data_6165
#######################
# Entry information #
#######################
save_entry_information
_Saveframe_category entry_information
_Entry_title
;
Solution structure of the PSI domain from the Met receptor
;
_BMRB_accession_number 6165
_BMRB_flat_file_name bmr6165.str
_Entry_type original
_Submission_date 2004-04-02
_Accession_date 2004-04-02
_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 Kozlov G. . .
2 Perreault A. . .
3 Schrag J. D. .
4 Cygler M. . .
5 Gehring K. . .
6 Ekiel I. . .
stop_
loop_
_Saveframe_category_type
_Saveframe_category_type_count
assigned_chemical_shifts 1
coupling_constants 1
stop_
loop_
_Data_type
_Data_type_count
"1H chemical shifts" 220
"coupling constants" 38
stop_
loop_
_Revision_date
_Revision_keyword
_Revision_author
_Revision_detail
2004-11-08 original BMRB .
stop_
_Original_release_date 2004-04-02
save_
#############################
# Citation for this entry #
#############################
save_entry_citation
_Saveframe_category entry_citation
_Citation_full .
_Citation_title
;
Insights into function of PSI domains from structure of the Met receptor PSI domain
;
_Citation_status published
_Citation_type journal
_CAS_abstract_code .
_MEDLINE_UI_code .
_PubMed_ID 15358240
loop_
_Author_ordinal
_Author_family_name
_Author_given_name
_Author_middle_initials
_Author_family_title
1 Kozlov G. . .
2 Perreault A. . .
3 Schrag J. D. .
4 Park M. . .
5 Cygler M. . .
6 Gehring K. . .
7 Ekiel I. . .
stop_
_Journal_abbreviation 'Biochem. Biophys. Res. Commun.'
_Journal_volume 321
_Journal_issue 1
_Journal_CSD .
_Book_chapter_title .
_Book_volume .
_Book_series .
_Book_ISBN .
_Conference_state_province .
_Conference_abstract_number .
_Page_first 234
_Page_last 240
_Year 2004
_Details .
loop_
_Keyword
'cysteine knot'
stop_
save_
##################################
# Molecular system description #
##################################
save_system_receptor
_Saveframe_category molecular_system
_Mol_system_name 'Hepatocyte growth factor receptor'
_Abbreviation_common 'Hepatocyte growth factor receptor'
_Enzyme_commission_number .
loop_
_Mol_system_component_name
_Mol_label
receptor $receptor
stop_
_System_molecular_weight .
_System_physical_state native
_System_oligomer_state monomer
_System_paramagnetic no
_System_thiol_state 'all disulfide bound'
_Database_query_date .
_Details .
save_
########################
# Monomeric polymers #
########################
save_receptor
_Saveframe_category monomeric_polymer
_Mol_type polymer
_Mol_polymer_class protein
_Name_common 'Hepatocyte growth factor receptor'
_Abbreviation_common 'Hepatocyte growth factor receptor'
_Molecular_mass .
_Mol_thiol_state 'all disulfide bound'
_Details .
##############################
# Polymer residue sequence #
##############################
_Residue_count 48
_Mol_residue_sequence
;
GSAMGCRHFQSCSQCLSAPP
FVQCGWCHDKCVRSEECLSG
TWTQQICL
;
loop_
_Residue_seq_code
_Residue_author_seq_code
_Residue_label
1 1 GLY 2 2 SER 3 3 ALA 4 4 MET 5 5 GLY
6 6 CYS 7 7 ARG 8 8 HIS 9 9 PHE 10 10 GLN
11 11 SER 12 12 CYS 13 13 SER 14 14 GLN 15 15 CYS
16 16 LEU 17 17 SER 18 18 ALA 19 19 PRO 20 20 PRO
21 21 PHE 22 22 VAL 23 23 GLN 24 24 CYS 25 25 GLY
26 26 TRP 27 27 CYS 28 28 HIS 29 29 ASP 30 30 LYS
31 31 CYS 32 32 VAL 33 33 ARG 34 34 SER 35 35 GLU
36 36 GLU 37 37 CYS 38 38 LEU 39 39 SER 40 40 GLY
41 41 THR 42 42 TRP 43 43 THR 44 44 GLN 45 45 GLN
46 46 ILE 47 47 CYS 48 48 LEU
stop_
_Sequence_homology_query_date 2008-08-19
_Sequence_homology_query_revised_last_date 2008-08-19
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 1SSL 'Solution Structure Of The Psi Domain From The Met Receptor' 100.00 48 100.00 100.00 9.34e-20
stop_
save_
####################
# Natural source #
####################
save_natural_source
_Saveframe_category natural_source
loop_
_Mol_label
_Organism_name_common
_NCBI_taxonomy_ID
_Superkingdom
_Kingdom
_Genus
_Species
$receptor Human 9606 Eukaryota Metazoa Homo sapiens
stop_
save_
#########################
# Experimental source #
#########################
save_experimental_source
_Saveframe_category experimental_source
loop_
_Mol_label
_Production_method
_Host_organism_name_common
_Genus
_Species
_Strain
_Vector_type
_Vector_name
$receptor 'recombinant technology' 'E. coli' Escherichia coli ORIGAMI(NOVAGEN) plasmid PET32A
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
$receptor 1 mM .
'phosphate buffer' 50 mM .
NaCl 0.15 M .
H2O 90 % .
D2O 10 % .
stop_
save_
save_sample_2
_Saveframe_category sample
_Sample_type solution
_Details .
loop_
_Mol_label
_Concentration_value
_Concentration_value_units
_Isotopic_labeling
$receptor 1 mM .
'phosphate buffer' 50 mM .
NaCl 0.15 M .
D2O 100 % .
stop_
save_
############################
# Computer software used #
############################
save_XWINNMR
_Saveframe_category software
_Name xwinnmr
_Version 2.1
loop_
_Task
collection
processing
stop_
_Details 'Bruker Biospin'
save_
save_XEASY
_Saveframe_category software
_Name XEASY
_Version 1.3.13
loop_
_Task
'data analysis'
stop_
_Details Wuthrich
save_
save_CYANA
_Saveframe_category software
_Name CYANA
_Version 1.0.6
loop_
_Task
'structure solution'
stop_
_Details Guentert
save_
save_Xplor-NIH
_Saveframe_category software
_Name 'X-PLOR NIH'
_Version 2.9.2
loop_
_Task
refinement
stop_
_Details Clore
save_
#########################
# Experimental detail #
#########################
##################################
# NMR Spectrometer definitions #
##################################
save_NMR_spectrometer
_Saveframe_category NMR_spectrometer
_Manufacturer Bruker
_Model DRX
_Field_strength 500
_Details .
save_
#############################
# NMR applied experiments #
#############################
save_2D_NOESY_1
_Saveframe_category NMR_applied_experiment
_Experiment_name '2D NOESY'
_Sample_label .
save_
save_DQF-COSY_2
_Saveframe_category NMR_applied_experiment
_Experiment_name DQF-COSY
_Sample_label .
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' 0.15 . M
pH 6.0 . pH
pressure 1 . atm
temperature 283 . 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 . ppm . . indirect . . . 1.0
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_
_Experiment_label
'2D NOESY'
DQF-COSY
stop_
loop_
_Sample_label
$sample_1
stop_
_Sample_conditions_label $sample_cond_1
_Chem_shift_reference_set_label $chemical_shift_reference
_Mol_system_component_name receptor
_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 1 GLY HA2 H 3.97 0.01 2
2 2 2 SER H H 8.73 0.01 1
3 2 2 SER HA H 4.41 0.01 1
4 2 2 SER HB2 H 3.79 0.01 2
5 3 3 ALA H H 8.60 0.01 1
6 3 3 ALA HA H 4.25 0.01 1
7 3 3 ALA HB H 1.29 0.01 1
8 4 4 MET H H 8.40 0.01 1
9 4 4 MET HA H 4.41 0.01 1
10 4 4 MET HB2 H 1.94 0.01 2
11 4 4 MET HG2 H 2.46 0.01 2
12 5 5 GLY H H 8.33 0.01 1
13 5 5 GLY HA2 H 4.06 0.01 2
14 5 5 GLY HA3 H 4.04 0.01 2
15 6 6 CYS H H 8.93 0.01 1
16 6 6 CYS HA H 4.73 0.01 1
17 6 6 CYS HB2 H 3.04 0.01 2
18 6 6 CYS HB3 H 2.94 0.01 2
19 7 7 ARG H H 8.14 0.01 1
20 7 7 ARG HA H 4.49 0.01 1
21 7 7 ARG HB2 H 1.76 0.01 2
22 7 7 ARG HB3 H 1.70 0.01 2
23 7 7 ARG HG2 H 1.87 0.01 2
24 7 7 ARG HD2 H 3.15 0.01 2
25 7 7 ARG HD3 H 3.25 0.01 2
26 7 7 ARG HH21 H 7.39 0.01 2
27 8 8 HIS H H 7.65 0.01 1
28 8 8 HIS HA H 4.16 0.01 1
29 8 8 HIS HB2 H 2.89 0.01 2
30 8 8 HIS HB3 H 2.56 0.01 2
31 8 8 HIS HD2 H 6.39 0.01 1
32 9 9 PHE H H 7.51 0.01 1
33 9 9 PHE HA H 4.49 0.01 1
34 9 9 PHE HB2 H 3.52 0.01 2
35 9 9 PHE HB3 H 2.61 0.01 2
36 9 9 PHE HD1 H 7.49 0.01 3
37 9 9 PHE HE1 H 7.31 0.01 3
38 10 10 GLN H H 8.44 0.01 1
39 10 10 GLN HA H 4.32 0.01 1
40 10 10 GLN HB2 H 1.95 0.01 2
41 10 10 GLN HG2 H 2.37 0.01 2
42 11 11 SER H H 7.48 0.01 1
43 11 11 SER HA H 4.40 0.01 1
44 11 11 SER HB2 H 3.66 0.01 2
45 12 12 CYS H H 8.01 0.01 1
46 12 12 CYS HA H 3.81 0.01 1
47 12 12 CYS HB2 H 2.53 0.01 2
48 12 12 CYS HB3 H 2.18 0.01 2
49 13 13 SER H H 8.48 0.01 1
50 13 13 SER HA H 3.62 0.01 1
51 13 13 SER HB2 H 3.57 0.01 2
52 14 14 GLN H H 7.26 0.01 1
53 14 14 GLN HA H 3.84 0.01 1
54 14 14 GLN HB2 H 2.19 0.01 2
55 14 14 GLN HB3 H 1.97 0.01 2
56 14 14 GLN HG2 H 2.34 0.01 2
57 15 15 CYS H H 8.26 0.01 1
58 15 15 CYS HA H 3.76 0.01 1
59 15 15 CYS HB2 H 3.22 0.01 2
60 15 15 CYS HB3 H 3.11 0.01 2
61 16 16 LEU H H 8.24 0.01 1
62 16 16 LEU HA H 3.86 0.01 1
63 16 16 LEU HB2 H 1.44 0.01 2
64 16 16 LEU HB3 H 1.35 0.01 2
65 16 16 LEU HG H 1.53 0.01 1
66 16 16 LEU HD1 H 0.54 0.01 2
67 16 16 LEU HD2 H 0.46 0.01 2
68 17 17 SER H H 7.06 0.01 1
69 17 17 SER HA H 4.36 0.01 1
70 17 17 SER HB2 H 3.77 0.01 2
71 18 18 ALA H H 6.61 0.01 1
72 18 18 ALA HA H 3.87 0.01 1
73 18 18 ALA HB H 0.62 0.01 1
74 20 20 PRO HA H 4.58 0.01 1
75 20 20 PRO HB2 H 2.38 0.01 2
76 20 20 PRO HB3 H 1.44 0.01 2
77 20 20 PRO HG2 H 2.08 0.01 2
78 20 20 PRO HG3 H 1.99 0.01 2
79 20 20 PRO HD2 H 3.88 0.01 2
80 20 20 PRO HD3 H 3.80 0.01 2
81 21 21 PHE H H 7.67 0.01 1
82 21 21 PHE HA H 4.49 0.01 1
83 21 21 PHE HB2 H 3.32 0.01 2
84 21 21 PHE HB3 H 3.05 0.01 2
85 21 21 PHE HD1 H 7.20 0.01 3
86 21 21 PHE HE1 H 7.36 0.01 3
87 22 22 VAL H H 7.16 0.01 1
88 22 22 VAL HA H 3.89 0.01 1
89 22 22 VAL HB H 2.18 0.01 1
90 22 22 VAL HG1 H 0.93 0.01 2
91 22 22 VAL HG2 H 0.78 0.01 2
92 23 23 GLN H H 7.47 0.01 1
93 23 23 GLN HA H 4.20 0.01 1
94 23 23 GLN HB2 H 2.15 0.01 2
95 23 23 GLN HG2 H 2.03 0.01 2
96 24 24 CYS H H 7.61 0.01 1
97 24 24 CYS HA H 4.96 0.01 1
98 24 24 CYS HB2 H 3.16 0.01 2
99 24 24 CYS HB3 H 2.35 0.01 2
100 25 25 GLY H H 8.94 0.01 1
101 25 25 GLY HA2 H 3.73 0.01 2
102 26 26 TRP H H 8.49 0.01 1
103 26 26 TRP HA H 5.04 0.01 1
104 26 26 TRP HB2 H 3.04 0.01 2
105 26 26 TRP HB3 H 2.70 0.01 2
106 26 26 TRP HD1 H 7.20 0.01 1
107 26 26 TRP HE3 H 7.16 0.01 1
108 26 26 TRP HE1 H 9.32 0.01 1
109 26 26 TRP HZ3 H 6.50 0.01 1
110 26 26 TRP HZ2 H 7.23 0.01 1
111 26 26 TRP HH2 H 6.82 0.01 1
112 27 27 CYS H H 8.70 0.01 1
113 27 27 CYS HA H 4.92 0.01 1
114 27 27 CYS HB2 H 3.15 0.01 2
115 27 27 CYS HB3 H 2.31 0.01 2
116 28 28 HIS H H 9.01 0.01 1
117 28 28 HIS HA H 4.03 0.01 1
118 28 28 HIS HB2 H 3.63 0.01 2
119 28 28 HIS HB3 H 3.04 0.01 2
120 29 29 ASP H H 8.97 0.01 1
121 29 29 ASP HA H 4.29 0.01 1
122 29 29 ASP HB2 H 2.86 0.01 2
123 29 29 ASP HB3 H 2.10 0.01 2
124 30 30 LYS H H 8.92 0.01 1
125 30 30 LYS HA H 3.97 0.01 1
126 30 30 LYS HB2 H 1.70 0.01 2
127 30 30 LYS HB3 H 1.24 0.01 2
128 30 30 LYS HG2 H 1.41 0.01 2
129 30 30 LYS HD2 H 1.56 0.01 2
130 30 30 LYS HE2 H 2.85 0.01 2
131 31 31 CYS H H 8.92 0.01 1
132 31 31 CYS HA H 5.28 0.01 1
133 31 31 CYS HB2 H 2.95 0.01 2
134 32 32 VAL H H 9.03 0.01 1
135 32 32 VAL HA H 5.04 0.01 1
136 32 32 VAL HB H 2.59 0.01 1
137 32 32 VAL HG1 H 0.77 0.01 1
138 32 32 VAL HG2 H 0.77 0.01 1
139 33 33 ARG H H 8.94 0.01 1
140 33 33 ARG HA H 4.97 0.01 1
141 33 33 ARG HB2 H 2.13 0.01 2
142 33 33 ARG HB3 H 1.49 0.01 2
143 33 33 ARG HG2 H 1.78 0.01 2
144 33 33 ARG HD2 H 3.19 0.01 2
145 33 33 ARG HD3 H 3.40 0.01 2
146 33 33 ARG HH21 H 7.75 0.01 2
147 33 33 ARG HH22 H 6.96 0.01 2
148 34 34 SER H H 9.14 0.01 1
149 35 35 GLU H H 9.17 0.01 1
150 35 35 GLU HA H 3.98 0.01 1
151 35 35 GLU HB2 H 1.90 0.01 2
152 35 35 GLU HG2 H 2.24 0.01 2
153 35 35 GLU HG3 H 2.00 0.01 2
154 36 36 GLU H H 7.55 0.01 1
155 36 36 GLU HA H 3.96 0.01 1
156 36 36 GLU HB2 H 2.27 0.01 2
157 36 36 GLU HG2 H 2.17 0.01 2
158 37 37 CYS H H 9.10 0.01 1
159 37 37 CYS HA H 5.04 0.01 1
160 37 37 CYS HB2 H 3.30 0.01 2
161 37 37 CYS HB3 H 2.35 0.01 2
162 38 38 LEU HA H 4.39 0.01 1
163 38 38 LEU HB2 H 1.61 0.01 2
164 38 38 LEU HB3 H 1.51 0.01 2
165 38 38 LEU HD1 H 0.83 0.01 2
166 38 38 LEU HD2 H 0.70 0.01 2
167 39 39 SER H H 7.68 0.01 1
168 39 39 SER HA H 4.37 0.01 1
169 39 39 SER HB2 H 3.93 0.01 2
170 39 39 SER HB3 H 3.69 0.01 2
171 40 40 GLY H H 8.25 0.01 1
172 40 40 GLY HA2 H 4.07 0.01 2
173 40 40 GLY HA3 H 3.89 0.01 2
174 41 41 THR H H 7.81 0.01 1
175 41 41 THR HA H 4.41 0.01 1
176 41 41 THR HB H 4.37 0.01 1
177 41 41 THR HG2 H 1.09 0.01 1
178 42 42 TRP H H 8.38 0.01 1
179 42 42 TRP HA H 4.75 0.01 1
180 42 42 TRP HB2 H 3.19 0.01 2
181 42 42 TRP HB3 H 3.07 0.01 2
182 42 42 TRP HD1 H 6.56 0.01 1
183 42 42 TRP HE3 H 7.39 0.01 1
184 42 42 TRP HE1 H 9.94 0.01 1
185 42 42 TRP HZ2 H 7.33 0.01 1
186 42 42 TRP HH2 H 6.86 0.01 1
187 43 43 THR H H 7.92 0.01 1
188 43 43 THR HA H 4.60 0.01 1
189 43 43 THR HB H 4.19 0.01 1
190 43 43 THR HG2 H 1.42 0.01 1
191 44 44 GLN H H 8.72 0.01 1
192 44 44 GLN HA H 4.29 0.01 1
193 44 44 GLN HB2 H 2.15 0.01 2
194 44 44 GLN HB3 H 1.59 0.01 2
195 44 44 GLN HG2 H 1.86 0.01 2
196 44 44 GLN HG3 H 1.21 0.01 2
197 44 44 GLN HE21 H 7.56 0.01 1
198 44 44 GLN HE22 H 7.38 0.01 1
199 45 45 GLN H H 8.82 0.01 1
200 45 45 GLN HA H 4.36 0.01 1
201 45 45 GLN HB2 H 2.01 0.01 2
202 45 45 GLN HB3 H 1.78 0.01 2
203 45 45 GLN HG2 H 2.25 0.01 2
204 46 46 ILE H H 7.18 0.01 1
205 46 46 ILE HA H 4.22 0.01 1
206 46 46 ILE HB H 1.66 0.01 1
207 46 46 ILE HG2 H 0.73 0.01 1
208 46 46 ILE HG12 H 1.33 0.01 2
209 46 46 ILE HG13 H 0.97 0.01 2
210 46 46 ILE HD1 H 0.76 0.01 1
211 47 47 CYS H H 8.14 0.01 1
212 47 47 CYS HA H 4.63 0.01 1
213 47 47 CYS HB2 H 2.81 0.01 2
214 47 47 CYS HB3 H 2.35 0.01 2
215 48 48 LEU H H 8.22 0.01 1
216 48 48 LEU HA H 4.07 0.01 1
217 48 48 LEU HB2 H 1.54 0.01 2
218 48 48 LEU HG H 0.88 0.01 1
219 48 48 LEU HD1 H 0.79 0.01 2
220 48 48 LEU HD2 H 0.73 0.01 2
stop_
save_
########################
# Coupling constants #
########################
save_coupling_constants_set_1
_Saveframe_category coupling_constants
_Details .
loop_
_Experiment_label
'2D NOESY'
DQF-COSY
stop_
loop_
_Sample_label
$sample_1
stop_
_Sample_conditions_label $sample_cond_1
_Spectrometer_frequency_1H 500
_Mol_system_component_name receptor
_Text_data_format .
_Text_data .
loop_
_Coupling_constant_ID
_Coupling_constant_code
_Atom_one_residue_seq_code
_Atom_one_residue_label
_Atom_one_name
_Atom_two_residue_seq_code
_Atom_two_residue_label
_Atom_two_name
_Coupling_constant_value
_Coupling_constant_min_value
_Coupling_constant_max_value
_Coupling_constant_value_error
1 3JHNHA 3 ALA H 3 ALA HA 7.2 . . 1.0
2 3JHNHA 4 MET H 4 MET HA 7.8 . . 1.0
3 3JHNHA 5 GLY H 5 GLY HA 11.0 . . 1.0
4 3JHNHA 7 ARG H 7 ARG HA 5.0 . . 1.0
5 3JHNHA 8 HIS H 8 HIS HA 7.6 . . 1.0
6 3JHNHA 9 PHE H 9 PHE HA 5.8 . . 1.0
7 3JHNHA 10 GLN H 10 GLN HA 8.0 . . 1.0
8 3JHNHA 11 SER H 11 SER HA 7.8 . . 1.0
9 3JHNHA 13 SER H 13 SER HA 5.4 . . 1.0
10 3JHNHA 14 GLN H 14 GLN HA 6.3 . . 1.0
11 3JHNHA 15 CYS H 15 CYS HA 6.3 . . 1.0
12 3JHNHA 16 LEU H 16 LEU HA 6.6 . . 1.0
13 3JHNHA 17 SER H 17 SER HA 8.4 . . 1.0
14 3JHNHA 18 ALA H 18 ALA HA 4.7 . . 1.0
15 3JHNHA 21 PHE H 21 PHE HA 7.1 . . 1.0
16 3JHNHA 22 VAL H 22 VAL HA 8.3 . . 1.0
17 3JHNHA 23 GLN H 23 GLN HA 9.9 . . 1.0
18 3JHNHA 24 CYS H 24 CYS HA 8.2 . . 1.0
19 3JHNHA 25 GLY H 25 GLY HA 8.4 . . 1.0
20 3JHNHA 26 TRP H 26 TRP HA 10.3 . . 1.0
21 3JHNHA 27 CYS H 27 CYS HA 10.3 . . 1.0
22 3JHNHA 28 HIS H 28 HIS HA 9.1 . . 1.0
23 3JHNHA 29 ASP H 29 ASP HA 11.3 . . 1.0
24 3JHNHA 31 CYS H 31 CYS HA 9.0 . . 1.0
25 3JHNHA 32 VAL H 32 VAL HA 7.6 . . 1.0
26 3JHNHA 33 ARG H 33 ARG HA 8.1 . . 1.0
27 3JHNHA 35 GLU H 35 GLU HA 5.2 . . 1.0
28 3JHNHA 36 GLU H 36 GLU HA 7.6 . . 1.0
29 3JHNHA 37 CYS H 37 CYS HA 8.7 . . 1.0
30 3JHNHA 39 SER H 39 SER HA 8.7 . . 1.0
31 3JHNHA 40 GLY H 40 GLY HA 10.6 . . 1.0
32 3JHNHA 41 THR H 41 THR HA 9.2 . . 1.0
33 3JHNHA 43 THR H 43 THR HA 9.0 . . 1.0
34 3JHNHA 44 GLN H 44 GLN HA 11.3 . . 1.0
35 3JHNHA 45 GLN H 45 GLN HA 10.1 . . 1.0
36 3JHNHA 46 ILE H 46 ILE HA 9.9 . . 1.0
37 3JHNHA 47 CYS H 47 CYS HA 9.0 . . 1.0
38 3JHNHA 48 LEU H 48 LEU HA 7.2 . . 1.0
stop_
save_