data_18548
#######################
# Entry information #
#######################
save_entry_information
_Saveframe_category entry_information
_Entry_title
;
1H, 13C, and 15N resonance assignments of the monomeric human Fam96a
;
_BMRB_accession_number 18548
_BMRB_flat_file_name bmr18548.str
_Entry_type original
_Submission_date 2012-06-25
_Accession_date 2012-06-25
_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 Xia Bin . .
2 Ouyang Bingjie . .
stop_
loop_
_Saveframe_category_type
_Saveframe_category_type_count
assigned_chemical_shifts 1
stop_
loop_
_Data_type
_Data_type_count
"1H chemical shifts" 830
"13C chemical shifts" 595
"15N chemical shifts" 136
stop_
loop_
_Revision_date
_Revision_keyword
_Revision_author
_Revision_detail
2013-09-12 original author .
stop_
_Original_release_date 2013-09-12
save_
#############################
# Citation for this entry #
#############################
save_entry_citation
_Saveframe_category entry_citation
_Citation_full .
_Citation_title 'Solution structure of monomeric human FAM96A'
_Citation_status published
_Citation_type journal
_CAS_abstract_code .
_MEDLINE_UI_code .
_PubMed_ID 23793605
loop_
_Author_ordinal
_Author_family_name
_Author_given_name
_Author_middle_initials
_Author_family_title
1 Ouyang Bingjie . .
2 Wang Lei . .
3 Wan Shuo . .
4 Luo Yang . .
5 Wang Lu . .
6 Lin Jian . .
7 Xia Bin . .
stop_
_Journal_abbreviation 'J. Biomol. NMR'
_Journal_volume 56
_Journal_issue 4
_Journal_CSD .
_Book_chapter_title .
_Book_volume .
_Book_series .
_Book_ISBN .
_Conference_state_province .
_Conference_abstract_number .
_Page_first 387
_Page_last 392
_Year 2013
_Details .
save_
##################################
# Molecular system description #
##################################
save_assembly
_Saveframe_category molecular_system
_Mol_system_name Fam96a
_Enzyme_commission_number .
loop_
_Mol_system_component_name
_Mol_label
Fam96a $Fam96a
stop_
_System_molecular_weight .
_System_physical_state native
_System_oligomer_state ?
_System_paramagnetic no
_System_thiol_state .
_Database_query_date .
_Details .
save_
########################
# Monomeric polymers #
########################
save_Fam96a
_Saveframe_category monomeric_polymer
_Mol_type polymer
_Mol_polymer_class protein
_Name_common Fam96a
_Molecular_mass .
_Mol_thiol_state 'all free'
_Details .
##############################
# Polymer residue sequence #
##############################
_Residue_count 143
_Mol_residue_sequence
;
MRQPRIMEEKALEVYDLIRT
IRDPEKPNTLEELEVVSESC
VEVQEINEEEYLVIIRFTPT
VPHCSLATLIGLCLRVKLQR
CLPFKHKLEIYISEGTHSTE
EDINKQINDKERVAAAMENP
NLREIVEQCVLEPDQLEHHH
HHH
;
loop_
_Residue_seq_code
_Residue_author_seq_code
_Residue_label
1 27 MET 2 28 ARG 3 29 GLN 4 30 PRO 5 31 ARG
6 32 ILE 7 33 MET 8 34 GLU 9 35 GLU 10 36 LYS
11 37 ALA 12 38 LEU 13 39 GLU 14 40 VAL 15 41 TYR
16 42 ASP 17 43 LEU 18 44 ILE 19 45 ARG 20 46 THR
21 47 ILE 22 48 ARG 23 49 ASP 24 50 PRO 25 51 GLU
26 52 LYS 27 53 PRO 28 54 ASN 29 55 THR 30 56 LEU
31 57 GLU 32 58 GLU 33 59 LEU 34 60 GLU 35 61 VAL
36 62 VAL 37 63 SER 38 64 GLU 39 65 SER 40 66 CYS
41 67 VAL 42 68 GLU 43 69 VAL 44 70 GLN 45 71 GLU
46 72 ILE 47 73 ASN 48 74 GLU 49 75 GLU 50 76 GLU
51 77 TYR 52 78 LEU 53 79 VAL 54 80 ILE 55 81 ILE
56 82 ARG 57 83 PHE 58 84 THR 59 85 PRO 60 86 THR
61 87 VAL 62 88 PRO 63 89 HIS 64 90 CYS 65 91 SER
66 92 LEU 67 93 ALA 68 94 THR 69 95 LEU 70 96 ILE
71 97 GLY 72 98 LEU 73 99 CYS 74 100 LEU 75 101 ARG
76 102 VAL 77 103 LYS 78 104 LEU 79 105 GLN 80 106 ARG
81 107 CYS 82 108 LEU 83 109 PRO 84 110 PHE 85 111 LYS
86 112 HIS 87 113 LYS 88 114 LEU 89 115 GLU 90 116 ILE
91 117 TYR 92 118 ILE 93 119 SER 94 120 GLU 95 121 GLY
96 122 THR 97 123 HIS 98 124 SER 99 125 THR 100 126 GLU
101 127 GLU 102 128 ASP 103 129 ILE 104 130 ASN 105 131 LYS
106 132 GLN 107 133 ILE 108 134 ASN 109 135 ASP 110 136 LYS
111 137 GLU 112 138 ARG 113 139 VAL 114 140 ALA 115 141 ALA
116 142 ALA 117 143 MET 118 144 GLU 119 145 ASN 120 146 PRO
121 147 ASN 122 148 LEU 123 149 ARG 124 150 GLU 125 151 ILE
126 152 VAL 127 153 GLU 128 154 GLN 129 155 CYS 130 156 VAL
131 157 LEU 132 158 GLU 133 159 PRO 134 160 ASP 135 161 GLN
136 162 LEU 137 163 GLU 138 164 HIS 139 165 HIS 140 166 HIS
141 167 HIS 142 168 HIS 143 169 HIS
stop_
_Sequence_homology_query_date .
_Sequence_homology_query_revised_last_date 2015-07-22
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 18137 Fam96a 88.81 130 100.00 100.00 1.67e-83
PDB 2M5H "Nmr Structure Note: Solution Structure Of Monomeric Human Fam96a" 97.20 139 100.00 100.00 5.93e-93
PDB 3UX2 "Crystal Structure Of Domain-Swapped Fam96a Major Dimer" 88.81 130 98.43 98.43 2.76e-81
PDB 3UX3 "Crystal Structure Of Domain-Swapped Fam96a Minor Dimer" 88.81 130 100.00 100.00 1.67e-83
DBJ BAB15496 "unnamed protein product [Homo sapiens]" 93.01 160 100.00 100.00 8.24e-89
DBJ BAB22285 "unnamed protein product [Mus musculus]" 92.31 160 96.97 100.00 2.11e-86
DBJ BAC36966 "unnamed protein product [Mus musculus]" 92.31 160 96.97 100.00 2.11e-86
DBJ BAE41803 "unnamed protein product [Mus musculus]" 92.31 160 96.97 100.00 2.11e-86
DBJ BAG35105 "unnamed protein product [Homo sapiens]" 93.01 160 100.00 100.00 8.24e-89
GB AAH05745 "Family with sequence similarity 96, member A [Mus musculus]" 92.31 160 96.97 100.00 2.11e-86
GB AAH08865 "Family with sequence similarity 96, member A [Homo sapiens]" 93.01 160 100.00 100.00 8.24e-89
GB AAI02257 "Family with sequence similarity 96, member A [Bos taurus]" 93.01 160 97.74 100.00 1.62e-87
GB AAI51429 "Family with sequence similarity 96, member A [Bos taurus]" 93.01 160 97.74 100.00 1.26e-87
GB ABQ82139 "FAM96A [Equus caballus]" 93.01 160 97.74 99.25 1.69e-87
REF NP_001030282 "MIP18 family protein FAM96A precursor [Bos taurus]" 93.01 160 97.74 100.00 1.62e-87
REF NP_001092912 "MIP18 family protein FAM96A precursor [Equus caballus]" 93.01 160 97.74 99.25 1.69e-87
REF NP_080911 "MIP18 family protein FAM96A precursor [Mus musculus]" 92.31 160 96.97 100.00 2.11e-86
REF NP_115607 "MIP18 family protein FAM96A isoform a precursor [Homo sapiens]" 93.01 160 100.00 100.00 8.24e-89
REF XP_002718208 "PREDICTED: MIP18 family protein FAM96A isoform X1 [Oryctolagus cuniculus]" 93.01 160 96.99 100.00 2.25e-87
SP Q3T0U7 "RecName: Full=MIP18 family protein FAM96A" 93.01 160 97.74 100.00 1.62e-87
SP Q9DCL2 "RecName: Full=MIP18 family protein FAM96A" 92.31 160 96.97 100.00 2.11e-86
SP Q9H5X1 "RecName: Full=MIP18 family protein FAM96A" 93.01 160 100.00 100.00 8.24e-89
TPG DAA25322 "TPA: family with sequence similarity 96, member A [Bos taurus]" 93.01 160 97.74 100.00 1.26e-87
stop_
save_
####################
# Natural source #
####################
save_natural_source
_Saveframe_category natural_source
loop_
_Mol_label
_Organism_name_common
_NCBI_taxonomy_ID
_Superkingdom
_Kingdom
_Genus
_Species
$Fam96a Humans 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_name
$Fam96a 'recombinant technology' . Escherichia coli . pPGH
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
$Fam96a 0.5 mM '[U-100% 13C; U-100% 15N]'
'sodium phosphate' 50 mM 'natural abundance'
'sodium chloride' 50 mM 'natural abundance'
EDTA 1 mM 'natural abundance'
DTT 50 mM 'natural abundance'
ARG 50 mM 'natural abundance'
GLU 50 mM 'natural abundance'
D2O 5 % 'natural abundance'
H2O 95 % 'natural abundance'
stop_
save_
############################
# Computer software used #
############################
save_NMRView
_Saveframe_category software
_Name NMRView
_Version .
loop_
_Vendor
_Address
_Electronic_address
'Johnson, One Moon Scientific' . .
stop_
loop_
_Task
'chemical shift assignment'
stop_
_Details .
save_
save_NMRPipe
_Saveframe_category software
_Name NMRPipe
_Version .
loop_
_Vendor
_Address
_Electronic_address
'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . .
stop_
loop_
_Task
processing
stop_
_Details .
save_
#########################
# Experimental detail #
#########################
##################################
# NMR Spectrometer definitions #
##################################
save_spectrometer_1
_Saveframe_category NMR_spectrometer
_Manufacturer Bruker
_Model Avance
_Field_strength 700
_Details .
save_
save_spectrometer_2
_Saveframe_category NMR_spectrometer
_Manufacturer Bruker
_Model Avance
_Field_strength 600
_Details .
save_
#############################
# NMR applied experiments #
#############################
save_2D_1H-15N_HSQC_1
_Saveframe_category NMR_applied_experiment
_Experiment_name '2D 1H-15N HSQC'
_Sample_label $sample_1
save_
save_3D_HNCACB_2
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HNCACB'
_Sample_label $sample_1
save_
save_3D_CBCA(CO)NH_3
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D CBCA(CO)NH'
_Sample_label $sample_1
save_
save_3D_HBHA(CO)NH_4
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HBHA(CO)NH'
_Sample_label $sample_1
save_
save_3D_HNCO_5
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HNCO'
_Sample_label $sample_1
save_
save_3D_HCCH-COSY_6
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HCCH-COSY'
_Sample_label $sample_1
save_
save_3D_HCCH-TOCSY_7
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HCCH-TOCSY'
_Sample_label $sample_1
save_
#######################
# Sample conditions #
#######################
save_sample_conditions_1
_Saveframe_category sample_conditions
_Details .
loop_
_Variable_type
_Variable_value
_Variable_value_error
_Variable_value_units
'ionic strength' 100 . mM
pH 7.0 . pH
pressure 1 . atm
temperature 298 . K
stop_
save_
####################
# NMR parameters #
####################
##############################
# Assigned chemical shifts #
##############################
################################
# Chemical shift referencing #
################################
save_chemical_shift_reference_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
DSS C 13 'methyl protons' ppm 0 internal indirect . . . 0.251449530
DSS H 1 'methyl protons' ppm 0 internal direct . . . 1.0
DSS N 15 'methyl protons' ppm 0 internal indirect . . . 0.101329118
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_assigned_chem_shift_list_1
_Saveframe_category assigned_chemical_shifts
_Details .
loop_
_Experiment_label
'2D 1H-15N HSQC'
'3D HNCACB'
'3D CBCA(CO)NH'
'3D HBHA(CO)NH'
'3D HNCO'
'3D HCCH-COSY'
'3D HCCH-TOCSY'
stop_
loop_
_Sample_label
$sample_1
stop_
_Sample_conditions_label $sample_conditions_1
_Chem_shift_reference_set_label $chemical_shift_reference_1
_Mol_system_component_name Fam96a
_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 27 1 MET HA H 4.459 . 1
2 27 1 MET HB2 H 1.972 . 2
3 27 1 MET HB3 H 2.043 . 2
4 27 1 MET HG2 H 2.481 . 2
5 27 1 MET HG3 H 2.528 . 2
6 27 1 MET HE H 2.087 . 1
7 27 1 MET C C 177.780 . 1
8 27 1 MET CA C 55.264 . 1
9 27 1 MET CB C 32.980 . 1
10 27 1 MET CG C 32.264 . 1
11 27 1 MET CE C 16.998 . 1
12 28 2 ARG H H 8.518 . 1
13 28 2 ARG HA H 4.323 . 1
14 28 2 ARG HB2 H 1.769 . 2
15 28 2 ARG HB3 H 1.838 . 2
16 28 2 ARG HG2 H 1.603 . 2
17 28 2 ARG HG3 H 1.651 . 2
18 28 2 ARG HD2 H 3.206 . 2
19 28 2 ARG HD3 H 3.252 . 2
20 28 2 ARG C C 177.580 . 1
21 28 2 ARG CA C 56.100 . 1
22 28 2 ARG CB C 30.860 . 1
23 28 2 ARG CG C 27.256 . 1
24 28 2 ARG CD C 43.425 . 1
25 28 2 ARG N N 123.166 . 1
26 29 3 GLN H H 8.519 . 1
27 29 3 GLN HA H 4.621 . 1
28 29 3 GLN HB2 H 1.970 . 2
29 29 3 GLN HB3 H 2.123 . 2
30 29 3 GLN HG2 H 2.409 . 2
31 29 3 GLN HG3 H 2.409 . 2
32 29 3 GLN HE21 H 7.593 . 2
33 29 3 GLN HE22 H 6.910 . 2
34 29 3 GLN C C 179.530 . 1
35 29 3 GLN CA C 54.060 . 1
36 29 3 GLN CB C 28.980 . 1
37 29 3 GLN CG C 33.513 . 1
38 29 3 GLN CD C 173.042 . 1
39 29 3 GLN N N 123.166 . 1
40 29 3 GLN NE2 N 112.450 . 1
41 30 4 PRO HA H 4.439 . 1
42 30 4 PRO HB2 H 1.858 . 2
43 30 4 PRO HB3 H 2.313 . 2
44 30 4 PRO HG2 H 2.011 . 2
45 30 4 PRO HG3 H 2.051 . 2
46 30 4 PRO HD2 H 3.681 . 2
47 30 4 PRO HD3 H 3.811 . 2
48 30 4 PRO C C 176.410 . 1
49 30 4 PRO CA C 63.530 . 1
50 30 4 PRO CB C 32.264 . 1
51 30 4 PRO CG C 27.513 . 1
52 30 4 PRO CD C 50.764 . 1
53 31 5 ARG H H 8.510 . 1
54 31 5 ARG HA H 4.383 . 1
55 31 5 ARG HB2 H 1.838 . 2
56 31 5 ARG HB3 H 1.916 . 2
57 31 5 ARG HG2 H 1.655 . 2
58 31 5 ARG HG3 H 1.710 . 2
59 31 5 ARG HD2 H 3.201 . 2
60 31 5 ARG HD3 H 3.245 . 2
61 31 5 ARG C C 176.790 . 1
62 31 5 ARG CA C 56.576 . 1
63 31 5 ARG CB C 30.730 . 1
64 31 5 ARG CG C 27.232 . 1
65 31 5 ARG CD C 43.381 . 1
66 31 5 ARG N N 121.390 . 1
67 32 6 ILE H H 8.204 . 1
68 32 6 ILE HA H 4.172 . 1
69 32 6 ILE HB H 1.959 . 1
70 32 6 ILE HG12 H 1.282 . 1
71 32 6 ILE HG13 H 1.527 . 1
72 32 6 ILE HG2 H 0.974 . 1
73 32 6 ILE HD1 H 0.874 . 1
74 32 6 ILE C C 176.300 . 1
75 32 6 ILE CA C 62.106 . 1
76 32 6 ILE CB C 37.965 . 1
77 32 6 ILE CG1 C 27.978 . 1
78 32 6 ILE CG2 C 17.807 . 1
79 32 6 ILE CD1 C 12.533 . 1
80 32 6 ILE N N 121.975 . 1
81 33 7 MET H H 8.359 . 1
82 33 7 MET HA H 4.552 . 1
83 33 7 MET HB2 H 2.043 . 2
84 33 7 MET HB3 H 2.117 . 2
85 33 7 MET HG2 H 2.759 . 2
86 33 7 MET HG3 H 2.522 . 2
87 33 7 MET HE H 2.082 . 1
88 33 7 MET C C 175.770 . 1
89 33 7 MET CA C 55.265 . 1
90 33 7 MET CB C 31.514 . 1
91 33 7 MET CG C 32.764 . 1
92 33 7 MET CE C 18.263 . 1
93 33 7 MET N N 122.400 . 1
94 34 8 GLU H H 8.415 . 1
95 34 8 GLU HA H 4.083 . 1
96 34 8 GLU HB2 H 2.058 . 2
97 34 8 GLU HB3 H 2.126 . 2
98 34 8 GLU HG2 H 2.287 . 2
99 34 8 GLU HG3 H 2.377 . 2
100 34 8 GLU CA C 59.515 . 1
101 34 8 GLU CB C 29.910 . 1
102 34 8 GLU CG C 36.764 . 1
103 34 8 GLU N N 123.170 . 1
104 35 9 GLU H H 8.546 . 1
105 35 9 GLU HA H 4.063 . 1
106 35 9 GLU HB2 H 2.082 . 2
107 35 9 GLU HB3 H 2.121 . 2
108 35 9 GLU HG2 H 2.330 . 2
109 35 9 GLU HG3 H 2.384 . 2
110 35 9 GLU C C 173.620 . 1
111 35 9 GLU CA C 59.730 . 1
112 35 9 GLU CB C 29.534 . 1
113 35 9 GLU CG C 36.499 . 1
114 35 9 GLU N N 119.490 . 1
115 36 10 LYS H H 7.856 . 1
116 36 10 LYS HA H 4.162 . 1
117 36 10 LYS HB2 H 1.287 . 2
118 36 10 LYS HB3 H 1.640 . 2
119 36 10 LYS HG2 H 0.970 . 2
120 36 10 LYS HG3 H 1.060 . 2
121 36 10 LYS HD2 H 0.419 . 2
122 36 10 LYS HD3 H 0.496 . 2
123 36 10 LYS HE2 H 1.863 . 2
124 36 10 LYS HE3 H 1.923 . 2
125 36 10 LYS C C 175.140 . 1
126 36 10 LYS CA C 58.590 . 1
127 36 10 LYS CB C 32.390 . 1
128 36 10 LYS CG C 25.265 . 1
129 36 10 LYS CD C 27.767 . 1
130 36 10 LYS CE C 41.245 . 1
131 36 10 LYS N N 118.800 . 1
132 37 11 ALA H H 7.891 . 1
133 37 11 ALA HA H 3.908 . 1
134 37 11 ALA HB H 1.532 . 1
135 37 11 ALA C C 173.550 . 1
136 37 11 ALA CA C 55.601 . 1
137 37 11 ALA CB C 17.820 . 1
138 37 11 ALA N N 121.310 . 1
139 38 12 LEU H H 7.768 . 1
140 38 12 LEU HA H 4.221 . 1
141 38 12 LEU HB2 H 1.687 . 2
142 38 12 LEU HB3 H 1.867 . 2
143 38 12 LEU HG H 1.815 . 1
144 38 12 LEU HD1 H 0.960 . 2
145 38 12 LEU HD2 H 0.890 . 2
146 38 12 LEU C C 174.420 . 1
147 38 12 LEU CA C 57.880 . 1
148 38 12 LEU CB C 41.310 . 1
149 38 12 LEU CG C 27.013 . 1
150 38 12 LEU CD1 C 24.833 . 1
151 38 12 LEU CD2 C 23.263 . 1
152 38 12 LEU N N 119.090 . 1
153 39 13 GLU H H 7.699 . 1
154 39 13 GLU HA H 4.107 . 1
155 39 13 GLU HB2 H 2.172 . 2
156 39 13 GLU HB3 H 2.334 . 2
157 39 13 GLU HG2 H 2.168 . 2
158 39 13 GLU HG3 H 2.457 . 2
159 39 13 GLU C C 173.680 . 1
160 39 13 GLU CA C 59.610 . 1
161 39 13 GLU CB C 29.760 . 1
162 39 13 GLU CG C 36.298 . 1
163 39 13 GLU N N 120.980 . 1
164 40 14 VAL H H 7.946 . 1
165 40 14 VAL HA H 3.412 . 1
166 40 14 VAL HB H 2.408 . 1
167 40 14 VAL HG1 H 0.893 . 2
168 40 14 VAL HG2 H 1.119 . 2
169 40 14 VAL C C 175.230 . 1
170 40 14 VAL CA C 66.590 . 1
171 40 14 VAL CB C 31.660 . 1
172 40 14 VAL CG1 C 22.794 . 1
173 40 14 VAL CG2 C 23.263 . 1
174 40 14 VAL N N 117.660 . 1
175 41 15 TYR H H 8.787 . 1
176 41 15 TYR HA H 4.062 . 1
177 41 15 TYR HB2 H 3.090 . 2
178 41 15 TYR HB3 H 3.169 . 2
179 41 15 TYR HD1 H 6.931 . 3
180 41 15 TYR HE1 H 6.448 . 3
181 41 15 TYR C C 176.960 . 1
182 41 15 TYR CA C 62.170 . 1
183 41 15 TYR CB C 38.263 . 1
184 41 15 TYR N N 120.470 . 1
185 42 16 ASP H H 8.383 . 1
186 42 16 ASP HA H 4.137 . 1
187 42 16 ASP HB2 H 2.576 . 2
188 42 16 ASP HB3 H 2.766 . 2
189 42 16 ASP C C 175.480 . 1
190 42 16 ASP CA C 57.264 . 1
191 42 16 ASP CB C 40.764 . 1
192 42 16 ASP N N 116.990 . 1
193 43 17 LEU H H 7.154 . 1
194 43 17 LEU HA H 4.225 . 1
195 43 17 LEU HB2 H 0.939 . 2
196 43 17 LEU HB3 H 2.066 . 2
197 43 17 LEU HG H 0.722 . 1
198 43 17 LEU HD2 H 0.839 . 2
199 43 17 LEU C C 174.920 . 1
200 43 17 LEU CA C 56.650 . 1
201 43 17 LEU CB C 44.010 . 1
202 43 17 LEU CG C 27.013 . 1
203 43 17 LEU CD2 C 23.492 . 1
204 43 17 LEU N N 115.350 . 1
205 44 18 ILE H H 7.597 . 1
206 44 18 ILE HA H 4.210 . 1
207 44 18 ILE HB H 1.828 . 1
208 44 18 ILE HG12 H 1.633 . 1
209 44 18 ILE HG13 H 1.106 . 1
210 44 18 ILE HG2 H 0.831 . 1
211 44 18 ILE HD1 H 0.785 . 1
212 44 18 ILE C C 175.870 . 1
213 44 18 ILE CA C 62.740 . 1
214 44 18 ILE CB C 37.960 . 1
215 44 18 ILE CG1 C 25.263 . 1
216 44 18 ILE CG2 C 18.013 . 1
217 44 18 ILE CD1 C 14.263 . 1
218 44 18 ILE N N 110.550 . 1
219 45 19 ARG H H 7.936 . 1
220 45 19 ARG HA H 3.623 . 1
221 45 19 ARG HB2 H 0.548 . 2
222 45 19 ARG HB3 H 1.619 . 2
223 45 19 ARG HG2 H 1.254 . 2
224 45 19 ARG HG3 H 1.618 . 2
225 45 19 ARG HD2 H 2.851 . 2
226 45 19 ARG HD3 H 3.032 . 2
227 45 19 ARG HE H 7.765 . 1
228 45 19 ARG C C 178.660 . 1
229 45 19 ARG CA C 58.420 . 1
230 45 19 ARG CB C 28.070 . 1
231 45 19 ARG CG C 25.771 . 1
232 45 19 ARG CD C 44.000 . 1
233 45 19 ARG N N 118.870 . 1
234 45 19 ARG NE N 84.667 . 1
235 46 20 THR H H 6.631 . 1
236 46 20 THR HA H 4.193 . 1
237 46 20 THR HB H 4.492 . 1
238 46 20 THR HG2 H 1.187 . 1
239 46 20 THR C C 178.070 . 1
240 46 20 THR CA C 60.765 . 1
241 46 20 THR CB C 68.720 . 1
242 46 20 THR CG2 C 22.496 . 1
243 46 20 THR N N 102.529 . 1
244 47 21 ILE H H 7.067 . 1
245 47 21 ILE HA H 3.953 . 1
246 47 21 ILE HB H 1.667 . 1
247 47 21 ILE HG12 H 1.818 . 1
248 47 21 ILE HG13 H 1.818 . 1
249 47 21 ILE HG2 H 0.794 . 1
250 47 21 ILE HD1 H 0.794 . 1
251 47 21 ILE C C 178.580 . 1
252 47 21 ILE CA C 62.765 . 1
253 47 21 ILE CB C 38.309 . 1
254 47 21 ILE CG1 C 30.013 . 1
255 47 21 ILE CG2 C 17.183 . 1
256 47 21 ILE CD1 C 14.757 . 1
257 47 21 ILE N N 125.020 . 1
258 48 22 ARG H H 8.494 . 1
259 48 22 ARG HA H 4.320 . 1
260 48 22 ARG HB2 H 1.835 . 2
261 48 22 ARG HB3 H 1.931 . 2
262 48 22 ARG HG2 H 1.813 . 2
263 48 22 ARG HG3 H 1.955 . 2
264 48 22 ARG HD2 H 3.118 . 2
265 48 22 ARG HD3 H 3.150 . 2
266 48 22 ARG HE H 7.252 . 1
267 48 22 ARG C C 178.300 . 1
268 48 22 ARG CA C 56.014 . 1
269 48 22 ARG CB C 31.513 . 1
270 48 22 ARG CG C 27.763 . 1
271 48 22 ARG CD C 43.514 . 1
272 48 22 ARG N N 128.150 . 1
273 48 22 ARG NE N 85.604 . 1
274 49 23 ASP H H 8.183 . 1
275 49 23 ASP HA H 4.591 . 1
276 49 23 ASP HB2 H 3.168 . 2
277 49 23 ASP HB3 H 2.327 . 2
278 49 23 ASP C C 178.370 . 1
279 49 23 ASP CA C 53.880 . 1
280 49 23 ASP CB C 44.335 . 1
281 49 23 ASP N N 122.860 . 1
282 50 24 PRO HA H 4.159 . 1
283 50 24 PRO HB2 H 1.750 . 2
284 50 24 PRO HB3 H 2.138 . 2
285 50 24 PRO HG2 H 1.863 . 2
286 50 24 PRO HG3 H 1.863 . 2
287 50 24 PRO HD2 H 3.640 . 2
288 50 24 PRO HD3 H 4.041 . 2
289 50 24 PRO C C 177.130 . 1
290 50 24 PRO CA C 65.310 . 1
291 50 24 PRO CB C 32.763 . 1
292 50 24 PRO CG C 28.040 . 1
293 50 24 PRO CD C 50.702 . 1
294 51 25 GLU H H 8.786 . 1
295 51 25 GLU HA H 4.486 . 1
296 51 25 GLU HB2 H 1.884 . 2
297 51 25 GLU HB3 H 2.036 . 2
298 51 25 GLU HG2 H 2.099 . 2
299 51 25 GLU HG3 H 2.174 . 2
300 51 25 GLU C C 176.870 . 1
301 51 25 GLU CA C 56.764 . 1
302 51 25 GLU CB C 33.513 . 1
303 51 25 GLU CG C 36.858 . 1
304 51 25 GLU N N 115.460 . 1
305 52 26 LYS H H 9.624 . 1
306 52 26 LYS HA H 4.594 . 1
307 52 26 LYS HB2 H 1.642 . 2
308 52 26 LYS HB3 H 2.080 . 2
309 52 26 LYS HG2 H 1.497 . 2
310 52 26 LYS HG3 H 1.566 . 2
311 52 26 LYS HD2 H 1.657 . 2
312 52 26 LYS HD3 H 1.745 . 2
313 52 26 LYS HE2 H 3.013 . 2
314 52 26 LYS HE3 H 3.051 . 2
315 52 26 LYS CA C 54.280 . 1
316 52 26 LYS CB C 33.264 . 1
317 52 26 LYS CG C 25.584 . 1
318 52 26 LYS CD C 29.451 . 1
319 52 26 LYS CE C 42.262 . 1
320 52 26 LYS N N 123.740 . 1
321 53 27 PRO HA H 4.658 . 1
322 53 27 PRO HB2 H 1.840 . 2
323 53 27 PRO HB3 H 2.284 . 2
324 53 27 PRO HG2 H 1.855 . 2
325 53 27 PRO HG3 H 2.047 . 2
326 53 27 PRO HD2 H 3.567 . 2
327 53 27 PRO HD3 H 3.638 . 2
328 53 27 PRO C C 178.230 . 1
329 53 27 PRO CA C 62.220 . 1
330 53 27 PRO CB C 28.263 . 1
331 53 27 PRO CG C 27.313 . 1
332 53 27 PRO CD C 49.514 . 1
333 54 28 ASN H H 8.368 . 1
334 54 28 ASN HA H 5.211 . 1
335 54 28 ASN HB2 H 1.875 . 2
336 54 28 ASN HB3 H 3.063 . 2
337 54 28 ASN HD21 H 7.536 . 2
338 54 28 ASN HD22 H 6.634 . 2
339 54 28 ASN C C 179.870 . 1
340 54 28 ASN CA C 53.515 . 1
341 54 28 ASN CB C 45.540 . 1
342 54 28 ASN N N 118.740 . 1
343 54 28 ASN ND2 N 108.830 . 1
344 55 29 THR H H 8.753 . 1
345 55 29 THR HA H 4.928 . 1
346 55 29 THR HB H 4.940 . 1
347 55 29 THR HG2 H 1.188 . 1
348 55 29 THR C C 176.990 . 1
349 55 29 THR CA C 60.320 . 1
350 55 29 THR CB C 71.560 . 1
351 55 29 THR CG2 C 21.888 . 1
352 55 29 THR N N 109.070 . 1
353 56 30 LEU H H 9.045 . 1
354 56 30 LEU HA H 3.971 . 1
355 56 30 LEU HB2 H 1.793 . 2
356 56 30 LEU HB3 H 1.260 . 2
357 56 30 LEU HG H 0.715 . 1
358 56 30 LEU HD1 H 0.792 . 2
359 56 30 LEU C C 173.520 . 1
360 56 30 LEU CA C 57.515 . 1
361 56 30 LEU CB C 42.014 . 1
362 56 30 LEU CG C 26.015 . 1
363 56 30 LEU CD1 C 19.966 . 1
364 56 30 LEU N N 115.780 . 1
365 57 31 GLU H H 7.698 . 1
366 57 31 GLU HA H 4.270 . 1
367 57 31 GLU HB2 H 2.139 . 2
368 57 31 GLU HB3 H 2.057 . 2
369 57 31 GLU HG2 H 2.394 . 2
370 57 31 GLU HG3 H 2.394 . 2
371 57 31 GLU C C 173.310 . 1
372 57 31 GLU CA C 59.330 . 1
373 57 31 GLU CB C 30.890 . 1
374 57 31 GLU N N 117.500 . 1
375 58 32 GLU H H 8.035 . 1
376 58 32 GLU HA H 4.017 . 1
377 58 32 GLU HB2 H 2.025 . 2
378 58 32 GLU HB3 H 2.456 . 2
379 58 32 GLU HG2 H 2.547 . 2
380 58 32 GLU HG3 H 2.413 . 2
381 58 32 GLU C C 174.820 . 1
382 58 32 GLU CA C 59.265 . 1
383 58 32 GLU CB C 30.014 . 1
384 58 32 GLU CG C 37.695 . 1
385 58 32 GLU N N 123.170 . 1
386 59 33 LEU H H 7.475 . 1
387 59 33 LEU HA H 4.355 . 1
388 59 33 LEU HB2 H 1.668 . 2
389 59 33 LEU HB3 H 1.763 . 2
390 59 33 LEU HG H 0.842 . 1
391 59 33 LEU HD2 H 0.788 . 2
392 59 33 LEU C C 177.870 . 1
393 59 33 LEU CA C 54.310 . 1
394 59 33 LEU CB C 43.090 . 1
395 59 33 LEU CG C 27.263 . 1
396 59 33 LEU CD2 C 21.513 . 1
397 59 33 LEU N N 114.920 . 1
398 60 34 GLU H H 8.012 . 1
399 60 34 GLU HA H 3.986 . 1
400 60 34 GLU HB2 H 2.265 . 2
401 60 34 GLU HB3 H 2.340 . 2
402 60 34 GLU HG2 H 2.162 . 2
403 60 34 GLU HG3 H 2.266 . 2
404 60 34 GLU C C 177.810 . 1
405 60 34 GLU CA C 58.015 . 1
406 60 34 GLU CB C 26.680 . 1
407 60 34 GLU CG C 37.264 . 1
408 60 34 GLU N N 114.100 . 1
409 61 35 VAL H H 8.464 . 1
410 61 35 VAL HA H 4.503 . 1
411 61 35 VAL HB H 2.112 . 1
412 61 35 VAL HG1 H 1.151 . 2
413 61 35 VAL HG2 H 1.223 . 2
414 61 35 VAL C C 176.120 . 1
415 61 35 VAL CA C 63.520 . 1
416 61 35 VAL CB C 33.014 . 1
417 61 35 VAL CG1 C 22.631 . 1
418 61 35 VAL CG2 C 22.513 . 1
419 61 35 VAL N N 119.792 . 1
420 62 36 VAL H H 6.928 . 1
421 62 36 VAL HA H 4.981 . 1
422 62 36 VAL HB H 2.268 . 1
423 62 36 VAL HG1 H 0.612 . 2
424 62 36 VAL HG2 H 0.853 . 2
425 62 36 VAL C C 180.280 . 1
426 62 36 VAL CA C 58.100 . 1
427 62 36 VAL CB C 35.550 . 1
428 62 36 VAL CG1 C 17.741 . 1
429 62 36 VAL CG2 C 21.763 . 1
430 62 36 VAL N N 104.530 . 1
431 63 37 SER H H 7.938 . 1
432 63 37 SER HA H 4.878 . 1
433 63 37 SER HB2 H 3.998 . 2
434 63 37 SER HB3 H 3.891 . 2
435 63 37 SER C C 178.650 . 1
436 63 37 SER CA C 57.760 . 1
437 63 37 SER CB C 65.580 . 1
438 63 37 SER N N 113.610 . 1
439 64 38 GLU H H 9.089 . 1
440 64 38 GLU HA H 2.698 . 1
441 64 38 GLU HB2 H 1.663 . 2
442 64 38 GLU HB3 H 1.616 . 2
443 64 38 GLU HG2 H 1.794 . 2
444 64 38 GLU HG3 H 1.946 . 2
445 64 38 GLU C C 176.070 . 1
446 64 38 GLU CA C 60.258 . 1
447 64 38 GLU CB C 29.267 . 1
448 64 38 GLU CG C 36.636 . 1
449 64 38 GLU N N 123.270 . 1
450 65 39 SER H H 7.761 . 1
451 65 39 SER HA H 4.391 . 1
452 65 39 SER HB2 H 3.848 . 2
453 65 39 SER HB3 H 3.994 . 2
454 65 39 SER C C 178.150 . 1
455 65 39 SER CA C 59.015 . 1
456 65 39 SER CB C 63.180 . 1
457 65 39 SER N N 109.640 . 1
458 66 40 CYS H H 7.943 . 1
459 66 40 CYS HA H 4.708 . 1
460 66 40 CYS HB2 H 3.478 . 2
461 66 40 CYS HB3 H 3.861 . 2
462 66 40 CYS C C 180.750 . 1
463 66 40 CYS CA C 59.800 . 1
464 66 40 CYS CB C 28.300 . 1
465 66 40 CYS N N 119.970 . 1
466 67 41 VAL H H 7.081 . 1
467 67 41 VAL HA H 4.931 . 1
468 67 41 VAL HB H 2.081 . 1
469 67 41 VAL HG1 H 1.035 . 2
470 67 41 VAL HG2 H 1.121 . 2
471 67 41 VAL C C 179.420 . 1
472 67 41 VAL CA C 61.081 . 1
473 67 41 VAL CB C 34.279 . 1
474 67 41 VAL CG1 C 22.016 . 1
475 67 41 VAL CG2 C 22.376 . 1
476 67 41 VAL N N 119.900 . 1
477 68 42 GLU H H 9.214 . 1
478 68 42 GLU HA H 4.700 . 1
479 68 42 GLU HB2 H 1.992 . 2
480 68 42 GLU HB3 H 1.992 . 2
481 68 42 GLU HG2 H 2.078 . 2
482 68 42 GLU HG3 H 2.273 . 2
483 68 42 GLU C C 179.280 . 1
484 68 42 GLU CA C 55.265 . 1
485 68 42 GLU CB C 33.920 . 1
486 68 42 GLU CG C 36.780 . 1
487 68 42 GLU N N 127.920 . 1
488 69 43 VAL H H 8.767 . 1
489 69 43 VAL HA H 5.390 . 1
490 69 43 VAL HB H 1.967 . 1
491 69 43 VAL HG1 H 0.862 . 2
492 69 43 VAL C C 178.840 . 1
493 69 43 VAL CA C 60.740 . 1
494 69 43 VAL CB C 34.513 . 1
495 69 43 VAL CG1 C 22.236 . 1
496 69 43 VAL N N 123.860 . 1
497 70 44 GLN H H 9.412 . 1
498 70 44 GLN HA H 5.006 . 1
499 70 44 GLN HB2 H 1.865 . 2
500 70 44 GLN HB3 H 2.066 . 2
501 70 44 GLN HG2 H 2.246 . 2
502 70 44 GLN HG3 H 2.329 . 2
503 70 44 GLN HE21 H 7.672 . 2
504 70 44 GLN HE22 H 6.602 . 2
505 70 44 GLN C C 178.110 . 1
506 70 44 GLN CA C 53.514 . 1
507 70 44 GLN CB C 32.513 . 1
508 70 44 GLN CG C 33.013 . 1
509 70 44 GLN CD C 174.539 . 1
510 70 44 GLN N N 123.940 . 1
511 70 44 GLN NE2 N 110.520 . 1
512 71 45 GLU H H 9.133 . 1
513 71 45 GLU HA H 4.226 . 1
514 71 45 GLU HB2 H 1.978 . 2
515 71 45 GLU HB3 H 2.051 . 2
516 71 45 GLU HG2 H 1.984 . 2
517 71 45 GLU HG3 H 1.868 . 2
518 71 45 GLU C C 177.190 . 1
519 71 45 GLU CA C 57.122 . 1
520 71 45 GLU CB C 31.260 . 1
521 71 45 GLU CG C 37.014 . 1
522 71 45 GLU N N 125.000 . 1
523 72 46 ILE H H 8.320 . 1
524 72 46 ILE HA H 4.169 . 1
525 72 46 ILE HB H 1.623 . 1
526 72 46 ILE HG12 H 0.959 . 1
527 72 46 ILE HG13 H 1.384 . 1
528 72 46 ILE HG2 H 0.850 . 1
529 72 46 ILE HD1 H 0.744 . 1
530 72 46 ILE C C 177.680 . 1
531 72 46 ILE CA C 63.015 . 1
532 72 46 ILE CB C 38.780 . 1
533 72 46 ILE CG1 C 27.280 . 1
534 72 46 ILE CG2 C 18.013 . 1
535 72 46 ILE CD1 C 13.248 . 1
536 72 46 ILE N N 125.130 . 1
537 73 47 ASN H H 8.048 . 1
538 73 47 ASN HA H 4.557 . 1
539 73 47 ASN HB2 H 2.898 . 2
540 73 47 ASN HB3 H 2.898 . 2
541 73 47 ASN HD21 H 7.636 . 2
542 73 47 ASN HD22 H 7.117 . 2
543 73 47 ASN C C 179.690 . 1
544 73 47 ASN CA C 52.264 . 1
545 73 47 ASN CB C 39.610 . 1
546 73 47 ASN N N 116.830 . 1
547 73 47 ASN ND2 N 115.025 . 1
548 74 48 GLU H H 8.649 . 1
549 74 48 GLU HA H 3.993 . 1
550 74 48 GLU HB2 H 2.004 . 2
551 74 48 GLU HB3 H 2.004 . 2
552 74 48 GLU HG2 H 2.286 . 2
553 74 48 GLU HG3 H 2.286 . 2
554 74 48 GLU C C 176.930 . 1
555 74 48 GLU CA C 59.095 . 1
556 74 48 GLU CB C 29.310 . 1
557 74 48 GLU CG C 36.513 . 1
558 74 48 GLU N N 117.090 . 1
559 75 49 GLU H H 8.766 . 1
560 75 49 GLU HA H 4.221 . 1
561 75 49 GLU HB2 H 2.036 . 2
562 75 49 GLU HB3 H 2.231 . 2
563 75 49 GLU HG2 H 2.254 . 2
564 75 49 GLU HG3 H 2.290 . 2
565 75 49 GLU C C 179.090 . 1
566 75 49 GLU CA C 56.510 . 1
567 75 49 GLU CB C 30.520 . 1
568 75 49 GLU CG C 36.512 . 1
569 75 49 GLU N N 117.450 . 1
570 76 50 GLU H H 7.466 . 1
571 76 50 GLU HA H 4.688 . 1
572 76 50 GLU HB2 H 1.620 . 2
573 76 50 GLU HB3 H 1.723 . 2
574 76 50 GLU HG2 H 2.003 . 2
575 76 50 GLU HG3 H 2.245 . 2
576 76 50 GLU C C 179.190 . 1
577 76 50 GLU CA C 56.060 . 1
578 76 50 GLU CB C 33.264 . 1
579 76 50 GLU CG C 36.816 . 1
580 76 50 GLU N N 119.220 . 1
581 77 51 TYR H H 8.062 . 1
582 77 51 TYR HA H 5.087 . 1
583 77 51 TYR HB2 H 2.773 . 2
584 77 51 TYR HB3 H 2.848 . 2
585 77 51 TYR HD1 H 6.948 . 3
586 77 51 TYR HE1 H 7.052 . 3
587 77 51 TYR C C 179.350 . 1
588 77 51 TYR CA C 57.515 . 1
589 77 51 TYR CB C 41.514 . 1
590 77 51 TYR N N 121.975 . 1
591 78 52 LEU H H 9.563 . 1
592 78 52 LEU HA H 5.057 . 1
593 78 52 LEU HB2 H 1.810 . 2
594 78 52 LEU HB3 H 1.371 . 2
595 78 52 LEU HG H 1.402 . 1
596 78 52 LEU HD1 H 0.844 . 2
597 78 52 LEU HD2 H 0.881 . 2
598 78 52 LEU C C 179.010 . 1
599 78 52 LEU CA C 54.170 . 1
600 78 52 LEU CB C 44.370 . 1
601 78 52 LEU CG C 27.634 . 1
602 78 52 LEU CD1 C 26.169 . 1
603 78 52 LEU CD2 C 22.874 . 1
604 78 52 LEU N N 125.680 . 1
605 79 53 VAL H H 9.335 . 1
606 79 53 VAL HA H 4.822 . 1
607 79 53 VAL HB H 2.195 . 1
608 79 53 VAL HG1 H 1.046 . 2
609 79 53 VAL HG2 H 0.887 . 2
610 79 53 VAL C C 180.140 . 1
611 79 53 VAL CA C 61.280 . 1
612 79 53 VAL CB C 33.514 . 1
613 79 53 VAL CG1 C 20.780 . 1
614 79 53 VAL CG2 C 22.513 . 1
615 79 53 VAL N N 128.312 . 1
616 80 54 ILE H H 9.381 . 1
617 80 54 ILE HA H 5.391 . 1
618 80 54 ILE HB H 1.786 . 1
619 80 54 ILE HG12 H 1.080 . 1
620 80 54 ILE HG13 H 1.525 . 1
621 80 54 ILE HG2 H 0.999 . 1
622 80 54 ILE HD1 H 0.846 . 1
623 80 54 ILE C C 177.310 . 1
624 80 54 ILE CA C 59.970 . 1
625 80 54 ILE CB C 41.060 . 1
626 80 54 ILE CG1 C 27.812 . 1
627 80 54 ILE CG2 C 18.254 . 1
628 80 54 ILE CD1 C 14.336 . 1
629 80 54 ILE N N 127.500 . 1
630 81 55 ILE H H 8.577 . 1
631 81 55 ILE HA H 5.043 . 1
632 81 55 ILE HB H 1.723 . 1
633 81 55 ILE HG12 H 1.075 . 1
634 81 55 ILE HG13 H 1.550 . 1
635 81 55 ILE HG2 H 0.892 . 1
636 81 55 ILE HD1 H 0.767 . 1
637 81 55 ILE C C 178.950 . 1
638 81 55 ILE CA C 59.265 . 1
639 81 55 ILE CB C 41.764 . 1
640 81 55 ILE CG1 C 27.763 . 1
641 81 55 ILE CG2 C 18.043 . 1
642 81 55 ILE CD1 C 15.263 . 1
643 81 55 ILE N N 125.740 . 1
644 82 56 ARG H H 8.269 . 1
645 82 56 ARG HA H 5.899 . 1
646 82 56 ARG HB2 H 1.595 . 2
647 82 56 ARG HB3 H 1.712 . 2
648 82 56 ARG HG2 H 1.586 . 2
649 82 56 ARG HG3 H 1.684 . 2
650 82 56 ARG HD2 H 3.180 . 2
651 82 56 ARG HD3 H 3.180 . 2
652 82 56 ARG HE H 7.367 . 1
653 82 56 ARG C C 177.880 . 1
654 82 56 ARG CA C 54.014 . 1
655 82 56 ARG CB C 31.870 . 1
656 82 56 ARG CG C 28.767 . 1
657 82 56 ARG CD C 43.267 . 1
658 82 56 ARG N N 126.440 . 1
659 82 56 ARG NE N 85.461 . 1
660 83 57 PHE H H 8.669 . 1
661 83 57 PHE HA H 5.547 . 1
662 83 57 PHE HB2 H 3.102 . 2
663 83 57 PHE HB3 H 2.596 . 2
664 83 57 PHE HD1 H 6.829 . 3
665 83 57 PHE HE1 H 6.965 . 3
666 83 57 PHE C C 179.980 . 1
667 83 57 PHE CA C 55.015 . 1
668 83 57 PHE CB C 42.050 . 1
669 83 57 PHE N N 119.190 . 1
670 84 58 THR H H 9.327 . 1
671 84 58 THR HA H 4.790 . 1
672 84 58 THR HB H 4.174 . 1
673 84 58 THR HG2 H 1.202 . 1
674 84 58 THR CA C 59.120 . 1
675 84 58 THR CB C 70.765 . 1
676 84 58 THR CG2 C 21.408 . 1
677 84 58 THR N N 118.400 . 1
678 85 59 PRO HA H 4.600 . 1
679 85 59 PRO HB2 H 2.206 . 2
680 85 59 PRO HB3 H 2.401 . 2
681 85 59 PRO HG2 H 1.855 . 2
682 85 59 PRO HG3 H 1.964 . 2
683 85 59 PRO HD2 H 3.544 . 2
684 85 59 PRO HD3 H 3.814 . 2
685 85 59 PRO C C 177.064 . 1
686 85 59 PRO CA C 62.627 . 1
687 85 59 PRO CB C 32.343 . 1
688 85 59 PRO CG C 27.263 . 1
689 85 59 PRO CD C 50.684 . 1
690 86 60 THR H H 8.873 . 1
691 86 60 THR HA H 4.102 . 1
692 86 60 THR HB H 4.258 . 1
693 86 60 THR HG2 H 1.399 . 1
694 86 60 THR C C 178.560 . 1
695 86 60 THR CA C 64.570 . 1
696 86 60 THR CB C 69.265 . 1
697 86 60 THR CG2 C 23.139 . 1
698 86 60 THR N N 113.441 . 1
699 87 61 VAL H H 7.146 . 1
700 87 61 VAL HA H 4.642 . 1
701 87 61 VAL HB H 2.008 . 1
702 87 61 VAL HG1 H 0.763 . 2
703 87 61 VAL HG2 H 0.925 . 2
704 87 61 VAL C C 177.990 . 1
705 87 61 VAL CA C 58.370 . 1
706 87 61 VAL CB C 34.420 . 1
707 87 61 VAL CG1 C 19.131 . 1
708 87 61 VAL CG2 C 22.084 . 1
709 87 61 VAL N N 114.200 . 1
710 88 62 PRO HA H 4.432 . 1
711 88 62 PRO HB2 H 2.251 . 2
712 88 62 PRO HB3 H 2.251 . 2
713 88 62 PRO HG2 H 1.987 . 2
714 88 62 PRO HG3 H 1.912 . 2
715 88 62 PRO HD2 H 3.618 . 2
716 88 62 PRO HD3 H 3.553 . 2
717 88 62 PRO CA C 63.015 . 1
718 88 62 PRO CB C 32.264 . 1
719 88 62 PRO CG C 27.000 . 1
720 88 62 PRO CD C 49.633 . 1
721 89 63 HIS HA H 4.612 . 1
722 89 63 HIS HB2 H 3.055 . 2
723 89 63 HIS HB3 H 3.133 . 2
724 89 63 HIS HD2 H 7.053 . 1
725 89 63 HIS CA C 56.015 . 1
726 89 63 HIS CB C 30.513 . 1
727 90 64 CYS HA H 4.027 . 1
728 90 64 CYS HB2 H 3.014 . 2
729 90 64 CYS HB3 H 3.128 . 2
730 90 64 CYS CA C 62.533 . 1
731 90 64 CYS CB C 28.013 . 1
732 91 65 SER HA H 4.388 . 1
733 91 65 SER HB2 H 4.024 . 2
734 91 65 SER HB3 H 4.024 . 2
735 91 65 SER CA C 61.265 . 1
736 91 65 SER CB C 62.498 . 1
737 92 66 LEU HA H 4.380 . 1
738 92 66 LEU HB2 H 1.694 . 2
739 92 66 LEU HB3 H 1.837 . 2
740 92 66 LEU HG H 1.717 . 1
741 92 66 LEU HD1 H 0.993 . 2
742 92 66 LEU HD2 H 0.982 . 2
743 92 66 LEU C C 175.430 . 1
744 92 66 LEU CA C 56.515 . 1
745 92 66 LEU CB C 42.264 . 1
746 92 66 LEU CG C 27.263 . 1
747 92 66 LEU CD1 C 24.763 . 1
748 92 66 LEU CD2 C 24.013 . 1
749 93 67 ALA H H 7.858 . 1
750 93 67 ALA HA H 4.115 . 1
751 93 67 ALA HB H 1.519 . 1
752 93 67 ALA C C 174.500 . 1
753 93 67 ALA CA C 56.140 . 1
754 93 67 ALA CB C 18.940 . 1
755 93 67 ALA N N 121.776 . 1
756 94 68 THR H H 8.268 . 1
757 94 68 THR HA H 3.804 . 1
758 94 68 THR HB H 4.236 . 1
759 94 68 THR HG2 H 1.150 . 1
760 94 68 THR C C 177.340 . 1
761 94 68 THR CA C 66.515 . 1
762 94 68 THR CB C 68.330 . 1
763 94 68 THR CG2 C 21.521 . 1
764 94 68 THR N N 111.800 . 1
765 95 69 LEU H H 7.580 . 1
766 95 69 LEU HA H 3.993 . 1
767 95 69 LEU HB2 H 1.502 . 2
768 95 69 LEU HB3 H 1.989 . 2
769 95 69 LEU HG H 1.686 . 1
770 95 69 LEU HD1 H 0.887 . 2
771 95 69 LEU HD2 H 0.934 . 2
772 95 69 LEU C C 174.220 . 1
773 95 69 LEU CA C 58.515 . 1
774 95 69 LEU CB C 42.660 . 1
775 95 69 LEU CG C 27.763 . 1
776 95 69 LEU CD1 C 25.013 . 1
777 95 69 LEU CD2 C 25.263 . 1
778 95 69 LEU N N 122.630 . 1
779 96 70 ILE H H 8.423 . 1
780 96 70 ILE HA H 3.481 . 1
781 96 70 ILE HB H 1.654 . 1
782 96 70 ILE HG12 H 1.055 . 1
783 96 70 ILE HG13 H 1.753 . 1
784 96 70 ILE HG2 H 0.235 . 1
785 96 70 ILE HD1 H 0.958 . 1
786 96 70 ILE C C 175.510 . 1
787 96 70 ILE CA C 66.380 . 1
788 96 70 ILE CB C 37.760 . 1
789 96 70 ILE CG1 C 29.360 . 1
790 96 70 ILE CG2 C 16.987 . 1
791 96 70 ILE CD1 C 13.728 . 1
792 96 70 ILE N N 120.620 . 1
793 97 71 GLY H H 8.107 . 1
794 97 71 GLY HA2 H 3.296 . 2
795 97 71 GLY HA3 H 3.545 . 2
796 97 71 GLY C C 178.260 . 1
797 97 71 GLY CA C 47.764 . 1
798 97 71 GLY N N 105.260 . 1
799 98 72 LEU H H 8.214 . 1
800 98 72 LEU HA H 4.054 . 1
801 98 72 LEU HB2 H 1.579 . 2
802 98 72 LEU HB3 H 1.995 . 2
803 98 72 LEU HD1 H 0.886 . 2
804 98 72 LEU HD2 H 0.841 . 2
805 98 72 LEU C C 175.010 . 1
806 98 72 LEU CA C 58.080 . 1
807 98 72 LEU CB C 42.300 . 1
808 98 72 LEU CD1 C 24.767 . 1
809 98 72 LEU CD2 C 25.763 . 1
810 98 72 LEU N N 121.600 . 1
811 99 73 CYS H H 8.107 . 1
812 99 73 CYS HA H 3.861 . 1
813 99 73 CYS HB2 H 2.385 . 2
814 99 73 CYS HB3 H 3.391 . 2
815 99 73 CYS C C 177.190 . 1
816 99 73 CYS CA C 64.360 . 1
817 99 73 CYS CB C 27.513 . 1
818 99 73 CYS N N 116.710 . 1
819 100 74 LEU H H 7.966 . 1
820 100 74 LEU HA H 3.549 . 1
821 100 74 LEU HB2 H 1.988 . 2
822 100 74 LEU HB3 H 0.924 . 2
823 100 74 LEU HG H 1.597 . 1
824 100 74 LEU HD1 H 0.599 . 2
825 100 74 LEU HD2 H 0.292 . 2
826 100 74 LEU C C 176.330 . 1
827 100 74 LEU CA C 58.420 . 1
828 100 74 LEU CB C 42.380 . 1
829 100 74 LEU CG C 26.263 . 1
830 100 74 LEU CD1 C 24.513 . 1
831 100 74 LEU CD2 C 26.763 . 1
832 100 74 LEU N N 117.180 . 1
833 101 75 ARG H H 7.545 . 1
834 101 75 ARG HA H 3.697 . 1
835 101 75 ARG HB2 H 1.802 . 2
836 101 75 ARG HB3 H 1.802 . 2
837 101 75 ARG HG2 H 1.717 . 2
838 101 75 ARG HD2 H 3.464 . 2
839 101 75 ARG HD3 H 2.958 . 2
840 101 75 ARG C C 175.050 . 1
841 101 75 ARG CA C 59.830 . 1
842 101 75 ARG CB C 30.260 . 1
843 101 75 ARG CD C 43.514 . 1
844 101 75 ARG N N 115.830 . 1
845 102 76 VAL H H 8.708 . 1
846 102 76 VAL HA H 3.584 . 1
847 102 76 VAL HB H 1.867 . 1
848 102 76 VAL HG1 H 0.776 . 2
849 102 76 VAL HG2 H 1.043 . 2
850 102 76 VAL C C 175.440 . 1
851 102 76 VAL CA C 66.515 . 1
852 102 76 VAL CB C 31.770 . 1
853 102 76 VAL CG1 C 20.427 . 1
854 102 76 VAL CG2 C 23.268 . 1
855 102 76 VAL N N 118.800 . 1
856 103 77 LYS H H 8.251 . 1
857 103 77 LYS HA H 3.883 . 1
858 103 77 LYS HB2 H 1.750 . 2
859 103 77 LYS HB3 H 1.750 . 2
860 103 77 LYS HG2 H 1.264 . 2
861 103 77 LYS HG3 H 1.395 . 2
862 103 77 LYS HD2 H 1.458 . 2
863 103 77 LYS HD3 H 1.739 . 2
864 103 77 LYS HE2 H 2.748 . 2
865 103 77 LYS HE3 H 3.077 . 2
866 103 77 LYS C C 174.770 . 1
867 103 77 LYS CA C 59.765 . 1
868 103 77 LYS CB C 33.013 . 1
869 103 77 LYS CG C 26.013 . 1
870 103 77 LYS CD C 30.150 . 1
871 103 77 LYS CE C 42.764 . 1
872 103 77 LYS N N 118.020 . 1
873 104 78 LEU H H 7.528 . 1
874 104 78 LEU HA H 3.823 . 1
875 104 78 LEU HB2 H 1.193 . 2
876 104 78 LEU HB3 H 1.857 . 2
877 104 78 LEU HG H 1.822 . 1
878 104 78 LEU HD1 H 0.709 . 2
879 104 78 LEU HD2 H 0.721 . 2
880 104 78 LEU C C 174.880 . 1
881 104 78 LEU CA C 58.100 . 1
882 104 78 LEU CB C 40.180 . 1
883 104 78 LEU CG C 27.763 . 1
884 104 78 LEU CD1 C 26.263 . 1
885 104 78 LEU CD2 C 23.742 . 1
886 104 78 LEU N N 115.830 . 1
887 105 79 GLN H H 8.606 . 1
888 105 79 GLN HA H 4.142 . 1
889 105 79 GLN HB2 H 2.192 . 2
890 105 79 GLN HB3 H 2.312 . 2
891 105 79 GLN HG2 H 2.492 . 2
892 105 79 GLN HG3 H 2.536 . 2
893 105 79 GLN HE21 H 7.449 . 2
894 105 79 GLN HE22 H 6.811 . 2
895 105 79 GLN C C 174.420 . 1
896 105 79 GLN CA C 59.265 . 1
897 105 79 GLN CB C 28.250 . 1
898 105 79 GLN CG C 34.188 . 1
899 105 79 GLN CD C 173.258 . 1
900 105 79 GLN N N 118.830 . 1
901 105 79 GLN NE2 N 111.740 . 1
902 106 80 ARG H H 7.773 . 1
903 106 80 ARG HA H 4.203 . 1
904 106 80 ARG HB2 H 1.967 . 2
905 106 80 ARG HB3 H 1.967 . 2
906 106 80 ARG HG2 H 1.961 . 2
907 106 80 ARG HG3 H 1.707 . 2
908 106 80 ARG HD2 H 3.101 . 2
909 106 80 ARG HD3 H 2.814 . 2
910 106 80 ARG C C 174.540 . 1
911 106 80 ARG CA C 59.060 . 1
912 106 80 ARG CB C 32.200 . 1
913 106 80 ARG CG C 27.572 . 1
914 106 80 ARG CD C 44.014 . 1
915 106 80 ARG N N 115.190 . 1
916 107 81 CYS H H 7.760 . 1
917 107 81 CYS HA H 4.533 . 1
918 107 81 CYS HB2 H 2.643 . 2
919 107 81 CYS HB3 H 3.010 . 2
920 107 81 CYS C C 178.000 . 1
921 107 81 CYS CA C 60.490 . 1
922 107 81 CYS CB C 31.764 . 1
923 107 81 CYS N N 112.250 . 1
924 108 82 LEU H H 8.555 . 1
925 108 82 LEU HA H 4.202 . 1
926 108 82 LEU HB2 H 0.624 . 2
927 108 82 LEU HB3 H 1.358 . 2
928 108 82 LEU HG H 0.923 . 1
929 108 82 LEU HD1 H 0.087 . 2
930 108 82 LEU HD2 H 0.178 . 2
931 108 82 LEU C C 176.340 . 1
932 108 82 LEU CA C 53.190 . 1
933 108 82 LEU CB C 41.630 . 1
934 108 82 LEU CG C 26.585 . 1
935 108 82 LEU CD1 C 24.263 . 1
936 108 82 LEU CD2 C 24.013 . 1
937 108 82 LEU N N 122.550 . 1
938 109 83 PRO HA H 4.625 . 1
939 109 83 PRO HB2 H 2.100 . 2
940 109 83 PRO HB3 H 2.276 . 2
941 109 83 PRO HG2 H 2.042 . 2
942 109 83 PRO HG3 H 2.159 . 2
943 109 83 PRO HD2 H 3.305 . 2
944 109 83 PRO HD3 H 3.956 . 2
945 109 83 PRO CA C 63.799 . 1
946 109 83 PRO CB C 31.176 . 1
947 109 83 PRO CG C 27.013 . 1
948 109 83 PRO CD C 50.764 . 1
949 110 84 PHE H H 6.350 . 1
950 110 84 PHE HA H 5.091 . 1
951 110 84 PHE HB2 H 3.166 . 2
952 110 84 PHE HB3 H 3.347 . 2
953 110 84 PHE HD1 H 7.215 . 3
954 110 84 PHE HE1 H 6.771 . 3
955 110 84 PHE C C 178.990 . 1
956 110 84 PHE CA C 53.515 . 1
957 110 84 PHE CB C 40.764 . 1
958 111 85 LYS H H 9.230 . 1
959 111 85 LYS HA H 4.355 . 1
960 111 85 LYS HB2 H 2.107 . 2
961 111 85 LYS HB3 H 2.159 . 2
962 111 85 LYS HG2 H 1.517 . 2
963 111 85 LYS HG3 H 1.680 . 2
964 111 85 LYS HD2 H 1.752 . 2
965 111 85 LYS HD3 H 1.752 . 2
966 111 85 LYS HE2 H 3.015 . 2
967 111 85 LYS HE3 H 3.051 . 2
968 111 85 LYS C C 176.900 . 1
969 111 85 LYS CA C 57.674 . 1
970 111 85 LYS CB C 32.460 . 1
971 111 85 LYS CG C 25.454 . 1
972 111 85 LYS CD C 29.497 . 1
973 111 85 LYS CE C 42.222 . 1
974 111 85 LYS N N 124.600 . 1
975 112 86 HIS H H 8.511 . 1
976 112 86 HIS HA H 6.289 . 1
977 112 86 HIS HB2 H 3.131 . 2
978 112 86 HIS HB3 H 3.131 . 2
979 112 86 HIS HD2 H 7.052 . 1
980 112 86 HIS C C 179.800 . 1
981 112 86 HIS CA C 55.660 . 1
982 112 86 HIS CB C 32.400 . 1
983 112 86 HIS N N 119.880 . 1
984 113 87 LYS H H 8.701 . 1
985 113 87 LYS HA H 4.539 . 1
986 113 87 LYS HB2 H 1.709 . 2
987 113 87 LYS HB3 H 1.852 . 2
988 113 87 LYS HG2 H 1.349 . 2
989 113 87 LYS HG3 H 1.496 . 2
990 113 87 LYS HD2 H 1.672 . 2
991 113 87 LYS HD3 H 1.672 . 2
992 113 87 LYS HE2 H 3.005 . 2
993 113 87 LYS HE3 H 2.968 . 2
994 113 87 LYS C C 179.150 . 1
995 113 87 LYS CA C 55.265 . 1
996 113 87 LYS CB C 35.540 . 1
997 113 87 LYS CG C 25.453 . 1
998 113 87 LYS CD C 29.221 . 1
999 113 87 LYS CE C 42.218 . 1
1000 113 87 LYS N N 121.200 . 1
1001 114 88 LEU H H 8.948 . 1
1002 114 88 LEU HA H 5.719 . 1
1003 114 88 LEU HB2 H 1.502 . 2
1004 114 88 LEU HB3 H 1.814 . 2
1005 114 88 LEU HG H 0.887 . 1
1006 114 88 LEU HD1 H 0.856 . 2
1007 114 88 LEU HD2 H 1.386 . 2
1008 114 88 LEU C C 177.370 . 1
1009 114 88 LEU CA C 53.515 . 1
1010 114 88 LEU CB C 45.600 . 1
1011 114 88 LEU CG C 27.528 . 1
1012 114 88 LEU CD1 C 24.763 . 1
1013 114 88 LEU CD2 C 27.763 . 1
1014 114 88 LEU N N 125.280 . 1
1015 115 89 GLU H H 9.337 . 1
1016 115 89 GLU HA H 4.421 . 1
1017 115 89 GLU HB2 H 1.852 . 2
1018 115 89 GLU HB3 H 1.924 . 2
1019 115 89 GLU HG2 H 2.210 . 2
1020 115 89 GLU HG3 H 2.115 . 2
1021 115 89 GLU C C 180.040 . 1
1022 115 89 GLU CA C 55.610 . 1
1023 115 89 GLU CB C 33.014 . 1
1024 115 89 GLU CG C 36.170 . 1
1025 115 89 GLU N N 128.722 . 1
1026 116 90 ILE H H 8.300 . 1
1027 116 90 ILE HA H 5.050 . 1
1028 116 90 ILE HB H 1.466 . 1
1029 116 90 ILE HG2 H 0.892 . 1
1030 116 90 ILE HD1 H 0.796 . 1
1031 116 90 ILE C C 179.810 . 1
1032 116 90 ILE CA C 58.783 . 1
1033 116 90 ILE CB C 40.820 . 1
1034 116 90 ILE CG2 C 19.763 . 1
1035 116 90 ILE CD1 C 15.512 . 1
1036 116 90 ILE N N 121.000 . 1
1037 117 91 TYR H H 9.042 . 1
1038 117 91 TYR HA H 5.143 . 1
1039 117 91 TYR HB2 H 3.067 . 2
1040 117 91 TYR HB3 H 2.398 . 2
1041 117 91 TYR HD1 H 6.859 . 3
1042 117 91 TYR HE1 H 6.738 . 3
1043 117 91 TYR C C 178.330 . 1
1044 117 91 TYR CA C 55.265 . 1
1045 117 91 TYR CB C 43.110 . 1
1046 117 91 TYR N N 121.181 . 1
1047 118 92 ILE H H 9.037 . 1
1048 118 92 ILE HA H 3.972 . 1
1049 118 92 ILE HB H 1.553 . 1
1050 118 92 ILE HG12 H 0.896 . 1
1051 118 92 ILE HG13 H 1.109 . 1
1052 118 92 ILE HG2 H 0.682 . 1
1053 118 92 ILE HD1 H 0.472 . 1
1054 118 92 ILE C C 176.250 . 1
1055 118 92 ILE CA C 59.608 . 1
1056 118 92 ILE CB C 38.691 . 1
1057 118 92 ILE CG1 C 27.970 . 1
1058 118 92 ILE CG2 C 17.501 . 1
1059 118 92 ILE CD1 C 14.003 . 1
1060 118 92 ILE N N 121.181 . 1
1061 119 93 SER H H 8.424 . 1
1062 119 93 SER HA H 4.092 . 1
1063 119 93 SER HB2 H 3.709 . 2
1064 119 93 SER HB3 H 3.709 . 2
1065 119 93 SER C C 179.080 . 1
1066 119 93 SER CA C 59.255 . 1
1067 119 93 SER CB C 63.310 . 1
1068 119 93 SER N N 122.560 . 1
1069 120 94 GLU H H 8.777 . 1
1070 120 94 GLU HA H 4.224 . 1
1071 120 94 GLU HB2 H 1.974 . 2
1072 120 94 GLU HB3 H 2.022 . 2
1073 120 94 GLU HG2 H 2.284 . 2
1074 120 94 GLU HG3 H 2.284 . 2
1075 120 94 GLU CA C 57.765 . 1
1076 120 94 GLU CB C 30.014 . 1
1077 120 94 GLU CG C 36.264 . 1
1078 120 94 GLU N N 125.110 . 1
1079 121 95 GLY HA2 H 3.936 . 2
1080 121 95 GLY HA3 H 4.044 . 2
1081 121 95 GLY C C 178.080 . 1
1082 121 95 GLY CA C 45.764 . 1
1083 122 96 THR H H 8.131 . 1
1084 122 96 THR HA H 4.296 . 1
1085 122 96 THR HB H 4.256 . 1
1086 122 96 THR HG2 H 1.071 . 1
1087 122 96 THR CA C 62.765 . 1
1088 122 96 THR CB C 69.515 . 1
1089 122 96 THR CG2 C 21.763 . 1
1090 122 96 THR N N 112.540 . 1
1091 123 97 HIS H H 7.851 . 1
1092 124 98 SER HA H 4.396 . 1
1093 124 98 SER HB2 H 3.864 . 2
1094 124 98 SER HB3 H 3.906 . 2
1095 124 98 SER CA C 60.265 . 1
1096 124 98 SER CB C 63.676 . 1
1097 125 99 THR HA H 4.656 . 1
1098 125 99 THR HB H 4.528 . 1
1099 125 99 THR HG2 H 1.265 . 1
1100 125 99 THR C C 178.050 . 1
1101 125 99 THR CA C 61.071 . 1
1102 125 99 THR CB C 69.115 . 1
1103 125 99 THR CG2 C 21.800 . 1
1104 126 100 GLU H H 7.992 . 1
1105 126 100 GLU HA H 3.993 . 1
1106 126 100 GLU HB2 H 2.040 . 2
1107 126 100 GLU HB3 H 2.160 . 2
1108 126 100 GLU HG2 H 2.304 . 2
1109 126 100 GLU HG3 H 2.304 . 2
1110 126 100 GLU C C 177.050 . 1
1111 126 100 GLU CA C 58.990 . 1
1112 126 100 GLU CB C 29.840 . 1
1113 126 100 GLU CG C 36.014 . 1
1114 126 100 GLU N N 121.393 . 1
1115 127 101 GLU H H 8.457 . 1
1116 127 101 GLU HA H 4.199 . 1
1117 127 101 GLU HB2 H 2.041 . 2
1118 127 101 GLU HB3 H 2.041 . 2
1119 127 101 GLU HG2 H 2.294 . 2
1120 127 101 GLU HG3 H 2.343 . 2
1121 127 101 GLU C C 175.390 . 1
1122 127 101 GLU CA C 58.940 . 1
1123 127 101 GLU CB C 29.774 . 1
1124 127 101 GLU CG C 36.350 . 1
1125 127 101 GLU N N 118.980 . 1
1126 128 102 ASP H H 8.136 . 1
1127 128 102 ASP HA H 4.555 . 1
1128 128 102 ASP HB2 H 2.722 . 2
1129 128 102 ASP HB3 H 2.768 . 2
1130 128 102 ASP C C 175.080 . 1
1131 128 102 ASP CA C 56.265 . 1
1132 128 102 ASP CB C 41.080 . 1
1133 128 102 ASP N N 119.720 . 1
1134 129 103 ILE H H 7.993 . 1
1135 129 103 ILE HA H 3.663 . 1
1136 129 103 ILE HB H 1.746 . 1
1137 129 103 ILE HG12 H 1.050 . 1
1138 129 103 ILE HG13 H 1.540 . 1
1139 129 103 ILE HG2 H 0.844 . 1
1140 129 103 ILE HD1 H 0.580 . 1
1141 129 103 ILE C C 176.240 . 1
1142 129 103 ILE CA C 65.130 . 1
1143 129 103 ILE CB C 37.870 . 1
1144 129 103 ILE CG1 C 28.767 . 1
1145 129 103 ILE CG2 C 17.763 . 1
1146 129 103 ILE CD1 C 13.263 . 1
1147 129 103 ILE N N 121.610 . 1
1148 130 104 ASN H H 8.472 . 1
1149 130 104 ASN HA H 4.574 . 1
1150 130 104 ASN HB2 H 2.819 . 2
1151 130 104 ASN HB3 H 3.033 . 2
1152 130 104 ASN HD21 H 7.526 . 2
1153 130 104 ASN HD22 H 7.455 . 2
1154 130 104 ASN C C 174.960 . 1
1155 130 104 ASN CA C 55.765 . 1
1156 130 104 ASN CB C 38.060 . 1
1157 130 104 ASN N N 117.800 . 1
1158 130 104 ASN ND2 N 109.950 . 1
1159 131 105 LYS H H 7.823 . 1
1160 131 105 LYS HA H 4.202 . 1
1161 131 105 LYS HB2 H 1.976 . 2
1162 131 105 LYS HB3 H 2.022 . 2
1163 131 105 LYS HG2 H 1.502 . 2
1164 131 105 LYS HG3 H 1.666 . 2
1165 131 105 LYS HD2 H 1.776 . 2
1166 131 105 LYS HD3 H 1.776 . 2
1167 131 105 LYS C C 174.360 . 1
1168 131 105 LYS CA C 59.265 . 1
1169 131 105 LYS CB C 32.560 . 1
1170 131 105 LYS CG C 25.323 . 1
1171 131 105 LYS CD C 29.513 . 1
1172 131 105 LYS N N 119.360 . 1
1173 132 106 GLN H H 7.817 . 1
1174 132 106 GLN HA H 4.020 . 1
1175 132 106 GLN HB2 H 2.209 . 2
1176 132 106 GLN HB3 H 2.173 . 2
1177 132 106 GLN HG2 H 2.370 . 2
1178 132 106 GLN HG3 H 2.555 . 2
1179 132 106 GLN HE21 H 7.370 . 2
1180 132 106 GLN HE22 H 6.832 . 2
1181 132 106 GLN C C 175.260 . 1
1182 132 106 GLN CA C 59.477 . 1
1183 132 106 GLN CB C 29.060 . 1
1184 132 106 GLN CG C 34.150 . 1
1185 132 106 GLN N N 117.380 . 1
1186 132 106 GLN NE2 N 111.589 . 1
1187 133 107 ILE H H 7.947 . 1
1188 133 107 ILE HA H 4.205 . 1
1189 133 107 ILE HB H 1.989 . 1
1190 133 107 ILE HG12 H 1.440 . 1
1191 133 107 ILE HG13 H 1.651 . 1
1192 133 107 ILE HG2 H 1.003 . 1
1193 133 107 ILE HD1 H 0.863 . 1
1194 133 107 ILE C C 177.880 . 1
1195 133 107 ILE CA C 62.864 . 1
1196 133 107 ILE CB C 37.960 . 1
1197 133 107 ILE CG1 C 25.389 . 1
1198 133 107 ILE CG2 C 18.263 . 1
1199 133 107 ILE CD1 C 14.758 . 1
1200 133 107 ILE N N 108.770 . 1
1201 134 108 ASN H H 7.144 . 1
1202 134 108 ASN HA H 4.820 . 1
1203 134 108 ASN HB2 H 2.580 . 2
1204 134 108 ASN HB3 H 2.944 . 2
1205 134 108 ASN HD21 H 7.904 . 2
1206 134 108 ASN HD22 H 8.431 . 2
1207 134 108 ASN C C 179.990 . 1
1208 134 108 ASN CA C 54.070 . 1
1209 134 108 ASN CB C 41.330 . 1
1210 134 108 ASN N N 115.800 . 1
1211 135 109 ASP H H 7.503 . 1
1212 135 109 ASP HA H 4.725 . 1
1213 135 109 ASP HB2 H 2.806 . 2
1214 135 109 ASP HB3 H 3.019 . 2
1215 135 109 ASP C C 177.170 . 1
1216 135 109 ASP CA C 54.015 . 1
1217 135 109 ASP CB C 42.258 . 1
1218 135 109 ASP N N 122.090 . 1
1219 136 110 LYS H H 8.946 . 1
1220 136 110 LYS HA H 3.859 . 1
1221 136 110 LYS HB2 H 1.890 . 2
1222 136 110 LYS HB3 H 1.958 . 2
1223 136 110 LYS HG2 H 1.493 . 2
1224 136 110 LYS HG3 H 1.574 . 2
1225 136 110 LYS HD2 H 1.741 . 2
1226 136 110 LYS HD3 H 1.741 . 2
1227 136 110 LYS HE2 H 3.056 . 2
1228 136 110 LYS HE3 H 3.056 . 2
1229 136 110 LYS C C 174.450 . 1
1230 136 110 LYS CA C 60.200 . 1
1231 136 110 LYS CB C 32.460 . 1
1232 136 110 LYS CG C 24.760 . 1
1233 136 110 LYS CD C 29.513 . 1
1234 136 110 LYS CE C 42.264 . 1
1235 136 110 LYS N N 126.750 . 1
1236 137 111 GLU H H 8.373 . 1
1237 137 111 GLU HA H 4.190 . 1
1238 137 111 GLU HB2 H 2.104 . 2
1239 137 111 GLU HB3 H 2.181 . 2
1240 137 111 GLU HG2 H 2.286 . 2
1241 137 111 GLU HG3 H 2.384 . 2
1242 137 111 GLU C C 173.730 . 1
1243 137 111 GLU CA C 59.265 . 1
1244 137 111 GLU CB C 29.230 . 1
1245 137 111 GLU CG C 36.764 . 1
1246 137 111 GLU N N 119.440 . 1
1247 138 112 ARG H H 8.016 . 1
1248 138 112 ARG HA H 4.147 . 1
1249 138 112 ARG HB2 H 2.030 . 2
1250 138 112 ARG HB3 H 2.173 . 2
1251 138 112 ARG HG2 H 1.730 . 2
1252 138 112 ARG HG3 H 1.793 . 2
1253 138 112 ARG HD2 H 3.207 . 2
1254 138 112 ARG HD3 H 3.255 . 2
1255 138 112 ARG C C 173.320 . 1
1256 138 112 ARG CA C 58.620 . 1
1257 138 112 ARG CB C 29.840 . 1
1258 138 112 ARG CG C 27.544 . 1
1259 138 112 ARG CD C 42.904 . 1
1260 138 112 ARG N N 121.633 . 1
1261 139 113 VAL H H 8.476 . 1
1262 139 113 VAL HA H 3.547 . 1
1263 139 113 VAL HB H 1.968 . 1
1264 139 113 VAL HG1 H 0.832 . 2
1265 139 113 VAL HG2 H 0.900 . 2
1266 139 113 VAL C C 176.270 . 1
1267 139 113 VAL CA C 66.820 . 1
1268 139 113 VAL CB C 31.910 . 1
1269 139 113 VAL CG1 C 20.723 . 1
1270 139 113 VAL CG2 C 22.535 . 1
1271 139 113 VAL N N 122.260 . 1
1272 140 114 ALA H H 7.671 . 1
1273 140 114 ALA HA H 4.006 . 1
1274 140 114 ALA HB H 1.471 . 1
1275 140 114 ALA C C 173.030 . 1
1276 140 114 ALA CA C 55.190 . 1
1277 140 114 ALA CB C 17.940 . 1
1278 140 114 ALA N N 119.990 . 1
1279 141 115 ALA H H 7.767 . 1
1280 141 115 ALA HA H 4.113 . 1
1281 141 115 ALA HB H 1.480 . 1
1282 141 115 ALA C C 172.430 . 1
1283 141 115 ALA CA C 54.810 . 1
1284 141 115 ALA CB C 18.120 . 1
1285 141 115 ALA N N 118.620 . 1
1286 142 116 ALA H H 7.891 . 1
1287 142 116 ALA HA H 4.159 . 1
1288 142 116 ALA HB H 1.480 . 1
1289 142 116 ALA C C 174.160 . 1
1290 142 116 ALA CA C 55.254 . 1
1291 142 116 ALA CB C 18.513 . 1
1292 142 116 ALA N N 122.250 . 1
1293 143 117 MET H H 7.693 . 1
1294 143 117 MET HA H 4.387 . 1
1295 143 117 MET HB2 H 2.091 . 2
1296 143 117 MET HB3 H 2.132 . 2
1297 143 117 MET HG2 H 2.607 . 2
1298 143 117 MET HG3 H 2.676 . 2
1299 143 117 MET HE H 1.943 . 1
1300 143 117 MET C C 175.850 . 1
1301 143 117 MET CA C 55.600 . 1
1302 143 117 MET CB C 31.020 . 1
1303 143 117 MET CG C 32.764 . 1
1304 143 117 MET CE C 16.763 . 1
1305 143 117 MET N N 111.854 . 1
1306 144 118 GLU H H 7.419 . 1
1307 144 118 GLU HA H 4.234 . 1
1308 144 118 GLU HB2 H 2.045 . 2
1309 144 118 GLU HB3 H 2.213 . 2
1310 144 118 GLU HG2 H 2.462 . 2
1311 144 118 GLU HG3 H 2.325 . 2
1312 144 118 GLU C C 177.140 . 1
1313 144 118 GLU CA C 56.515 . 1
1314 144 118 GLU CB C 30.100 . 1
1315 144 118 GLU CG C 36.287 . 1
1316 144 118 GLU N N 116.970 . 1
1317 145 119 ASN H H 7.590 . 1
1318 145 119 ASN HA H 5.021 . 1
1319 145 119 ASN HB2 H 2.903 . 2
1320 145 119 ASN HB3 H 3.482 . 2
1321 145 119 ASN HD21 H 7.872 . 2
1322 145 119 ASN HD22 H 7.289 . 2
1323 145 119 ASN C C 179.380 . 1
1324 145 119 ASN CA C 50.650 . 1
1325 145 119 ASN CB C 39.120 . 1
1326 145 119 ASN N N 121.660 . 1
1327 145 119 ASN ND2 N 113.450 . 1
1328 146 120 PRO HA H 4.219 . 1
1329 146 120 PRO HB2 H 2.023 . 2
1330 146 120 PRO HB3 H 2.384 . 2
1331 146 120 PRO HG2 H 2.093 . 2
1332 146 120 PRO HG3 H 2.093 . 2
1333 146 120 PRO HD2 H 3.932 . 2
1334 146 120 PRO HD3 H 4.270 . 2
1335 146 120 PRO C C 174.900 . 1
1336 146 120 PRO CA C 65.265 . 1
1337 146 120 PRO CB C 32.360 . 1
1338 146 120 PRO CG C 27.513 . 1
1339 146 120 PRO CD C 51.014 . 1
1340 147 121 ASN H H 7.908 . 1
1341 147 121 ASN HA H 4.496 . 1
1342 147 121 ASN HB2 H 2.811 . 2
1343 147 121 ASN HB3 H 2.811 . 2
1344 147 121 ASN HD21 H 7.688 . 2
1345 147 121 ASN HD22 H 7.073 . 2
1346 147 121 ASN C C 176.320 . 1
1347 147 121 ASN CA C 56.050 . 1
1348 147 121 ASN CB C 38.550 . 1
1349 147 121 ASN N N 114.760 . 1
1350 147 121 ASN ND2 N 113.640 . 1
1351 148 122 LEU H H 7.379 . 1
1352 148 122 LEU HA H 4.215 . 1
1353 148 122 LEU HB2 H 2.027 . 2
1354 148 122 LEU HB3 H 1.401 . 2
1355 148 122 LEU HG H 1.630 . 1
1356 148 122 LEU HD1 H 0.966 . 2
1357 148 122 LEU HD2 H 0.826 . 2
1358 148 122 LEU C C 174.940 . 1
1359 148 122 LEU CA C 57.267 . 1
1360 148 122 LEU CB C 41.330 . 1
1361 148 122 LEU CG C 27.513 . 1
1362 148 122 LEU CD1 C 25.513 . 1
1363 148 122 LEU CD2 C 23.252 . 1
1364 148 122 LEU N N 119.640 . 1
1365 149 123 ARG H H 8.539 . 1
1366 149 123 ARG HA H 3.812 . 1
1367 149 123 ARG HB2 H 1.819 . 2
1368 149 123 ARG HB3 H 2.064 . 2
1369 149 123 ARG HG2 H 1.678 . 2
1370 149 123 ARG HG3 H 1.678 . 2
1371 149 123 ARG HD2 H 3.284 . 2
1372 149 123 ARG HD3 H 3.335 . 2
1373 149 123 ARG HE H 7.958 . 1
1374 149 123 ARG C C 175.790 . 1
1375 149 123 ARG CA C 59.720 . 1
1376 149 123 ARG CB C 29.990 . 1
1377 149 123 ARG CG C 27.513 . 1
1378 149 123 ARG CD C 43.269 . 1
1379 149 123 ARG N N 118.998 . 1
1380 149 123 ARG NE N 85.691 . 1
1381 150 124 GLU H H 7.659 . 1
1382 150 124 GLU HA H 4.027 . 1
1383 150 124 GLU HB2 H 2.143 . 2
1384 150 124 GLU HB3 H 2.045 . 2
1385 150 124 GLU HG2 H 2.304 . 2
1386 150 124 GLU HG3 H 2.371 . 2
1387 150 124 GLU C C 174.510 . 1
1388 150 124 GLU CA C 59.387 . 1
1389 150 124 GLU CB C 29.513 . 1
1390 150 124 GLU CG C 36.254 . 1
1391 150 124 GLU N N 115.460 . 1
1392 151 125 ILE H H 7.126 . 1
1393 151 125 ILE HA H 3.811 . 1
1394 151 125 ILE HB H 2.019 . 1
1395 151 125 ILE HG12 H 1.172 . 1
1396 151 125 ILE HG13 H 1.779 . 1
1397 151 125 ILE HG2 H 0.963 . 1
1398 151 125 ILE HD1 H 0.894 . 1
1399 151 125 ILE C C 175.410 . 1
1400 151 125 ILE CA C 64.515 . 1
1401 151 125 ILE CB C 38.470 . 1
1402 151 125 ILE CG1 C 28.513 . 1
1403 151 125 ILE CG2 C 18.263 . 1
1404 151 125 ILE CD1 C 13.269 . 1
1405 151 125 ILE N N 119.270 . 1
1406 152 126 VAL H H 8.056 . 1
1407 152 126 VAL HA H 3.668 . 1
1408 152 126 VAL HB H 2.148 . 1
1409 152 126 VAL HG1 H 0.876 . 2
1410 152 126 VAL HG2 H 1.024 . 2
1411 152 126 VAL C C 175.220 . 1
1412 152 126 VAL CA C 66.265 . 1
1413 152 126 VAL CB C 32.166 . 1
1414 152 126 VAL CG1 C 20.975 . 1
1415 152 126 VAL CG2 C 22.950 . 1
1416 152 126 VAL N N 120.630 . 1
1417 153 127 GLU H H 8.438 . 1
1418 153 127 GLU HA H 4.061 . 1
1419 153 127 GLU HB2 H 1.935 . 2
1420 153 127 GLU HB3 H 2.013 . 2
1421 153 127 GLU HG2 H 2.427 . 2
1422 153 127 GLU HG3 H 2.427 . 2
1423 153 127 GLU C C 173.850 . 1
1424 153 127 GLU CA C 58.760 . 1
1425 153 127 GLU CB C 28.763 . 1
1426 153 127 GLU CG C 35.363 . 1
1427 153 127 GLU N N 114.270 . 1
1428 154 128 GLN H H 7.562 . 1
1429 154 128 GLN HA H 4.098 . 1
1430 154 128 GLN HB2 H 2.190 . 2
1431 154 128 GLN HB3 H 2.304 . 2
1432 154 128 GLN HG2 H 2.490 . 2
1433 154 128 GLN HG3 H 2.534 . 2
1434 154 128 GLN HE21 H 7.465 . 2
1435 154 128 GLN HE22 H 6.773 . 2
1436 154 128 GLN CA C 58.330 . 1
1437 154 128 GLN CB C 28.750 . 1
1438 154 128 GLN CG C 34.128 . 1
1439 154 128 GLN CD C 173.256 . 1
1440 154 128 GLN N N 116.370 . 1
1441 154 128 GLN NE2 N 111.015 . 1
1442 155 129 CYS H H 8.112 . 1
1443 155 129 CYS HA H 4.190 . 1
1444 155 129 CYS HB2 H 3.183 . 2
1445 155 129 CYS HB3 H 3.236 . 2
1446 155 129 CYS C C 177.020 . 1
1447 155 129 CYS CA C 63.515 . 1
1448 155 129 CYS CB C 28.960 . 1
1449 155 129 CYS N N 116.680 . 1
1450 156 130 VAL H H 7.691 . 1
1451 156 130 VAL HA H 4.446 . 1
1452 156 130 VAL HB H 2.320 . 1
1453 156 130 VAL HG1 H 0.903 . 2
1454 156 130 VAL HG2 H 1.002 . 2
1455 156 130 VAL C C 177.590 . 1
1456 156 130 VAL CA C 61.515 . 1
1457 156 130 VAL CB C 31.610 . 1
1458 156 130 VAL CG1 C 18.245 . 1
1459 156 130 VAL CG2 C 21.814 . 1
1460 156 130 VAL N N 107.690 . 1
1461 157 131 LEU H H 6.959 . 1
1462 157 131 LEU HA H 4.151 . 1
1463 157 131 LEU HB2 H 1.488 . 2
1464 157 131 LEU HB3 H 1.698 . 2
1465 157 131 LEU HG H 1.810 . 1
1466 157 131 LEU HD1 H 0.886 . 2
1467 157 131 LEU HD2 H 0.841 . 2
1468 157 131 LEU C C 176.120 . 1
1469 157 131 LEU CA C 55.515 . 1
1470 157 131 LEU CB C 42.560 . 1
1471 157 131 LEU CG C 26.263 . 1
1472 157 131 LEU CD1 C 24.951 . 1
1473 157 131 LEU CD2 C 24.013 . 1
1474 157 131 LEU N N 122.980 . 1
1475 158 132 GLU H H 8.597 . 1
1476 158 132 GLU HA H 4.546 . 1
1477 158 132 GLU HB2 H 1.834 . 2
1478 158 132 GLU HB3 H 2.079 . 2
1479 158 132 GLU HG2 H 2.331 . 2
1480 158 132 GLU HG3 H 2.290 . 2
1481 158 132 GLU C C 178.290 . 1
1482 158 132 GLU CA C 54.370 . 1
1483 158 132 GLU CB C 29.580 . 1
1484 158 132 GLU CG C 36.007 . 1
1485 158 132 GLU N N 125.120 . 1
1486 159 133 PRO HA H 4.320 . 1
1487 159 133 PRO HB2 H 1.920 . 2
1488 159 133 PRO HB3 H 2.299 . 2
1489 159 133 PRO HG2 H 2.005 . 2
1490 159 133 PRO HG3 H 2.045 . 2
1491 159 133 PRO HD2 H 3.809 . 2
1492 159 133 PRO HD3 H 3.809 . 2
1493 159 133 PRO C C 176.410 . 1
1494 159 133 PRO CA C 64.015 . 1
1495 159 133 PRO CB C 32.100 . 1
1496 159 133 PRO CG C 27.365 . 1
1497 159 133 PRO CD C 50.583 . 1
1498 160 134 ASP H H 8.427 . 1
1499 160 134 ASP HA H 4.503 . 1
1500 160 134 ASP HB2 H 2.661 . 2
1501 160 134 ASP HB3 H 2.661 . 2
1502 160 134 ASP C C 176.930 . 1
1503 160 134 ASP CA C 54.790 . 1
1504 160 134 ASP CB C 40.830 . 1
1505 160 134 ASP N N 118.670 . 1
1506 161 135 GLN H H 8.177 . 1
1507 161 135 GLN HA H 4.291 . 1
1508 161 135 GLN HB2 H 2.010 . 2
1509 161 135 GLN HB3 H 2.142 . 2
1510 161 135 GLN HG2 H 2.336 . 2
1511 161 135 GLN HG3 H 2.336 . 2
1512 161 135 GLN HE21 H 7.580 . 2
1513 161 135 GLN HE22 H 6.822 . 2
1514 161 135 GLN C C 177.360 . 1
1515 161 135 GLN CA C 56.050 . 1
1516 161 135 GLN CB C 29.460 . 1
1517 161 135 GLN CG C 33.943 . 1
1518 161 135 GLN N N 119.660 . 1
1519 161 135 GLN NE2 N 112.790 . 1
1520 162 136 LEU H H 8.062 . 1
1521 162 136 LEU HA H 4.230 . 1
1522 162 136 LEU HB2 H 1.488 . 2
1523 162 136 LEU HB3 H 1.605 . 2
1524 162 136 LEU HG H 1.568 . 1
1525 162 136 LEU HD1 H 0.882 . 2
1526 162 136 LEU HD2 H 0.821 . 2
1527 162 136 LEU C C 176.040 . 1
1528 162 136 LEU CA C 55.515 . 1
1529 162 136 LEU CB C 42.310 . 1
1530 162 136 LEU CG C 27.013 . 1
1531 162 136 LEU CD1 C 25.013 . 1
1532 162 136 LEU CD2 C 23.335 . 1
1533 162 136 LEU N N 122.173 . 1
1534 163 137 GLU H H 8.229 . 1
1535 163 137 GLU HA H 4.151 . 1
1536 163 137 GLU HB2 H 1.868 . 2
1537 163 137 GLU HB3 H 1.868 . 2
1538 163 137 GLU HG2 H 2.104 . 2
1539 163 137 GLU HG3 H 2.184 . 2
1540 163 137 GLU C C 177.160 . 1
1541 163 137 GLU CA C 56.810 . 1
1542 163 137 GLU CB C 30.220 . 1
1543 163 137 GLU CG C 36.014 . 1
1544 163 137 GLU N N 120.440 . 1
1545 164 138 HIS H H 8.177 . 1
1546 164 138 HIS HA H 4.549 . 1
1547 164 138 HIS HB2 H 2.977 . 2
1548 164 138 HIS HB3 H 3.045 . 2
1549 164 138 HIS HD2 H 6.950 . 1
1550 164 138 HIS C C 179.420 . 1
1551 164 138 HIS CA C 56.050 . 1
1552 164 138 HIS CB C 30.514 . 1
1553 164 138 HIS N N 119.570 . 1
1554 165 139 HIS H H 8.083 . 1
1555 165 139 HIS HA H 4.412 . 1
1556 165 139 HIS HB2 H 3.055 . 2
1557 165 139 HIS HB3 H 3.184 . 2
1558 165 139 HIS C C 174.100 . 1
1559 165 139 HIS CA C 57.510 . 1
1560 165 139 HIS CB C 30.480 . 1
1561 165 139 HIS N N 125.349 . 1
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