data_2198
#######################
# Entry information #
#######################
save_entry_information
_Saveframe_category entry_information
_Entry_title
;
1H NMR Studies of Plastocyanin from Scenedesmus obliquus: Complete
Sequence-Specific Assignment, Secondary Structure Analysis, and Global Fold
;
_BMRB_accession_number 2198
_BMRB_flat_file_name bmr2198.str
_Entry_type update
_Submission_date 1995-07-31
_Accession_date 1996-03-25
_Entry_origination BMRB
_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 Moore Jonathan M. .
2 Chazin Walter J. .
3 Powls Roy . .
4 Wright Peter E. .
stop_
loop_
_Saveframe_category_type
_Saveframe_category_type_count
assigned_chemical_shifts 1
stop_
loop_
_Data_type
_Data_type_count
"1H chemical shifts" 470
stop_
loop_
_Revision_date
_Revision_keyword
_Revision_author
_Revision_detail
2010-06-16 revision BMRB 'Complete natural source information'
1999-06-14 revision BMRB 'Converted to BMRB NMR-STAR V 2.1 format'
1996-03-25 reformat BMRB 'Converted to the BMRB 1996-03-01 STAR flat-file format'
1995-07-31 original BMRB 'Last release in original BMRB flat-file format'
stop_
save_
#############################
# Citation for this entry #
#############################
save_entry_citation
_Saveframe_category entry_citation
_Citation_full
;
Moore, Jonathan M., Chazin, Walter J., Powls, Roy, Wright, Peter E.,
"1H NMR Studies of Plastocyanin from Scenedesmus obliquus: Complete
Sequence-Specific Assignment, Secondary Structure Analysis, and Global
Fold,"
Biochemistry 27 (20), 7806-7816 (1988).
;
_Citation_title
;
1H NMR Studies of Plastocyanin from Scenedesmus obliquus: Complete
Sequence-Specific Assignment, Secondary Structure Analysis, and Global Fold
;
_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 Moore Jonathan M. .
2 Chazin Walter J. .
3 Powls Roy . .
4 Wright Peter E. .
stop_
_Journal_abbreviation Biochemistry
_Journal_volume 27
_Journal_issue 20
_Journal_CSD .
_Book_chapter_title .
_Book_volume .
_Book_series .
_Book_ISBN .
_Conference_state_province .
_Conference_abstract_number .
_Page_first 7806
_Page_last 7816
_Year 1988
_Details .
save_
##################################
# Molecular system description #
##################################
save_system_plastocyanin
_Saveframe_category molecular_system
_Mol_system_name plastocyanin
_Enzyme_commission_number .
loop_
_Mol_system_component_name
_Mol_label
plastocyanin $plastocyanin
stop_
_System_molecular_weight .
_System_oligomer_state ?
_System_paramagnetic ?
_System_thiol_state .
_Database_query_date .
_Details .
save_
########################
# Monomeric polymers #
########################
save_plastocyanin
_Saveframe_category monomeric_polymer
_Mol_type polymer
_Mol_polymer_class protein
_Name_common plastocyanin
_Molecular_mass .
_Mol_thiol_state .
_Details .
##############################
# Polymer residue sequence #
##############################
_Residue_count 97
_Mol_residue_sequence
;
ANVKLGADSGALVFEPATVT
IKAGDSVTWTNNAGFPHNIV
FDEDAVPAGVNADALSHDDY
LNAPGESYTAKFDTAGEYGY
FCEPHQGAGMVGKVIVQ
;
loop_
_Residue_seq_code
_Residue_label
1 ALA 2 ASN 3 VAL 4 LYS 5 LEU
6 GLY 7 ALA 8 ASP 9 SER 10 GLY
11 ALA 12 LEU 13 VAL 14 PHE 15 GLU
16 PRO 17 ALA 18 THR 19 VAL 20 THR
21 ILE 22 LYS 23 ALA 24 GLY 25 ASP
26 SER 27 VAL 28 THR 29 TRP 30 THR
31 ASN 32 ASN 33 ALA 34 GLY 35 PHE
36 PRO 37 HIS 38 ASN 39 ILE 40 VAL
41 PHE 42 ASP 43 GLU 44 ASP 45 ALA
46 VAL 47 PRO 48 ALA 49 GLY 50 VAL
51 ASN 52 ALA 53 ASP 54 ALA 55 LEU
56 SER 57 HIS 58 ASP 59 ASP 60 TYR
61 LEU 62 ASN 63 ALA 64 PRO 65 GLY
66 GLU 67 SER 68 TYR 69 THR 70 ALA
71 LYS 72 PHE 73 ASP 74 THR 75 ALA
76 GLY 77 GLU 78 TYR 79 GLY 80 TYR
81 PHE 82 CYS 83 GLU 84 PRO 85 HIS
86 GLN 87 GLY 88 ALA 89 GLY 90 MET
91 VAL 92 GLY 93 LYS 94 VAL 95 ILE
96 VAL 97 GLN
stop_
_Sequence_homology_query_date .
_Sequence_homology_query_revised_last_date 2015-11-25
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
GB AAD03610 "plastocyanin [Acutodesmus obliquus]" 100.00 145 100.00 100.00 1.45e-64
SP P26956 "RecName: Full=Plastocyanin, chloroplastic; Flags: Precursor" 100.00 145 100.00 100.00 1.45e-64
stop_
save_
####################
# Natural source #
####################
save_natural_source
_Saveframe_category natural_source
loop_
_Mol_label
_Organism_name_common
_NCBI_taxonomy_ID
_Superkingdom
_Kingdom
_Genus
_Species
_Strain
$plastocyanin 'green alga' 3088 Eukaryota Viridiplantae Scenedesmus obliquus 'generic ?'
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
$plastocyanin 'not available' . . . . .
stop_
save_
#####################################
# Sample contents and methodology #
#####################################
########################
# Sample description #
########################
save_sample_one
_Saveframe_category sample
_Sample_type solution
_Details .
save_
#########################
# Experimental detail #
#########################
##################################
# NMR Spectrometer definitions #
##################################
save_spectrometer_list
_Saveframe_category NMR_spectrometer
_Manufacturer unknown
_Model unknown
_Field_strength 0
_Details 'spectrometer information not available'
save_
#############################
# NMR applied experiments #
#############################
save__1
_Saveframe_category NMR_applied_experiment
_Sample_label $sample_one
save_
#######################
# Sample conditions #
#######################
save_sample_condition_set_one
_Saveframe_category sample_conditions
_Details .
loop_
_Variable_type
_Variable_value
_Variable_value_error
_Variable_value_units
pH 6.2 . na
temperature 303 . K
stop_
save_
####################
# NMR parameters #
####################
##############################
# Assigned chemical shifts #
##############################
################################
# Chemical shift referencing #
################################
save_chem_shift_reference_par_set_one
_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
p-dioxane H . . ppm 3.75 . . . . . $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_assignment_data_set_one
_Saveframe_category assigned_chemical_shifts
_Details .
loop_
_Sample_label
$sample_one
stop_
_Sample_conditions_label $sample_condition_set_one
_Chem_shift_reference_set_label $chem_shift_reference_par_set_one
_Mol_system_component_name plastocyanin
_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 . 1 ALA HA H 4.07 . 1
2 . 1 ALA HB H 1.29 . 1
3 . 2 ASN H H 8.69 . 1
4 . 2 ASN HA H 5.46 . 1
5 . 2 ASN HB2 H 2.48 . 2
6 . 2 ASN HB3 H 2.635 . 2
7 . 2 ASN HD21 H 6.94 . 2
8 . 2 ASN HD22 H 7.545 . 2
9 . 3 VAL H H 8.8 . 1
10 . 3 VAL HA H 4.455 . 1
11 . 3 VAL HB H 1.255 . 1
12 . 3 VAL HG1 H 1.14 . 2
13 . 3 VAL HG2 H .42 . 2
14 . 4 LYS H H 9.16 . 1
15 . 4 LYS HA H 4.7 . 1
16 . 4 LYS HB2 H 1.895 . 2
17 . 4 LYS HB3 H 1.665 . 2
18 . 5 LEU H H 8.485 . 1
19 . 5 LEU HA H 4.2 . 1
20 . 5 LEU HB2 H 2.52 . 2
21 . 5 LEU HB3 H 1.1 . 2
22 . 5 LEU HG H 1.69 . 1
23 . 5 LEU HD1 H 1.025 . 2
24 . 5 LEU HD2 H .935 . 2
25 . 6 GLY H H 7.915 . 1
26 . 6 GLY HA2 H 3.89 . 2
27 . 6 GLY HA3 H 5.075 . 2
28 . 7 ALA H H 8.295 . 1
29 . 7 ALA HA H 4.355 . 1
30 . 7 ALA HB H 1.43 . 1
31 . 8 ASP H H 9.255 . 1
32 . 8 ASP HA H 4.12 . 1
33 . 8 ASP HB2 H 2.71 . 2
34 . 8 ASP HB3 H 2.57 . 2
35 . 9 SER H H 7.755 . 1
36 . 9 SER HA H 4.175 . 1
37 . 9 SER HB2 H 4.03 . 2
38 . 9 SER HB3 H 3.86 . 2
39 . 10 GLY H H 8.21 . 1
40 . 10 GLY HA2 H 3.205 . 2
41 . 10 GLY HA3 H 4.32 . 2
42 . 11 ALA H H 7.18 . 1
43 . 11 ALA HA H 4.025 . 1
44 . 11 ALA HB H 1.22 . 1
45 . 12 LEU H H 8.335 . 1
46 . 12 LEU HA H 4.04 . 1
47 . 12 LEU HB2 H 1.66 . 2
48 . 12 LEU HB3 H .9 . 2
49 . 12 LEU HG H 1.565 . 1
50 . 12 LEU HD1 H .535 . 2
51 . 12 LEU HD2 H .295 . 2
52 . 13 VAL H H 7.22 . 1
53 . 13 VAL HA H 4.62 . 1
54 . 13 VAL HB H 2.17 . 1
55 . 13 VAL HG1 H .775 . 2
56 . 13 VAL HG2 H .56 . 2
57 . 14 PHE H H 8.85 . 1
58 . 14 PHE HA H 5 . 1
59 . 14 PHE HB2 H 2.595 . 2
60 . 14 PHE HB3 H 3.08 . 2
61 . 14 PHE HD1 H 6.92 . 1
62 . 14 PHE HD2 H 6.92 . 1
63 . 14 PHE HE1 H 7.22 . 1
64 . 14 PHE HE2 H 7.22 . 1
65 . 14 PHE HZ H 7.29 . 1
66 . 15 GLU H H 8.655 . 1
67 . 15 GLU HA H 5.02 . 1
68 . 15 GLU HB2 H 1.715 . 2
69 . 15 GLU HB3 H 2.03 . 2
70 . 16 PRO HA H 4.94 . 1
71 . 16 PRO HB2 H 2.28 . 2
72 . 16 PRO HB3 H 2.5 . 2
73 . 17 ALA H H 8.4 . 1
74 . 17 ALA HA H 4.16 . 1
75 . 17 ALA HB H 1.74 . 1
76 . 18 THR H H 7.68 . 1
77 . 18 THR HA H 5.275 . 1
78 . 18 THR HB H 3.875 . 1
79 . 18 THR HG2 H 1.05 . 1
80 . 19 VAL H H 8.015 . 1
81 . 19 VAL HA H 4.56 . 1
82 . 19 VAL HB H 1.73 . 1
83 . 19 VAL HG1 H .76 . 2
84 . 19 VAL HG2 H .715 . 2
85 . 20 THR H H 8.205 . 1
86 . 20 THR HA H 5.46 . 1
87 . 20 THR HB H 3.8 . 1
88 . 20 THR HG2 H .98 . 1
89 . 21 ILE H H 9.18 . 1
90 . 21 ILE HA H 4.71 . 1
91 . 21 ILE HB H 2.18 . 1
92 . 21 ILE HG12 H 1.04 . 2
93 . 21 ILE HG13 H .4 . 2
94 . 21 ILE HG2 H .61 . 1
95 . 21 ILE HD1 H .295 . 1
96 . 22 LYS H H 8.64 . 1
97 . 22 LYS HA H 4.79 . 1
98 . 22 LYS HB2 H 1.78 . 2
99 . 22 LYS HB3 H 1.705 . 2
100 . 22 LYS HG2 H 1.47 . 1
101 . 22 LYS HG3 H 1.47 . 1
102 . 23 ALA H H 8.52 . 1
103 . 23 ALA HA H 3.715 . 1
104 . 23 ALA HB H 1.2 . 1
105 . 24 GLY H H 9.46 . 1
106 . 24 GLY HA2 H 3.56 . 2
107 . 24 GLY HA3 H 4.39 . 2
108 . 25 ASP H H 8.29 . 1
109 . 25 ASP HA H 4.79 . 1
110 . 25 ASP HB2 H 3.1 . 2
111 . 25 ASP HB3 H 2.855 . 2
112 . 26 SER H H 8.455 . 1
113 . 26 SER HA H 5.52 . 1
114 . 26 SER HB2 H 3.45 . 2
115 . 26 SER HB3 H 3.39 . 2
116 . 27 VAL H H 8.655 . 1
117 . 27 VAL HA H 4.115 . 1
118 . 27 VAL HB H 1.19 . 1
119 . 27 VAL HG1 H .37 . 2
120 . 27 VAL HG2 H .68 . 2
121 . 28 THR H H 8.12 . 1
122 . 28 THR HA H 5.085 . 1
123 . 28 THR HB H 3.71 . 1
124 . 28 THR HG2 H .98 . 1
125 . 29 TRP H H 9.95 . 1
126 . 29 TRP HA H 5.68 . 1
127 . 29 TRP HB2 H 3.25 . 2
128 . 29 TRP HB3 H 2.93 . 2
129 . 29 TRP HD1 H 6.84 . 1
130 . 29 TRP HE1 H 9.58 . 1
131 . 29 TRP HE3 H 7.81 . 1
132 . 29 TRP HZ2 H 6.1 . 1
133 . 29 TRP HZ3 H 6.86 . 1
134 . 29 TRP HH2 H 6.975 . 1
135 . 30 THR H H 8.4 . 1
136 . 30 THR HA H 4.825 . 1
137 . 30 THR HB H 3.74 . 1
138 . 30 THR HG2 H 1.105 . 1
139 . 31 ASN H H 9.245 . 1
140 . 31 ASN HA H 5.155 . 1
141 . 31 ASN HB2 H 2.79 . 1
142 . 31 ASN HB3 H 2.79 . 1
143 . 31 ASN HD21 H 5.105 . 2
144 . 31 ASN HD22 H 6.68 . 2
145 . 32 ASN H H 8.915 . 1
146 . 32 ASN HA H 5.175 . 1
147 . 32 ASN HB2 H 2.445 . 2
148 . 32 ASN HB3 H 3.48 . 2
149 . 32 ASN HD21 H 7.78 . 2
150 . 32 ASN HD22 H 7.93 . 2
151 . 33 ALA H H 8.975 . 1
152 . 33 ALA HA H 4.47 . 1
153 . 33 ALA HB H 1.28 . 1
154 . 34 GLY H H 8.765 . 1
155 . 34 GLY HA2 H 3.42 . 2
156 . 34 GLY HA3 H 3.54 . 2
157 . 35 PHE H H 5.73 . 1
158 . 35 PHE HA H 3.19 . 1
159 . 35 PHE HB2 H 3.135 . 1
160 . 35 PHE HB3 H 3.135 . 1
161 . 35 PHE HD1 H 6.775 . 1
162 . 35 PHE HD2 H 6.775 . 1
163 . 35 PHE HE1 H 7.22 . 1
164 . 35 PHE HE2 H 7.22 . 1
165 . 35 PHE HZ H 7.375 . 1
166 . 36 PRO HA H 4.97 . 1
167 . 36 PRO HB2 H 1.48 . 2
168 . 36 PRO HB3 H 2.41 . 2
169 . 37 HIS H H 7.285 . 1
170 . 37 HIS HA H 5.69 . 1
171 . 37 HIS HB2 H 2.575 . 2
172 . 37 HIS HB3 H 3.62 . 2
173 . 37 HIS HD2 H 7.72 . 1
174 . 37 HIS HE1 H 7.07 . 1
175 . 37 HIS HE2 H 9.855 . 1
176 . 38 ASN H H 10.03 . 1
177 . 38 ASN HA H 4.47 . 1
178 . 38 ASN HB2 H 2.64 . 2
179 . 38 ASN HB3 H 3.64 . 2
180 . 38 ASN HD21 H 6.58 . 2
181 . 38 ASN HD22 H 7.97 . 2
182 . 39 ILE H H 6.445 . 1
183 . 39 ILE HA H 4.045 . 1
184 . 39 ILE HB H 1.03 . 1
185 . 39 ILE HG12 H .94 . 2
186 . 39 ILE HG13 H .135 . 2
187 . 39 ILE HG2 H -.59 . 1
188 . 39 ILE HD1 H .305 . 1
189 . 40 VAL H H 8.865 . 1
190 . 40 VAL HA H 3.915 . 1
191 . 40 VAL HB H .77 . 1
192 . 40 VAL HG1 H .62 . 2
193 . 40 VAL HG2 H .565 . 2
194 . 41 PHE H H 8.495 . 1
195 . 41 PHE HA H 4.295 . 1
196 . 41 PHE HB2 H 2.64 . 2
197 . 41 PHE HB3 H 2.985 . 2
198 . 41 PHE HD1 H 7.065 . 1
199 . 41 PHE HD2 H 7.065 . 1
200 . 41 PHE HE1 H 6.885 . 1
201 . 41 PHE HE2 H 6.885 . 1
202 . 42 ASP H H 8.435 . 1
203 . 42 ASP HA H 4.575 . 1
204 . 42 ASP HB2 H 3.05 . 2
205 . 42 ASP HB3 H 2.515 . 2
206 . 43 GLU H H 8.875 . 1
207 . 43 GLU HA H 4.015 . 1
208 . 43 GLU HB2 H 2.13 . 2
209 . 43 GLU HB3 H 2.17 . 2
210 . 44 ASP H H 8.575 . 1
211 . 44 ASP HA H 4.86 . 1
212 . 44 ASP HB2 H 2.855 . 2
213 . 44 ASP HB3 H 2.65 . 2
214 . 45 ALA H H 8.41 . 1
215 . 45 ALA HA H 4.73 . 1
216 . 45 ALA HB H 1.435 . 1
217 . 46 VAL H H 7.015 . 1
218 . 46 VAL HA H 5.075 . 1
219 . 46 VAL HB H 1.915 . 1
220 . 46 VAL HG1 H 1.31 . 2
221 . 46 VAL HG2 H .885 . 2
222 . 47 PRO HA H 4.28 . 1
223 . 47 PRO HB2 H 1.555 . 2
224 . 47 PRO HB3 H 2.365 . 2
225 . 47 PRO HD2 H 2.355 . 2
226 . 47 PRO HD3 H 2.675 . 2
227 . 48 ALA H H 8.25 . 1
228 . 48 ALA HA H 4.145 . 1
229 . 48 ALA HB H 1.36 . 1
230 . 49 GLY H H 8.62 . 1
231 . 49 GLY HA2 H 3.62 . 2
232 . 49 GLY HA3 H 4.205 . 2
233 . 50 VAL H H 7.635 . 1
234 . 50 VAL HA H 3.965 . 1
235 . 50 VAL HB H 2.16 . 1
236 . 50 VAL HG1 H .91 . 1
237 . 50 VAL HG2 H .91 . 1
238 . 51 ASN H H 8.44 . 1
239 . 51 ASN HA H 4.885 . 1
240 . 51 ASN HB2 H 2.745 . 2
241 . 51 ASN HB3 H 2.975 . 2
242 . 51 ASN HD21 H 7.09 . 2
243 . 51 ASN HD22 H 7.63 . 2
244 . 52 ALA H H 9.175 . 1
245 . 52 ALA HA H 3.8 . 1
246 . 52 ALA HB H 1.42 . 1
247 . 53 ASP H H 8.245 . 1
248 . 53 ASP HA H 4.375 . 1
249 . 53 ASP HB2 H 2.82 . 2
250 . 53 ASP HB3 H 2.72 . 2
251 . 54 ALA H H 7.425 . 1
252 . 54 ALA HA H 4.18 . 1
253 . 54 ALA HB H 1.43 . 1
254 . 55 LEU H H 7 . 1
255 . 55 LEU HA H 4.04 . 1
256 . 55 LEU HB2 H 1.165 . 2
257 . 55 LEU HB3 H .64 . 2
258 . 55 LEU HG H 1.285 . 1
259 . 55 LEU HD1 H .355 . 2
260 . 55 LEU HD2 H .065 . 2
261 . 56 SER H H 7.47 . 1
262 . 56 SER HA H 4.32 . 1
263 . 56 SER HB2 H 4.1 . 2
264 . 56 SER HB3 H 3.89 . 2
265 . 57 HIS H H 9.46 . 1
266 . 57 HIS HA H 4.415 . 1
267 . 57 HIS HB2 H .93 . 2
268 . 57 HIS HB3 H 2.41 . 2
269 . 57 HIS HD2 H 8.29 . 1
270 . 57 HIS HE1 H 7.05 . 1
271 . 58 ASP H H 8.635 . 1
272 . 58 ASP HA H 4.09 . 1
273 . 58 ASP HB2 H 2.53 . 1
274 . 58 ASP HB3 H 2.53 . 1
275 . 59 ASP H H 7.99 . 1
276 . 59 ASP HA H 4.32 . 1
277 . 59 ASP HB2 H 2.5 . 2
278 . 59 ASP HB3 H 2.13 . 2
279 . 60 TYR H H 8.345 . 1
280 . 60 TYR HA H 4.59 . 1
281 . 60 TYR HB2 H 2.775 . 2
282 . 60 TYR HB3 H 2.96 . 2
283 . 60 TYR HD1 H 7 . 1
284 . 60 TYR HD2 H 7 . 1
285 . 60 TYR HE1 H 6.74 . 1
286 . 60 TYR HE2 H 6.74 . 1
287 . 61 LEU H H 9.39 . 1
288 . 61 LEU HA H 4.455 . 1
289 . 61 LEU HB2 H 1.63 . 2
290 . 61 LEU HB3 H 1.24 . 2
291 . 61 LEU HG H 1.375 . 1
292 . 61 LEU HD1 H .555 . 2
293 . 61 LEU HD2 H .455 . 2
294 . 62 ASN H H 8.385 . 1
295 . 62 ASN HA H 4.705 . 1
296 . 62 ASN HB2 H 2.69 . 1
297 . 62 ASN HB3 H 2.69 . 1
298 . 62 ASN HD21 H 6.72 . 2
299 . 62 ASN HD22 H 7.505 . 2
300 . 63 ALA H H 8.22 . 1
301 . 63 ALA HA H 4.59 . 1
302 . 63 ALA HB H 1.265 . 1
303 . 64 PRO HA H 3.7 . 1
304 . 64 PRO HB2 H 1.955 . 2
305 . 64 PRO HB3 H 2.37 . 2
306 . 64 PRO HG2 H 1.88 . 2
307 . 64 PRO HG3 H 1.64 . 2
308 . 64 PRO HD2 H 3.49 . 2
309 . 64 PRO HD3 H 3.59 . 2
310 . 65 GLY H H 8.43 . 1
311 . 65 GLY HA2 H 3.575 . 2
312 . 65 GLY HA3 H 4.195 . 2
313 . 66 GLU H H 7.32 . 1
314 . 66 GLU HA H 4.2 . 1
315 . 66 GLU HB2 H 1.965 . 2
316 . 66 GLU HB3 H 2.07 . 2
317 . 67 SER H H 8.58 . 1
318 . 67 SER HA H 5.965 . 1
319 . 67 SER HB2 H 3.72 . 2
320 . 67 SER HB3 H 3.68 . 2
321 . 68 TYR H H 8.9 . 1
322 . 68 TYR HA H 4.99 . 1
323 . 68 TYR HB2 H 2.455 . 2
324 . 68 TYR HB3 H 2.89 . 2
325 . 68 TYR HD1 H 7.275 . 1
326 . 68 TYR HD2 H 7.275 . 1
327 . 68 TYR HE1 H 7.05 . 1
328 . 68 TYR HE2 H 7.05 . 1
329 . 69 THR H H 7.79 . 1
330 . 69 THR HA H 5.54 . 1
331 . 69 THR HB H 3.57 . 1
332 . 69 THR HG2 H .905 . 1
333 . 70 ALA H H 8.62 . 1
334 . 70 ALA HA H 4.46 . 1
335 . 70 ALA HB H 1.13 . 1
336 . 71 LYS H H 7.82 . 1
337 . 71 LYS HA H 4.52 . 1
338 . 71 LYS HB2 H 1.435 . 2
339 . 71 LYS HB3 H 1.35 . 2
340 . 72 PHE H H 8.01 . 1
341 . 72 PHE HA H 4.355 . 1
342 . 72 PHE HB2 H 2.37 . 2
343 . 72 PHE HB3 H 2.67 . 2
344 . 72 PHE HD1 H 6.255 . 1
345 . 72 PHE HD2 H 6.255 . 1
346 . 72 PHE HE1 H 6.495 . 1
347 . 72 PHE HE2 H 6.495 . 1
348 . 72 PHE HZ H 7.02 . 1
349 . 73 ASP H H 8.3 . 1
350 . 73 ASP HA H 4.605 . 1
351 . 73 ASP HB2 H 2.595 . 2
352 . 73 ASP HB3 H 2.49 . 2
353 . 74 THR H H 7.925 . 1
354 . 74 THR HA H 4.405 . 1
355 . 74 THR HB H 3.88 . 1
356 . 74 THR HG2 H 1.265 . 1
357 . 75 ALA H H 8.97 . 1
358 . 75 ALA HA H 3.995 . 1
359 . 75 ALA HB H 1.38 . 1
360 . 76 GLY H H 9.195 . 1
361 . 76 GLY HA2 H 3.805 . 2
362 . 76 GLY HA3 H 4.46 . 2
363 . 77 GLU H H 8.165 . 1
364 . 77 GLU HA H 5.13 . 1
365 . 77 GLU HB2 H 1.83 . 2
366 . 77 GLU HB3 H 1.91 . 2
367 . 78 TYR H H 9.49 . 1
368 . 78 TYR HA H 5.66 . 1
369 . 78 TYR HB2 H 3.09 . 2
370 . 78 TYR HB3 H 3.635 . 2
371 . 78 TYR HD1 H 7.155 . 1
372 . 78 TYR HD2 H 7.155 . 1
373 . 78 TYR HE1 H 6.66 . 1
374 . 78 TYR HE2 H 6.66 . 1
375 . 78 TYR HH H 10.115 . 1
376 . 79 GLY H H 9.54 . 1
377 . 79 GLY HA2 H 3.93 . 2
378 . 79 GLY HA3 H 4.91 . 2
379 . 80 TYR H H 8.44 . 1
380 . 80 TYR HA H 5.15 . 1
381 . 80 TYR HB2 H 1.34 . 2
382 . 80 TYR HB3 H 1.46 . 2
383 . 80 TYR HD1 H 6.15 . 1
384 . 80 TYR HD2 H 6.15 . 1
385 . 80 TYR HE1 H 5.29 . 1
386 . 80 TYR HE2 H 5.29 . 1
387 . 80 TYR HH H 9.68 . 1
388 . 81 PHE H H 9.03 . 1
389 . 81 PHE HA H 5.15 . 1
390 . 81 PHE HB2 H 3.04 . 2
391 . 81 PHE HB3 H 3.27 . 2
392 . 81 PHE HD1 H 6.775 . 1
393 . 81 PHE HD2 H 6.775 . 1
394 . 81 PHE HE1 H 7.025 . 1
395 . 81 PHE HE2 H 7.025 . 1
396 . 81 PHE HZ H 7.24 . 1
397 . 82 CYS H H 7.67 . 1
398 . 82 CYS HA H 5.18 . 1
399 . 82 CYS HB2 H 3.335 . 2
400 . 82 CYS HB3 H 2.805 . 2
401 . 83 GLU H H 10.03 . 1
402 . 83 GLU HA H 4.42 . 1
403 . 83 GLU HB2 H 2.36 . 1
404 . 83 GLU HB3 H 2.36 . 1
405 . 84 PRO HA H 4.16 . 1
406 . 84 PRO HB2 H .96 . 2
407 . 84 PRO HB3 H 1.75 . 2
408 . 84 PRO HD2 H 3.325 . 2
409 . 84 PRO HD3 H 5.125 . 2
410 . 85 HIS H H 8.255 . 1
411 . 85 HIS HA H 5.165 . 1
412 . 85 HIS HB2 H 3.35 . 2
413 . 85 HIS HB3 H 3.78 . 2
414 . 85 HIS HD2 H 7.14 . 1
415 . 85 HIS HE1 H 7.75 . 1
416 . 86 GLN H H 8.46 . 1
417 . 86 GLN HA H 3.97 . 1
418 . 86 GLN HB2 H 2.13 . 2
419 . 86 GLN HB3 H 2.53 . 2
420 . 86 GLN HE21 H 6.765 . 2
421 . 86 GLN HE22 H 6.05 . 2
422 . 87 GLY H H 9.065 . 1
423 . 87 GLY HA2 H 3.79 . 2
424 . 87 GLY HA3 H 3.875 . 2
425 . 88 ALA H H 7.5 . 1
426 . 88 ALA HA H 4.55 . 1
427 . 88 ALA HB H 1.57 . 1
428 . 89 GLY H H 8.01 . 1
429 . 89 GLY HA2 H 3.77 . 2
430 . 89 GLY HA3 H 4.425 . 2
431 . 90 MET H H 7.56 . 1
432 . 90 MET HA H 4.525 . 1
433 . 90 MET HB2 H 2.15 . 2
434 . 90 MET HB3 H 1.42 . 2
435 . 90 MET HE H .59 . 1
436 . 91 VAL H H 7.82 . 1
437 . 91 VAL HA H 4.92 . 1
438 . 91 VAL HB H 2.215 . 1
439 . 91 VAL HG1 H 1.02 . 2
440 . 91 VAL HG2 H .895 . 2
441 . 92 GLY H H 8.465 . 1
442 . 92 GLY HA2 H 2.72 . 2
443 . 92 GLY HA3 H 4.79 . 2
444 . 93 LYS H H 8.74 . 1
445 . 93 LYS HA H 5.645 . 1
446 . 93 LYS HB2 H 1.805 . 2
447 . 93 LYS HB3 H 1.43 . 2
448 . 94 VAL H H 9.435 . 1
449 . 94 VAL HA H 4.63 . 1
450 . 94 VAL HB H 1.675 . 1
451 . 94 VAL HG1 H .85 . 2
452 . 94 VAL HG2 H .21 . 2
453 . 95 ILE H H 9.32 . 1
454 . 95 ILE HA H 4.52 . 1
455 . 95 ILE HB H 2.065 . 1
456 . 95 ILE HG12 H 1.45 . 2
457 . 95 ILE HG13 H 1.025 . 2
458 . 95 ILE HG2 H .825 . 1
459 . 95 ILE HD1 H .77 . 1
460 . 96 VAL H H 9.14 . 1
461 . 96 VAL HA H 4.55 . 1
462 . 96 VAL HB H 2.46 . 1
463 . 96 VAL HG1 H .62 . 2
464 . 96 VAL HG2 H .45 . 2
465 . 97 GLN H H 9.225 . 1
466 . 97 GLN HA H 4.38 . 1
467 . 97 GLN HB2 H 1.945 . 2
468 . 97 GLN HB3 H 2.21 . 2
469 . 97 GLN HE21 H 7.34 . 2
470 . 97 GLN HE22 H 6.73 . 2
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