data_6090
#######################
# Entry information #
#######################
save_entry_information
_Saveframe_category entry_information
_Entry_title
;
1H, 13C and 15N resonance assignement of the reduced form of methionine
sulfoxide reductase A from Escherichia coli
;
_BMRB_accession_number 6090
_BMRB_flat_file_name bmr6090.str
_Entry_type original
_Submission_date 2004-02-04
_Accession_date 2004-02-04
_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 Coudevylle Nicolas . .
2 Thureau Aurelien . .
3 Azza Said . .
4 Boshi-Muller Sandrine . .
5 Branlant Guy . .
6 Cung Manh-Thong . .
stop_
loop_
_Saveframe_category_type
_Saveframe_category_type_count
assigned_chemical_shifts 1
stop_
loop_
_Data_type
_Data_type_count
"1H chemical shifts" 637
"13C chemical shifts" 651
"15N chemical shifts" 184
stop_
loop_
_Revision_date
_Revision_keyword
_Revision_author
_Revision_detail
2005-04-29 update author 'update chemical shift table'
2004-02-20 original author 'original release'
stop_
save_
#############################
# Citation for this entry #
#############################
save_entry_citation
_Saveframe_category entry_citation
_Citation_full .
_Citation_title
;
Letter to the Editor: 1H, 13C and 15N resonance assignement of the reduced form
of methionine sulfoxide reductase A from Escherichia coli
;
_Citation_status published
_Citation_type journal
_CAS_abstract_code .
_MEDLINE_UI_code .
_PubMed_ID ?
loop_
_Author_ordinal
_Author_family_name
_Author_given_name
_Author_middle_initials
_Author_family_title
1 Coudevylle Nicolas . .
2 Thureau Aurelien . .
3 Azza Said . .
4 Boshi-Muller Sandrine . .
5 Branlant Guy . .
6 Cung Manh-Thong . .
stop_
_Journal_abbreviation 'J. Biomol. NMR'
_Journal_volume 30
_Journal_issue 3
_Journal_CSD .
_Book_chapter_title .
_Book_volume .
_Book_series .
_Book_ISBN .
_Conference_state_province .
_Conference_abstract_number .
_Page_first 363
_Page_last 364
_Year 2004
_Details .
loop_
_Keyword
'methionine sulfoxide reductase A'
'Escherichia coli'
'resonance assignement'
stop_
save_
##################################
# Molecular system description #
##################################
save_system_MsrA
_Saveframe_category molecular_system
_Mol_system_name 'methionine sulfoxide reductase A'
_Abbreviation_common MsrA
_Enzyme_commission_number .
loop_
_Mol_system_component_name
_Mol_label
MsrA $MsrA
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_MsrA
_Saveframe_category monomeric_polymer
_Mol_type polymer
_Mol_polymer_class protein
_Name_common 'Methionine sulfoxide reductase A'
_Abbreviation_common MsrA
_Molecular_mass .
_Mol_thiol_state 'all free'
_Details .
##############################
# Polymer residue sequence #
##############################
_Residue_count 211
_Mol_residue_sequence
;
SLFDKKHLVSPADALPGRNT
PMPVATLHAVNGHSMTNVPD
GMEIAIFAMGCFWGVERLFW
QLPGVYSTAAGYTGGYTPNP
TYREVCSGDTGHAEAVRIVY
DPSVISYEQLLQVFWENHDP
AQGMRQGNDHGTQYRSAIYP
LTPEQDAAARASLERFQAAM
LAADDDRHITTEIANATPFY
YAEDDHQQYLHKNPYGYCGI
GGIGVCLPPEA
;
loop_
_Residue_seq_code
_Residue_label
1 SER 2 LEU 3 PHE 4 ASP 5 LYS
6 LYS 7 HIS 8 LEU 9 VAL 10 SER
11 PRO 12 ALA 13 ASP 14 ALA 15 LEU
16 PRO 17 GLY 18 ARG 19 ASN 20 THR
21 PRO 22 MET 23 PRO 24 VAL 25 ALA
26 THR 27 LEU 28 HIS 29 ALA 30 VAL
31 ASN 32 GLY 33 HIS 34 SER 35 MET
36 THR 37 ASN 38 VAL 39 PRO 40 ASP
41 GLY 42 MET 43 GLU 44 ILE 45 ALA
46 ILE 47 PHE 48 ALA 49 MET 50 GLY
51 CYS 52 PHE 53 TRP 54 GLY 55 VAL
56 GLU 57 ARG 58 LEU 59 PHE 60 TRP
61 GLN 62 LEU 63 PRO 64 GLY 65 VAL
66 TYR 67 SER 68 THR 69 ALA 70 ALA
71 GLY 72 TYR 73 THR 74 GLY 75 GLY
76 TYR 77 THR 78 PRO 79 ASN 80 PRO
81 THR 82 TYR 83 ARG 84 GLU 85 VAL
86 CYS 87 SER 88 GLY 89 ASP 90 THR
91 GLY 92 HIS 93 ALA 94 GLU 95 ALA
96 VAL 97 ARG 98 ILE 99 VAL 100 TYR
101 ASP 102 PRO 103 SER 104 VAL 105 ILE
106 SER 107 TYR 108 GLU 109 GLN 110 LEU
111 LEU 112 GLN 113 VAL 114 PHE 115 TRP
116 GLU 117 ASN 118 HIS 119 ASP 120 PRO
121 ALA 122 GLN 123 GLY 124 MET 125 ARG
126 GLN 127 GLY 128 ASN 129 ASP 130 HIS
131 GLY 132 THR 133 GLN 134 TYR 135 ARG
136 SER 137 ALA 138 ILE 139 TYR 140 PRO
141 LEU 142 THR 143 PRO 144 GLU 145 GLN
146 ASP 147 ALA 148 ALA 149 ALA 150 ARG
151 ALA 152 SER 153 LEU 154 GLU 155 ARG
156 PHE 157 GLN 158 ALA 159 ALA 160 MET
161 LEU 162 ALA 163 ALA 164 ASP 165 ASP
166 ASP 167 ARG 168 HIS 169 ILE 170 THR
171 THR 172 GLU 173 ILE 174 ALA 175 ASN
176 ALA 177 THR 178 PRO 179 PHE 180 TYR
181 TYR 182 ALA 183 GLU 184 ASP 185 ASP
186 HIS 187 GLN 188 GLN 189 TYR 190 LEU
191 HIS 192 LYS 193 ASN 194 PRO 195 TYR
196 GLY 197 TYR 198 CYS 199 GLY 200 ILE
201 GLY 202 GLY 203 ILE 204 GLY 205 VAL
206 CYS 207 LEU 208 PRO 209 PRO 210 GLU
211 ALA
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
BMRB 6786 MsrA 100.00 211 99.05 99.05 1.09e-153
PDB 1FF3 "Structure Of The Peptide Methionine Sulfoxide Reductase From Escherichia Coli" 100.00 211 99.53 99.53 2.51e-154
PDB 2GT3 "Solution Structure And Dynamics Of The Reduced Form Of Methionine Sulfoxide Reductase A From Escherichia Coli, A 23 Kda Protein" 100.00 212 100.00 100.00 6.74e-156
PDB 2IEM "Solution Structure Of An Oxidized Form (Cys51-Cys198) Of E. Coli Methionine Sulfoxide Reductase A (Msra)" 100.00 211 99.05 99.05 1.09e-153
DBJ BAB38620 "peptide methionine sulfoxide reductase [Escherichia coli O157:H7 str. Sakai]" 100.00 212 99.53 99.53 1.02e-154
DBJ BAE78220 "methionine sulfoxide reductase A [Escherichia coli str. K-12 substr. W3110]" 100.00 212 100.00 100.00 6.74e-156
DBJ BAG80049 "peptide methionine sulfoxide reductase [Escherichia coli SE11]" 100.00 212 99.05 99.05 5.08e-154
DBJ BAI28524 "methionine sulfoxide reductase A [Escherichia coli O26:H11 str. 11368]" 100.00 212 100.00 100.00 6.74e-156
DBJ BAI33698 "methionine sulfoxide reductase A [Escherichia coli O103:H2 str. 12009]" 100.00 212 100.00 100.00 6.74e-156
EMBL CAP78740 "Peptide methionine sulfoxide reductase msrA [Escherichia coli LF82]" 100.00 212 99.05 99.05 8.77e-154
EMBL CAQ34570 "methionine sulfoxide reductase A [Escherichia coli BL21(DE3)]" 100.00 212 100.00 100.00 6.74e-156
EMBL CAR01194 "methionine sulfoxide reductase A [Escherichia coli IAI1]" 100.00 212 100.00 100.00 6.74e-156
EMBL CAR05961 "methionine sulfoxide reductase A [Escherichia coli S88]" 100.00 212 100.00 100.00 6.74e-156
EMBL CAR11177 "methionine sulfoxide reductase A [Escherichia coli ED1a]" 100.00 212 99.53 99.53 5.22e-155
GB AAA24399 "peptide methionine sulfoxide reductase [Escherichia coli]" 100.00 212 100.00 100.00 6.74e-156
GB AAA97115 "peptide methionine sulfoxide reductase [Escherichia coli str. K-12 substr. MG1655]" 100.00 212 100.00 100.00 6.74e-156
GB AAC77176 "methionine sulfoxide reductase A [Escherichia coli str. K-12 substr. MG1655]" 100.00 212 100.00 100.00 6.74e-156
GB AAG59417 "peptide methionine sulfoxide reductase [Escherichia coli O157:H7 str. EDL933]" 100.00 212 99.53 99.53 1.02e-154
GB AAN45686 "peptide methionine sulfoxide reductase [Shigella flexneri 2a str. 301]" 100.00 212 100.00 100.00 6.74e-156
REF NP_290851 "methionine sulfoxide reductase A [Escherichia coli O157:H7 str. EDL933]" 100.00 212 99.53 99.53 1.02e-154
REF NP_313224 "methionine sulfoxide reductase A [Escherichia coli O157:H7 str. Sakai]" 100.00 212 99.53 99.53 1.02e-154
REF NP_418640 "methionine sulfoxide reductase A [Escherichia coli str. K-12 substr. MG1655]" 100.00 212 100.00 100.00 6.74e-156
REF NP_709979 "methionine sulfoxide reductase A [Shigella flexneri 2a str. 301]" 100.00 212 100.00 100.00 6.74e-156
REF NP_757164 "methionine sulfoxide reductase A [Escherichia coli CFT073]" 100.00 234 99.05 99.05 9.04e-154
SP A7ZV98 "RecName: Full=Peptide methionine sulfoxide reductase MsrA; Short=Protein-methionine-S-oxide reductase; AltName: Full=Peptide-me" 100.00 212 100.00 100.00 6.74e-156
SP A8A7X5 "RecName: Full=Peptide methionine sulfoxide reductase MsrA; Short=Protein-methionine-S-oxide reductase; AltName: Full=Peptide-me" 100.00 212 100.00 100.00 6.74e-156
SP B1ISY2 "RecName: Full=Peptide methionine sulfoxide reductase MsrA; Short=Protein-methionine-S-oxide reductase; AltName: Full=Peptide-me" 100.00 212 100.00 100.00 6.74e-156
SP B1LRA3 "RecName: Full=Peptide methionine sulfoxide reductase MsrA; Short=Protein-methionine-S-oxide reductase; AltName: Full=Peptide-me" 100.00 212 99.05 99.05 1.02e-153
SP B1XDW8 "RecName: Full=Peptide methionine sulfoxide reductase MsrA; Short=Protein-methionine-S-oxide reductase; AltName: Full=Peptide-me" 100.00 212 100.00 100.00 6.74e-156
stop_
save_
####################
# Natural source #
####################
save_natural_source
_Saveframe_category natural_source
loop_
_Mol_label
_Organism_name_common
_NCBI_taxonomy_ID
_Superkingdom
_Kingdom
_Genus
_Species
$MsrA 'Esherichia coli' 562 Eubacteria . Esherichia 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
$MsrA '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
$MsrA 0.9 mM '[U-99% 13C; U-99% 15N]'
stop_
save_
############################
# Computer software used #
############################
save_XWINNMR
_Saveframe_category software
_Name XWINNMR
_Version 3.1
loop_
_Task
'spectra processing'
stop_
_Details .
save_
save_XEASY
_Saveframe_category software
_Name XEASY
_Version .
loop_
_Task
'peak peaking'
'spectra assignment'
stop_
_Details 'Bartel et al, 1995.'
save_
#########################
# Experimental detail #
#########################
##################################
# NMR Spectrometer definitions #
##################################
save_NMR_spectrometer
_Saveframe_category NMR_spectrometer
_Manufacturer Bruker
_Model DRX
_Field_strength 600
_Details .
save_
#############################
# NMR applied experiments #
#############################
save_1H-15N_HSQC_1
_Saveframe_category NMR_applied_experiment
_Experiment_name '1H-15N HSQC'
_Sample_label .
save_
save_HNCA_2
_Saveframe_category NMR_applied_experiment
_Experiment_name HNCA
_Sample_label .
save_
save_HN(CO)CA_3
_Saveframe_category NMR_applied_experiment
_Experiment_name HN(CO)CA
_Sample_label .
save_
save_HNCO_4
_Saveframe_category NMR_applied_experiment
_Experiment_name HNCO
_Sample_label .
save_
save_HN(CA)CO_5
_Saveframe_category NMR_applied_experiment
_Experiment_name HN(CA)CO
_Sample_label .
save_
save_CBCANH_6
_Saveframe_category NMR_applied_experiment
_Experiment_name CBCANH
_Sample_label .
save_
save_CBCA(CO)NH_7
_Saveframe_category NMR_applied_experiment
_Experiment_name CBCA(CO)NH
_Sample_label .
save_
save_HNHA_8
_Saveframe_category NMR_applied_experiment
_Experiment_name HNHA
_Sample_label .
save_
save_HCCH-TOCSY_9
_Saveframe_category NMR_applied_experiment
_Experiment_name HCCH-TOCSY
_Sample_label .
save_
save_NMR_spec_expt__0_1
_Saveframe_category NMR_applied_experiment
_Experiment_name '1H-15N HSQC'
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_2
_Saveframe_category NMR_applied_experiment
_Experiment_name HNCA
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_3
_Saveframe_category NMR_applied_experiment
_Experiment_name HN(CO)CA
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_4
_Saveframe_category NMR_applied_experiment
_Experiment_name HNCO
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_5
_Saveframe_category NMR_applied_experiment
_Experiment_name HN(CA)CO
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_6
_Saveframe_category NMR_applied_experiment
_Experiment_name CBCANH
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_7
_Saveframe_category NMR_applied_experiment
_Experiment_name CBCA(CO)NH
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_8
_Saveframe_category NMR_applied_experiment
_Experiment_name HNHA
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_9
_Saveframe_category NMR_applied_experiment
_Experiment_name HCCH-TOCSY
_BMRB_pulse_sequence_accession_number .
_Details .
save_
#######################
# Sample conditions #
#######################
save_Ex-cond_1
_Saveframe_category sample_conditions
_Details .
loop_
_Variable_type
_Variable_value
_Variable_value_error
_Variable_value_units
pH 7.1 0.1 n/a
temperature 298 0.2 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
DSS H 1 'methyl protons' ppm 0.0 internal direct . . . 1.0
DSS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118
DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530
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_shift_set_1
_Saveframe_category assigned_chemical_shifts
_Details .
loop_
_Sample_label
$sample_1
stop_
_Sample_conditions_label $Ex-cond_1
_Chem_shift_reference_set_label $chemical_shift_reference
_Mol_system_component_name MsrA
_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 . 2 LEU C C 177.584 0.100 1
2 . 2 LEU CA C 56.151 0.100 1
3 . 2 LEU CB C 42.785 0.100 1
4 . 3 PHE H H 8.171 0.010 1
5 . 3 PHE HA H 4.419 0.010 1
6 . 3 PHE HB2 H 3.029 0.010 1
7 . 3 PHE HB3 H 3.029 0.010 1
8 . 3 PHE C C 175.463 0.100 1
9 . 3 PHE CA C 58.996 0.100 1
10 . 3 PHE CB C 39.741 0.100 1
11 . 3 PHE N N 120.320 0.100 1
12 . 4 ASP H H 7.638 0.010 1
13 . 4 ASP HA H 4.478 0.010 1
14 . 4 ASP HB2 H 2.446 0.010 1
15 . 4 ASP HB3 H 2.446 0.010 1
16 . 4 ASP C C 176.385 0.100 1
17 . 4 ASP CA C 54.147 0.100 1
18 . 4 ASP CB C 42.531 0.100 1
19 . 4 ASP N N 123.978 0.100 1
20 . 5 LYS H H 8.260 0.010 1
21 . 5 LYS HA H 4.051 0.010 1
22 . 5 LYS HB2 H 1.811 0.010 1
23 . 5 LYS HB3 H 1.811 0.010 1
24 . 5 LYS HG2 H 1.465 0.010 1
25 . 5 LYS HG3 H 1.465 0.010 1
26 . 5 LYS HD2 H 1.681 0.010 1
27 . 5 LYS HD3 H 1.681 0.010 1
28 . 5 LYS HE2 H 2.979 0.010 1
29 . 5 LYS HE3 H 2.979 0.010 1
30 . 5 LYS C C 177.783 0.100 1
31 . 5 LYS CA C 57.835 0.100 1
32 . 5 LYS CB C 32.897 0.100 1
33 . 5 LYS CG C 25.819 0.100 1
34 . 5 LYS CD C 29.847 0.100 1
35 . 5 LYS CE C 42.800 0.100 1
36 . 5 LYS N N 122.882 0.100 1
37 . 6 LYS H H 8.432 0.010 1
38 . 6 LYS HA H 4.198 0.010 1
39 . 6 LYS HB2 H 1.675 0.010 1
40 . 6 LYS HB3 H 1.675 0.010 1
41 . 6 LYS HG2 H 1.257 0.010 1
42 . 6 LYS HG3 H 1.257 0.010 1
43 . 6 LYS HD2 H 1.596 0.010 1
44 . 6 LYS HD3 H 1.596 0.010 1
45 . 6 LYS HE2 H 2.896 0.010 1
46 . 6 LYS HE3 H 2.896 0.010 1
47 . 6 LYS C C 176.693 0.100 1
48 . 6 LYS CA C 57.521 0.100 1
49 . 6 LYS CB C 32.487 0.100 1
50 . 6 LYS CG C 25.209 0.100 1
51 . 6 LYS CD C 29.420 0.100 1
52 . 6 LYS CE C 42.504 0.100 1
53 . 6 LYS N N 120.849 0.100 1
54 . 7 HIS H H 7.894 0.010 1
55 . 7 HIS HA H 4.596 0.010 1
56 . 7 HIS HB2 H 3.148 0.010 1
57 . 7 HIS HB3 H 2.941 0.010 1
58 . 7 HIS C C 175.320 0.100 1
59 . 7 HIS CA C 56.130 0.100 1
60 . 7 HIS CB C 31.400 0.100 1
61 . 7 HIS N N 117.975 0.100 1
62 . 8 LEU H H 7.686 0.010 1
63 . 8 LEU HA H 4.478 0.010 1
64 . 8 LEU HB2 H 1.723 0.010 1
65 . 8 LEU HB3 H 1.723 0.010 1
66 . 8 LEU HG H 1.678 0.010 1
67 . 8 LEU HD1 H 0.956 0.010 1
68 . 8 LEU HD2 H 0.877 0.010 1
69 . 8 LEU C C 177.013 0.100 1
70 . 8 LEU CA C 54.800 0.100 1
71 . 8 LEU CB C 43.987 0.100 1
72 . 8 LEU CG C 27.658 0.100 1
73 . 8 LEU CD1 C 25.418 0.100 1
74 . 8 LEU CD2 C 24.280 0.100 1
75 . 8 LEU N N 122.405 0.100 1
76 . 9 VAL H H 7.686 0.010 1
77 . 9 VAL HA H 3.977 0.010 1
78 . 9 VAL HB H 2.103 0.010 1
79 . 9 VAL HG1 H 0.949 0.010 1
80 . 9 VAL HG2 H 0.698 0.010 1
81 . 9 VAL C C 174.122 0.100 1
82 . 9 VAL CA C 61.990 0.100 1
83 . 9 VAL CB C 32.774 0.100 1
84 . 9 VAL CG1 C 21.274 0.100 1
85 . 9 VAL CG2 C 20.360 0.100 1
86 . 9 VAL N N 122.405 0.100 1
87 . 10 SER H H 8.536 0.010 1
88 . 10 SER HA H 4.573 0.010 1
89 . 10 SER HB2 H 3.760 0.010 1
90 . 10 SER HB3 H 3.760 0.010 1
91 . 10 SER C C 174.833 0.100 1
92 . 10 SER CA C 56.853 0.100 1
93 . 10 SER CB C 63.536 0.100 1
94 . 10 SER N N 122.647 0.100 1
95 . 11 PRO HA H 3.134 0.010 1
96 . 11 PRO HB2 H 1.511 0.010 1
97 . 11 PRO HB3 H 1.511 0.010 1
98 . 11 PRO HG2 H 1.787 0.010 1
99 . 11 PRO HD2 H 3.632 0.010 1
100 . 11 PRO HD3 H 3.632 0.010 1
101 . 11 PRO C C 179.125 0.100 1
102 . 11 PRO CA C 65.763 0.100 1
103 . 11 PRO CB C 31.189 0.100 1
104 . 12 ALA H H 7.560 0.010 1
105 . 12 ALA HA H 3.948 0.010 1
106 . 12 ALA HB H 1.159 0.010 1
107 . 12 ALA C C 178.614 0.100 1
108 . 12 ALA CA C 54.550 0.100 1
109 . 12 ALA CB C 19.119 0.100 1
110 . 12 ALA N N 117.140 0.100 1
111 . 13 ASP H H 7.391 0.010 1
112 . 13 ASP HA H 4.587 0.010 1
113 . 13 ASP HB2 H 2.669 0.010 1
114 . 13 ASP HB3 H 2.378 0.010 1
115 . 13 ASP C C 175.686 0.100 1
116 . 13 ASP CA C 54.394 0.100 1
117 . 13 ASP CB C 42.480 0.100 1
118 . 13 ASP N N 115.868 0.100 1
119 . 14 ALA H H 6.924 0.010 1
120 . 14 ALA HA H 4.453 0.010 1
121 . 14 ALA C C 178.152 0.100 1
122 . 14 ALA CA C 51.902 0.100 1
123 . 14 ALA CB C 20.131 0.100 1
124 . 14 ALA N N 122.594 0.100 1
125 . 15 LEU H H 7.478 0.010 1
126 . 15 LEU HA H 3.853 0.010 1
127 . 15 LEU C C 177.923 0.100 1
128 . 15 LEU CA C 54.776 0.100 1
129 . 15 LEU CB C 40.201 0.100 1
130 . 15 LEU N N 120.223 0.100 1
131 . 16 PRO C C 178.724 0.100 1
132 . 16 PRO CA C 64.754 0.100 1
133 . 16 PRO CB C 32.168 0.100 1
134 . 17 GLY H H 8.412 0.010 1
135 . 17 GLY HA2 H 3.979 0.010 1
136 . 17 GLY HA3 H 3.174 0.010 1
137 . 17 GLY C C 173.261 0.100 1
138 . 17 GLY CA C 46.182 0.100 1
139 . 17 GLY N N 107.461 0.100 1
140 . 18 ARG H H 7.727 0.010 1
141 . 18 ARG HA H 4.082 0.010 1
142 . 18 ARG HB2 H 2.082 0.010 1
143 . 18 ARG HB3 H 2.082 0.010 1
144 . 18 ARG C C 175.578 0.100 1
145 . 18 ARG CA C 54.877 0.100 1
146 . 18 ARG CB C 29.889 0.100 1
147 . 18 ARG N N 117.333 0.100 1
148 . 19 ASN C C 175.471 0.100 1
149 . 19 ASN CA C 53.725 0.100 1
150 . 19 ASN CB C 39.300 0.100 1
151 . 20 THR H H 6.913 0.010 1
152 . 20 THR HA H 4.528 0.010 1
153 . 20 THR HB H 3.946 0.010 1
154 . 20 THR HG2 H 1.178 0.010 1
155 . 20 THR C C 172.317 0.100 1
156 . 20 THR CA C 58.910 0.100 1
157 . 20 THR CB C 70.255 0.100 1
158 . 20 THR CG2 C 22.181 0.100 1
159 . 20 THR N N 114.307 0.100 1
160 . 21 PRO HA H 4.374 0.010 1
161 . 21 PRO HB2 H 2.830 0.010 1
162 . 21 PRO HB3 H 2.830 0.010 1
163 . 21 PRO C C 177.237 0.100 1
164 . 21 PRO CA C 62.140 0.100 1
165 . 21 PRO CB C 33.289 0.100 1
166 . 22 MET H H 8.675 0.010 1
167 . 22 MET C C 175.492 0.100 1
168 . 22 MET CA C 52.899 0.100 1
169 . 22 MET CB C 32.613 0.100 1
170 . 22 MET N N 124.362 0.100 1
171 . 23 PRO HB2 H 2.250 0.010 1
172 . 23 PRO HB3 H 1.830 0.010 1
173 . 23 PRO HG2 H 1.922 0.010 1
174 . 23 PRO HG3 H 1.922 0.010 1
175 . 23 PRO HD2 H 3.687 0.010 1
176 . 23 PRO HD3 H 3.563 0.010 1
177 . 23 PRO C C 176.751 0.100 1
178 . 23 PRO CA C 63.656 0.100 1
179 . 23 PRO CB C 32.084 0.100 1
180 . 23 PRO CG C 27.700 0.100 1
181 . 23 PRO CD C 50.942 0.100 1
182 . 24 VAL H H 7.980 0.010 1
183 . 24 VAL HA H 4.245 0.010 1
184 . 24 VAL HB H 1.614 0.010 1
185 . 24 VAL HG1 H 0.817 0.010 1
186 . 24 VAL HG2 H 0.545 0.010 1
187 . 24 VAL C C 175.463 0.100 1
188 . 24 VAL CA C 61.124 0.100 1
189 . 24 VAL CB C 35.461 0.100 1
190 . 24 VAL CG1 C 22.030 0.100 1
191 . 24 VAL CG2 C 21.501 0.100 1
192 . 24 VAL N N 123.690 0.100 1
193 . 25 ALA H H 9.635 0.010 1
194 . 25 ALA HA H 4.156 0.010 1
195 . 25 ALA HB H 1.435 0.010 1
196 . 25 ALA C C 177.609 0.100 1
197 . 25 ALA CA C 52.851 0.100 1
198 . 25 ALA CB C 19.506 0.100 1
199 . 25 ALA N N 131.529 0.100 1
200 . 26 THR H H 7.939 0.010 1
201 . 26 THR HA H 3.948 0.010 1
202 . 26 THR HB H 4.092 0.010 1
203 . 26 THR HG2 H 1.206 0.010 1
204 . 26 THR C C 176.379 0.100 1
205 . 26 THR CA C 65.429 0.100 1
206 . 26 THR CB C 69.566 0.100 1
207 . 26 THR CG2 C 23.164 0.100 1
208 . 26 THR N N 111.494 0.100 1
209 . 27 LEU H H 7.652 0.010 1
210 . 27 LEU HA H 4.944 0.010 1
211 . 27 LEU HB2 H 1.540 0.010 1
212 . 27 LEU HB3 H 0.962 0.010 1
213 . 27 LEU HG H 1.475 0.010 1
214 . 27 LEU HD1 H 0.782 0.010 1
215 . 27 LEU HD2 H 0.692 0.010 1
216 . 27 LEU C C 177.094 0.100 1
217 . 27 LEU CA C 53.273 0.100 1
218 . 27 LEU CB C 44.831 0.100 1
219 . 27 LEU CG C 26.840 0.100 1
220 . 27 LEU CD1 C 25.722 0.100 1
221 . 27 LEU CD2 C 22.360 0.100 1
222 . 27 LEU N N 118.104 0.100 1
223 . 28 HIS H H 9.159 0.010 1
224 . 28 HIS HA H 4.129 0.010 1
225 . 28 HIS HB2 H 3.029 0.010 1
226 . 28 HIS HB3 H 2.700 0.010 1
227 . 28 HIS C C 178.496 0.100 1
228 . 28 HIS CA C 58.760 0.100 1
229 . 28 HIS CB C 33.097 0.100 1
230 . 28 HIS N N 125.952 0.100 1
231 . 29 ALA H H 8.460 0.010 1
232 . 29 ALA HA H 3.799 0.010 1
233 . 29 ALA HB H 1.123 0.010 1
234 . 29 ALA C C 177.208 0.100 1
235 . 29 ALA CA C 54.877 0.100 1
236 . 29 ALA CB C 19.590 0.100 1
237 . 29 ALA N N 129.449 0.100 1
238 . 30 VAL H H 7.691 0.010 1
239 . 30 VAL HA H 2.876 0.010 1
240 . 30 VAL HB H 1.195 0.010 1
241 . 30 VAL HG1 H 0.337 0.010 1
242 . 30 VAL HG2 H -1.013 0.010 1
243 . 30 VAL C C 178.095 0.100 1
244 . 30 VAL CA C 63.994 0.100 1
245 . 30 VAL CB C 31.746 0.100 1
246 . 30 VAL CG1 C 20.866 0.100 1
247 . 30 VAL CG2 C 19.290 0.100 1
248 . 30 VAL N N 114.073 0.100 1
249 . 31 ASN H H 7.526 0.010 1
250 . 31 ASN HA H 4.409 0.010 1
251 . 31 ASN HB2 H 2.195 0.010 1
252 . 31 ASN HB3 H 2.195 0.010 1
253 . 31 ASN C C 177.208 0.100 1
254 . 31 ASN CA C 52.477 0.100 1
255 . 31 ASN CB C 39.453 0.100 1
256 . 31 ASN N N 113.002 0.100 1
257 . 32 GLY H H 7.485 0.010 1
258 . 32 GLY HA2 H 3.784 0.010 1
259 . 32 GLY HA3 H 3.784 0.010 1
260 . 32 GLY C C 174.348 0.100 1
261 . 32 GLY CA C 47.038 0.100 1
262 . 32 GLY N N 105.956 0.100 1
263 . 33 HIS H H 8.153 0.010 1
264 . 33 HIS HA H 4.736 0.010 1
265 . 33 HIS HB2 H 2.663 0.010 1
266 . 33 HIS HB3 H 2.040 0.010 1
267 . 33 HIS C C 174.805 0.100 1
268 . 33 HIS CA C 52.766 0.100 1
269 . 33 HIS CB C 29.045 0.100 1
270 . 33 HIS N N 117.558 0.100 1
271 . 34 SER H H 7.840 0.010 1
272 . 34 SER C C 177.552 0.100 1
273 . 34 SER CA C 59.435 0.100 1
274 . 34 SER CB C 63.741 0.100 1
275 . 34 SER N N 111.848 0.100 1
276 . 35 MET H H 8.193 0.010 1
277 . 35 MET HA H 4.632 0.010 1
278 . 35 MET C C 177.866 0.100 1
279 . 35 MET CA C 56.660 0.100 1
280 . 35 MET N N 124.521 0.100 1
281 . 36 THR H H 8.071 0.010 1
282 . 36 THR HA H 4.379 0.010 1
283 . 36 THR HB H 4.001 0.010 1
284 . 36 THR HG2 H 0.849 0.010 1
285 . 36 THR C C 175.521 0.100 1
286 . 36 THR CA C 62.728 0.100 1
287 . 36 THR CB C 70.494 0.100 1
288 . 36 THR N N 107.958 0.100 1
289 . 37 ASN H H 8.300 0.010 1
290 . 37 ASN HA H 4.409 0.010 1
291 . 37 ASN C C 174.920 0.100 1
292 . 37 ASN CA C 54.961 0.100 1
293 . 37 ASN CB C 39.682 0.100 1
294 . 37 ASN N N 121.850 0.100 1
295 . 38 VAL H H 8.244 0.010 1
296 . 38 VAL HA H 4.096 0.010 1
297 . 38 VAL HB H 1.867 0.010 1
298 . 38 VAL HG1 H 0.754 0.010 1
299 . 38 VAL HG2 H 0.482 0.010 1
300 . 38 VAL C C 173.890 0.100 1
301 . 38 VAL CA C 59.773 0.100 1
302 . 38 VAL CB C 32.590 0.100 1
303 . 38 VAL CG1 C 21.389 0.100 1
304 . 38 VAL CG2 C 21.240 0.100 1
305 . 38 VAL N N 124.629 0.100 1
306 . 39 PRO C C 175.549 0.100 1
307 . 39 PRO CA C 63.150 0.100 1
308 . 39 PRO CB C 32.506 0.100 1
309 . 40 ASP H H 8.102 0.010 1
310 . 40 ASP HA H 4.141 0.010 1
311 . 40 ASP HB2 H 2.440 0.010 1
312 . 40 ASP HB3 H 2.440 0.010 1
313 . 40 ASP C C 177.609 0.100 1
314 . 40 ASP CA C 56.818 0.100 1
315 . 40 ASP CB C 40.948 0.100 1
316 . 40 ASP N N 121.256 0.100 1
317 . 41 GLY H H 8.511 0.010 1
318 . 41 GLY HA2 H 4.126 0.010 1
319 . 41 GLY HA3 H 3.461 0.010 1
320 . 41 GLY C C 175.206 0.100 1
321 . 41 GLY CA C 45.506 0.100 1
322 . 41 GLY N N 112.593 0.100 1
323 . 42 MET H H 7.770 0.010 1
324 . 42 MET HA H 4.498 0.010 1
325 . 42 MET C C 174.748 0.100 1
326 . 42 MET CA C 56.987 0.100 1
327 . 42 MET CB C 31.915 0.100 1
328 . 42 MET N N 118.107 0.100 1
329 . 43 GLU H H 8.173 0.010 1
330 . 43 GLU HA H 4.334 0.010 1
331 . 43 GLU C C 173.318 0.100 1
332 . 43 GLU CA C 55.130 0.100 1
333 . 43 GLU CB C 34.110 0.100 1
334 . 43 GLU N N 118.666 0.100 1
335 . 44 ILE H H 7.493 0.010 1
336 . 44 ILE HA H 5.257 0.010 1
337 . 44 ILE HB H 1.315 0.010 1
338 . 44 ILE HG12 H 1.380 0.010 1
339 . 44 ILE HG13 H 0.656 0.010 1
340 . 44 ILE HG2 H 0.531 0.010 1
341 . 44 ILE HD1 H 0.698 0.010 1
342 . 44 ILE C C 176.093 0.100 1
343 . 44 ILE CA C 60.195 0.100 1
344 . 44 ILE CB C 41.792 0.100 1
345 . 44 ILE CG1 C 28.480 0.100 1
346 . 44 ILE CG2 C 19.220 0.100 1
347 . 44 ILE CD1 C 14.889 0.100 1
348 . 44 ILE N N 117.582 0.100 1
349 . 45 ALA H H 9.500 0.010 1
350 . 45 ALA HA H 4.885 0.010 1
351 . 45 ALA HB H 1.105 0.010 1
352 . 45 ALA C C 175.435 0.100 1
353 . 45 ALA CA C 50.572 0.100 1
354 . 45 ALA CB C 23.558 0.100 1
355 . 45 ALA N N 128.325 0.100 1
356 . 46 ILE H H 7.343 0.010 1
357 . 46 ILE HA H 4.944 0.010 1
358 . 46 ILE HB H 1.719 0.010 1
359 . 46 ILE HG2 H 0.809 0.010 1
360 . 46 ILE HD1 H 0.634 0.010 1
361 . 46 ILE C C 175.664 0.100 1
362 . 46 ILE CA C 60.364 0.100 1
363 . 46 ILE CB C 40.695 0.100 1
364 . 46 ILE CG2 C 19.372 0.100 1
365 . 46 ILE CD1 C 17.504 0.100 1
366 . 46 ILE N N 118.924 0.100 1
367 . 47 PHE H H 7.864 0.010 1
368 . 47 PHE HA H 5.078 0.010 1
369 . 47 PHE HB2 H 3.112 0.010 1
370 . 47 PHE HB3 H 2.280 0.010 1
371 . 47 PHE C C 173.518 0.100 1
372 . 47 PHE CA C 56.059 0.100 1
373 . 47 PHE CB C 46.097 0.100 1
374 . 47 PHE N N 123.232 0.100 1
375 . 48 ALA H H 9.426 0.010 1
376 . 48 ALA HA H 5.123 0.010 1
377 . 48 ALA HB H 1.613 0.010 1
378 . 48 ALA C C 176.350 0.100 1
379 . 48 ALA CA C 52.598 0.100 1
380 . 48 ALA CB C 23.389 0.100 1
381 . 48 ALA N N 125.244 0.100 1
382 . 49 MET H H 9.356 0.010 1
383 . 49 MET HA H 3.873 0.010 1
384 . 49 MET HE H 1.593 0.010 1
385 . 49 MET C C 172.946 0.100 1
386 . 49 MET CA C 55.046 0.100 1
387 . 49 MET CE C 16.425 0.100 1
388 . 49 MET N N 121.804 0.100 1
389 . 50 GLY H H 9.387 0.010 1
390 . 50 GLY C C 173.604 0.100 1
391 . 50 GLY CA C 43.227 0.100 1
392 . 50 GLY N N 109.083 0.100 1
393 . 51 CYS H H 9.140 0.010 1
394 . 51 CYS C C 179.697 0.100 1
395 . 51 CYS CA C 59.206 0.100 1
396 . 51 CYS N N 121.530 0.100 1
397 . 53 TRP H H 7.809 0.010 1
398 . 53 TRP HA H 3.977 0.010 1
399 . 53 TRP C C 181.156 0.100 1
400 . 53 TRP CA C 58.230 0.100 1
401 . 53 TRP CB C 29.168 0.100 1
402 . 53 TRP N N 123.767 0.100 1
403 . 54 GLY H H 8.368 0.010 1
404 . 54 GLY HA2 H 3.705 0.010 1
405 . 54 GLY HA3 H 3.705 0.010 1
406 . 54 GLY C C 176.264 0.100 1
407 . 54 GLY CA C 47.619 0.100 1
408 . 54 GLY N N 106.403 0.100 1
409 . 55 VAL H H 6.911 0.010 1
410 . 55 VAL HA H 3.353 0.010 1
411 . 55 VAL HB H 1.985 0.010 1
412 . 55 VAL HG1 H 1.199 0.010 1
413 . 55 VAL HG2 H 0.837 0.010 1
414 . 55 VAL C C 177.409 0.100 1
415 . 55 VAL CA C 66.273 0.100 1
416 . 55 VAL CB C 32.980 0.100 1
417 . 55 VAL CG1 C 22.958 0.100 1
418 . 55 VAL CG2 C 24.303 0.100 1
419 . 55 VAL N N 121.263 0.100 1
420 . 56 GLU H H 8.808 0.010 1
421 . 56 GLU C C 178.152 0.100 1
422 . 56 GLU CA C 61.870 0.100 1
423 . 56 GLU CB C 28.853 0.100 1
424 . 56 GLU N N 119.821 0.100 1
425 . 57 ARG H H 6.349 0.010 1
426 . 57 ARG C C 176.436 0.100 1
427 . 57 ARG CA C 57.494 0.100 1
428 . 57 ARG CB C 31.240 0.100 1
429 . 57 ARG N N 115.728 0.100 1
430 . 58 LEU H H 6.766 0.010 1
431 . 58 LEU HA H 3.427 0.010 1
432 . 58 LEU HB2 H 1.476 0.010 1
433 . 58 LEU HB3 H 1.200 0.010 1
434 . 58 LEU HG H 0.778 0.010 1
435 . 58 LEU HD1 H 0.436 0.010 1
436 . 58 LEU HD2 H 0.259 0.010 1
437 . 58 LEU C C 178.925 0.100 1
438 . 58 LEU CA C 57.578 0.100 1
439 . 58 LEU CB C 42.552 0.100 1
440 . 58 LEU CG C 26.213 0.100 1
441 . 58 LEU CD1 C 24.150 0.100 1
442 . 58 LEU CD2 C 26.213 0.100 1
443 . 58 LEU N N 117.330 0.100 1
444 . 59 PHE H H 6.967 0.010 1
445 . 59 PHE HA H 4.349 0.010 1
446 . 59 PHE HB2 H 2.875 0.010 1
447 . 59 PHE HB3 H 2.875 0.010 1
448 . 59 PHE C C 179.440 0.100 1
449 . 59 PHE CA C 62.306 0.100 1
450 . 59 PHE CB C 41.708 0.100 1
451 . 59 PHE N N 110.219 0.100 1
452 . 60 TRP H H 8.473 0.010 1
453 . 60 TRP HA H 4.602 0.010 1
454 . 60 TRP HB2 H 3.752 0.010 1
455 . 60 TRP HB3 H 3.402 0.010 1
456 . 60 TRP C C 178.238 0.100 1
457 . 60 TRP CA C 60.702 0.100 1
458 . 60 TRP CB C 25.162 0.100 1
459 . 60 TRP N N 116.441 0.100 1
460 . 61 GLN H H 6.821 0.010 1
461 . 61 GLN HA H 4.364 0.010 1
462 . 61 GLN HB2 H 2.171 0.010 1
463 . 61 GLN HB3 H 1.775 0.010 1
464 . 61 GLN HG2 H 2.419 0.010 1
465 . 61 GLN HG3 H 2.165 0.010 1
466 . 61 GLN C C 176.608 0.100 1
467 . 61 GLN CA C 56.650 0.100 1
468 . 61 GLN CB C 31.071 0.100 1
469 . 61 GLN CG C 35.950 0.100 1
470 . 61 GLN N N 117.935 0.100 1
471 . 62 LEU H H 7.369 0.010 1
472 . 62 LEU HA H 4.483 0.010 1
473 . 62 LEU HB2 H 1.190 0.010 1
474 . 62 LEU HB3 H 1.190 0.010 1
475 . 62 LEU HD1 H 0.696 0.010 1
476 . 62 LEU C C 175.549 0.100 1
477 . 62 LEU CA C 53.526 0.100 1
478 . 62 LEU CB C 41.539 0.100 1
479 . 62 LEU CD1 C 23.143 0.100 1
480 . 62 LEU N N 122.324 0.100 1
481 . 63 PRO HA H 4.336 0.010 1
482 . 63 PRO C C 176.722 0.100 1
483 . 63 PRO CA C 63.910 0.100 1
484 . 63 PRO CB C 31.577 0.100 1
485 . 64 GLY H H 8.567 0.010 1
486 . 64 GLY HA2 H 4.349 0.010 1
487 . 64 GLY HA3 H 3.546 0.010 1
488 . 64 GLY C C 175.692 0.100 1
489 . 64 GLY CA C 46.435 0.100 1
490 . 64 GLY N N 109.285 0.100 1
491 . 65 VAL H H 7.661 0.010 1
492 . 65 VAL HA H 4.126 0.010 1
493 . 65 VAL HB H 2.401 0.010 1
494 . 65 VAL HG1 H 1.053 0.010 1
495 . 65 VAL HG2 H 0.879 0.010 1
496 . 65 VAL C C 175.921 0.100 1
497 . 65 VAL CA C 64.754 0.100 1
498 . 65 VAL CB C 31.492 0.100 1
499 . 65 VAL CG1 C 23.705 0.100 1
500 . 65 VAL CG2 C 23.033 0.100 1
501 . 65 VAL N N 122.893 0.100 1
502 . 66 TYR H H 9.599 0.010 1
503 . 66 TYR HA H 4.320 0.010 1
504 . 66 TYR HB2 H 3.124 0.010 1
505 . 66 TYR HB3 H 2.538 0.010 1
506 . 66 TYR C C 176.951 0.100 1
507 . 66 TYR CA C 60.533 0.100 1
508 . 66 TYR CB C 41.286 0.100 1
509 . 66 TYR N N 132.918 0.100 1
510 . 67 SER H H 8.215 0.010 1
511 . 67 SER HA H 3.992 0.010 1
512 . 67 SER HB2 H 3.740 0.010 1
513 . 67 SER HB3 H 3.740 0.010 1
514 . 67 SER C C 171.630 0.100 1
515 . 67 SER CA C 58.169 0.100 1
516 . 67 SER CB C 65.345 0.100 1
517 . 67 SER N N 111.589 0.100 1
518 . 68 THR H H 7.002 0.010 1
519 . 68 THR HA H 5.599 0.010 1
520 . 68 THR HB H 4.467 0.010 1
521 . 68 THR HG2 H 1.338 0.010 1
522 . 68 THR C C 172.803 0.100 1
523 . 68 THR CA C 60.870 0.100 1
524 . 68 THR CB C 73.195 0.100 1
525 . 68 THR CG2 C 23.780 0.100 1
526 . 68 THR N N 110.131 0.100 1
527 . 69 ALA H H 8.001 0.010 1
528 . 69 ALA HA H 4.811 0.010 1
529 . 69 ALA HB H 1.356 0.010 1
530 . 69 ALA C C 176.465 0.100 1
531 . 69 ALA CA C 52.175 0.100 1
532 . 69 ALA CB C 23.980 0.100 1
533 . 69 ALA N N 116.866 0.100 1
534 . 70 ALA H H 9.363 0.010 1
535 . 70 ALA HA H 4.751 0.010 1
536 . 70 ALA HB H 0.305 0.010 1
537 . 70 ALA C C 178.610 0.100 1
538 . 70 ALA CA C 51.162 0.100 1
539 . 70 ALA CB C 17.986 0.100 1
540 . 70 ALA N N 126.369 0.100 1
541 . 71 GLY H H 8.876 0.010 1
542 . 71 GLY HA2 H 3.460 0.010 1
543 . 71 GLY HA3 H 3.130 0.010 1
544 . 71 GLY C C 169.942 0.100 1
545 . 71 GLY CA C 47.701 0.100 1
546 . 71 GLY N N 112.280 0.100 1
547 . 72 TYR H H 8.741 0.010 1
548 . 72 TYR HA H 5.525 0.010 1
549 . 72 TYR C C 175.149 0.100 1
550 . 72 TYR CA C 53.442 0.100 1
551 . 72 TYR CB C 41.539 0.100 1
552 . 72 TYR N N 120.268 0.100 1
553 . 73 THR H H 8.546 0.010 1
554 . 73 THR HA H 4.587 0.010 1
555 . 73 THR HB H 3.794 0.010 1
556 . 73 THR HG2 H 0.447 0.010 1
557 . 73 THR C C 172.860 0.100 1
558 . 73 THR CA C 62.474 0.100 1
559 . 73 THR CB C 69.143 0.100 1
560 . 73 THR CG2 C 19.390 0.100 1
561 . 73 THR N N 116.203 0.100 1
562 . 74 GLY H H 7.458 0.010 1
563 . 74 GLY HA2 H 4.320 0.010 1
564 . 74 GLY HA3 H 3.204 0.010 1
565 . 74 GLY C C 174.348 0.100 1
566 . 74 GLY CA C 44.662 0.100 1
567 . 74 GLY N N 108.911 0.100 1
568 . 75 GLY H H 8.902 0.010 1
569 . 75 GLY HA2 H 3.263 0.010 1
570 . 75 GLY HA3 H 3.263 0.010 1
571 . 75 GLY C C 174.147 0.100 1
572 . 75 GLY CA C 41.961 0.100 1
573 . 75 GLY N N 111.942 0.100 1
574 . 76 TYR H H 7.590 0.010 1
575 . 76 TYR HA H 4.647 0.010 1
576 . 76 TYR C C 176.608 0.100 1
577 . 76 TYR CA C 58.760 0.100 1
578 . 76 TYR CB C 41.370 0.100 1
579 . 76 TYR N N 118.411 0.100 1
580 . 77 THR H H 6.532 0.010 1
581 . 77 THR HA H 4.141 0.010 1
582 . 77 THR HB H 3.302 0.010 1
583 . 77 THR HG2 H 0.790 0.010 1
584 . 77 THR C C 173.032 0.100 1
585 . 77 THR CA C 62.559 0.100 1
586 . 77 THR CB C 72.858 0.100 1
587 . 77 THR CG2 C 21.090 0.100 1
588 . 77 THR N N 116.674 0.100 1
589 . 80 PRO CA C 63.125 0.100 1
590 . 80 PRO CB C 33.803 0.100 1
591 . 81 THR H H 8.167 0.010 1
592 . 81 THR HA H 4.647 0.010 1
593 . 81 THR C C 175.206 0.100 1
594 . 81 THR CA C 59.036 0.100 1
595 . 81 THR CB C 72.161 0.100 1
596 . 81 THR N N 106.932 0.100 1
597 . 82 TYR H H 11.548 0.010 1
598 . 82 TYR C C 180.241 0.100 1
599 . 82 TYR CA C 63.470 0.100 1
600 . 82 TYR CB C 38.525 0.100 1
601 . 82 TYR N N 125.693 0.100 1
602 . 83 ARG H H 8.312 0.010 1
603 . 83 ARG HA H 3.724 0.010 1
604 . 83 ARG C C 180.295 0.100 1
605 . 83 ARG CA C 59.703 0.100 1
606 . 83 ARG N N 117.421 0.100 1
607 . 84 GLU H H 7.411 0.010 1
608 . 84 GLU HA H 3.739 0.010 1
609 . 84 GLU C C 180.952 0.100 1
610 . 84 GLU CA C 59.074 0.100 1
611 . 84 GLU CB C 30.115 0.100 1
612 . 84 GLU N N 118.667 0.100 1
613 . 85 VAL H H 8.608 0.010 1
614 . 85 VAL HA H 3.260 0.010 1
615 . 85 VAL HB H 1.362 0.010 1
616 . 85 VAL HG1 H 0.390 0.010 1
617 . 85 VAL HG2 H 0.004 0.010 1
618 . 85 VAL C C 180.870 0.100 1
619 . 85 VAL CA C 66.571 0.100 1
620 . 85 VAL CB C 31.300 0.100 1
621 . 85 VAL CG1 C 20.343 0.100 1
622 . 85 VAL CG2 C 21.539 0.100 1
623 . 85 VAL N N 123.454 0.100 1
624 . 86 CYS H H 8.449 0.010 1
625 . 86 CYS HA H 4.082 0.010 1
626 . 86 CYS CA C 61.581 0.100 1
627 . 86 CYS CB C 28.103 0.100 1
628 . 86 CYS N N 117.579 0.100 1
629 . 87 SER H H 7.278 0.010 1
630 . 87 SER HA H 4.201 0.010 1
631 . 87 SER HB2 H 4.019 0.010 1
632 . 87 SER HB3 H 4.019 0.010 1
633 . 87 SER C C 175.950 0.100 1
634 . 87 SER CA C 61.030 0.100 1
635 . 87 SER CB C 65.621 0.100 1
636 . 87 SER N N 114.713 0.100 1
637 . 88 GLY H H 7.339 0.010 1
638 . 88 GLY HA2 H 4.441 0.010 1
639 . 88 GLY HA3 H 3.469 0.010 1
640 . 88 GLY C C 176.093 0.100 1
641 . 88 GLY CA C 46.737 0.100 1
642 . 88 GLY N N 108.684 0.100 1
643 . 89 ASP H H 8.134 0.010 1
644 . 89 ASP HA H 4.825 0.010 1
645 . 89 ASP HB2 H 3.048 0.010 1
646 . 89 ASP HB3 H 2.425 0.010 1
647 . 89 ASP C C 176.236 0.100 1
648 . 89 ASP CA C 56.860 0.100 1
649 . 89 ASP CB C 40.109 0.100 1
650 . 89 ASP N N 118.357 0.100 1
651 . 90 THR H H 8.191 0.010 1
652 . 90 THR HA H 5.302 0.010 1
653 . 90 THR HB H 4.046 0.010 1
654 . 90 THR HG2 H 0.939 0.010 1
655 . 90 THR C C 176.407 0.100 1
656 . 90 THR CA C 62.305 0.100 1
657 . 90 THR CB C 71.885 0.100 1
658 . 90 THR N N 106.015 0.100 1
659 . 91 GLY H H 6.682 0.010 1
660 . 91 GLY HA2 H 4.171 0.010 1
661 . 91 GLY HA3 H 3.710 0.010 1
662 . 91 GLY C C 174.090 0.100 1
663 . 91 GLY CA C 46.607 0.100 1
664 . 91 GLY N N 109.396 0.100 1
665 . 92 HIS H H 8.009 0.010 1
666 . 92 HIS HA H 4.007 0.010 1
667 . 92 HIS C C 175.832 0.100 1
668 . 92 HIS CA C 57.409 0.100 1
669 . 92 HIS CB C 33.350 0.100 1
670 . 92 HIS N N 120.908 0.100 1
671 . 93 ALA H H 9.569 0.010 1
672 . 93 ALA HA H 4.483 0.010 1
673 . 93 ALA HB H 1.215 0.010 1
674 . 93 ALA C C 178.982 0.100 1
675 . 93 ALA CA C 50.994 0.100 1
676 . 93 ALA CB C 20.603 0.100 1
677 . 93 ALA N N 122.523 0.100 1
678 . 94 GLU H H 9.113 0.010 1
679 . 94 GLU C C 177.294 0.100 1
680 . 94 GLU CA C 59.013 0.100 1
681 . 94 GLU N N 119.945 0.100 1
682 . 95 ALA H H 9.566 0.010 1
683 . 95 ALA HA H 5.406 0.010 1
684 . 95 ALA HB H 1.231 0.010 1
685 . 95 ALA C C 175.091 0.100 1
686 . 95 ALA CA C 51.416 0.100 1
687 . 95 ALA CB C 26.006 0.100 1
688 . 95 ALA N N 129.724 0.100 1
689 . 96 VAL H H 8.920 0.010 1
690 . 96 VAL HA H 5.346 0.010 1
691 . 96 VAL HB H 1.812 0.010 1
692 . 96 VAL HG1 H 0.984 0.010 1
693 . 96 VAL HG2 H 0.984 0.010 1
694 . 96 VAL C C 173.490 0.100 1
695 . 96 VAL CA C 60.001 0.100 1
696 . 96 VAL CB C 36.484 0.100 1
697 . 96 VAL CG1 C 22.777 0.100 1
698 . 96 VAL CG2 C 22.777 0.100 1
699 . 96 VAL N N 114.374 0.100 1
700 . 97 ARG H H 8.366 0.010 1
701 . 97 ARG HA H 4.245 0.010 1
702 . 97 ARG C C 175.606 0.100 1
703 . 97 ARG CA C 54.455 0.100 1
704 . 97 ARG N N 125.710 0.100 1
705 . 98 ILE H H 9.447 0.010 1
706 . 98 ILE HA H 4.573 0.010 1
707 . 98 ILE HB H 1.720 0.010 1
708 . 98 ILE HG12 H 1.074 0.010 1
709 . 98 ILE HG13 H 0.601 0.010 1
710 . 98 ILE HG2 H 0.921 0.010 1
711 . 98 ILE HD1 H -0.250 0.010 1
712 . 98 ILE C C 175.120 0.100 1
713 . 98 ILE CA C 60.702 0.100 1
714 . 98 ILE CB C 41.539 0.100 1
715 . 98 ILE CG1 C 29.383 0.100 1
716 . 98 ILE CG2 C 20.941 0.100 1
717 . 98 ILE CD1 C 15.630 0.100 1
718 . 98 ILE N N 130.129 0.100 1
719 . 99 VAL H H 8.515 0.010 1
720 . 99 VAL HA H 5.123 0.010 1
721 . 99 VAL HB H 2.336 0.010 1
722 . 99 VAL HG1 H 0.931 0.010 1
723 . 99 VAL HG2 H 0.836 0.010 1
724 . 99 VAL C C 176.665 0.100 1
725 . 99 VAL CA C 61.461 0.100 1
726 . 99 VAL CB C 32.675 0.100 1
727 . 99 VAL CG1 C 24.082 0.100 1
728 . 99 VAL CG2 C 22.578 0.100 1
729 . 99 VAL N N 127.556 0.100 1
730 . 100 TYR H H 9.388 0.010 1
731 . 100 TYR HA H 5.554 0.010 1
732 . 100 TYR HB2 H 2.746 0.010 1
733 . 100 TYR HB3 H 2.621 0.010 1
734 . 100 TYR C C 171.687 0.100 1
735 . 100 TYR CA C 55.552 0.100 1
736 . 100 TYR CB C 42.299 0.100 1
737 . 100 TYR N N 125.950 0.100 1
738 . 101 ASP H H 8.431 0.010 1
739 . 101 ASP HA H 5.004 0.010 1
740 . 101 ASP HB2 H 3.125 0.010 1
741 . 101 ASP HB3 H 2.529 0.010 1
742 . 101 ASP CA C 50.267 0.100 1
743 . 101 ASP CB C 42.480 0.100 1
744 . 101 ASP N N 120.296 0.100 1
745 . 102 PRO C C 178.381 0.100 1
746 . 102 PRO CA C 63.830 0.100 1
747 . 102 PRO CB C 32.746 0.100 1
748 . 103 SER H H 8.393 0.010 1
749 . 103 SER HA H 4.349 0.010 1
750 . 103 SER C C 174.577 0.100 1
751 . 103 SER CA C 60.857 0.100 1
752 . 103 SER CB C 63.739 0.100 1
753 . 103 SER N N 115.679 0.100 1
754 . 104 VAL H H 8.167 0.010 1
755 . 104 VAL HA H 4.022 0.010 1
756 . 104 VAL HB H 1.996 0.010 1
757 . 104 VAL C C 175.349 0.100 1
758 . 104 VAL CA C 64.440 0.100 1
759 . 104 VAL CB C 35.004 0.100 1
760 . 104 VAL CG1 C 21.900 0.100 1
761 . 104 VAL CG2 C 21.900 0.100 1
762 . 104 VAL N N 123.386 0.100 1
763 . 105 ILE H H 8.673 0.010 1
764 . 105 ILE HA H 4.647 0.010 1
765 . 105 ILE C C 171.373 0.100 1
766 . 105 ILE CA C 59.534 0.100 1
767 . 105 ILE CB C 42.091 0.100 1
768 . 105 ILE N N 122.150 0.100 1
769 . 106 SER H H 8.302 0.010 1
770 . 106 SER HA H 4.885 0.010 1
771 . 106 SER HB2 H 4.438 0.010 1
772 . 106 SER HB3 H 3.993 0.010 1
773 . 106 SER C C 176.379 0.100 1
774 . 106 SER CA C 56.481 0.100 1
775 . 106 SER CB C 67.286 0.100 1
776 . 106 SER N N 119.195 0.100 1
777 . 107 TYR H H 9.349 0.010 1
778 . 107 TYR HA H 3.963 0.010 1
779 . 107 TYR HB2 H 3.450 0.010 1
780 . 107 TYR HB3 H 2.794 0.010 1
781 . 107 TYR C C 178.038 0.100 1
782 . 107 TYR CA C 62.981 0.100 1
783 . 107 TYR CB C 38.246 0.100 1
784 . 107 TYR N N 122.164 0.100 1
785 . 108 GLU H H 8.430 0.010 1
786 . 108 GLU HA H 3.873 0.010 1
787 . 108 GLU C C 179.983 0.100 1
788 . 108 GLU CA C 60.945 0.100 1
789 . 108 GLU CB C 29.253 0.100 1
790 . 108 GLU N N 116.370 0.100 1
791 . 109 GLN H H 7.849 0.010 1
792 . 109 GLN HA H 4.037 0.010 1
793 . 109 GLN C C 180.440 0.100 1
794 . 109 GLN CA C 59.440 0.100 1
795 . 109 GLN N N 120.236 0.100 1
796 . 110 LEU H H 7.788 0.010 1
797 . 110 LEU HA H 3.866 0.010 1
798 . 110 LEU HB2 H 1.904 0.010 1
799 . 110 LEU HB3 H 1.126 0.010 1
800 . 110 LEU HG H 1.406 0.010 1
801 . 110 LEU HD1 H -0.140 0.010 1
802 . 110 LEU HD2 H 0.640 0.010 1
803 . 110 LEU C C 179.182 0.100 1
804 . 110 LEU CA C 58.790 0.100 1
805 . 110 LEU CB C 41.320 0.100 1
806 . 110 LEU CG C 26.864 0.100 1
807 . 110 LEU CD1 C 25.736 0.100 1
808 . 110 LEU CD2 C 24.382 0.100 1
809 . 110 LEU N N 121.653 0.100 1
810 . 111 LEU H H 8.323 0.010 1
811 . 111 LEU HA H 3.597 0.010 1
812 . 111 LEU C C 178.674 0.100 1
813 . 111 LEU CA C 57.349 0.100 1
814 . 111 LEU CB C 42.046 0.100 1
815 . 111 LEU N N 118.578 0.100 1
816 . 112 GLN H H 7.549 0.010 1
817 . 112 GLN HA H 3.888 0.010 1
818 . 112 GLN C C 177.294 0.100 1
819 . 112 GLN CA C 60.756 0.100 1
820 . 112 GLN CB C 27.908 0.100 1
821 . 112 GLN N N 118.629 0.100 1
822 . 113 VAL H H 7.072 0.010 1
823 . 113 VAL HA H 3.263 0.010 1
824 . 113 VAL HB H 2.061 0.010 1
825 . 113 VAL HG1 H 0.184 0.010 1
826 . 113 VAL HG2 H 0.851 0.010 1
827 . 113 VAL C C 179.154 0.100 1
828 . 113 VAL CA C 66.524 0.100 1
829 . 113 VAL CB C 31.174 0.100 1
830 . 113 VAL CG1 C 22.659 0.100 1
831 . 113 VAL CG2 C 22.734 0.100 1
832 . 113 VAL N N 117.892 0.100 1
833 . 114 PHE H H 7.844 0.010 1
834 . 114 PHE HA H 3.977 0.010 1
835 . 114 PHE C C 177.437 0.100 1
836 . 114 PHE CA C 61.122 0.100 1
837 . 114 PHE CB C 38.956 0.100 1
838 . 114 PHE N N 120.512 0.100 1
839 . 115 TRP H H 8.488 0.010 1
840 . 115 TRP HA H 3.620 0.010 1
841 . 115 TRP C C 177.037 0.100 1
842 . 115 TRP CA C 60.015 0.100 1
843 . 115 TRP CB C 29.822 0.100 1
844 . 115 TRP N N 118.813 0.100 1
845 . 116 GLU H H 7.570 0.010 1
846 . 116 GLU HA H 4.305 0.010 1
847 . 116 GLU C C 178.867 0.100 1
848 . 116 GLU CA C 57.930 0.100 1
849 . 116 GLU CB C 30.368 0.100 1
850 . 116 GLU N N 108.183 0.100 1
851 . 117 ASN H H 6.955 0.010 1
852 . 117 ASN HA H 4.811 0.010 1
853 . 117 ASN HB2 H 2.626 0.010 1
854 . 117 ASN HB3 H 2.223 0.010 1
855 . 117 ASN C C 173.289 0.100 1
856 . 117 ASN CA C 54.233 0.100 1
857 . 117 ASN CB C 42.005 0.100 1
858 . 117 ASN N N 112.972 0.100 1
859 . 118 HIS H H 7.473 0.010 1
860 . 118 HIS HA H 4.617 0.010 1
861 . 118 HIS C C 172.088 0.100 1
862 . 118 HIS CA C 55.343 0.100 1
863 . 118 HIS CB C 30.977 0.100 1
864 . 118 HIS N N 113.217 0.100 1
865 . 119 ASP H H 9.001 0.010 1
866 . 119 ASP C C 171.960 0.100 1
867 . 119 ASP CA C 50.743 0.100 1
868 . 119 ASP CB C 42.262 0.100 1
869 . 119 ASP N N 119.828 0.100 1
870 . 120 PRO C C 175.006 0.100 1
871 . 120 PRO CA C 64.327 0.100 1
872 . 120 PRO CB C 33.421 0.100 1
873 . 121 ALA H H 8.357 0.010 1
874 . 121 ALA HA H 5.123 0.010 1
875 . 121 ALA HB H 1.129 0.010 1
876 . 121 ALA C C 177.723 0.100 1
877 . 121 ALA CA C 51.909 0.100 1
878 . 121 ALA CB C 21.203 0.100 1
879 . 121 ALA N N 124.372 0.100 1
880 . 122 GLN H H 8.516 0.010 1
881 . 122 GLN HA H 4.290 0.010 1
882 . 122 GLN C C 177.266 0.100 1
883 . 122 GLN CA C 57.042 0.100 1
884 . 122 GLN CB C 30.187 0.100 1
885 . 122 GLN N N 118.125 0.100 1
886 . 123 GLY H H 8.347 0.010 1
887 . 123 GLY HA2 H 4.111 0.010 1
888 . 123 GLY HA3 H 4.111 0.010 1
889 . 123 GLY C C 176.922 0.100 1
890 . 123 GLY CA C 46.309 0.100 1
891 . 123 GLY N N 109.937 0.100 1
892 . 124 MET HE H 2.066 0.010 1
893 . 124 MET C C 175.842 0.100 1
894 . 124 MET CA C 52.580 0.100 1
895 . 124 MET CE C 19.550 0.100 1
896 . 125 ARG H H 8.058 0.010 1
897 . 125 ARG HA H 4.632 0.010 1
898 . 125 ARG C C 174.187 0.100 1
899 . 125 ARG CA C 56.206 0.100 1
900 . 125 ARG CB C 32.343 0.100 1
901 . 125 ARG N N 120.262 0.100 1
902 . 126 GLN H H 8.617 0.010 1
903 . 126 GLN HA H 4.721 0.010 1
904 . 126 GLN C C 176.413 0.100 1
905 . 126 GLN CA C 55.950 0.100 1
906 . 126 GLN CB C 30.043 0.100 1
907 . 126 GLN N N 121.098 0.100 1
908 . 127 GLY H H 10.091 0.010 1
909 . 127 GLY HA2 H 3.913 0.010 1
910 . 127 GLY HA3 H 3.616 0.010 1
911 . 127 GLY C C 175.757 0.100 1
912 . 127 GLY CA C 47.293 0.100 1
913 . 127 GLY N N 119.822 0.100 1
914 . 128 ASN H H 8.928 0.010 1
915 . 128 ASN HA H 4.602 0.010 1
916 . 128 ASN HB2 H 2.879 0.010 1
917 . 128 ASN HB3 H 2.573 0.010 1
918 . 128 ASN C C 174.529 0.100 1
919 . 128 ASN CA C 53.977 0.100 1
920 . 128 ASN CB C 39.315 0.100 1
921 . 128 ASN N N 124.971 0.100 1
922 . 129 ASP H H 7.870 0.010 1
923 . 129 ASP HA H 4.409 0.010 1
924 . 129 ASP C C 173.758 0.100 1
925 . 129 ASP CA C 54.912 0.100 1
926 . 129 ASP CB C 39.459 0.100 1
927 . 129 ASP N N 121.706 0.100 1
928 . 130 HIS H H 8.721 0.010 1
929 . 130 HIS HA H 4.453 0.010 1
930 . 130 HIS HB2 H 2.993 0.010 1
931 . 130 HIS HB3 H 2.993 0.010 1
932 . 130 HIS C C 175.157 0.100 1
933 . 130 HIS CA C 56.478 0.100 1
934 . 130 HIS CB C 32.629 0.100 1
935 . 130 HIS N N 123.809 0.100 1
936 . 131 GLY H H 8.281 0.010 1
937 . 131 GLY HA2 H 4.692 0.010 1
938 . 131 GLY HA3 H 3.877 0.010 1
939 . 131 GLY C C 175.120 0.100 1
940 . 131 GLY CA C 45.239 0.100 1
941 . 131 GLY N N 111.886 0.100 1
942 . 132 THR H H 8.657 0.010 1
943 . 132 THR HA H 4.201 0.010 1
944 . 132 THR HB H 4.164 0.010 1
945 . 132 THR HG2 H 1.392 0.010 1
946 . 132 THR CA C 64.662 0.100 1
947 . 132 THR CB C 70.148 0.100 1
948 . 132 THR CG2 C 22.050 0.100 1
949 . 132 THR N N 112.171 0.100 1
950 . 133 GLN H H 10.119 0.010 1
951 . 133 GLN C C 175.785 0.100 1
952 . 133 GLN CA C 56.664 0.100 1
953 . 133 GLN CB C 27.340 0.100 1
954 . 133 GLN N N 123.951 0.100 1
955 . 134 TYR H H 7.236 0.010 1
956 . 134 TYR HA H 5.019 0.010 1
957 . 134 TYR C C 174.872 0.100 1
958 . 134 TYR CA C 56.803 0.100 1
959 . 134 TYR CB C 38.668 0.100 1
960 . 134 TYR N N 119.799 0.100 1
961 . 135 ARG HA H 5.183 0.010 1
962 . 136 SER CA C 57.355 0.100 1
963 . 136 SER CB C 61.380 0.100 1
964 . 137 ALA H H 10.249 0.010 1
965 . 137 ALA HA H 5.183 0.010 1
966 . 137 ALA HB H 1.011 0.010 1
967 . 137 ALA C C 174.376 0.100 1
968 . 137 ALA CA C 53.526 0.100 1
969 . 137 ALA CB C 24.064 0.100 1
970 . 137 ALA N N 133.578 0.100 1
971 . 138 ILE H H 8.295 0.010 1
972 . 138 ILE HA H 3.650 0.010 1
973 . 138 ILE HB H 1.174 0.010 1
974 . 138 ILE HG2 H 0.649 0.010 1
975 . 138 ILE HD1 H 0.304 0.010 1
976 . 138 ILE C C 174.262 0.100 1
977 . 138 ILE CA C 62.026 0.100 1
978 . 138 ILE CB C 42.013 0.100 1
979 . 138 ILE CG1 C 27.691 0.100 1
980 . 138 ILE CG2 C 18.810 0.100 1
981 . 138 ILE CD1 C 14.230 0.100 1
982 . 138 ILE N N 118.850 0.100 1
983 . 139 TYR H H 6.435 0.010 1
984 . 139 TYR HA H 6.032 0.010 1
985 . 139 TYR HB2 H 2.885 0.010 1
986 . 139 TYR HB3 H 2.557 0.010 1
987 . 139 TYR C C 174.262 0.100 1
988 . 139 TYR CA C 53.833 0.100 1
989 . 139 TYR CB C 39.315 0.100 1
990 . 139 TYR N N 123.356 0.100 1
991 . 140 PRO CA C 63.817 0.100 1
992 . 140 PRO CB C 34.304 0.100 1
993 . 141 LEU H H 8.665 0.010 1
994 . 141 LEU HA H 4.424 0.010 1
995 . 141 LEU C C 177.437 0.100 1
996 . 141 LEU CA C 55.952 0.100 1
997 . 141 LEU CB C 45.439 0.100 1
998 . 141 LEU N N 123.056 0.100 1
999 . 142 THR H H 7.014 0.010 1
1000 . 142 THR HA H 4.930 0.010 1
1001 . 142 THR HB H 4.651 0.010 1
1002 . 142 THR HG2 H 1.079 0.010 1
1003 . 142 THR C C 173.804 0.100 1
1004 . 142 THR CA C 57.976 0.100 1
1005 . 142 THR CB C 70.825 0.100 1
1006 . 142 THR N N 107.727 0.100 1
1007 . 143 PRO C C 179.811 0.100 1
1008 . 143 PRO CA C 64.907 0.100 1
1009 . 143 PRO CB C 32.279 0.100 1
1010 . 144 GLU H H 8.680 0.010 1
1011 . 144 GLU HA H 4.052 0.010 1
1012 . 144 GLU HB2 H 2.092 0.010 1
1013 . 144 GLU HB3 H 1.903 0.010 1
1014 . 144 GLU HG2 H 2.472 0.010 1
1015 . 144 GLU HG3 H 2.208 0.010 1
1016 . 144 GLU C C 181.385 0.100 1
1017 . 144 GLU CA C 61.325 0.100 1
1018 . 144 GLU CB C 28.853 0.100 1
1019 . 144 GLU CG C 37.975 0.100 1
1020 . 144 GLU N N 118.985 0.100 1
1021 . 145 GLN H H 7.914 0.010 1
1022 . 145 GLN HA H 3.814 0.010 1
1023 . 145 GLN C C 178.383 0.100 1
1024 . 145 GLN CA C 59.368 0.100 1
1025 . 145 GLN N N 120.608 0.100 1
1026 . 146 ASP H H 8.095 0.010 1
1027 . 146 ASP HA H 4.082 0.010 1
1028 . 146 ASP HB2 H 2.807 0.010 1
1029 . 146 ASP HB3 H 2.524 0.010 1
1030 . 146 ASP C C 177.752 0.100 1
1031 . 146 ASP CA C 59.036 0.100 1
1032 . 146 ASP CB C 43.412 0.100 1
1033 . 146 ASP N N 120.553 0.100 1
1034 . 147 ALA H H 8.135 0.010 1
1035 . 147 ALA HA H 4.022 0.010 1
1036 . 147 ALA HB H 1.498 0.010 1
1037 . 147 ALA C C 181.871 0.100 1
1038 . 147 ALA CA C 55.824 0.100 1
1039 . 147 ALA CB C 18.412 0.100 1
1040 . 147 ALA N N 119.382 0.100 1
1041 . 148 ALA H H 7.677 0.010 1
1042 . 148 ALA HA H 4.334 0.010 1
1043 . 148 ALA HB H 1.723 0.010 1
1044 . 148 ALA C C 181.880 0.100 1
1045 . 148 ALA CA C 55.523 0.100 1
1046 . 148 ALA CB C 19.190 0.100 1
1047 . 148 ALA N N 120.553 0.100 1
1048 . 149 ALA H H 9.517 0.010 1
1049 . 149 ALA HA H 4.260 0.010 1
1050 . 149 ALA HB H 1.717 0.010 1
1051 . 149 ALA C C 181.757 0.100 1
1052 . 149 ALA CA C 55.974 0.100 1
1053 . 149 ALA CB C 19.252 0.100 1
1054 . 149 ALA N N 123.694 0.100 1
1055 . 150 ARG H H 8.601 0.010 1
1056 . 150 ARG HA H 3.858 0.010 1
1057 . 150 ARG C C 179.754 0.100 1
1058 . 150 ARG CA C 61.091 0.100 1
1059 . 150 ARG CB C 29.865 0.100 1
1060 . 150 ARG N N 119.249 0.100 1
1061 . 151 ALA H H 7.997 0.010 1
1062 . 151 ALA HA H 4.245 0.010 1
1063 . 151 ALA HB H 1.536 0.010 1
1064 . 151 ALA C C 181.270 0.100 1
1065 . 151 ALA CA C 55.630 0.100 1
1066 . 151 ALA CB C 18.400 0.100 1
1067 . 151 ALA N N 121.786 0.100 1
1068 . 152 SER H H 8.384 0.010 1
1069 . 152 SER HA H 3.918 0.010 1
1070 . 152 SER CA C 62.430 0.100 1
1071 . 152 SER N N 114.568 0.100 1
1072 . 153 LEU H H 7.669 0.010 1
1073 . 153 LEU HA H 3.561 0.010 1
1074 . 153 LEU HB2 H 1.978 0.010 1
1075 . 153 LEU HB3 H 1.978 0.010 1
1076 . 153 LEU HG H 1.870 0.010 1
1077 . 153 LEU HD1 H 1.143 0.010 1
1078 . 153 LEU HD2 H 0.916 0.010 1
1079 . 153 LEU C C 178.867 0.100 1
1080 . 153 LEU CA C 60.242 0.100 1
1081 . 153 LEU CB C 42.674 0.100 1
1082 . 153 LEU CG C 29.010 0.100 1
1083 . 153 LEU CD1 C 28.337 0.100 1
1084 . 153 LEU CD2 C 24.751 0.100 1
1085 . 153 LEU N N 126.288 0.100 1
1086 . 154 GLU H H 7.100 0.010 1
1087 . 154 GLU HA H 3.918 0.010 1
1088 . 154 GLU HB2 H 2.093 0.010 1
1089 . 154 GLU HB3 H 2.093 0.010 1
1090 . 154 GLU HG2 H 2.410 0.010 1
1091 . 154 GLU HG3 H 2.500 0.010 1
1092 . 154 GLU C C 180.841 0.100 1
1093 . 154 GLU CA C 60.087 0.100 1
1094 . 154 GLU CB C 29.453 0.100 1
1095 . 154 GLU CG C 36.630 0.100 1
1096 . 154 GLU N N 117.574 0.100 1
1097 . 155 ARG H H 7.715 0.010 1
1098 . 155 ARG HA H 4.067 0.010 1
1099 . 155 ARG C C 179.382 0.100 1
1100 . 155 ARG CA C 60.230 0.100 1
1101 . 155 ARG CB C 31.121 0.100 1
1102 . 155 ARG N N 117.730 0.100 1
1103 . 156 PHE H H 8.555 0.010 1
1104 . 156 PHE HA H 3.769 0.010 1
1105 . 156 PHE HB2 H 2.000 0.010 1
1106 . 156 PHE HB3 H 1.780 0.010 1
1107 . 156 PHE C C 177.609 0.100 1
1108 . 156 PHE CA C 63.321 0.100 1
1109 . 156 PHE CB C 37.604 0.100 1
1110 . 156 PHE N N 123.079 0.100 1
1111 . 157 GLN H H 8.562 0.010 1
1112 . 157 GLN HA H 4.141 0.010 1
1113 . 157 GLN C C 179.297 0.100 1
1114 . 157 GLN CA C 58.755 0.100 1
1115 . 157 GLN CB C 29.681 0.100 1
1116 . 157 GLN N N 118.235 0.100 1
1117 . 158 ALA H H 7.325 0.010 1
1118 . 158 ALA HA H 4.067 0.010 1
1119 . 158 ALA C C 180.956 0.100 1
1120 . 158 ALA CA C 55.175 0.100 1
1121 . 158 ALA CB C 18.256 0.100 1
1122 . 158 ALA N N 120.305 0.100 1
1123 . 159 ALA H H 7.802 0.010 1
1124 . 159 ALA HA H 3.963 0.010 1
1125 . 159 ALA C C 181.270 0.100 1
1126 . 159 ALA CA C 55.387 0.100 1
1127 . 159 ALA CB C 18.256 0.100 1
1128 . 159 ALA N N 124.242 0.100 1
1129 . 160 MET H H 8.267 0.010 1
1130 . 160 MET HA H 3.576 0.010 1
1131 . 160 MET HE H 1.741 0.010 1
1132 . 160 MET C C 178.706 0.100 1
1133 . 160 MET CA C 61.072 0.100 1
1134 . 160 MET CB C 33.206 0.100 1
1135 . 160 MET CE C 16.268 0.100 1
1136 . 160 MET N N 120.449 0.100 1
1137 . 161 LEU H H 7.453 0.010 1
1138 . 161 LEU HA H 3.882 0.010 1
1139 . 161 LEU HD1 H 0.849 0.010 1
1140 . 161 LEU HD2 H 0.849 0.010 1
1141 . 161 LEU CA C 58.721 0.100 1
1142 . 161 LEU CB C 41.830 0.100 1
1143 . 161 LEU CD1 C 24.733 0.100 1
1144 . 161 LEU CD2 C 24.733 0.100 1
1145 . 162 ALA H H 7.901 0.010 1
1146 . 162 ALA HA H 4.126 0.010 1
1147 . 162 ALA C C 178.295 0.100 1
1148 . 162 ALA CA C 54.813 0.100 1
1149 . 162 ALA CB C 18.184 0.100 1
1150 . 162 ALA N N 122.161 0.100 1
1151 . 163 ALA H H 7.363 0.010 1
1152 . 163 ALA HA H 4.409 0.010 1
1153 . 163 ALA HB H 1.325 0.010 1
1154 . 163 ALA C C 176.751 0.100 1
1155 . 163 ALA CA C 51.935 0.100 1
1156 . 163 ALA CB C 18.879 0.100 1
1157 . 163 ALA N N 121.576 0.100 1
1158 . 164 ASP H H 7.848 0.010 1
1159 . 164 ASP HA H 4.171 0.010 1
1160 . 164 ASP HB2 H 2.993 0.010 1
1161 . 164 ASP HB3 H 2.663 0.010 1
1162 . 164 ASP C C 174.348 0.100 1
1163 . 164 ASP CA C 56.368 0.100 1
1164 . 164 ASP CB C 39.335 0.100 1
1165 . 164 ASP N N 114.654 0.100 1
1166 . 165 ASP H H 8.032 0.010 1
1167 . 165 ASP HA H 4.602 0.010 1
1168 . 165 ASP CA C 53.348 0.100 1
1169 . 165 ASP CB C 41.759 0.100 1
1170 . 165 ASP N N 119.884 0.100 1
1171 . 166 ASP H H 7.915 0.010 1
1172 . 166 ASP HA H 4.409 0.010 1
1173 . 166 ASP HB2 H 2.736 0.010 1
1174 . 166 ASP HB3 H 2.425 0.010 1
1175 . 166 ASP C C 177.466 0.100 1
1176 . 166 ASP CA C 53.606 0.100 1
1177 . 166 ASP CB C 40.609 0.100 1
1178 . 166 ASP N N 122.008 0.100 1
1179 . 167 ARG H H 7.610 0.010 1
1180 . 167 ARG HA H 4.156 0.010 1
1181 . 167 ARG C C 176.779 0.100 1
1182 . 167 ARG CA C 56.884 0.100 1
1183 . 167 ARG CB C 32.648 0.100 1
1184 . 167 ARG N N 119.949 0.100 1
1185 . 168 HIS H H 8.390 0.010 1
1186 . 168 HIS HA H 4.677 0.010 1
1187 . 168 HIS HB2 H 3.029 0.010 1
1188 . 168 HIS HB3 H 3.029 0.010 1
1189 . 168 HIS C C 175.664 0.100 1
1190 . 168 HIS CA C 55.331 0.100 1
1191 . 168 HIS CB C 30.259 0.100 1
1192 . 168 HIS N N 119.231 0.100 1
1193 . 169 ILE H H 8.770 0.010 1
1194 . 169 ILE HA H 3.722 0.010 1
1195 . 169 ILE HB H 1.680 0.010 1
1196 . 169 ILE C C 177.952 0.100 1
1197 . 169 ILE CA C 64.840 0.100 1
1198 . 169 ILE CB C 40.265 0.100 1
1199 . 169 ILE N N 126.232 0.100 1
1200 . 170 THR H H 9.915 0.010 1
1201 . 170 THR HA H 3.750 0.010 1
1202 . 170 THR CA C 62.777 0.100 1
1203 . 170 THR N N 118.746 0.100 1
1204 . 171 THR H H 7.766 0.010 1
1205 . 171 THR HA H 4.275 0.010 1
1206 . 171 THR CA C 65.696 0.100 1
1207 . 171 THR CB C 71.011 0.100 1
1208 . 171 THR N N 122.927 0.100 1
1209 . 172 GLU H H 8.312 0.010 1
1210 . 172 GLU HA H 4.290 0.010 1
1211 . 172 GLU C C 174.662 0.100 1
1212 . 172 GLU CA C 55.329 0.100 1
1213 . 172 GLU CB C 31.344 0.100 1
1214 . 172 GLU N N 130.033 0.100 1
1215 . 173 ILE H H 8.134 0.010 1
1216 . 173 ILE HA H 4.959 0.010 1
1217 . 173 ILE HB H 1.650 0.010 1
1218 . 173 ILE HD1 H 0.840 0.010 1
1219 . 173 ILE C C 175.778 0.100 1
1220 . 173 ILE CA C 61.558 0.100 1
1221 . 173 ILE CB C 38.596 0.100 1
1222 . 173 ILE CD1 C 15.027 0.100 1
1223 . 173 ILE N N 124.619 0.100 1
1224 . 174 ALA H H 7.909 0.010 1
1225 . 174 ALA HA H 4.662 0.010 1
1226 . 174 ALA HB H 1.343 0.010 1
1227 . 174 ALA C C 175.435 0.100 1
1228 . 174 ALA CA C 51.046 0.100 1
1229 . 174 ALA CB C 22.934 0.100 1
1230 . 174 ALA N N 129.709 0.100 1
1231 . 175 ASN H H 8.228 0.010 1
1232 . 175 ASN HA H 4.364 0.010 1
1233 . 175 ASN HB2 H 2.755 0.010 1
1234 . 175 ASN HB3 H 2.535 0.010 1
1235 . 175 ASN C C 177.123 0.100 1
1236 . 175 ASN CA C 54.472 0.100 1
1237 . 175 ASN CB C 38.586 0.100 1
1238 . 175 ASN N N 117.786 0.100 1
1239 . 176 ALA H H 7.703 0.010 1
1240 . 176 ALA HA H 4.052 0.010 1
1241 . 176 ALA HB H 1.207 0.010 1
1242 . 176 ALA C C 178.181 0.100 1
1243 . 176 ALA CA C 54.316 0.100 1
1244 . 176 ALA CB C 19.352 0.100 1
1245 . 176 ALA N N 123.896 0.100 1
1246 . 177 THR H H 8.715 0.010 1
1247 . 177 THR HA H 4.468 0.010 1
1248 . 177 THR HB H 4.578 0.010 1
1249 . 177 THR HG2 H 1.134 0.010 1
1250 . 177 THR C C 172.174 0.100 1
1251 . 177 THR CA C 60.468 0.100 1
1252 . 177 THR CB C 68.411 0.100 1
1253 . 177 THR CG2 C 22.700 0.100 1
1254 . 177 THR N N 117.587 0.100 1
1255 . 178 PRO CA C 65.685 0.100 1
1256 . 178 PRO CB C 31.500 0.100 1
1257 . 179 PHE H H 8.561 0.010 1
1258 . 179 PHE HA H 4.007 0.010 1
1259 . 179 PHE C C 173.633 0.100 1
1260 . 179 PHE CA C 57.587 0.100 1
1261 . 179 PHE CB C 40.066 0.100 1
1262 . 179 PHE N N 126.691 0.100 1
1263 . 180 TYR H H 7.903 0.010 1
1264 . 180 TYR HA H 4.751 0.010 1
1265 . 180 TYR C C 174.348 0.100 1
1266 . 180 TYR CA C 56.481 0.100 1
1267 . 180 TYR CB C 39.287 0.100 1
1268 . 180 TYR N N 128.601 0.100 1
1269 . 181 TYR H H 9.388 0.010 1
1270 . 181 TYR C C 175.807 0.100 1
1271 . 181 TYR CA C 60.702 0.100 1
1272 . 181 TYR CB C 39.091 0.100 1
1273 . 181 TYR N N 124.315 0.100 1
1274 . 182 ALA H H 7.779 0.010 1
1275 . 182 ALA HA H 3.888 0.010 1
1276 . 182 ALA C C 176.379 0.100 1
1277 . 182 ALA CA C 51.173 0.100 1
1278 . 182 ALA CB C 20.594 0.100 1
1279 . 182 ALA N N 121.686 0.100 1
1280 . 183 GLU H H 11.381 0.010 1
1281 . 183 GLU C C 178.324 0.100 1
1282 . 183 GLU CA C 58.626 0.100 1
1283 . 183 GLU CB C 31.043 0.100 1
1284 . 183 GLU N N 120.883 0.100 1
1285 . 184 ASP H H 8.676 0.010 1
1286 . 184 ASP HA H 4.662 0.010 1
1287 . 184 ASP HB2 H 2.753 0.010 1
1288 . 184 ASP HB3 H 2.433 0.010 1
1289 . 184 ASP C C 178.496 0.100 1
1290 . 184 ASP CA C 58.989 0.100 1
1291 . 184 ASP CB C 43.181 0.100 1
1292 . 184 ASP N N 121.978 0.100 1
1293 . 185 ASP H H 8.254 0.010 1
1294 . 185 ASP HA H 4.171 0.010 1
1295 . 185 ASP HB2 H 2.406 0.010 1
1296 . 185 ASP HB3 H 1.985 0.010 1
1297 . 185 ASP C C 177.466 0.100 1
1298 . 185 ASP CA C 56.808 0.100 1
1299 . 185 ASP CB C 40.845 0.100 1
1300 . 185 ASP N N 112.771 0.100 1
1301 . 186 HIS H H 7.729 0.010 1
1302 . 186 HIS HA H 4.632 0.010 1
1303 . 186 HIS C C 176.836 0.100 1
1304 . 186 HIS CA C 58.677 0.100 1
1305 . 186 HIS CB C 33.836 0.100 1
1306 . 186 HIS N N 113.202 0.100 1
1307 . 187 GLN H H 7.488 0.010 1
1308 . 187 GLN HA H 4.349 0.010 1
1309 . 187 GLN C C 176.979 0.100 1
1310 . 187 GLN CA C 55.718 0.100 1
1311 . 187 GLN CB C 41.935 0.100 1
1312 . 187 GLN N N 119.789 0.100 1
1313 . 188 GLN H H 10.640 0.010 1
1314 . 188 GLN HA H 4.110 0.010 1
1315 . 188 GLN C C 177.494 0.100 1
1316 . 188 GLN CA C 58.489 0.100 1
1317 . 188 GLN CB C 26.407 0.100 1
1318 . 188 GLN N N 123.628 0.100 1
1319 . 189 TYR H H 7.614 0.010 1
1320 . 189 TYR HA H 4.111 0.010 1
1321 . 189 TYR C C 178.725 0.100 1
1322 . 189 TYR CA C 63.994 0.100 1
1323 . 189 TYR N N 119.610 0.100 1
1324 . 190 LEU H H 10.262 0.010 1
1325 . 190 LEU HA H 4.156 0.010 1
1326 . 190 LEU C C 178.696 0.100 1
1327 . 190 LEU CA C 56.481 0.100 1
1328 . 190 LEU CB C 42.552 0.100 1
1329 . 190 LEU N N 115.809 0.100 1
1330 . 191 HIS H H 7.695 0.010 1
1331 . 191 HIS HA H 4.424 0.010 1
1332 . 191 HIS HB2 H 2.763 0.010 1
1333 . 191 HIS HB3 H 2.543 0.010 1
1334 . 191 HIS C C 176.756 0.100 1
1335 . 191 HIS CA C 59.447 0.100 1
1336 . 191 HIS CB C 32.990 0.100 1
1337 . 191 HIS N N 118.943 0.100 1
1338 . 192 LYS H H 6.888 0.010 1
1339 . 192 LYS HA H 3.620 0.010 1
1340 . 192 LYS C C 177.013 0.100 1
1341 . 192 LYS CA C 58.679 0.100 1
1342 . 192 LYS CB C 34.140 0.100 1
1343 . 192 LYS N N 117.962 0.100 1
1344 . 193 ASN H H 7.909 0.010 1
1345 . 193 ASN HA H 4.706 0.010 1
1346 . 193 ASN C C 172.417 0.100 1
1347 . 193 ASN CA C 50.704 0.100 1
1348 . 193 ASN CB C 38.740 0.100 1
1349 . 193 ASN N N 114.568 0.100 1
1350 . 194 PRO HA H 4.459 0.010 1
1351 . 194 PRO HB2 H 1.380 0.010 1
1352 . 194 PRO HB3 H 1.990 0.010 1
1353 . 194 PRO HG2 H 1.654 0.010 1
1354 . 194 PRO HG3 H 1.347 0.010 1
1355 . 194 PRO HD2 H 3.299 0.010 1
1356 . 194 PRO HD3 H 3.018 0.010 1
1357 . 194 PRO C C 178.009 0.100 1
1358 . 194 PRO CA C 64.608 0.100 1
1359 . 194 PRO CB C 31.833 0.100 1
1360 . 194 PRO CG C 27.600 0.100 1
1361 . 194 PRO CD C 50.399 0.100 1
1362 . 195 TYR H H 7.816 0.010 1
1363 . 195 TYR HA H 4.617 0.010 1
1364 . 195 TYR HB2 H 3.252 0.010 1
1365 . 195 TYR HB3 H 2.711 0.010 1
1366 . 195 TYR C C 177.180 0.100 1
1367 . 195 TYR CA C 57.072 0.100 1
1368 . 195 TYR CB C 37.591 0.100 1
1369 . 195 TYR N N 117.553 0.100 1
1370 . 196 GLY H H 7.854 0.010 1
1371 . 196 GLY HA2 H 4.096 0.010 1
1372 . 196 GLY HA3 H 3.516 0.010 1
1373 . 196 GLY C C 172.774 0.100 1
1374 . 196 GLY CA C 45.564 0.100 1
1375 . 196 GLY N N 108.203 0.100 1
1376 . 197 TYR H H 8.227 0.010 1
1377 . 197 TYR HA H 4.483 0.010 1
1378 . 197 TYR C C 174.805 0.100 1
1379 . 197 TYR CA C 59.208 0.100 1
1380 . 197 TYR CB C 39.812 0.100 1
1381 . 197 TYR N N 120.769 0.100 1
1382 . 198 CYS H H 8.057 0.010 1
1383 . 198 CYS HA H 4.424 0.010 1
1384 . 198 CYS HB2 H 2.803 0.010 1
1385 . 198 CYS HB3 H 2.717 0.010 1
1386 . 198 CYS C C 174.434 0.100 1
1387 . 198 CYS CA C 58.588 0.100 1
1388 . 198 CYS CB C 28.392 0.100 1
1389 . 198 CYS N N 125.941 0.100 1
1390 . 199 GLY H H 7.800 0.010 1
1391 . 199 GLY HA2 H 4.156 0.010 1
1392 . 199 GLY HA3 H 4.156 0.010 1
1393 . 199 GLY C C 174.577 0.100 1
1394 . 199 GLY CA C 46.287 0.100 1
1395 . 199 GLY N N 112.582 0.100 1
1396 . 200 ILE H H 7.317 0.010 1
1397 . 200 ILE HA H 4.394 0.010 1
1398 . 200 ILE HB H 1.902 0.010 1
1399 . 200 ILE HG12 H 1.320 0.010 1
1400 . 200 ILE HG13 H 1.077 0.010 1
1401 . 200 ILE HG2 H 0.871 0.010 1
1402 . 200 ILE HD1 H 0.718 0.010 1
1403 . 200 ILE C C 176.350 0.100 1
1404 . 200 ILE CA C 60.844 0.100 1
1405 . 200 ILE CB C 39.475 0.100 1
1406 . 200 ILE CG1 C 27.616 0.100 1
1407 . 200 ILE CG2 C 18.612 0.100 1
1408 . 200 ILE CD1 C 14.081 0.100 1
1409 . 200 ILE N N 117.828 0.100 1
1410 . 201 GLY H H 7.675 0.010 1
1411 . 201 GLY HA2 H 4.082 0.010 1
1412 . 201 GLY HA3 H 4.082 0.010 1
1413 . 201 GLY C C 174.090 0.100 1
1414 . 201 GLY CA C 45.892 0.100 1
1415 . 201 GLY N N 112.386 0.100 1
1416 . 202 GLY H H 8.371 0.010 1
1417 . 202 GLY HA2 H 3.858 0.010 1
1418 . 202 GLY HA3 H 3.858 0.010 1
1419 . 202 GLY C C 175.521 0.100 1
1420 . 202 GLY CA C 44.500 0.100 1
1421 . 202 GLY N N 109.310 0.100 1
1422 . 203 ILE HA H 4.450 0.010 1
1423 . 203 ILE HB H 2.224 0.010 1
1424 . 203 ILE HG2 H 0.825 0.010 1
1425 . 203 ILE HD1 H 0.913 0.010 1
1426 . 203 ILE C C 177.266 0.100 1
1427 . 203 ILE CA C 61.683 0.100 1
1428 . 203 ILE CB C 38.419 0.100 1
1429 . 203 ILE CG2 C 18.128 0.100 1
1430 . 203 ILE CD1 C 14.451 0.100 1
1431 . 204 GLY H H 8.478 0.010 1
1432 . 204 GLY HA2 H 4.111 0.010 1
1433 . 204 GLY HA3 H 3.561 0.010 1
1434 . 204 GLY C C 174.233 0.100 1
1435 . 204 GLY CA C 46.430 0.100 1
1436 . 204 GLY N N 111.838 0.100 1
1437 . 205 VAL H H 7.132 0.010 1
1438 . 205 VAL HA H 4.067 0.010 1
1439 . 205 VAL HB H 1.630 0.010 1
1440 . 205 VAL HG1 H 0.678 0.010 1
1441 . 205 VAL HG2 H 0.356 0.010 1
1442 . 205 VAL C C 175.757 0.100 1
1443 . 205 VAL CA C 61.955 0.100 1
1444 . 205 VAL CB C 34.284 0.100 1
1445 . 205 VAL CG1 C 21.719 0.100 1
1446 . 205 VAL CG2 C 22.079 0.100 1
1447 . 205 VAL N N 120.236 0.100 1
1448 . 206 CYS H H 8.358 0.010 1
1449 . 206 CYS HA H 4.617 0.010 1
1450 . 206 CYS C C 174.529 0.100 1
1451 . 206 CYS CA C 58.086 0.100 1
1452 . 206 CYS N N 122.389 0.100 1
1453 . 209 PRO C C 177.037 0.100 1
1454 . 209 PRO CA C 62.923 0.100 1
1455 . 209 PRO CB C 32.807 0.100 1
1456 . 210 GLU H H 8.532 0.010 1
1457 . 210 GLU HA H 3.933 0.010 1
1458 . 210 GLU HB2 H 1.883 0.010 1
1459 . 210 GLU HB3 H 1.883 0.010 1
1460 . 210 GLU HG2 H 2.179 0.010 1
1461 . 210 GLU HG3 H 2.179 0.010 1
1462 . 210 GLU C C 175.492 0.100 1
1463 . 210 GLU CA C 57.509 0.100 1
1464 . 210 GLU CB C 30.644 0.100 1
1465 . 210 GLU CG C 36.060 0.100 1
1466 . 210 GLU N N 120.661 0.100 1
1467 . 211 ALA H H 7.815 0.010 1
1468 . 211 ALA HA H 4.022 0.010 1
1469 . 211 ALA C C 182.815 0.100 1
1470 . 211 ALA CA C 54.161 0.100 1
1471 . 211 ALA CB C 20.910 0.100 1
1472 . 211 ALA N N 130.708 0.100 1
stop_
save_