_System_paramagnetic no
_System_thiol_state 'all free'
_Database_query_date .
_Details .
save_
########################
# Monomeric polymers #
########################
save_ycgL
_Saveframe_category monomeric_polymer
_Mol_type polymer
_Mol_polymer_class protein
_Name_common 'Hypothetical protein ycgL'
_Abbreviation_common 'Hypothetical protein ycgL'
_Molecular_mass .
_Mol_thiol_state 'all free'
_Details .
##############################
# Polymer residue sequence #
##############################
_Residue_count 110
_Mol_residue_sequence
;
GSMPKPGILKSKSMFCVIYR
SSKRDQTYLYVEKKDDFSRV
PEELMKGFGQPQLAMILPLD
GRKKLVNADIEKVKQALTEQ
GYYLQLPPPPEDLLKQHLSV
MGQKTDDTNK
;
loop_
_Residue_seq_code
_Residue_label
1 GLY 2 SER 3 MET 4 PRO 5 LYS
6 PRO 7 GLY 8 ILE 9 LEU 10 LYS
11 SER 12 LYS 13 SER 14 MET 15 PHE
16 CYS 17 VAL 18 ILE 19 TYR 20 ARG
21 SER 22 SER 23 LYS 24 ARG 25 ASP
26 GLN 27 THR 28 TYR 29 LEU 30 TYR
31 VAL 32 GLU 33 LYS 34 LYS 35 ASP
36 ASP 37 PHE 38 SER 39 ARG 40 VAL
41 PRO 42 GLU 43 GLU 44 LEU 45 MET
46 LYS 47 GLY 48 PHE 49 GLY 50 GLN
51 PRO 52 GLN 53 LEU 54 ALA 55 MET
56 ILE 57 LEU 58 PRO 59 LEU 60 ASP
61 GLY 62 ARG 63 LYS 64 LYS 65 LEU
66 VAL 67 ASN 68 ALA 69 ASP 70 ILE
71 GLU 72 LYS 73 VAL 74 LYS 75 GLN
76 ALA 77 LEU 78 THR 79 GLU 80 GLN
81 GLY 82 TYR 83 TYR 84 LEU 85 GLN
86 LEU 87 PRO 88 PRO 89 PRO 90 PRO
91 GLU 92 ASP 93 LEU 94 LEU 95 LYS
96 GLN 97 HIS 98 LEU 99 SER 100 VAL
101 MET 102 GLY 103 GLN 104 LYS 105 THR
106 ASP 107 ASP 108 THR 109 ASN 110 LYS
stop_
_Sequence_homology_query_date .
_Sequence_homology_query_revised_last_date 2015-01-28
loop_
_Database_name
_Database_accession_code
_Database_entry_mol_name
_Sequence_query_to_submitted_percentage
_Sequence_subject_length
_Sequence_identity
_Sequence_positive
_Sequence_homology_expectation_value
PDB 2H7A "Nmr Structure Of The Conserved Protein Ycgl From Escherichia Coli Representing The Duf709 Family Reveals A Novel ABA SANDWICH F" 100.00 110 100.00 100.00 9.27e-73
DBJ BAA36013 "conserved hypothetical protein [Escherichia coli str. K-12 substr. W3110]" 98.18 108 100.00 100.00 4.01e-71
DBJ BAB35097 "hypothetical protein [Escherichia coli O157:H7 str. Sakai]" 98.18 108 100.00 100.00 4.01e-71
DBJ BAG76750 "conserved hypothetical protein [Escherichia coli SE11]" 98.18 108 99.07 99.07 5.21e-70
DBJ BAI24991 "conserved predicted protein [Escherichia coli O26:H11 str. 11368]" 88.18 97 98.97 98.97 4.32e-62
DBJ BAI30116 "conserved predicted protein [Escherichia coli O103:H2 str. 12009]" 88.18 97 98.97 98.97 4.32e-62
EMBL CAP75714 "Uncharacterized protein ycgl [Escherichia coli LF82]" 98.18 108 100.00 100.00 4.01e-71
EMBL CAQ31681 "conserved protein [Escherichia coli BL21(DE3)]" 98.18 108 99.07 99.07 5.21e-70
EMBL CAQ98057 "conserved hypothetical protein [Escherichia coli IAI1]" 98.18 108 99.07 99.07 5.21e-70
EMBL CAR02568 "conserved hypothetical protein [Escherichia coli S88]" 98.18 108 100.00 100.00 4.01e-71
EMBL CAR07521 "conserved hypothetical protein [Escherichia coli ED1a]" 98.18 108 100.00 100.00 4.01e-71
GB AAC74263 "UPF0745 family protein [Escherichia coli str. K-12 substr. MG1655]" 88.18 97 100.00 100.00 3.26e-63
GB AAG56030 "orf, hypothetical protein [Escherichia coli O157:H7 str. EDL933]" 98.18 108 100.00 100.00 4.01e-71
GB AAN42784 "conserved hypothetical protein [Shigella flexneri 2a str. 301]" 98.18 108 99.07 99.07 5.21e-70
GB AAN80092 "Protein ycgL [Escherichia coli CFT073]" 98.18 108 100.00 100.00 4.01e-71
GB AAP16675 "hypothetical protein S1256 [Shigella flexneri 2a str. 2457T]" 98.18 108 98.15 98.15 1.87e-69
REF NP_287418 "hypothetical protein Z1941 [Escherichia coli O157:H7 str. EDL933]" 98.18 108 100.00 100.00 4.01e-71
REF NP_309701 "hypothetical protein ECs1674 [Escherichia coli O157:H7 str. Sakai]" 88.18 97 100.00 100.00 3.26e-63
REF NP_415697 "UPF0745 family protein [Escherichia coli str. K-12 substr. MG1655]" 88.18 97 100.00 100.00 3.26e-63
REF NP_707077 "hypothetical protein SF1168 [Shigella flexneri 2a str. 301]" 98.18 108 99.07 99.07 5.21e-70
REF NP_753532 "hypothetical protein c1627 [Escherichia coli CFT073]" 98.18 108 100.00 100.00 4.01e-71
SP A1AAA3 "RecName: Full=Protein YcgL [Escherichia coli APEC O1]" 98.18 108 100.00 100.00 4.01e-71
SP A7ZKV0 "RecName: Full=Protein YcgL [Escherichia coli E24377A]" 98.18 108 99.07 99.07 5.21e-70
SP A7ZZB3 "RecName: Full=Protein YcgL [Escherichia coli HS]" 98.18 108 99.07 99.07 5.21e-70
SP B1IUB2 "RecName: Full=Protein YcgL [Escherichia coli ATCC 8739]" 98.18 108 99.07 99.07 5.21e-70
SP B1LHY8 "RecName: Full=Protein YcgL [Escherichia coli SMS-3-5]" 98.18 108 100.00 100.00 4.01e-71
stop_
save_
####################
# Natural source #
####################
save_natural_source
_Saveframe_category natural_source
loop_
_Mol_label
_Organism_name_common
_NCBI_taxonomy_ID
_Superkingdom
_Kingdom
_Genus
_Species
$ycgL 'Escherichia coli' 562 Bacteria . Escherichia coli
stop_
save_
#########################
# Experimental source #
#########################
save_experimental_source
_Saveframe_category experimental_source
loop_
_Mol_label
_Production_method
_Host_organism_name_common
_Genus
_Species
_Strain
_Vector_name
$ycgL 'recombinant technology' . . . . .
stop_
save_
#####################################
# Sample contents and methodology #
#####################################
########################
# Sample description #
########################
save_sample_1
_Saveframe_category sample
_Sample_type solution
_Details .
loop_
_Mol_label
_Concentration_value
_Concentration_value_units
_Isotopic_labeling
$ycgL . mM .
'phosphate buffer' 50 mM .
DTT 15 mM .
'sodium azide' 0.02 '% (w/v)' .
D2O 10 % .
H2O 90 % .
stop_
save_
############################
# Computer software used #
############################
save_XWINNMR
_Saveframe_category software
_Name xwinnmr
_Version .
loop_
_Task
collection
stop_
_Details .
save_
save_NMRPipe
_Saveframe_category software
_Name NMRPipe
_Version .
loop_
_Task
processing
stop_
_Details 'Frank Delaglio'
save_
save_CARA
_Saveframe_category software
_Name CARA
_Version 135
loop_
_Task
'data analysis'
stop_
_Details 'Rochus Keller'
save_
save_XEASY
_Saveframe_category software
_Name XEASY
_Version .
loop_
_Task
'data analysis'
stop_
_Details .
save_
save_CYANA
_Saveframe_category software
_Name CYANA
_Version 2.1
loop_
_Task
'structure solution'
stop_
_Details 'Peter Guntert'
save_
save_XPLOR-NIH
_Saveframe_category software
_Name 'X-PLOR NIH'
_Version 2112
loop_
_Task
refinement
stop_
_Details .
save_
#########################
# Experimental detail #
#########################
##################################
# NMR Spectrometer definitions #
##################################
save_NMR_spectrometer
_Saveframe_category NMR_spectrometer
_Manufacturer Varian
_Model INOVA
_Field_strength 500
_Details .
save_
#############################
# NMR applied experiments #
#############################
save_2D_NOESY_1
_Saveframe_category NMR_applied_experiment
_Experiment_name '2D NOESY'
_Sample_label $sample_1
save_
save_3D_15N-separated_NOESY_2
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D 15N-separated NOESY'
_Sample_label $sample_1
save_
save_3D_13C-separated_NOESY_3
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D 13C-separated NOESY'
_Sample_label $sample_1
save_
save_2D_TOCSY_4
_Saveframe_category NMR_applied_experiment
_Experiment_name '2D TOCSY'
_Sample_label $sample_1
save_
save_HNHA_5
_Saveframe_category NMR_applied_experiment
_Experiment_name HNHA
_Sample_label $sample_1
save_
save_HNCACB_6
_Saveframe_category NMR_applied_experiment
_Experiment_name HNCACB
_Sample_label $sample_1
save_
save_CBCA(CO)NH_7
_Saveframe_category NMR_applied_experiment
_Experiment_name CBCA(CO)NH
_Sample_label $sample_1
save_
save_HN(CA)CO_8
_Saveframe_category NMR_applied_experiment
_Experiment_name HN(CA)CO
_Sample_label $sample_1
save_
save_HBHA(CO)NH_9
_Saveframe_category NMR_applied_experiment
_Experiment_name HBHA(CO)NH
_Sample_label $sample_1
save_
save_3D-HCCH-TOCSY_10
_Saveframe_category NMR_applied_experiment
_Experiment_name 3D-HCCH-TOCSY
_Sample_label $sample_1
save_
save_1H-15N_TOCSY-HMQC_11
_Saveframe_category NMR_applied_experiment
_Experiment_name '1H-15N TOCSY-HMQC'
_Sample_label $sample_1
save_
#######################
# Sample conditions #
#######################
save_sample_cond_1
_Saveframe_category sample_conditions
_Details .
loop_
_Variable_type
_Variable_value
_Variable_value_error
_Variable_value_units
'ionic strength' 150 . mM
pH 6.8 . pH
pressure 1 . atm
temperature 308 . K
stop_
save_
####################
# NMR parameters #
####################
##############################
# Assigned chemical shifts #
##############################
################################
# Chemical shift referencing #
################################
save_chemical_shift_reference
_Saveframe_category chemical_shift_reference
_Details .
loop_
_Mol_common_name
_Atom_type
_Atom_isotope_number
_Atom_group
_Chem_shift_units
_Chem_shift_value
_Reference_method
_Reference_type
_External_reference_sample_geometry
_External_reference_location
_External_reference_axis
_Indirect_shift_ratio_citation_label
_Correction_value_citation_label
. C 13 . ppm . . . . . . $entry_citation $entry_citation
. H 1 . ppm . . . . . . $entry_citation $entry_citation
. N 15 . ppm . . . . . . $entry_citation $entry_citation
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_chemical_shift_set_1
_Saveframe_category assigned_chemical_shifts
_Details .
loop_
_Sample_label
$sample_1
stop_
_Sample_conditions_label $sample_cond_1
_Chem_shift_reference_set_label $chemical_shift_reference
_Mol_system_component_name 'Hypothetical protein ycgL'
_Text_data_format .
_Text_data .
loop_
_Atom_shift_assign_ID
_Residue_author_seq_code
_Residue_seq_code
_Residue_label
_Atom_name
_Atom_type
_Chem_shift_value
_Chem_shift_value_error
_Chem_shift_ambiguity_code
1 . 4 PRO CD C 50.695 0.000 .
2 . 4 PRO CA C 63.429 0.000 .
3 . 4 PRO HA H 4.475 0.000 .
4 . 4 PRO CB C 31.909 0.000 .
5 . 4 PRO HB2 H 2.324 0.000 .
6 . 4 PRO HB3 H 1.946 0.000 .
7 . 4 PRO CG C 27.307 0.000 .
8 . 4 PRO HG2 H 2.060 0.000 .
9 . 4 PRO HD2 H 3.742 0.000 .
10 . 4 PRO HD3 H 3.857 0.000 .
11 . 5 LYS N N 121.793 0.000 .
12 . 5 LYS H H 8.211 0.000 .
13 . 5 LYS HA H 4.488 0.000 .
14 . 5 LYS HB2 H 1.734 0.000 .
15 . 5 LYS HG2 H 1.450 0.000 .
16 . 5 LYS HD2 H 1.736 0.000 .
17 . 5 LYS HE2 H 2.773 0.000 .
18 . 6 PRO CD C 50.835 0.000 .
19 . 6 PRO CA C 63.522 0.000 .
20 . 6 PRO HA H 4.475 0.000 .
21 . 6 PRO CB C 32.056 0.000 .
22 . 6 PRO HB2 H 2.330 0.000 .
23 . 6 PRO HB3 H 1.990 0.000 .
24 . 6 PRO CG C 27.283 0.000 .
25 . 6 PRO HG2 H 2.062 0.000 .
26 . 6 PRO HD2 H 3.717 0.000 .
27 . 6 PRO HD3 H 3.865 0.000 .
28 . 7 GLY N N 109.648 0.000 .
29 . 7 GLY H H 8.472 0.000 .
30 . 7 GLY CA C 45.235 0.000 .
31 . 7 GLY HA2 H 4.012 0.000 .
32 . 7 GLY HA3 H 3.959 0.000 .
33 . 7 GLY C C 171.439 0.000 .
34 . 8 ILE N N 120.531 0.000 .
35 . 8 ILE H H 7.928 0.000 .
36 . 8 ILE CA C 60.905 0.000 .
37 . 8 ILE HA H 4.216 0.000 .
38 . 8 ILE CB C 38.520 0.000 .
39 . 8 ILE HB H 1.921 0.000 .
40 . 8 ILE HG2 H 0.929 0.000 .
41 . 8 ILE CG2 C 17.365 0.000 .
42 . 8 ILE CG1 C 27.279 0.000 .
43 . 8 ILE HG12 H 1.229 0.000 .
44 . 8 ILE HG13 H 1.467 0.000 .
45 . 8 ILE HD1 H 0.889 0.000 .
46 . 8 ILE CD1 C 12.769 0.000 .
47 . 8 ILE C C 173.555 0.000 .
48 . 9 LEU N N 126.756 0.000 .
49 . 9 LEU H H 8.318 0.000 .
50 . 9 LEU CA C 55.010 0.000 .
51 . 9 LEU HA H 4.427 0.000 .
52 . 9 LEU CB C 42.238 0.000 .
53 . 9 LEU HB2 H 1.688 0.000 .
54 . 9 LEU HB3 H 1.639 0.000 .
55 . 9 LEU HD1 H 0.968 0.000 .
56 . 9 LEU HD2 H 0.913 0.000 .
57 . 9 LEU CD1 C 24.876 0.000 .
58 . 9 LEU CD2 C 23.195 0.000 .
59 . 9 LEU C C 174.451 0.000 .
60 . 10 LYS N N 123.489 0.000 .
61 . 10 LYS H H 8.310 0.000 .
62 . 10 LYS CA C 62.416 0.000 .
63 . 10 LYS HA H 4.511 0.000 .
64 . 12 LYS N N 123.335 0.000 .
65 . 12 LYS H H 8.326 0.000 .
66 . 12 LYS CA C 56.007 0.000 .
67 . 12 LYS HA H 4.397 0.000 .
68 . 12 LYS CB C 32.759 0.000 .
69 . 12 LYS HB2 H 1.860 0.000 .
70 . 12 LYS HB3 H 1.856 0.000 .
71 . 12 LYS HG2 H 1.501 0.000 .
72 . 12 LYS HG3 H 1.469 0.000 .
73 . 12 LYS HE2 H 3.053 0.000 .
74 . 13 SER N N 117.537 0.000 .
75 . 13 SER H H 8.287 0.000 .
76 . 13 SER CA C 58.117 0.000 .
77 . 13 SER HA H 4.464 0.000 .
78 . 13 SER CB C 63.484 0.000 .
79 . 13 SER HB2 H 3.840 0.000 .
80 . 14 MET N N 122.969 0.000 .
81 . 14 MET H H 8.490 0.000 .
82 . 14 MET CA C 55.262 0.000 .
83 . 14 MET HA H 4.623 0.000 .
84 . 14 MET CB C 33.933 0.000 .
85 . 14 MET HB2 H 1.999 0.000 .
86 . 14 MET CG C 32.249 0.000 .
87 . 14 MET HG2 H 2.602 0.000 .
88 . 14 MET HG3 H 2.503 0.000 .
89 . 14 MET C C 171.866 0.000 .
90 . 15 PHE N N 121.796 0.000 .
91 . 15 PHE H H 8.438 0.000 .
92 . 15 PHE CA C 56.632 0.000 .
93 . 15 PHE HA H 5.225 0.000 .
94 . 15 PHE CB C 42.260 0.000 .
95 . 15 PHE HB2 H 2.986 0.000 .
96 . 15 PHE HD1 H 7.109 0.000 .
97 . 15 PHE HE1 H 7.341 0.000 .
98 . 15 PHE CD1 C 132.431 0.000 .
99 . 15 PHE CE1 C 132.206 0.000 .
100 . 15 PHE CZ C 132.302 0.000 .
101 . 15 PHE HZ H 7.109 0.000 .
102 . 15 PHE CE2 C 132.206 0.000 .
103 . 15 PHE CD2 C 132.431 0.000 .
104 . 16 CYS N N 114.301 0.000 .
105 . 16 CYS H H 8.806 0.000 .
106 . 16 CYS CA C 55.961 0.000 .
107 . 16 CYS HA H 5.279 0.000 .
108 . 16 CYS CB C 31.407 0.000 .
109 . 16 CYS HB2 H 3.151 0.000 .
110 . 16 CYS HB3 H 2.808 0.000 .
111 . 16 CYS C C 168.486 0.000 .
112 . 17 VAL N N 122.003 0.000 .
113 . 17 VAL H H 8.998 0.000 .
114 . 17 VAL CA C 62.008 0.000 .
115 . 17 VAL HA H 4.499 0.000 .
116 . 17 VAL CB C 33.016 0.000 .
117 . 17 VAL HB H 1.873 0.000 .
118 . 17 VAL HG1 H 0.718 0.000 .
119 . 17 VAL HG2 H 0.820 0.000 .
120 . 17 VAL CG1 C 23.100 0.000 .
121 . 17 VAL CG2 C 21.006 0.000 .
122 . 17 VAL C C 171.230 0.000 .
123 . 18 ILE N N 124.820 0.000 .
124 . 18 ILE H H 8.752 0.000 .
125 . 18 ILE CA C 60.921 0.000 .
126 . 18 ILE HA H 4.767 0.000 .
127 . 18 ILE CB C 39.161 0.000 .
128 . 18 ILE HB H 1.541 0.000 .
129 . 18 ILE HG2 H 0.518 0.000 .
130 . 18 ILE CG2 C 17.662 0.000 .
131 . 18 ILE CG1 C 26.918 0.000 .
132 . 18 ILE HG12 H 1.262 0.000 .
133 . 18 ILE HG13 H 0.169 0.000 .
134 . 18 ILE HD1 H 0.536 0.000 .
135 . 18 ILE CD1 C 15.039 0.000 .
136 . 18 ILE C C 172.672 0.000 .
137 . 19 TYR N N 126.689 0.000 .
138 . 19 TYR H H 9.981 0.000 .
139 . 19 TYR CA C 57.351 0.000 .
140 . 19 TYR HA H 5.206 0.000 .
141 . 19 TYR CB C 42.013 0.000 .
142 . 19 TYR HB2 H 3.129 0.000 .
143 . 19 TYR HB3 H 3.058 0.000 .
144 . 19 TYR HD2 H 7.065 0.000 .
145 . 19 TYR HE1 H 6.832 0.000 .
146 . 19 TYR CD1 C 133.065 0.000 .
147 . 19 TYR CE1 C 118.744 0.000 .
148 . 19 TYR CE2 C 118.744 0.000 .
149 . 19 TYR CD2 C 133.065 0.000 .
150 . 19 TYR C C 172.834 0.000 .
151 . 20 ARG N N 122.224 0.000 .
152 . 20 ARG H H 9.943 0.000 .
153 . 20 ARG CA C 54.124 0.000 .
154 . 20 ARG HA H 5.075 0.000 .
155 . 20 ARG CB C 33.494 0.000 .
156 . 20 ARG HB2 H 1.866 0.000 .
157 . 20 ARG HB3 H 1.972 0.000 .
158 . 20 ARG CG C 27.441 0.000 .
159 . 20 ARG HG3 H 1.440 0.000 .
160 . 20 ARG HG2 H 1.730 0.000 .
161 . 20 ARG CD C 43.391 0.000 .
162 . 20 ARG HD2 H 3.299 0.000 .
163 . 20 ARG C C 172.114 0.000 .
164 . 21 SER N N 116.249 0.000 .
165 . 21 SER H H 7.808 0.000 .
166 . 21 SER CA C 56.649 0.000 .
167 . 21 SER HA H 3.830 0.000 .
168 . 21 SER CB C 63.479 0.000 .
169 . 21 SER HB2 H 3.480 0.000 .
170 . 21 SER HB3 H 2.195 0.000 .
171 . 21 SER C C 173.202 0.000 .
172 . 22 SER N N 121.576 0.000 .
173 . 22 SER H H 8.041 0.000 .
174 . 22 SER CA C 59.845 0.000 .
175 . 22 SER HA H 4.360 0.000 .
176 . 22 SER CB C 63.116 0.000 .
177 . 22 SER HB3 H 3.998 0.000 .
178 . 22 SER HB2 H 4.035 0.000 .
179 . 22 SER C C 171.509 0.000 .
180 . 23 LYS N N 120.485 0.000 .
181 . 23 LYS H H 7.715 0.000 .
182 . 23 LYS CA C 56.739 0.000 .
183 . 23 LYS HA H 4.391 0.000 .
184 . 23 LYS CB C 34.816 0.000 .
185 . 23 LYS HB2 H 1.686 0.000 .
186 . 23 LYS HB3 H 1.514 0.000 .
187 . 23 LYS CG C 24.349 0.000 .
188 . 23 LYS HG2 H 1.321 0.000 .
189 . 23 LYS CD C 28.794 0.000 .
190 . 23 LYS CE C 41.967 0.000 .
191 . 23 LYS HZ H 6.127 0.000 .
192 . 23 LYS C C 173.230 0.000 .
193 . 24 ARG N N 119.260 0.000 .
194 . 24 ARG H H 7.522 0.000 .
195 . 24 ARG CA C 54.135 0.000 .
196 . 24 ARG HA H 4.497 0.000 .
197 . 24 ARG CB C 31.019 0.000 .
198 . 24 ARG HB2 H 1.781 0.000 .
199 . 24 ARG HG2 H 1.500 0.000 .
200 . 25 ASP N N 124.470 0.000 .
201 . 25 ASP H H 8.463 0.000 .
202 . 25 ASP CA C 55.036 0.000 .
203 . 25 ASP HA H 4.494 0.000 .
204 . 25 ASP CB C 41.355 0.000 .
205 . 25 ASP HB2 H 2.622 0.000 .
206 . 25 ASP HB3 H 2.699 0.000 .
207 . 25 ASP C C 174.592 0.000 .
208 . 26 GLN N N 118.446 0.000 .
209 . 26 GLN H H 8.815 0.000 .
210 . 26 GLN CA C 57.099 0.000 .
211 . 26 GLN HA H 3.770 0.000 .
212 . 26 GLN CB C 27.023 0.000 .
213 . 26 GLN HB2 H 2.135 0.000 .
214 . 26 GLN CG C 33.680 0.000 .
215 . 26 GLN HG2 H 2.400 0.000 .
216 . 26 GLN NE2 N 112.086 0.000 .
217 . 26 GLN HE21 H 7.386 0.000 .
218 . 26 GLN HE22 H 6.934 0.000 .
219 . 26 GLN C C 169.772 0.000 .
220 . 27 THR N N 113.337 0.000 .
221 . 27 THR H H 6.982 0.000 .
222 . 27 THR CA C 61.667 0.000 .
223 . 27 THR HA H 5.099 0.000 .
224 . 27 THR CB C 69.618 0.000 .
225 . 27 THR HB H 3.684 0.000 .
226 . 27 THR HG2 H 1.260 0.000 .
227 . 27 THR CG2 C 19.908 0.000 .
228 . 27 THR C C 170.495 0.000 .
229 . 28 TYR N N 124.227 0.000 .
230 . 28 TYR H H 9.038 0.000 .
231 . 28 TYR CA C 56.212 0.000 .
232 . 28 TYR HA H 5.871 0.000 .
233 . 28 TYR CB C 43.012 0.000 .
234 . 28 TYR HB2 H 3.031 0.000 .
235 . 28 TYR HB3 H 2.937 0.000 .
236 . 28 TYR HD2 H 6.940 0.000 .
237 . 28 TYR HE1 H 6.689 0.000 .
238 . 28 TYR CD1 C 131.672 0.000 .
239 . 28 TYR CE1 C 118.114 0.000 .
240 . 28 TYR CE2 C 118.114 0.000 .
241 . 28 TYR CD2 C 131.672 0.000 .
242 . 28 TYR C C 170.695 0.000 .
243 . 29 LEU N N 124.897 0.000 .
244 . 29 LEU H H 9.579 0.000 .
245 . 29 LEU CA C 53.486 0.000 .
246 . 29 LEU HA H 5.455 0.000 .
247 . 29 LEU CB C 47.332 0.000 .
248 . 29 LEU HB2 H 1.484 0.000 .
249 . 29 LEU HB3 H 0.905 0.000 .
250 . 29 LEU CG C 27.341 0.000 .
251 . 29 LEU HG H 1.450 0.000 .
252 . 29 LEU HD1 H 0.400 0.000 .
253 . 29 LEU HD2 H 0.646 0.000 .
254 . 29 LEU CD1 C 26.074 0.000 .
255 . 29 LEU CD2 C 23.650 0.000 .
256 . 29 LEU C C 171.579 0.000 .
257 . 30 TYR N N 128.545 0.000 .
258 . 30 TYR H H 9.990 0.000 .
259 . 30 TYR CA C 55.702 0.000 .
260 . 30 TYR HA H 5.845 0.000 .
261 . 30 TYR CB C 39.247 0.000 .
262 . 30 TYR HB2 H 3.538 0.000 .
263 . 30 TYR HB3 H 2.734 0.000 .
264 . 30 TYR HD2 H 7.407 0.000 .
265 . 30 TYR HE1 H 6.767 0.000 .
266 . 30 TYR CD1 C 134.229 0.000 .
267 . 30 TYR CE1 C 118.250 0.000 .
268 . 30 TYR CE2 C 118.250 0.000 .
269 . 30 TYR CD2 C 134.229 0.000 .
270 . 30 TYR C C 173.532 0.000 .
271 . 31 VAL N N 113.516 0.000 .
272 . 31 VAL H H 9.249 0.000 .
273 . 31 VAL CA C 59.719 0.000 .
274 . 31 VAL HA H 5.074 0.000 .
275 . 31 VAL CB C 35.767 0.000 .
276 . 31 VAL HB H 2.740 0.000 .
277 . 31 VAL HG1 H 0.919 0.000 .
278 . 31 VAL HG2 H 1.161 0.000 .
279 . 31 VAL CG1 C 18.867 0.000 .
280 . 31 VAL CG2 C 22.642 0.000 .
281 . 31 VAL C C 172.602 0.000 .
282 . 32 GLU N N 119.470 0.000 .
283 . 32 GLU H H 8.225 0.000 .
284 . 32 GLU CA C 59.923 0.000 .
285 . 32 GLU HA H 4.277 0.000 .
286 . 32 GLU CB C 32.202 0.000 .
287 . 32 GLU HB3 H 2.107 0.000 .
288 . 32 GLU HB2 H 2.157 0.000 .
289 . 32 GLU CG C 38.207 0.000 .
290 . 32 GLU HG3 H 2.237 0.000 .
291 . 32 GLU HG2 H 2.440 0.000 .
292 . 32 GLU C C 173.090 0.000 .
293 . 33 LYS N N 117.365 0.000 .
294 . 33 LYS H H 8.649 0.000 .
295 . 33 LYS CA C 54.236 0.000 .
296 . 33 LYS HA H 4.578 0.000 .
297 . 33 LYS CB C 35.520 0.000 .
298 . 33 LYS HB2 H 1.841 0.000 .
299 . 33 LYS HB3 H 1.782 0.000 .
300 . 33 LYS HG2 H 1.389 0.000 .
301 . 33 LYS HG3 H 1.450 0.000 .
302 . 33 LYS CD C 29.312 0.000 .
303 . 33 LYS HD2 H 1.760 0.000 .
304 . 33 LYS CE C 42.038 0.000 .
305 . 33 LYS HE2 H 3.034 0.000 .
306 . 33 LYS C C 171.904 0.000 .
307 . 34 LYS N N 122.203 0.000 .
308 . 34 LYS H H 8.476 0.000 .
309 . 34 LYS CA C 58.299 0.000 .
310 . 34 LYS HA H 3.834 0.000 .
311 . 34 LYS C C 173.904 0.000 .
312 . 35 ASP N N 117.655 0.000 .
313 . 35 ASP H H 8.350 0.000 .
314 . 35 ASP CA C 56.092 0.000 .
315 . 35 ASP HA H 3.933 0.000 .
316 . 35 ASP CB C 39.395 0.000 .
317 . 35 ASP HB3 H 2.886 0.000 .
318 . 35 ASP HB2 H 2.978 0.000 .
319 . 35 ASP C C 172.648 0.000 .
320 . 36 ASP N N 117.855 0.000 .
321 . 36 ASP H H 7.247 0.000 .
322 . 36 ASP CA C 52.864 0.000 .
323 . 36 ASP HA H 4.815 0.000 .
324 . 36 ASP CB C 40.647 0.000 .
325 . 36 ASP HB2 H 2.986 0.000 .
326 . 36 ASP HB3 H 2.198 0.000 .
327 . 36 ASP C C 172.792 0.000 .
328 . 37 PHE N N 125.673 0.000 .
329 . 37 PHE H H 8.597 0.000 .
330 . 37 PHE CA C 56.153 0.000 .
331 . 37 PHE HA H 4.766 0.000 .
332 . 37 PHE CB C 37.907 0.000 .
333 . 37 PHE HB2 H 3.507 0.000 .
334 . 37 PHE HB3 H 2.665 0.000 .
335 . 37 PHE HD1 H 6.957 0.000 .
336 . 37 PHE HE1 H 6.722 0.000 .
337 . 37 PHE CD1 C 134.260 0.000 .
338 . 37 PHE HZ H 5.669 0.000 .
339 . 37 PHE CD2 C 134.260 0.000 .
340 . 37 PHE C C 175.322 0.000 .
341 . 38 SER N N 118.512 0.000 .
342 . 38 SER H H 8.572 0.000 .
343 . 38 SER CA C 61.945 0.000 .
344 . 38 SER HA H 4.150 0.000 .
345 . 38 SER CB C 62.749 0.000 .
346 . 38 SER HB2 H 4.093 0.000 .
347 . 39 ARG N N 120.732 0.000 .
348 . 39 ARG H H 8.824 0.000 .
349 . 39 ARG CA C 55.730 0.000 .
350 . 39 ARG HA H 4.530 0.000 .
351 . 39 ARG CB C 29.891 0.000 .
352 . 39 ARG HB2 H 2.692 0.000 .
353 . 39 ARG HB3 H 1.723 0.000 .
354 . 39 ARG CG C 27.080 0.000 .
355 . 39 ARG CD C 43.170 0.000 .
356 . 39 ARG C C 172.913 0.000 .
357 . 40 VAL N N 122.389 0.000 .
358 . 40 VAL H H 7.660 0.000 .
359 . 40 VAL CA C 60.006 0.000 .
360 . 40 VAL HA H 3.522 0.000 .
361 . 40 VAL CB C 32.189 0.000 .
362 . 40 VAL HB H 2.065 0.000 .
363 . 40 VAL HG1 H 0.519 0.000 .
364 . 40 VAL HG2 H 0.806 0.000 .
365 . 40 VAL CG1 C 21.511 0.000 .
366 . 40 VAL CG2 C 21.479 0.000 .
367 . 40 VAL C C 171.899 0.000 .
368 . 41 PRO CD C 51.721 0.000 .
369 . 41 PRO CA C 63.300 0.000 .
370 . 41 PRO HA H 4.356 0.000 .
371 . 41 PRO CB C 32.525 0.000 .
372 . 41 PRO HB2 H 2.551 0.000 .
373 . 41 PRO HB3 H 1.830 0.000 .
374 . 41 PRO CG C 27.822 0.000 .
375 . 41 PRO HG2 H 2.152 0.000 .
376 . 41 PRO HD2 H 2.999 0.000 .
377 . 41 PRO HD3 H 3.949 0.000 .
378 . 42 GLU N N 127.137 0.000 .
379 . 42 GLU H H 8.991 0.000 .
380 . 42 GLU CA C 60.012 0.000 .
381 . 42 GLU HA H 3.869 0.000 .
382 . 42 GLU CB C 29.603 0.000 .
383 . 42 GLU HB2 H 2.135 0.000 .
384 . 42 GLU HB3 H 2.024 0.000 .
385 . 42 GLU CG C 35.532 0.000 .
386 . 42 GLU HG2 H 2.349 0.000 .
387 . 42 GLU HG3 H 2.266 0.000 .
388 . 42 GLU C C 176.020 0.000 .
389 . 43 GLU N N 118.171 0.000 .
390 . 43 GLU H H 9.347 0.000 .
391 . 43 GLU CA C 59.194 0.000 .
392 . 43 GLU HA H 4.019 0.000 .
393 . 43 GLU CB C 28.588 0.000 .
394 . 43 GLU HB2 H 2.064 0.000 .
395 . 43 GLU HB3 H 2.029 0.000 .
396 . 43 GLU CG C 35.318 0.000 .
397 . 43 GLU HG2 H 2.364 0.000 .
398 . 43 GLU HG3 H 2.322 0.000 .
399 . 43 GLU C C 176.252 0.000 .
400 . 44 LEU N N 120.952 0.000 .
401 . 44 LEU H H 6.989 0.000 .
402 . 44 LEU CA C 57.499 0.000 .
403 . 44 LEU HA H 4.199 0.000 .
404 . 44 LEU CB C 41.761 0.000 .
405 . 44 LEU HB2 H 1.695 0.000 .
406 . 44 LEU HB3 H 1.508 0.000 .
407 . 44 LEU HG H 1.247 0.000 .
408 . 44 LEU HD1 H 0.752 0.000 .
409 . 44 LEU HD2 H 0.744 0.000 .
410 . 44 LEU CD1 C 25.939 0.000 .
411 . 44 LEU CD2 C 23.730 0.000 .
412 . 44 LEU C C 177.159 0.000 .
413 . 45 MET N N 119.255 0.000 .
414 . 45 MET H H 7.623 0.000 .
415 . 45 MET CA C 56.082 0.000 .
416 . 45 MET HA H 4.336 0.000 .
417 . 45 MET CB C 29.996 0.000 .
418 . 45 MET HB2 H 2.001 0.000 .
419 . 45 MET HB3 H 1.945 0.000 .
420 . 45 MET CG C 32.470 0.000 .
421 . 45 MET HE H 1.178 0.000 .
422 . 45 MET CE C 14.880 0.000 .
423 . 45 MET C C 177.112 0.000 .
424 . 46 LYS N N 120.849 0.000 .
425 . 46 LYS H H 8.403 0.000 .
426 . 46 LYS CA C 59.284 0.000 .
427 . 46 LYS HA H 4.052 0.000 .
428 . 46 LYS CB C 32.014 0.000 .
429 . 46 LYS CG C 24.424 0.000 .
430 . 46 LYS CD C 31.941 0.000 .
431 . 46 LYS CE C 41.981 0.000 .
432 . 46 LYS C C 176.624 0.000 .
433 . 47 GLY N N 105.249 0.000 .
434 . 47 GLY H H 7.454 0.000 .
435 . 47 GLY CA C 45.663 0.000 .
436 . 47 GLY HA2 H 4.067 0.000 .
437 . 47 GLY HA3 H 3.902 0.000 .
438 . 47 GLY C C 171.718 0.000 .
439 . 48 PHE N N 122.490 0.000 .
440 . 48 PHE H H 8.002 0.000 .
441 . 48 PHE CA C 60.490 0.000 .
442 . 48 PHE HA H 3.999 0.000 .
443 . 48 PHE CB C 41.132 0.000 .
444 . 48 PHE HB2 H 3.180 0.000 .
445 . 48 PHE HD1 H 7.024 0.000 .
446 . 48 PHE HE1 H 7.163 0.000 .
447 . 48 PHE CD1 C 132.439 0.000 .
448 . 48 PHE CE1 C 132.591 0.000 .
449 . 48 PHE HZ H 6.900 0.000 .
450 . 48 PHE CE2 C 132.591 0.000 .
451 . 48 PHE CD2 C 132.439 0.000 .
452 . 48 PHE C C 174.671 0.000 .
453 . 49 GLY N N 105.768 0.000 .
454 . 49 GLY H H 7.789 0.000 .
455 . 49 GLY CA C 43.739 0.000 .
456 . 49 GLY HA2 H 3.750 0.000 .
457 . 49 GLY HA3 H 3.970 0.000 .
458 . 49 GLY C C 169.765 0.000 .
459 . 50 GLN N N 121.534 0.000 .
460 . 50 GLN H H 8.367 0.000 .
461 . 50 GLN CA C 54.585 0.000 .
462 . 50 GLN HA H 4.497 0.000 .
463 . 50 GLN CB C 28.881 0.000 .
464 . 50 GLN HB2 H 2.011 0.000 .
465 . 50 GLN HG2 H 2.359 0.000 .
466 . 50 GLN NE2 N 112.978 0.000 .
467 . 50 GLN HE21 H 7.607 0.000 .
468 . 50 GLN HE22 H 6.959 0.000 .
469 . 51 PRO CD C 50.939 0.000 .
470 . 51 PRO CA C 62.678 0.000 .
471 . 51 PRO HA H 4.869 0.000 .
472 . 51 PRO CB C 32.681 0.000 .
473 . 51 PRO HB2 H 1.767 0.000 .
474 . 51 PRO CG C 27.410 0.000 .
475 . 51 PRO HG2 H 1.349 0.000 .
476 . 51 PRO HG3 H 1.147 0.000 .
477 . 51 PRO HD2 H 3.478 0.000 .
478 . 51 PRO HD3 H 4.078 0.000 .
479 . 52 GLN N N 123.406 0.000 .
480 . 52 GLN H H 9.022 0.000 .
481 . 52 GLN CA C 54.060 0.000 .
482 . 52 GLN HA H 4.949 0.000 .
483 . 52 GLN CB C 30.446 0.000 .
484 . 52 GLN HB2 H 2.081 0.000 .
485 . 52 GLN CG C 33.805 0.000 .
486 . 52 GLN HG2 H 2.426 0.000 .
487 . 52 GLN NE2 N 112.341 0.000 .
488 . 52 GLN HE21 H 7.522 0.000 .
489 . 52 GLN HE22 H 6.878 0.000 .
490 . 53 LEU N N 130.879 0.000 .
491 . 53 LEU H H 9.297 0.000 .
492 . 53 LEU CA C 58.455 0.000 .
493 . 53 LEU HA H 3.548 0.000 .
494 . 53 LEU CB C 41.232 0.000 .
495 . 53 LEU HB2 H 1.570 0.000 .
496 . 53 LEU HB3 H 1.800 0.000 .
497 . 53 LEU CG C 27.310 0.000 .
498 . 53 LEU HG H 1.137 0.000 .
499 . 53 LEU HD1 H 0.770 0.000 .
500 . 53 LEU HD2 H 0.550 0.000 .
501 . 53 LEU CD1 C 25.290 0.000 .
502 . 53 LEU CD2 C 24.390 0.000 .
503 . 53 LEU C C 174.532 0.000 .
504 . 54 ALA N N 131.042 0.000 .
505 . 54 ALA H H 9.511 0.000 .
506 . 54 ALA CA C 53.155 0.000 .
507 . 54 ALA HA H 4.782 0.000 .
508 . 54 ALA HB H 1.385 0.000 .
509 . 54 ALA CB C 19.861 0.000 .
510 . 54 ALA C C 169.757 0.000 .
511 . 55 MET N N 113.430 0.000 .
512 . 55 MET H H 7.755 0.000 .
513 . 55 MET CA C 55.628 0.000 .
514 . 55 MET HA H 4.560 0.000 .
515 . 55 MET CB C 35.755 0.000 .
516 . 55 MET CG C 31.114 0.000 .
517 . 55 MET C C 169.880 0.000 .
518 . 56 ILE N N 122.887 0.000 .
519 . 56 ILE H H 8.406 0.000 .
520 . 56 ILE CA C 61.143 0.000 .
521 . 56 ILE HA H 4.679 0.000 .
522 . 56 ILE CB C 38.552 0.000 .
523 . 56 ILE HB H 1.781 0.000 .
524 . 56 ILE HG2 H 0.831 0.000 .
525 . 56 ILE CG2 C 17.441 0.000 .
526 . 56 ILE CG1 C 27.669 0.000 .
527 . 56 ILE HG12 H 1.561 0.000 .
528 . 56 ILE HG13 H 1.149 0.000 .
529 . 56 ILE HD1 H 0.821 0.000 .
530 . 56 ILE CD1 C 12.974 0.000 .
531 . 56 ILE C C 172.346 0.000 .
532 . 57 LEU N N 130.022 0.000 .
533 . 57 LEU H H 8.966 0.000 .
534 . 57 LEU CA C 51.545 0.000 .
535 . 57 LEU HA H 5.126 0.000 .
536 . 57 LEU CB C 45.385 0.000 .
537 . 57 LEU HB2 H 2.004 0.000 .
538 . 57 LEU HB3 H 1.284 0.000 .
539 . 57 LEU CG C 26.699 0.000 .
540 . 57 LEU HG H 1.586 0.000 .
541 . 57 LEU HD1 H 0.949 0.000 .
542 . 57 LEU HD2 H 0.902 0.000 .
543 . 57 LEU CD1 C 24.976 0.000 .
544 . 57 LEU CD2 C 25.794 0.000 .
545 . 57 LEU C C 171.016 0.000 .
546 . 58 PRO HD2 H 4.061 0.000 .
547 . 58 PRO HD3 H 3.813 0.000 .
548 . 59 LEU N N 123.992 0.000 .
549 . 59 LEU H H 8.375 0.000 .
550 . 59 LEU CA C 53.972 0.000 .
551 . 59 LEU HA H 4.480 0.000 .
552 . 59 LEU CB C 41.305 0.000 .
553 . 59 LEU HB2 H 1.466 0.000 .
554 . 59 LEU HB3 H 1.790 0.000 .
555 . 59 LEU CG C 26.215 0.000 .
556 . 59 LEU HG H 1.136 0.000 .
557 . 59 LEU HD1 H 0.821 0.000 .
558 . 59 LEU HD2 H 0.736 0.000 .
559 . 59 LEU CD1 C 23.578 0.000 .
560 . 59 LEU CD2 C 23.138 0.000 .
561 . 59 LEU C C 173.462 0.000 .
562 . 60 ASP N N 118.816 0.000 .
563 . 60 ASP H H 7.762 0.000 .
564 . 60 ASP CA C 53.450 0.000 .
565 . 60 ASP HA H 4.583 0.000 .
566 . 60 ASP CB C 41.138 0.000 .
567 . 60 ASP HB2 H 2.624 0.000 .
568 . 60 ASP HB3 H 2.928 0.000 .
569 . 60 ASP C C 174.276 0.000 .
570 . 61 GLY N N 109.472 0.000 .
571 . 61 GLY H H 8.421 0.000 .
572 . 61 GLY CA C 45.231 0.000 .
573 . 61 GLY HA2 H 3.773 0.000 .
574 . 61 GLY HA3 H 4.150 0.000 .
575 . 61 GLY C C 171.416 0.000 .
576 . 62 ARG N N 120.506 0.000 .
577 . 62 ARG H H 8.193 0.000 .
578 . 62 ARG CA C 57.258 0.000 .
579 . 62 ARG CB C 29.737 0.000 .
580 . 62 ARG CG C 26.631 0.000 .
581 . 62 ARG CD C 42.581 0.000 .
582 . 62 ARG C C 172.904 0.000 .
583 . 64 LYS CA C 53.450 0.000 .
584 . 64 LYS HA H 4.480 0.000 .
585 . 64 LYS CB C 33.536 0.000 .
586 . 64 LYS HB2 H 1.810 0.000 .
587 . 64 LYS CG C 24.566 0.000 .
588 . 64 LYS CD C 29.024 0.000 .
589 . 64 LYS CE C 42.154 0.000 .
590 . 64 LYS HE2 H 3.034 0.000 .
591 . 65 LEU N N 124.033 0.000 .
592 . 65 LEU H H 8.452 0.000 .
593 . 65 LEU CA C 54.206 0.000 .
594 . 65 LEU HA H 4.533 0.000 .
595 . 65 LEU CB C 43.034 0.000 .
596 . 65 LEU HB2 H 1.563 0.000 .
597 . 65 LEU HB3 H 1.559 0.000 .
598 . 65 LEU CG C 27.171 0.000 .
599 . 65 LEU HD1 H 0.867 0.000 .
600 . 65 LEU HD2 H 0.937 0.000 .
601 . 65 LEU CD1 C 23.589 0.000 .
602 . 65 LEU CD2 C 25.802 0.000 .
603 . 66 VAL N N 119.477 0.000 .
604 . 66 VAL H H 8.166 0.000 .
605 . 66 VAL CA C 62.659 0.000 .
606 . 66 VAL HA H 4.063 0.000 .
607 . 66 VAL CB C 32.271 0.000 .
608 . 66 VAL HB H 2.073 0.000 .
609 . 66 VAL HG1 H 0.922 0.000 .
610 . 66 VAL HG2 H 0.916 0.000 .
611 . 66 VAL CG1 C 20.750 0.000 .
612 . 66 VAL CG2 C 20.719 0.000 .
613 . 66 VAL C C 173.927 0.000 .
614 . 67 ASN N N 120.190 0.000 .
615 . 67 ASN H H 8.640 0.000 .
616 . 67 ASN CA C 53.512 0.000 .
617 . 67 ASN HA H 4.624 0.000 .
618 . 67 ASN CB C 37.868 0.000 .
619 . 67 ASN HB2 H 2.830 0.000 .
620 . 67 ASN HB3 H 3.005 0.000 .
621 . 67 ASN C C 171.911 0.000 .
622 . 68 ALA N N 120.712 0.000 .
623 . 68 ALA H H 7.444 0.000 .
624 . 68 ALA CA C 51.514 0.000 .
625 . 68 ALA HA H 4.430 0.000 .
626 . 68 ALA HB H 1.166 0.000 .
627 . 68 ALA CB C 21.202 0.000 .
628 . 68 ALA C C 173.369 0.000 .
629 . 69 ASP N N 120.959 0.000 .
630 . 69 ASP H H 8.430 0.000 .
631 . 69 ASP CA C 52.819 0.000 .
632 . 69 ASP HA H 4.720 0.000 .
633 . 69 ASP CB C 41.564 0.000 .
634 . 69 ASP HB2 H 2.578 0.000 .
635 . 69 ASP HB3 H 2.812 0.000 .
636 . 69 ASP C C 174.113 0.000 .
637 . 70 ILE N N 126.756 0.000 .
638 . 70 ILE H H 8.617 0.000 .
639 . 70 ILE CA C 63.614 0.000 .
640 . 70 ILE HA H 3.631 0.000 .
641 . 70 ILE CB C 37.972 0.000 .
642 . 70 ILE HB H 1.912 0.000 .
643 . 70 ILE HG2 H 0.967 0.000 .
644 . 70 ILE CG2 C 17.532 0.000 .
645 . 70 ILE CG1 C 28.423 0.000 .
646 . 70 ILE HG12 H 1.346 0.000 .
647 . 70 ILE HG13 H 1.396 0.000 .
648 . 70 ILE HD1 H 0.848 0.000 .
649 . 70 ILE CD1 C 12.948 0.000 .
650 . 70 ILE C C 173.648 0.000 .
651 . 71 GLU N N 120.632 0.000 .
652 . 71 GLU H H 8.270 0.000 .
653 . 71 GLU CA C 58.981 0.000 .
654 . 71 GLU HA H 4.062 0.000 .
655 . 71 GLU CB C 28.328 0.000 .
656 . 71 GLU HB2 H 2.071 0.000 .
657 . 71 GLU CG C 36.199 0.000 .
658 . 71 GLU HG2 H 2.336 0.000 .
659 . 71 GLU C C 177.136 0.000 .
660 . 72 LYS N N 120.937 0.000 .
661 . 72 LYS H H 7.379 0.000 .
662 . 72 LYS CA C 58.427 0.000 .
663 . 72 LYS HA H 4.044 0.000 .
664 . 72 LYS CB C 31.721 0.000 .
665 . 72 LYS HB2 H 1.926 0.000 .
666 . 72 LYS HB3 H 1.860 0.000 .
667 . 72 LYS CG C 25.305 0.000 .
668 . 72 LYS HG2 H 1.815 0.000 .
669 . 72 LYS CD C 28.723 0.000 .
670 . 72 LYS HD2 H 1.889 0.000 .
671 . 72 LYS CE C 42.052 0.000 .
672 . 72 LYS HE2 H 3.080 0.000 .
673 . 72 LYS C C 176.647 0.000 .
674 . 73 VAL N N 121.288 0.000 .
675 . 73 VAL H H 7.691 0.000 .
676 . 73 VAL CA C 66.238 0.000 .
677 . 73 VAL HA H 2.679 0.000 .
678 . 73 VAL CB C 31.029 0.000 .
679 . 73 VAL HB H 1.748 0.000 .
680 . 73 VAL HG1 H 0.468 0.000 .
681 . 73 VAL CG1 C 21.420 0.000 .
682 . 73 VAL CG2 C 21.139 0.000 .
683 . 73 VAL C C 174.648 0.000 .
684 . 73 VAL HG2 H -0.084 0.000 .
685 . 74 LYS N N 118.275 0.000 .
686 . 74 LYS H H 8.324 0.000 .
687 . 74 LYS CA C 60.481 0.000 .
688 . 74 LYS HA H 3.717 0.000 .
689 . 74 LYS CB C 32.420 0.000 .
690 . 74 LYS HB2 H 1.872 0.000 .
691 . 74 LYS HB3 H 1.802 0.000 .
692 . 74 LYS CG C 26.315 0.000 .
693 . 74 LYS HG2 H 1.429 0.000 .
694 . 74 LYS HG3 H 1.664 0.000 .
695 . 74 LYS CD C 29.668 0.000 .
696 . 74 LYS HD2 H 1.679 0.000 .
697 . 74 LYS CE C 41.570 0.000 .
698 . 74 LYS HE2 H 2.896 0.000 .
699 . 74 LYS C C 176.438 0.000 .
700 . 75 GLN N N 119.240 0.000 .
701 . 75 GLN H H 7.702 0.000 .
702 . 75 GLN CA C 58.823 0.000 .
703 . 75 GLN HA H 4.003 0.000 .
704 . 75 GLN CB C 28.014 0.000 .
705 . 75 GLN HB2 H 2.097 0.000 .
706 . 75 GLN CG C 33.152 0.000 .
707 . 75 GLN HG2 H 2.340 0.000 .
708 . 75 GLN HG3 H 2.482 0.000 .
709 . 75 GLN NE2 N 112.341 0.000 .
710 . 75 GLN HE21 H 7.758 0.000 .
711 . 75 GLN HE22 H 6.780 0.000 .
712 . 75 GLN C C 174.857 0.000 .
713 . 76 ALA N N 123.005 0.000 .
714 . 76 ALA H H 7.932 0.000 .
715 . 76 ALA CA C 55.091 0.000 .
716 . 76 ALA HA H 4.274 0.000 .
717 . 76 ALA HB H 1.693 0.000 .
718 . 76 ALA CB C 18.969 0.000 .
719 . 76 ALA C C 177.926 0.000 .
720 . 77 LEU N N 119.019 0.000 .
721 . 77 LEU H H 8.664 0.000 .
722 . 77 LEU CA C 58.778 0.000 .
723 . 77 LEU HA H 3.626 0.000 .
724 . 77 LEU CB C 40.881 0.000 .
725 . 77 LEU HB2 H 1.904 0.000 .
726 . 77 LEU HB3 H 1.390 0.000 .
727 . 77 LEU CG C 27.135 0.000 .
728 . 77 LEU HG H 1.753 0.000 .
729 . 77 LEU HD1 H 0.767 0.000 .
730 . 77 LEU HD2 H 0.610 0.000 .
731 . 77 LEU CD1 C 26.010 0.000 .
732 . 77 LEU CD2 C 22.707 0.000 .
733 . 77 LEU C C 176.647 0.000 .
734 . 78 THR N N 114.104 0.000 .
735 . 78 THR H H 7.790 0.000 .
736 . 78 THR CA C 66.284 0.000 .
737 . 78 THR HA H 4.028 0.000 .
738 . 78 THR CB C 69.123 0.000 .
739 . 78 THR HB H 4.313 0.000 .
740 . 78 THR HG2 H 1.289 0.000 .
741 . 78 THR CG2 C 21.213 0.000 .
742 . 78 THR C C 173.490 0.000 .
743 . 79 GLU N N 120.690 0.000 .
744 . 79 GLU H H 8.421 0.000 .
745 . 79 GLU CA C 59.138 0.000 .
746 . 79 GLU HA H 4.221 0.000 .
747 . 79 GLU CB C 30.741 0.000 .
748 . 79 GLU HB2 H 2.091 0.000 .
749 . 79 GLU CG C 36.480 0.000 .
750 . 79 GLU HG2 H 2.509 0.000 .
751 . 79 GLU HG3 H 2.291 0.000 .
752 . 79 GLU C C 175.020 0.000 .
753 . 80 GLN N N 114.906 0.000 .
754 . 80 GLN H H 8.808 0.000 .
755 . 80 GLN CA C 55.337 0.000 .
756 . 80 GLN HA H 4.870 0.000 .
757 . 80 GLN CB C 30.505 0.000 .
758 . 80 GLN HB3 H 2.201 0.000 .
759 . 80 GLN HB2 H 2.159 0.000 .
760 . 80 GLN CG C 32.938 0.000 .
761 . 80 GLN HG2 H 2.592 0.000 .
762 . 80 GLN NE2 N 110.929 0.000 .
763 . 80 GLN HE21 H 6.931 0.000 .
764 . 80 GLN HE22 H 6.515 0.000 .
765 . 80 GLN C C 173.230 0.000 .
766 . 81 GLY N N 107.739 0.000 .
767 . 81 GLY H H 7.902 0.000 .
768 . 81 GLY CA C 45.450 0.000 .
769 . 81 GLY HA2 H 4.328 0.000 .
770 . 81 GLY HA3 H 4.114 0.000 .
771 . 81 GLY C C 170.160 0.000 .
772 . 82 TYR N N 114.689 0.000 .
773 . 82 TYR H H 7.251 0.000 .
774 . 82 TYR CA C 56.225 0.000 .
775 . 82 TYR HA H 5.655 0.000 .
776 . 82 TYR CB C 40.412 0.000 .
777 . 82 TYR HB2 H 3.274 0.000 .
778 . 82 TYR HB3 H 2.893 0.000 .
779 . 82 TYR HD2 H 6.707 0.000 .
780 . 82 TYR HE1 H 6.724 0.000 .
781 . 82 TYR CD1 C 133.202 0.000 .
782 . 82 TYR CE1 C 118.106 0.000 .
783 . 82 TYR CE2 C 118.106 0.000 .
784 . 82 TYR CD2 C 133.202 0.000 .
785 . 82 TYR C C 169.393 0.000 .
786 . 83 TYR N N 120.183 0.000 .
787 . 83 TYR H H 8.959 0.000 .
788 . 83 TYR CA C 57.469 0.000 .
789 . 83 TYR HA H 4.474 0.000 .
790 . 83 TYR CB C 42.105 0.000 .
791 . 83 TYR HB2 H 2.780 0.000 .
792 . 83 TYR HB3 H 2.568 0.000 .
793 . 83 TYR HD2 H 6.577 0.000 .
794 . 83 TYR HE1 H 6.594 0.000 .
795 . 83 TYR CD1 C 133.491 0.000 .
796 . 83 TYR CE1 C 118.141 0.000 .
797 . 83 TYR CE2 C 118.141 0.000 .
798 . 83 TYR CD2 C 133.491 0.000 .
799 . 83 TYR C C 169.858 0.000 .
800 . 84 LEU N N 132.338 0.000 .
801 . 84 LEU H H 8.306 0.000 .
802 . 84 LEU CA C 53.361 0.000 .
803 . 84 LEU HA H 5.218 0.000 .
804 . 84 LEU CB C 44.387 0.000 .
805 . 84 LEU HB2 H 1.974 0.000 .
806 . 84 LEU HB3 H 1.197 0.000 .
807 . 84 LEU CG C 27.659 0.000 .
808 . 84 LEU HG H 1.441 0.000 .
809 . 84 LEU HD1 H 1.013 0.000 .
810 . 84 LEU HD2 H 1.006 0.000 .
811 . 84 LEU CD1 C 23.698 0.000 .
812 . 84 LEU CD2 C 26.463 0.000 .
813 . 84 LEU C C 170.184 0.000 .
814 . 85 GLN N N 129.790 0.000 .
815 . 85 GLN H H 9.574 0.000 .
816 . 85 GLN CA C 54.312 0.000 .
817 . 85 GLN HA H 4.570 0.000 .
818 . 85 GLN CB C 31.678 0.000 .
819 . 85 GLN HB2 H 2.302 0.000 .
820 . 85 GLN HG2 H 2.610 0.000 .
821 . 85 GLN NE2 N 113.452 0.000 .
822 . 85 GLN HE21 H 7.951 0.000 .
823 . 85 GLN HE22 H 6.848 0.000 .
824 . 86 LEU N N 128.429 0.000 .
825 . 86 LEU H H 8.353 0.000 .
826 . 86 LEU CA C 53.014 0.000 .
827 . 86 LEU HA H 4.896 0.000 .
828 . 86 LEU CB C 41.495 0.000 .
829 . 86 LEU HB2 H 1.712 0.000 .
830 . 86 LEU CG C 28.889 0.000 .
831 . 86 LEU HG H 1.715 0.000 .
832 . 86 LEU HD1 H 0.981 0.000 .
833 . 86 LEU HD2 H 1.028 0.000 .
834 . 86 LEU CD1 C 23.259 0.000 .
835 . 86 LEU CD2 C 25.175 0.000 .
836 . 90 PRO CD C 50.817 0.000 .
837 . 90 PRO CA C 63.455 0.000 .
838 . 90 PRO HA H 4.446 0.000 .
839 . 90 PRO CB C 31.924 0.000 .
840 . 90 PRO HB2 H 2.329 0.000 .
841 . 90 PRO HB3 H 1.951 0.000 .
842 . 90 PRO CG C 27.439 0.000 .
843 . 90 PRO HG2 H 2.063 0.000 .
844 . 90 PRO HD2 H 3.740 0.000 .
845 . 90 PRO HD3 H 3.879 0.000 .
846 . 90 PRO C C 174.986 0.000 .
847 . 91 GLU N N 120.554 0.000 .
848 . 91 GLU H H 8.777 0.000 .
849 . 91 GLU CA C 57.727 0.000 .
850 . 91 GLU HA H 4.219 0.000 .
851 . 91 GLU CB C 29.688 0.000 .
852 . 91 GLU HB2 H 2.056 0.000 .
853 . 91 GLU HB3 H 2.021 0.000 .
854 . 91 GLU HG2 H 2.343 0.000 .
855 . 91 GLU C C 174.183 0.000 .
856 . 92 ASP N N 121.461 0.000 .
857 . 92 ASP H H 8.263 0.000 .
858 . 92 ASP CA C 54.576 0.000 .
859 . 92 ASP HA H 4.608 0.000 .
860 . 92 ASP CB C 40.895 0.000 .
861 . 92 ASP HB2 H 2.767 0.000 .
862 . 92 ASP HB3 H 2.686 0.000 .
863 . 92 ASP C C 174.369 0.000 .
864 . 93 LEU N N 122.919 0.000 .
865 . 93 LEU H H 8.037 0.000 .
866 . 93 LEU CA C 56.129 0.000 .
867 . 93 LEU HA H 4.263 0.000 .
868 . 93 LEU CB C 41.999 0.000 .
869 . 93 LEU HB2 H 1.705 0.000 .
870 . 93 LEU CG C 26.917 0.000 .
871 . 93 LEU HG H 1.693 0.000 .
872 . 93 LEU HD1 H 0.966 0.000 .
873 . 93 LEU HD2 H 0.905 0.000 .
874 . 93 LEU CD1 C 24.699 0.000 .
875 . 93 LEU CD2 C 23.459 0.000 .
876 . 93 LEU C C 175.508 0.000 .
877 . 94 LEU N N 120.792 0.000 .
878 . 94 LEU H H 8.063 0.000 .
879 . 94 LEU CA C 55.890 0.000 .
880 . 94 LEU HA H 4.313 0.000 .
881 . 94 LEU CB C 41.860 0.000 .
882 . 94 LEU HB2 H 1.759 0.000 .
883 . 94 LEU HB3 H 1.771 0.000 .
884 . 94 LEU CG C 26.908 0.000 .
885 . 94 LEU HG H 1.693 0.000 .
886 . 94 LEU HD1 H 0.914 0.000 .
887 . 94 LEU HD2 H 0.974 0.000 .
888 . 94 LEU CD1 C 24.821 0.000 .
889 . 94 LEU CD2 C 23.397 0.000 .
890 . 94 LEU C C 175.299 0.000 .
891 . 95 LYS N N 120.392 0.000 .
892 . 95 LYS H H 7.916 0.000 .
893 . 95 LYS CA C 57.067 0.000 .
894 . 95 LYS HA H 4.235 0.000 .
895 . 95 LYS CB C 32.536 0.000 .
896 . 95 LYS HB2 H 1.734 0.000 .
897 . 95 LYS HB3 H 1.853 0.000 .
898 . 95 LYS CG C 24.821 0.000 .
899 . 95 LYS HG2 H 1.470 0.000 .
900 . 95 LYS CD C 32.582 0.000 .
901 . 95 LYS HD2 H 1.499 0.000 .
902 . 95 LYS CE C 42.052 0.000 .
903 . 95 LYS HE2 H 3.052 0.000 .
904 . 95 LYS C C 174.392 0.000 .
905 . 96 GLN N N 120.254 0.000 .
906 . 96 GLN H H 8.149 0.000 .
907 . 96 GLN CA C 56.299 0.000 .
908 . 96 GLN HA H 4.279 0.000 .
909 . 96 GLN CB C 29.131 0.000 .
910 . 96 GLN HB2 H 2.087 0.000 .
911 . 96 GLN HB3 H 2.037 0.000 .
912 . 96 GLN HG2 H 2.373 0.000 .
913 . 96 GLN C C 173.741 0.000 .
914 . 97 HIS CA C 56.356 0.000 .
915 . 97 HIS CB C 30.086 0.000 .
916 . 97 HIS CD2 C 120.412 0.000 .
917 . 97 HIS C C 172.672 0.000 .
918 . 98 LEU N N 122.930 0.000 .
919 . 98 LEU H H 8.136 0.000 .
920 . 98 LEU CA C 55.337 0.000 .
921 . 98 LEU HA H 4.367 0.000 .
922 . 98 LEU CB C 42.053 0.000 .
923 . 98 LEU HB2 H 1.705 0.000 .
924 . 98 LEU HB3 H 1.602 0.000 .
925 . 98 LEU CG C 28.993 0.000 .
926 . 98 LEU HG H 1.482 0.000 .
927 . 98 LEU HD1 H 0.945 0.000 .
928 . 98 LEU HD2 H 0.891 0.000 .
929 . 98 LEU CD1 C 23.244 0.000 .
930 . 98 LEU CD2 C 24.959 0.000 .
931 . 98 LEU C C 174.842 0.000 .
932 . 99 SER N N 116.990 0.000 .
933 . 99 SER H H 8.281 0.000 .
934 . 99 SER CA C 58.430 0.000 .
935 . 99 SER HA H 4.508 0.000 .
936 . 99 SER CB C 63.599 0.000 .
937 . 99 SER HB2 H 3.942 0.000 .
938 . 99 SER C C 172.183 0.000 .
939 . 100 VAL N N 121.695 0.000 .
940 . 100 VAL H H 8.087 0.000 .
941 . 100 VAL CA C 62.457 0.000 .
942 . 100 VAL HA H 4.203 0.000 .
943 . 100 VAL CB C 32.375 0.000 .
944 . 100 VAL HB H 2.182 0.000 .
945 . 100 VAL CG1 C 21.057 0.000 .
946 . 100 VAL CG2 C 20.351 0.000 .
947 . 100 VAL HG1 H 0.993 0.000 .
948 . 100 VAL C C 173.997 0.000 .
949 . 101 MET N N 121.906 0.000 .
950 . 101 MET H H 9.320 0.000 .
951 . 101 MET CA C 53.879 0.000 .
952 . 101 MET HA H 4.537 0.000 .
953 . 101 MET CB C 30.515 0.000 .
954 . 101 MET HB2 H 2.130 0.000 .
955 . 101 MET CG C 31.963 0.000 .
956 . 101 MET HG2 H 2.418 0.000 .
957 . 101 MET C C 174.090 0.000 .
958 . 102 GLY N N 110.483 0.000 .
959 . 102 GLY H H 8.376 0.000 .
960 . 102 GLY CA C 45.221 0.000 .
961 . 102 GLY HA2 H 4.000 0.000 .
962 . 102 GLY C C 171.269 0.000 .
963 . 103 GLN N N 120.379 0.000 .
964 . 103 GLN H H 8.187 0.000 .
965 . 103 GLN CA C 55.738 0.000 .
966 . 103 GLN HA H 4.396 0.000 .
967 . 103 GLN CB C 29.497 0.000 .
968 . 103 GLN HB2 H 2.146 0.000 .
969 . 103 GLN HB3 H 2.029 0.000 .
970 . 103 GLN HG2 H 2.397 0.000 .
971 . 103 GLN C C 173.671 0.000 .
972 . 104 LYS CA C 56.113 0.000 .
973 . 104 LYS CB C 32.886 0.000 .
974 . 104 LYS CG C 25.548 0.000 .
975 . 104 LYS CD C 31.079 0.000 .
976 . 105 THR N N 116.356 0.000 .
977 . 105 THR H H 8.300 0.000 .
978 . 105 THR CA C 61.490 0.000 .
979 . 105 THR HA H 4.414 0.000 .
980 . 105 THR CB C 69.667 0.000 .
981 . 105 THR HB H 4.287 0.000 .
982 . 105 THR HG2 H 1.223 0.000 .
983 . 105 THR CG2 C 21.429 0.000 .
984 . 105 THR C C 61.784 0.000 .
985 . 106 ASP N N 123.192 0.000 .
986 . 106 ASP H H 8.418 0.000 .
987 . 106 ASP CA C 54.050 0.000 .
988 . 106 ASP HA H 4.700 0.000 .
989 . 106 ASP CB C 41.128 0.000 .
990 . 106 ASP HB2 H 2.774 0.000 .
991 . 106 ASP HB3 H 2.705 0.000 .
992 . 107 ASP N N 121.826 0.000 .
993 . 107 ASP H H 8.378 0.000 .
994 . 107 ASP CA C 54.300 0.000 .
995 . 107 ASP HA H 4.704 0.000 .
996 . 107 ASP CB C 41.300 0.000 .
997 . 107 ASP HB2 H 2.769 0.000 .
998 . 107 ASP HB3 H 2.692 0.000 .
999 . 107 ASP C C 173.997 0.000 .
1000 . 108 THR N N 114.133 0.000 .
1001 . 108 THR H H 8.208 0.000 .
1002 . 108 THR CA C 62.380 0.000 .
1003 . 108 THR HA H 4.038 0.000 .
1004 . 108 THR CB C 69.441 0.000 .
1005 . 108 THR HB H 4.290 0.000 .
1006 . 108 THR HG2 H 1.306 0.000 .
1007 . 108 THR CG2 C 21.419 0.000 .
1008 . 108 THR C C 172.013 0.000 .
1009 . 109 ASN N N 121.932 0.000 .
1010 . 109 ASN H H 8.426 0.000 .
1011 . 109 ASN CA C 53.446 0.000 .
1012 . 109 ASN HA H 4.784 0.000 .
1013 . 109 ASN CB C 38.719 0.000 .
1014 . 109 ASN HB2 H 2.902 0.000 .
1015 . 109 ASN HB3 H 2.892 0.000 .
1016 . 109 ASN C C 171.354 0.000 .
1017 . 110 LYS N N 127.261 0.000 .
1018 . 110 LYS H H 7.810 0.000 .
1019 . 110 LYS CA C 57.860 0.000 .
1020 . 110 LYS HA H 4.142 0.000 .
1021 . 110 LYS CB C 33.660 0.000 .
1022 . 110 LYS HB2 H 1.874 0.000 .
1023 . 110 LYS HB3 H 1.759 0.000 .
1024 . 110 LYS HG2 H 1.428 0.000 .
1025 . 110 LYS HE2 H 3.055 0.000 .
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