data_4600
#######################
# Entry information #
#######################
save_entry_information
_Saveframe_category entry_information
_Entry_title
;
Nucleocapsid protein from Mason-Pfizer monkey virus (MPMV)
;
_BMRB_accession_number 4600
_BMRB_flat_file_name bmr4600.str
_Entry_type original
_Submission_date 2000-05-05
_Accession_date 2000-09-07
_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 Gao Y. . .
2 Kaluarachchi K. . .
3 Giedroc D. P. .
stop_
loop_
_Saveframe_category_type
_Saveframe_category_type_count
assigned_chemical_shifts 1
stop_
loop_
_Data_type
_Data_type_count
"1H chemical shifts" 287
"13C chemical shifts" 110
"15N chemical shifts" 54
stop_
loop_
_Revision_date
_Revision_keyword
_Revision_author
_Revision_detail
2000-12-21 original author .
stop_
_Original_release_date 2000-12-21
save_
#############################
# Citation for this entry #
#############################
save_entry_citation
_Saveframe_category entry_citation
_Citation_full .
_Citation_title
;
Solution Structure and Backbone Dynamics of Mason-Pfizer Monkey Virus (MPMV)
Nucleocapsid Protein
;
_Citation_status published
_Citation_type journal
_CAS_abstract_code .
_MEDLINE_UI_code 99043695
_PubMed_ID 9827993
loop_
_Author_ordinal
_Author_family_name
_Author_given_name
_Author_middle_initials
_Author_family_title
1 Gao Y. . .
2 Kaluarachchi K. . .
3 Giedroc D. P. .
stop_
_Journal_abbreviation 'Protein Sci.'
_Journal_volume 7
_Journal_issue .
_Journal_CSD .
_Book_chapter_title .
_Book_volume .
_Book_series .
_Book_ISBN .
_Conference_state_province .
_Conference_abstract_number .
_Page_first 2265
_Page_last 2280
_Year 1998
_Details .
loop_
_Keyword
'Nucleocapsid protein'
'Rna binding protein'
Retrovirus
'Viral protein'
stop_
save_
##################################
# Molecular system description #
##################################
save_system_GAG
_Saveframe_category molecular_system
_Mol_system_name 'GAG Polyprotein'
_Enzyme_commission_number .
loop_
_Mol_system_component_name
_Mol_label
GAG $GAG
Zn $ZN
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_GAG
_Saveframe_category monomeric_polymer
_Mol_type polymer
_Mol_polymer_class protein
_Name_common 'Protein (GAG Polyprotein)'
_Molecular_mass .
_Mol_thiol_state 'all free'
_Details .
##############################
# Polymer residue sequence #
##############################
_Residue_count 60
_Mol_residue_sequence
;
GGSCFKCGKKGHFAKNCHEH
AHNNAEPKVPGLCPRCKRGK
HWANECKSKTDNQGNPIPPH
;
loop_
_Residue_seq_code
_Residue_author_seq_code
_Residue_label
1 21 GLY 2 22 GLY 3 23 SER 4 24 CYS 5 25 PHE
6 26 LYS 7 27 CYS 8 28 GLY 9 29 LYS 10 30 LYS
11 31 GLY 12 32 HIS 13 33 PHE 14 34 ALA 15 35 LYS
16 36 ASN 17 37 CYS 18 38 HIS 19 39 GLU 20 40 HIS
21 41 ALA 22 42 HIS 23 43 ASN 24 44 ASN 25 45 ALA
26 46 GLU 27 47 PRO 28 48 LYS 29 49 VAL 30 50 PRO
31 51 GLY 32 52 LEU 33 53 CYS 34 54 PRO 35 55 ARG
36 56 CYS 37 57 LYS 38 58 ARG 39 59 GLY 40 60 LYS
41 61 HIS 42 62 TRP 43 63 ALA 44 64 ASN 45 65 GLU
46 66 CYS 47 67 LYS 48 68 SER 49 69 LYS 50 70 THR
51 71 ASP 52 72 ASN 53 73 GLN 54 74 GLY 55 75 ASN
56 76 PRO 57 77 ILE 58 78 PRO 59 79 PRO 60 80 HIS
stop_
_Sequence_homology_query_date .
_Sequence_homology_query_revised_last_date 2015-02-04
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 4498 "GAG MPMV" 100.00 61 100.00 100.00 4.32e-34
PDB 1CL4 "Nucleocapsid Protein From Mason-Pfizer Monkey Virus (Mpmv)" 100.00 60 100.00 100.00 4.03e-34
GB AAA47710 "gag polyprotein [Mason-Pfizer monkey virus]" 100.00 657 98.33 98.33 6.38e-33
GB AAC82573 "Pr78 [Mason-Pfizer monkey virus]" 100.00 657 98.33 98.33 6.38e-33
GB AAC82574 "Pr95 [Mason-Pfizer monkey virus]" 100.00 911 98.33 98.33 8.37e-33
GB AAC82576 "RT-IN [Mason-Pfizer monkey virus]" 100.00 1771 98.33 98.33 1.58e-36
GB ABD83648 "codon usage optimized MPMV-gag protein [synthetic construct]" 100.00 657 98.33 98.33 6.38e-33
REF NP_056891 "RT-IN [Mason-Pfizer monkey virus]" 100.00 1771 98.33 98.33 1.58e-36
REF NP_056892 "Pr95 [Mason-Pfizer monkey virus]" 100.00 911 98.33 98.33 8.37e-33
REF NP_056893 "Pr78 [Mason-Pfizer monkey virus]" 100.00 657 98.33 98.33 6.38e-33
REF NP_954556 "p14 NC [Mason-Pfizer monkey virus]" 100.00 97 98.33 98.33 1.31e-33
REF NP_954564 "DU [Mason-Pfizer monkey virus]" 100.00 234 98.33 98.33 2.15e-34
SP P07567 "RecName: Full=Gag polyprotein; AltName: Full=Core polyprotein; Contains: RecName: Full=Matrix protein p10; Contains: RecName: F" 100.00 657 98.33 98.33 6.38e-33
stop_
save_
#############
# Ligands #
#############
save_ZN
_Saveframe_category ligand
_Mol_type non-polymer
_Name_common "ZN (ZINC ION)"
_BMRB_code .
_PDB_code ZN
_Molecular_mass 65.409
_Mol_charge 2
_Mol_paramagnetic .
_Mol_aromatic no
_Details
;
Information obtained from PDB's Chemical Component Dictionary
at http://wwpdb-remediation.rutgers.edu/downloads.html
Downloaded on Fri Jun 10 14:33:36 2011
;
loop_
_Atom_name
_PDB_atom_name
_Atom_type
_Atom_chirality
_Atom_charge
_Atom_oxidation_number
_Atom_unpaired_electrons
ZN ZN ZN . 2 . ?
stop_
_Mol_thiol_state .
_Sequence_homology_query_date .
save_
####################
# Natural source #
####################
save_natural_source
_Saveframe_category natural_source
loop_
_Mol_label
_Organism_name_common
_NCBI_taxonomy_ID
_Superkingdom
_Kingdom
_Genus
_Species
$GAG 'Mason-Pfizer monkey virus' . . . . .
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
$GAG 'recombinant technology' . Escherichia coli BL21(DE3)/PLYSS PT72180.MPMV
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
$GAG . mM .
stop_
save_
############################
# Computer software used #
############################
save_X-PLOR
_Saveframe_category software
_Name X-PLOR
_Version 3.1
loop_
_Task
refinement
stop_
_Details Brunger
save_
#########################
# Experimental detail #
#########################
##################################
# NMR Spectrometer definitions #
##################################
save_NMR_spectrometer
_Saveframe_category NMR_spectrometer
_Manufacturer VARIAN
_Model 'UNITY INOVA'
_Field_strength 500
_Details .
save_
#############################
# NMR applied experiments #
#############################
save__1
_Saveframe_category NMR_applied_experiment
_Sample_label $sample_1
save_
#######################
# Sample conditions #
#######################
save_sample_cond_1
_Saveframe_category sample_conditions
_Details .
loop_
_Variable_type
_Variable_value
_Variable_value_error
_Variable_value_units
pH 6.2 . n/a
temperature 298.0 . K
pressure 1 . atm
stop_
save_
####################
# NMR parameters #
####################
##############################
# Assigned chemical shifts #
##############################
################################
# Chemical shift referencing #
################################
save_chemical_shift_ref_1
_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
. H 1 . ppm . . . . . . $entry_citation $entry_citation
. C 13 . ppm . . . . . . $entry_citation $entry_citation
. N 15 . ppm . . . . . . $entry_citation $entry_citation
stop_
save_
###################################
# Assigned chemical shift lists #
###################################
###################################################################
# Chemical Shift Ambiguity Index Value Definitions #
# #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains. #
# #
# Index Value Definition #
# #
# 1 Unique (including isolated methyl protons, #
# geminal atoms, and geminal methyl #
# groups with identical chemical shifts) #
# (e.g. ILE HD11, HD12, HD13 protons) #
# 2 Ambiguity of geminal atoms or geminal methyl #
# proton groups (e.g. ASP HB2 and HB3 #
# protons, LEU CD1 and CD2 carbons, or #
# LEU HD11, HD12, HD13 and HD21, HD22, #
# HD23 methyl protons) #
# 3 Aromatic atoms on opposite sides of #
# symmetrical rings (e.g. TYR HE1 and HE2 #
# protons) #
# 4 Intraresidue ambiguities (e.g. LYS HG and #
# HD protons or TRP HZ2 and HZ3 protons) #
# 5 Interresidue ambiguities (LYS 12 vs. LYS 27) #
# 6 Intermolecular ambiguities (e.g. ASP 31 CA #
# in monomer 1 and ASP 31 CA in monomer 2 #
# of an asymmetrical homodimer, duplex #
# DNA assignments, or other assignments #
# that may apply to atoms in one or more #
# molecule in the molecular assembly) #
# 9 Ambiguous, specific ambiguity not defined #
# #
###################################################################
save_chemical_shift_set_1
_Saveframe_category assigned_chemical_shifts
_Details .
loop_
_Sample_label
$sample_1
stop_
_Sample_conditions_label $sample_cond_1
_Chem_shift_reference_set_label $chemical_shift_ref_1
_Mol_system_component_name GAG
_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 . 3 SER N N 114.8 . .
2 . 3 SER H H 7.85 . .
3 . 3 SER C C 173.0 . .
4 . 3 SER CA C 57.8 . .
5 . 3 SER HA H 4.39 . .
6 . 3 SER HB2 H 3.80 . .
7 . 3 SER HB3 H 3.45 . .
8 . 4 CYS N N 126.0 . .
9 . 4 CYS H H 8.25 . .
10 . 4 CYS C C 178.5 . .
11 . 4 CYS CA C 59.7 . .
12 . 4 CYS HA H 4.16 . .
13 . 4 CYS HB2 H 2.81 . .
14 . 4 CYS HB3 H 1.88 . .
15 . 5 PHE N N 127.7 . .
16 . 5 PHE H H 8.27 . .
17 . 5 PHE C C 175.9 . .
18 . 5 PHE CA C 59.1 . .
19 . 5 PHE HA H 4.54 . .
20 . 5 PHE HB2 H 3.29 . .
21 . 5 PHE HB3 H 3.10 . .
22 . 5 PHE HD1 H 7.24 . .
23 . 5 PHE HD2 H 7.24 . .
24 . 5 PHE HZ H 7.24 . .
25 . 6 LYS N N 123.7 . .
26 . 6 LYS H H 9.14 . .
27 . 6 LYS C C 177.5 . .
28 . 6 LYS CA C 59.2 . .
29 . 6 LYS HA H 4.14 . .
30 . 6 LYS HB2 H 1.83 . .
31 . 6 LYS HB3 H 1.60 . .
32 . 6 LYS HG2 H 1.16 . .
33 . 6 LYS HG3 H 1.03 . .
34 . 7 CYS N N 116.6 . .
35 . 7 CYS H H 8.44 . .
36 . 7 CYS C C 176.5 . .
37 . 7 CYS CA C 58.3 . .
38 . 7 CYS HA H 4.93 . .
39 . 7 CYS HB2 H 3.15 . .
40 . 7 CYS HB3 H 2.48 . .
41 . 8 GLY N N 113.0 . .
42 . 8 GLY H H 7.95 . .
43 . 8 GLY C C 174.1 . .
44 . 8 GLY CA C 46.1 . .
45 . 8 GLY HA2 H 4.12 . .
46 . 8 GLY HA3 H 3.83 . .
47 . 9 LYS N N 121.3 . .
48 . 9 LYS H H 8.35 . .
49 . 9 LYS C C 175.7 . .
50 . 9 LYS CA C 56.3 . .
51 . 9 LYS HA H 4.42 . .
52 . 9 LYS HB2 H 1.85 . .
53 . 9 LYS HB3 H 1.71 . .
54 . 9 LYS HG2 H 1.57 . .
55 . 9 LYS HG3 H 1.40 . .
56 . 10 LYS N N 117.9 . .
57 . 10 LYS H H 8.22 . .
58 . 10 LYS C C 178.1 . .
59 . 10 LYS CA C 56.1 . .
60 . 10 LYS HA H 4.33 . .
61 . 10 LYS HB2 H 1.74 . .
62 . 10 LYS HB3 H 1.64 . .
63 . 10 LYS HG2 H 1.43 . .
64 . 10 LYS HG3 H 1.29 . .
65 . 11 GLY N N 106.7 . .
66 . 11 GLY H H 8.23 . .
67 . 11 GLY C C 173.4 . .
68 . 11 GLY CA C 45.5 . .
69 . 11 GLY HA2 H 4.31 . .
70 . 11 GLY HA3 H 3.53 . .
71 . 12 HIS N N 112.6 . .
72 . 12 HIS H H 6.89 . .
73 . 12 HIS C C 171.8 . .
74 . 12 HIS CA C 55.0 . .
75 . 12 HIS HA H 4.56 . .
76 . 12 HIS HB2 H 3.05 . .
77 . 12 HIS HD2 H 6.70 . .
78 . 12 HIS HE1 H 7.38 . .
79 . 13 PHE N N 116.0 . .
80 . 13 PHE H H 8.44 . .
81 . 13 PHE C C 177.5 . .
82 . 13 PHE CA C 55.9 . .
83 . 13 PHE HA H 4.84 . .
84 . 13 PHE HB2 H 3.47 . .
85 . 13 PHE HB3 H 2.82 . .
86 . 13 PHE HD1 H 7.29 . .
87 . 13 PHE HD2 H 7.29 . .
88 . 13 PHE HZ H 7.29 . .
89 . 14 ALA N N 124.6 . .
90 . 14 ALA H H 8.97 . .
91 . 14 ALA C C 180.4 . .
92 . 14 ALA CA C 55.9 . .
93 . 14 ALA HA H 4.87 . .
94 . 14 ALA HB H 1.33 . .
95 . 15 LYS N N 115.4 . .
96 . 15 LYS H H 8.27 . .
97 . 15 LYS C C 176.3 . .
98 . 15 LYS CA C 58.4 . .
99 . 15 LYS HA H 4.14 . .
100 . 15 LYS HB2 H 1.91 . .
101 . 15 LYS HB3 H 1.74 . .
102 . 15 LYS HG2 H 1.36 . .
103 . 15 LYS HG3 H 0.91 . .
104 . 16 ASN N N 115.2 . .
105 . 16 ASN H H 7.94 . .
106 . 16 ASN C C 173.1 . .
107 . 16 ASN CA C 51.9 . .
108 . 16 ASN HA H 4.70 . .
109 . 16 ASN HB2 H 3.10 . .
110 . 16 ASN HB3 H 2.57 . .
111 . 17 CYS N N 122.7 . .
112 . 17 CYS H H 7.42 . .
113 . 17 CYS CA C 62.0 . .
114 . 17 CYS HA H 3.67 . .
115 . 17 CYS HB2 H 3.15 . .
116 . 17 CYS HB3 H 2.82 . .
117 . 18 HIS CA C 54.0 . .
118 . 18 HIS HB2 H 3.33 . .
119 . 18 HIS HD2 H 7.12 . .
120 . 19 GLU N N 122.5 . .
121 . 19 GLU H H 8.41 . .
122 . 19 GLU C C 176.1 . .
123 . 19 GLU CA C 56.9 . .
124 . 19 GLU HA H 4.14 . .
125 . 19 GLU HB2 H 1.89 . .
126 . 19 GLU HB3 H 1.81 . .
127 . 19 GLU HG2 H 2.12 . .
128 . 19 GLU HG3 H 2.12 . .
129 . 20 HIS HB2 H 3.25 . .
130 . 20 HIS HB3 H 2.95 . .
131 . 20 HIS HD2 H 7.02 . .
132 . 20 HIS HE1 H 8.28 . .
133 . 21 ALA N N 130.5 . .
134 . 21 ALA H H 8.11 . .
135 . 21 ALA C C 179.5 . .
136 . 21 ALA CA C 53.6 . .
137 . 21 ALA HA H 4.09 . .
138 . 21 ALA HB H 1.27 . .
139 . 22 HIS HD2 H 7.38 . .
140 . 22 HIS HE1 H 8.09 . .
141 . 23 ASN N N 121.7 . .
142 . 23 ASN H H 8.36 . .
143 . 23 ASN C C 176.3 . .
144 . 23 ASN CA C 52.3 . .
145 . 23 ASN HA H 4.26 . .
146 . 23 ASN HB2 H 2.25 . .
147 . 24 ASN N N 127.5 . .
148 . 24 ASN H H 7.90 . .
149 . 24 ASN C C 174.6 . .
150 . 24 ASN CA C 53.3 . .
151 . 24 ASN HA H 4.64 . .
152 . 24 ASN HB2 H 2.80 . .
153 . 24 ASN HB3 H 2.71 . .
154 . 24 ASN HD21 H 7.56 . .
155 . 24 ASN HD22 H 6.89 . .
156 . 24 ASN ND2 N 112.5 . .
157 . 25 ALA N N 123.4 . .
158 . 25 ALA H H 8.18 . .
159 . 25 ALA C C 177.2 . .
160 . 25 ALA CA C 52.2 . .
161 . 25 ALA HA H 4.29 . .
162 . 25 ALA HB H 1.31 . .
163 . 26 GLU N N 121.2 . .
164 . 26 GLU H H 8.19 . .
165 . 26 GLU C C 174.5 . .
166 . 26 GLU CA C 54.3 . .
167 . 26 GLU HA H 4.50 . .
168 . 26 GLU HB2 H 1.97 . .
169 . 26 GLU HB3 H 1.87 . .
170 . 26 GLU HG2 H 2.23 . .
171 . 26 GLU HG3 H 2.23 . .
172 . 27 PRO C C 176.7 . .
173 . 27 PRO CA C 63.2 . .
174 . 27 PRO HA H 4.40 . .
175 . 27 PRO HB2 H 2.29 . .
176 . 27 PRO HB3 H 1.94 . .
177 . 28 LYS N N 121.2 . .
178 . 28 LYS H H 8.49 . .
179 . 28 LYS C C 176.1 . .
180 . 28 LYS CA C 56.1 . .
181 . 28 LYS HA H 4.44 . .
182 . 28 LYS HB2 H 1.93 . .
183 . 28 LYS HB3 H 1.82 . .
184 . 28 LYS HG2 H 1.66 . .
185 . 28 LYS HG3 H 1.48 . .
186 . 28 LYS HE2 H 2.93 . .
187 . 28 LYS HE3 H 2.93 . .
188 . 29 VAL N N 120.3 . .
189 . 29 VAL H H 8.08 . .
190 . 29 VAL C C 175.1 . .
191 . 29 VAL CA C 58.8 . .
192 . 29 VAL HA H 4.48 . .
193 . 29 VAL HB H 1.99 . .
194 . 29 VAL HG1 H 0.84 . .
195 . 29 VAL HG2 H 0.79 . .
196 . 30 PRO C C 177.1 . .
197 . 30 PRO CA C 63.0 . .
198 . 30 PRO HA H 3.33 . .
199 . 30 PRO HB2 H 1.06 . .
200 . 30 PRO HB3 H 0.33 . .
201 . 30 PRO HG2 H 1.38 . .
202 . 30 PRO HG3 H 1.03 . .
203 . 30 PRO HD2 H 3.48 . .
204 . 30 PRO HD3 H 3.28 . .
205 . 31 GLY N N 107.1 . .
206 . 31 GLY H H 7.44 . .
207 . 31 GLY C C 172.6 . .
208 . 31 GLY CA C 43.2 . .
209 . 31 GLY HA2 H 3.99 . .
210 . 31 GLY HA3 H 3.50 . .
211 . 32 LEU N N 118.7 . .
212 . 32 LEU H H 7.94 . .
213 . 32 LEU C C 176.9 . .
214 . 32 LEU CA C 55.4 . .
215 . 32 LEU HA H 3.60 . .
216 . 32 LEU HB2 H 1.40 . .
217 . 32 LEU HB3 H 1.23 . .
218 . 32 LEU HG H 1.30 . .
219 . 32 LEU HD1 H 0.69 . .
220 . 32 LEU HD2 H 0.55 . .
221 . 33 CYS N N 131.5 . .
222 . 33 CYS H H 8.34 . .
223 . 33 CYS C C 176.1 . .
224 . 33 CYS CA C 56.7 . .
225 . 33 CYS HA H 4.56 . .
226 . 33 CYS HB2 H 2.68 . .
227 . 33 CYS HB3 H 1.87 . .
228 . 34 PRO C C 177.1 . .
229 . 34 PRO CA C 63.8 . .
230 . 34 PRO HA H 4.46 . .
231 . 34 PRO HB2 H 2.28 . .
232 . 34 PRO HB3 H 2.02 . .
233 . 34 PRO HG2 H 2.18 . .
234 . 34 PRO HG3 H 2.04 . .
235 . 34 PRO HD2 H 4.12 . .
236 . 34 PRO HD3 H 4.12 . .
237 . 35 ARG N N 123.4 . .
238 . 35 ARG H H 9.30 . .
239 . 35 ARG C C 176.6 . .
240 . 35 ARG CA C 58.7 . .
241 . 35 ARG HA H 4.27 . .
242 . 35 ARG HB2 H 2.03 . .
243 . 35 ARG HB3 H 1.92 . .
244 . 35 ARG HG2 H 1.64 . .
245 . 35 ARG HG3 H 1.48 . .
246 . 35 ARG HD2 H 3.20 . .
247 . 35 ARG HD3 H 3.20 . .
248 . 36 CYS N N 116.1 . .
249 . 36 CYS H H 8.65 . .
250 . 36 CYS C C 174.1 . .
251 . 36 CYS CA C 57.9 . .
252 . 36 CYS HA H 4.87 . .
253 . 36 CYS HB2 H 3.16 . .
254 . 36 CYS HB3 H 2.63 . .
255 . 37 LYS N N 118.3 . .
256 . 37 LYS H H 8.02 . .
257 . 37 LYS C C 176.2 . .
258 . 37 LYS CA C 58.6 . .
259 . 37 LYS HA H 3.98 . .
260 . 37 LYS HB2 H 2.00 . .
261 . 37 LYS HB3 H 1.30 . .
262 . 37 LYS HG2 H 1.64 . .
263 . 37 LYS HG3 H 1.55 . .
264 . 38 ARG N N 117.3 . .
265 . 38 ARG H H 8.89 . .
266 . 38 ARG C C 176.3 . .
267 . 38 ARG CA C 56.8 . .
268 . 38 ARG HA H 4.47 . .
269 . 38 ARG HB2 H 2.02 . .
270 . 38 ARG HB3 H 1.78 . .
271 . 38 ARG HG2 H 1.51 . .
272 . 38 ARG HG3 H 1.27 . .
273 . 38 ARG HD2 H 3.11 . .
274 . 38 ARG HD3 H 3.11 . .
275 . 39 GLY N N 103.7 . .
276 . 39 GLY H H 7.03 . .
277 . 39 GLY C C 173.1 . .
278 . 39 GLY CA C 44.0 . .
279 . 39 GLY HA2 H 4.06 . .
280 . 39 GLY HA3 H 3.90 . .
281 . 40 LYS N N 120.9 . .
282 . 40 LYS H H 8.54 . .
283 . 40 LYS C C 174.2 . .
284 . 40 LYS CA C 55.7 . .
285 . 40 LYS HA H 4.31 . .
286 . 40 LYS HB2 H 1.52 . .
287 . 40 LYS HB3 H 1.24 . .
288 . 40 LYS HG2 H 0.74 . .
289 . 40 LYS HG3 H 0.74 . .
290 . 41 HIS N N 117.5 . .
291 . 41 HIS H H 6.92 . .
292 . 41 HIS C C 173.2 . .
293 . 41 HIS CA C 54.1 . .
294 . 41 HIS HA H 4.29 . .
295 . 41 HIS HB2 H 3.38 . .
296 . 41 HIS HB3 H 3.31 . .
297 . 41 HIS HD2 H 6.87 . .
298 . 41 HIS HE1 H 7.41 . .
299 . 42 TRP N N 120.1 . .
300 . 42 TRP H H 8.58 . .
301 . 42 TRP C C 178.5 . .
302 . 42 TRP CA C 56.7 . .
303 . 42 TRP HA H 4.88 . .
304 . 42 TRP HB2 H 3.67 . .
305 . 42 TRP HB3 H 2.99 . .
306 . 42 TRP HD1 H 7.43 . .
307 . 42 TRP HE1 H 10.17 . .
308 . 42 TRP HE3 H 7.91 . .
309 . 42 TRP HZ2 H 7.21 . .
310 . 42 TRP HZ3 H 7.13 . .
311 . 42 TRP HH2 H 6.93 . .
312 . 42 TRP NE1 N 127.0 . .
313 . 43 ALA N N 125.8 . .
314 . 43 ALA H H 9.49 . .
315 . 43 ALA C C 180.1 . .
316 . 43 ALA CA C 55.7 . .
317 . 43 ALA HA H 4.74 . .
318 . 43 ALA HB H 1.56 . .
319 . 44 ASN N N 111.6 . .
320 . 44 ASN H H 8.54 . .
321 . 44 ASN C C 175.8 . .
322 . 44 ASN CA C 54.8 . .
323 . 44 ASN HA H 4.50 . .
324 . 44 ASN HB2 H 2.92 . .
325 . 44 ASN HB3 H 2.77 . .
326 . 44 ASN HD21 H 7.54 . .
327 . 44 ASN HD22 H 6.81 . .
328 . 44 ASN ND2 N 112.0 . .
329 . 45 GLU N N 117.7 . .
330 . 45 GLU H H 7.81 . .
331 . 45 GLU C C 175.1 . .
332 . 45 GLU CA C 55.0 . .
333 . 45 GLU HA H 4.43 . .
334 . 45 GLU HB2 H 2.32 . .
335 . 45 GLU HB3 H 2.12 . .
336 . 46 CYS N N 122.9 . .
337 . 46 CYS H H 7.36 . .
338 . 46 CYS C C 176.6 . .
339 . 46 CYS CA C 62.3 . .
340 . 46 CYS HA H 3.67 . .
341 . 46 CYS HB2 H 3.29 . .
342 . 46 CYS HB3 H 3.01 . .
343 . 47 LYS N N 128.1 . .
344 . 47 LYS H H 8.62 . .
345 . 47 LYS C C 176.9 . .
346 . 47 LYS CA C 55.0 . .
347 . 47 LYS HA H 4.51 . .
348 . 47 LYS HB2 H 2.99 . .
349 . 47 LYS HB3 H 1.56 . .
350 . 47 LYS HG2 H 1.32 . .
351 . 47 LYS HG3 H 1.32 . .
352 . 48 SER N N 119.1 . .
353 . 48 SER H H 8.46 . .
354 . 48 SER C C 174.5 . .
355 . 48 SER CA C 59.7 . .
356 . 48 SER HA H 4.28 . .
357 . 48 SER HB2 H 3.93 . .
358 . 48 SER HB3 H 3.79 . .
359 . 49 LYS C C 177.1 . .
360 . 49 LYS CA C 56.9 . .
361 . 49 LYS HA H 4.44 . .
362 . 49 LYS HB2 H 1.95 . .
363 . 49 LYS HB3 H 1.84 . .
364 . 50 THR N N 109.7 . .
365 . 50 THR H H 7.64 . .
366 . 50 THR C C 174.4 . .
367 . 50 THR CA C 59.4 . .
368 . 50 THR HA H 4.91 . .
369 . 50 THR HB H 3.85 . .
370 . 50 THR HG2 H 0.95 . .
371 . 51 ASP N N 120.4 . .
372 . 51 ASP H H 8.68 . .
373 . 51 ASP C C 177.3 . .
374 . 51 ASP CA C 52.6 . .
375 . 51 ASP HA H 4.91 . .
376 . 51 ASP HB2 H 3.10 . .
377 . 51 ASP HB3 H 2.64 . .
378 . 52 ASN N N 116.4 . .
379 . 52 ASN H H 8.23 . .
380 . 52 ASN C C 178.0 . .
381 . 52 ASN CA C 55.3 . .
382 . 52 ASN HA H 4.31 . .
383 . 52 ASN HB2 H 2.86 . .
384 . 52 ASN HB3 H 2.66 . .
385 . 52 ASN HD21 H 7.52 . .
386 . 52 ASN HD22 H 6.90 . .
387 . 52 ASN ND2 N 112.9 . .
388 . 53 GLN N N 118.5 . .
389 . 53 GLN H H 8.17 . .
390 . 53 GLN C C 175.8 . .
391 . 53 GLN CA C 55.3 . .
392 . 53 GLN HA H 4.40 . .
393 . 53 GLN HB2 H 2.24 . .
394 . 53 GLN HB3 H 1.94 . .
395 . 53 GLN HG2 H 2.23 . .
396 . 53 GLN HG3 H 1.88 . .
397 . 53 GLN HE21 H 7.87 . .
398 . 53 GLN HE22 H 7.07 . .
399 . 53 GLN NE2 N 112.3 . .
400 . 54 GLY N N 107.4 . .
401 . 54 GLY H H 8.13 . .
402 . 54 GLY C C 174.0 . .
403 . 54 GLY CA C 44.9 . .
404 . 54 GLY HA2 H 4.14 . .
405 . 54 GLY HA3 H 3.60 . .
406 . 55 ASN N N 120.1 . .
407 . 55 ASN H H 8.44 . .
408 . 55 ASN C C 173.0 . .
409 . 55 ASN CA C 51.7 . .
410 . 55 ASN HA H 4.97 . .
411 . 55 ASN HB2 H 2.84 . .
412 . 55 ASN HB3 H 2.62 . .
413 . 55 ASN HD21 H 8.24 . .
414 . 55 ASN HD22 H 7.01 . .
415 . 55 ASN ND2 N 116.4 . .
416 . 56 PRO C C 176.5 . .
417 . 56 PRO CA C 63.0 . .
418 . 56 PRO HA H 4.52 . .
419 . 56 PRO HB2 H 2.27 . .
420 . 56 PRO HB3 H 1.79 . .
421 . 56 PRO HD2 H 3.64 . .
422 . 56 PRO HD3 H 3.64 . .
423 . 57 ILE N N 123.6 . .
424 . 57 ILE H H 7.82 . .
425 . 57 ILE C C 174.2 . .
426 . 57 ILE CA C 58.4 . .
427 . 57 ILE HA H 4.41 . .
428 . 57 ILE HB H 1.52 . .
429 . 57 ILE HG12 H 1.36 . .
430 . 57 ILE HG13 H 1.36 . .
431 . 57 ILE HG2 H 0.88 . .
432 . 57 ILE HD1 H 0.51 . .
433 . 58 PRO C C 176.7 . .
434 . 58 PRO CA C 63.0 . .
435 . 58 PRO HA H 4.64 . .
436 . 58 PRO HB2 H 2.30 . .
437 . 58 PRO HB3 H 1.88 . .
438 . 59 PRO C C 176.2 . .
439 . 59 PRO CA C 63.7 . .
440 . 59 PRO HA H 4.36 . .
441 . 59 PRO HB2 H 2.23 . .
442 . 59 PRO HB3 H 1.88 . .
443 . 60 HIS N N 122.1 . .
444 . 60 HIS H H 7.85 . .
445 . 60 HIS C C 176.3 . .
446 . 60 HIS CA C 56.6 . .
447 . 60 HIS HA H 4.36 . .
448 . 60 HIS HB2 H 3.13 . .
449 . 60 HIS HB3 H 3.08 . .
450 . 60 HIS HD2 H 7.18 . .
451 . 60 HIS HE1 H 8.42 . .
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