data_5928
#######################
# Entry information #
#######################
save_entry_information
_Saveframe_category entry_information
_Entry_title
;
NMR assignment of the hypothetical ENTH-VHS domain At3g16270 from Arabidopsis
thaliana
;
_BMRB_accession_number 5928
_BMRB_flat_file_name bmr5928.str
_Entry_type original
_Submission_date 2003-09-01
_Accession_date 2003-09-02
_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 Lopez-Mendez Blanca . .
2 Pantoja-Uceda David . .
3 Tomizawa Tadashi . .
4 Koshiba Seizo . .
5 Kigawa Takanori . .
6 Shirouzu Mikako . .
7 Terada Takaho . .
8 Inoue Makoto . .
9 Yabuki Takashi . .
10 Aoki Masaaki . .
11 Seki Eiko . .
12 Matsuda Takayoshi . .
13 Hirota Hiroshi . .
14 Yoshida Mayumi . .
15 Tanaka Akiko . .
16 Osanai Takashi . .
17 Seki Motoaki . .
18 Shinozaki Kazuo . .
19 Yokoyama Shigeyuki . .
20 Guntert Peter . .
stop_
loop_
_Saveframe_category_type
_Saveframe_category_type_count
assigned_chemical_shifts 1
stop_
loop_
_Data_type
_Data_type_count
"1H chemical shifts" 784
"13C chemical shifts" 585
"15N chemical shifts" 129
stop_
loop_
_Revision_date
_Revision_keyword
_Revision_author
_Revision_detail
2004-04-07 original author .
stop_
_Original_release_date 2004-04-07
save_
#############################
# Citation for this entry #
#############################
save_entry_citation
_Saveframe_category entry_citation
_Citation_full .
_Citation_title
;
Letter to the Editor: NMR assignment of the hypothetical ENTH-VHS
domain At3g16270 from Arabidopsis thaliana
;
_Citation_status published
_Citation_type journal
_CAS_abstract_code .
_MEDLINE_UI_code .
_PubMed_ID 15014234
loop_
_Author_ordinal
_Author_family_name
_Author_given_name
_Author_middle_initials
_Author_family_title
1 Lopez-Mendez Blanca . .
2 Pantoja-Uceda David . .
3 Tomizawa Tadashi . .
4 Koshiba Seizo . .
5 Kigawa Takanori . .
6 Shirouzu Mikako . .
7 Terada Takaho . .
8 Inoue Makoto . .
9 Yabuki Takashi . .
10 Aoki Masaaki . .
11 Seki Eiko . .
12 Matsuda Takayoshi . .
13 Hirota Hiroshi . .
14 Yoshida Mayumi . .
15 Tanaka Akiko . .
16 Osanai Takashi . .
17 Seki Motoaki . .
18 Shinozaki Kazuo . .
19 Yokoyama Shigeyuki . .
20 Guntert Peter . .
stop_
_Journal_abbreviation 'J. Biomol. NMR'
_Journal_volume 29
_Journal_issue 2
_Journal_CSD .
_Book_chapter_title .
_Book_volume .
_Book_series .
_Book_ISBN .
_Conference_state_province .
_Conference_abstract_number .
_Page_first 205
_Page_last 206
_Year 2004
_Details .
save_
##################################
# Molecular system description #
##################################
save_system_enth-vhs
_Saveframe_category molecular_system
_Mol_system_name 'enth-vhs domain'
_Abbreviation_common 'enth-vhs domain'
_Enzyme_commission_number .
loop_
_Mol_system_component_name
_Mol_label
'enth-vhs monomer' $enth-vhs
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_enth-vhs
_Saveframe_category monomeric_polymer
_Mol_type polymer
_Mol_polymer_class protein
_Name_common 'enth-vhs domain'
_Abbreviation_common 'enth-vhs domain'
_Molecular_mass .
_Mol_thiol_state 'all free'
_Details .
##############################
# Polymer residue sequence #
##############################
_Residue_count 140
_Mol_residue_sequence
;
GSSGSSGESYWRSRMIDAVT
SDEDKVAPVYKLEEICDLLR
SSHVSIVKEFSEFILKRLDN
KSPIVKQKALRLIKYAVGKS
GSEFRREMQRNSVAVRNLFH
YKGHPDPLKGDALNKAVRET
AHETISAIFSEENGSGPSSG
;
loop_
_Residue_seq_code
_Residue_label
1 GLY 2 SER 3 SER 4 GLY 5 SER
6 SER 7 GLY 8 GLU 9 SER 10 TYR
11 TRP 12 ARG 13 SER 14 ARG 15 MET
16 ILE 17 ASP 18 ALA 19 VAL 20 THR
21 SER 22 ASP 23 GLU 24 ASP 25 LYS
26 VAL 27 ALA 28 PRO 29 VAL 30 TYR
31 LYS 32 LEU 33 GLU 34 GLU 35 ILE
36 CYS 37 ASP 38 LEU 39 LEU 40 ARG
41 SER 42 SER 43 HIS 44 VAL 45 SER
46 ILE 47 VAL 48 LYS 49 GLU 50 PHE
51 SER 52 GLU 53 PHE 54 ILE 55 LEU
56 LYS 57 ARG 58 LEU 59 ASP 60 ASN
61 LYS 62 SER 63 PRO 64 ILE 65 VAL
66 LYS 67 GLN 68 LYS 69 ALA 70 LEU
71 ARG 72 LEU 73 ILE 74 LYS 75 TYR
76 ALA 77 VAL 78 GLY 79 LYS 80 SER
81 GLY 82 SER 83 GLU 84 PHE 85 ARG
86 ARG 87 GLU 88 MET 89 GLN 90 ARG
91 ASN 92 SER 93 VAL 94 ALA 95 VAL
96 ARG 97 ASN 98 LEU 99 PHE 100 HIS
101 TYR 102 LYS 103 GLY 104 HIS 105 PRO
106 ASP 107 PRO 108 LEU 109 LYS 110 GLY
111 ASP 112 ALA 113 LEU 114 ASN 115 LYS
116 ALA 117 VAL 118 ARG 119 GLU 120 THR
121 ALA 122 HIS 123 GLU 124 THR 125 ILE
126 SER 127 ALA 128 ILE 129 PHE 130 SER
131 GLU 132 GLU 133 ASN 134 GLY 135 SER
136 GLY 137 PRO 138 SER 139 SER 140 GLY
stop_
_Sequence_homology_query_date .
_Sequence_homology_query_revised_last_date 2015-01-28
loop_
_Database_name
_Database_accession_code
_Database_entry_mol_name
_Sequence_query_to_submitted_percentage
_Sequence_subject_length
_Sequence_identity
_Sequence_positive
_Sequence_homology_expectation_value
PDB 1VDY "Nmr Structure Of The Hypothetical Enth-Vhs Domain At3g16270 From Arabidopsis Thaliana" 100.00 140 100.00 100.00 2.83e-96
PDB 2DCP "Fully Automated Nmr Structure Determination Of The Enth-Vhs Domain At3g16270 From Arabidopsis Thaliana" 100.00 140 100.00 100.00 2.83e-96
DBJ BAB01267 "unnamed protein product [Arabidopsis thaliana]" 94.29 714 96.97 99.24 6.85e-83
DBJ BAH57080 "AT3G16270 [Arabidopsis thaliana]" 94.29 701 96.97 99.24 6.16e-83
GB AAB63649 "hypothetical protein [Arabidopsis thaliana]" 94.29 701 96.97 99.24 6.16e-83
GB AAK25955 "unknown protein [Arabidopsis thaliana]" 94.29 690 96.97 99.24 2.94e-83
GB AAK64101 "unknown protein [Arabidopsis thaliana]" 94.29 690 96.97 99.24 2.94e-83
GB AEE75792 "ENTH/VHS family protein [Arabidopsis thaliana]" 94.29 690 96.97 99.24 2.94e-83
REF NP_566540 "ENTH/VHS family protein [Arabidopsis thaliana]" 94.29 690 96.97 99.24 2.94e-83
REF XP_010419285 "PREDICTED: VHS domain-containing protein At3g16270-like [Camelina sativa]" 94.29 520 96.97 99.24 2.01e-84
REF XP_010465644 "PREDICTED: VHS domain-containing protein At3g16270 isoform X1 [Camelina sativa]" 94.29 693 96.97 99.24 2.40e-83
REF XP_010465645 "PREDICTED: VHS domain-containing protein At3g16270 isoform X2 [Camelina sativa]" 94.29 693 96.97 99.24 2.42e-83
REF XP_010487480 "PREDICTED: VHS domain-containing protein At3g16270-like [Camelina sativa]" 94.29 693 96.97 99.24 2.20e-83
SP Q9C5H4 "RecName: Full=VHS domain-containing protein At3g16270 [Arabidopsis thaliana]" 94.29 690 96.97 99.24 2.94e-83
stop_
save_
####################
# Natural source #
####################
save_natural_source
_Saveframe_category natural_source
loop_
_Mol_label
_Organism_name_common
_NCBI_taxonomy_ID
_Superkingdom
_Kingdom
_Genus
_Species
$enth-vhs 'Thale cress' 3702 Eukaryota Viridiplantae Arabidopsis thaliana
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
$enth-vhs 'cell free synthesis' . . . . .
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
$enth-vhs 1.20 mM '[U-13C; U-15N]'
'Tris buffer' 20 mM .
NaCl 100 mM .
dithiothreitol 1 mM .
'sodium azide' 0.02 '% (v/v)' .
H2O 90 '% (v/v)' .
D2O 10 '% (v/v)' .
stop_
save_
#########################
# Experimental detail #
#########################
##################################
# NMR Spectrometer definitions #
##################################
save_NMR_spectrometer_1
_Saveframe_category NMR_spectrometer
_Manufacturer Bruker
_Model DRX
_Field_strength 600
_Details .
save_
save_NMR_spectrometer_2
_Saveframe_category NMR_spectrometer
_Manufacturer Bruker
_Model AV
_Field_strength 800
_Details .
save_
#############################
# NMR applied experiments #
#############################
save_2D_[1H,15N_]-HSQC_1
_Saveframe_category NMR_applied_experiment
_Experiment_name '2D [1H,15N ]-HSQC'
_Sample_label .
save_
save_2D_[1H,13C]-HSQC_2
_Saveframe_category NMR_applied_experiment
_Experiment_name '2D [1H,13C]-HSQC'
_Sample_label .
save_
save_3D_HNCO_3
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HNCO'
_Sample_label .
save_
save_3D_HN(CA)CO_4
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HN(CA)CO'
_Sample_label .
save_
save_3D_HNCA_5
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HNCA'
_Sample_label .
save_
save_3D_HN(CO)CA_6
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HN(CO)CA'
_Sample_label .
save_
save_3D_HNCACB_7
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HNCACB'
_Sample_label .
save_
save_3D_CBCA(CO)NH_8
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D CBCA(CO)NH'
_Sample_label .
save_
save_3D_HBHA(CO)NH_9
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HBHA(CO)NH'
_Sample_label .
save_
save_3D_(H)CC(CO)NH_10
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D (H)CC(CO)NH'
_Sample_label .
save_
save_3D_HCCH-COSY_11
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HCCH-COSY'
_Sample_label .
save_
save_3D_HCCH-TOCSY_12
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HCCH-TOCSY'
_Sample_label .
save_
save_3D_H(CCCO)NH_13
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D H(CCCO)NH'
_Sample_label .
save_
save_3D_(H)CCH-TOCSY_14
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D (H)CCH-TOCSY'
_Sample_label .
save_
save_3D_15N-edited_[1H,1H]-NOESY_15
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D 15N-edited [1H,1H]-NOESY'
_Sample_label .
save_
save_3D_13C-edited_[1H,1H]-NOESY_16
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D 13C-edited [1H,1H]-NOESY'
_Sample_label .
save_
save_NMR_spec_expt__0_1
_Saveframe_category NMR_applied_experiment
_Experiment_name '2D [1H,15N ]-HSQC'
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_2
_Saveframe_category NMR_applied_experiment
_Experiment_name '2D [1H,13C]-HSQC'
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_3
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HNCO'
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_4
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HN(CA)CO'
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_5
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HNCA'
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_6
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HN(CO)CA'
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_7
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HNCACB'
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_8
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D CBCA(CO)NH'
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_9
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HBHA(CO)NH'
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_10
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D (H)CC(CO)NH'
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_11
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HCCH-COSY'
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_12
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D HCCH-TOCSY'
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_13
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D H(CCCO)NH'
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_14
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D (H)CCH-TOCSY'
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_15
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D 15N-edited [1H,1H]-NOESY'
_BMRB_pulse_sequence_accession_number .
_Details .
save_
save_NMR_spec_expt__0_16
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D 13C-edited [1H,1H]-NOESY'
_BMRB_pulse_sequence_accession_number .
_Details .
save_
#######################
# Sample conditions #
#######################
save_condition_set_1
_Saveframe_category sample_conditions
_Details .
loop_
_Variable_type
_Variable_value
_Variable_value_error
_Variable_value_units
pH 7.5 0.2 n/a
temperature 298 0.5 K
stop_
save_
####################
# NMR parameters #
####################
##############################
# Assigned chemical shifts #
##############################
################################
# Chemical shift referencing #
################################
save_chemical_shift_reference
_Saveframe_category chemical_shift_reference
_Details
;
Chemical shift reference of 1H was based on the proton of water (4.700 ppm at
300 K) and then those of 15N and 13C were calculated based on their
gyromagnetic ratios.
;
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 0.00 . indirect . . . 0.251449530
H2O H 1 protons ppm 4.700 internal direct . . . 1.0
DSS N 15 'methyl protons' ppm 0.00 . 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_shift_set_1
_Saveframe_category assigned_chemical_shifts
_Details .
loop_
_Sample_label
$sample_1
stop_
_Sample_conditions_label $condition_set_1
_Chem_shift_reference_set_label $chemical_shift_reference
_Mol_system_component_name 'enth-vhs monomer'
_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 GLY CA C 41.8 0.30 1
2 . 1 GLY HA2 H 3.71 0.03 1
3 . 1 GLY HA3 H 3.71 0.03 1
4 . 7 GLY CA C 43.7 0.30 1
5 . 7 GLY HA2 H 3.96 0.03 1
6 . 7 GLY HA3 H 3.96 0.03 1
7 . 8 GLU N N 120.6 0.30 1
8 . 8 GLU H H 8.38 0.03 1
9 . 8 GLU CA C 56.6 0.30 1
10 . 8 GLU HA H 4.25 0.03 1
11 . 8 GLU CB C 27.2 0.30 1
12 . 8 GLU HB2 H 2.00 0.03 2
13 . 8 GLU HB3 H 2.08 0.03 2
14 . 8 GLU CG C 34.5 0.30 1
15 . 8 GLU HG2 H 2.31 0.03 1
16 . 8 GLU HG3 H 2.31 0.03 1
17 . 8 GLU C C 176.1 0.30 1
18 . 9 SER N N 115.6 0.30 1
19 . 9 SER H H 8.28 0.03 1
20 . 9 SER CA C 59.9 0.30 1
21 . 9 SER HA H 4.17 0.03 1
22 . 9 SER CB C 60.7 0.30 1
23 . 9 SER HB2 H 3.88 0.03 1
24 . 9 SER HB3 H 3.88 0.03 1
25 . 9 SER C C 173.6 0.30 1
26 . 10 TYR N N 121.0 0.30 1
27 . 10 TYR H H 7.75 0.03 1
28 . 10 TYR CA C 58.2 0.30 1
29 . 10 TYR HA H 4.04 0.03 1
30 . 10 TYR CB C 35.4 0.30 1
31 . 10 TYR HB2 H 2.82 0.03 2
32 . 10 TYR HB3 H 2.95 0.03 2
33 . 10 TYR HD1 H 6.65 0.03 1
34 . 10 TYR HD2 H 6.65 0.03 1
35 . 10 TYR HE1 H 6.43 0.03 1
36 . 10 TYR HE2 H 6.43 0.03 1
37 . 10 TYR CD1 C 130.7 0.30 1
38 . 10 TYR CE1 C 115.7 0.30 1
39 . 10 TYR CE2 C 115.7 0.30 1
40 . 10 TYR CD2 C 130.7 0.30 1
41 . 10 TYR C C 175.2 0.30 1
42 . 11 TRP N N 120.0 0.30 1
43 . 11 TRP H H 7.60 0.03 1
44 . 11 TRP CA C 57.8 0.30 1
45 . 11 TRP HA H 4.04 0.03 1
46 . 11 TRP CB C 26.3 0.30 1
47 . 11 TRP HB2 H 3.25 0.03 2
48 . 11 TRP HB3 H 3.39 0.03 2
49 . 11 TRP CD1 C 125.5 0.30 1
50 . 11 TRP CE3 C 118.4 0.30 1
51 . 11 TRP NE1 N 129.3 0.30 1
52 . 11 TRP HD1 H 7.25 0.03 1
53 . 11 TRP HE3 H 7.52 0.03 1
54 . 11 TRP CZ3 C 119.6 0.30 1
55 . 11 TRP CZ2 C 112.6 0.30 1
56 . 11 TRP HE1 H 10.11 0.03 1
57 . 11 TRP HZ3 H 7.10 0.03 1
58 . 11 TRP CH2 C 122.4 0.30 1
59 . 11 TRP HZ2 H 7.46 0.03 1
60 . 11 TRP HH2 H 7.20 0.03 1
61 . 11 TRP C C 176.4 0.30 1
62 . 12 ARG N N 119.5 0.30 1
63 . 12 ARG H H 7.66 0.03 1
64 . 12 ARG CA C 58.5 0.30 1
65 . 12 ARG HA H 3.69 0.03 1
66 . 12 ARG CB C 28.6 0.30 1
67 . 12 ARG HB2 H 0.92 0.03 2
68 . 12 ARG HB3 H 1.85 0.03 2
69 . 12 ARG CG C 27.4 0.30 1
70 . 12 ARG HG2 H 1.55 0.03 2
71 . 12 ARG HG3 H 1.69 0.03 2
72 . 12 ARG CD C 41.4 0.30 1
73 . 12 ARG HD2 H 2.16 0.03 2
74 . 12 ARG HD3 H 2.67 0.03 2
75 . 12 ARG NE N 82.9 0.30 1
76 . 12 ARG HE H 7.63 0.03 1
77 . 12 ARG C C 175.1 0.30 1
78 . 13 SER N N 112.6 0.30 1
79 . 13 SER H H 7.52 0.03 1
80 . 13 SER CA C 58.7 0.30 1
81 . 13 SER HA H 2.96 0.03 1
82 . 13 SER CB C 59.5 0.30 1
83 . 13 SER HB2 H 3.20 0.03 2
84 . 13 SER HB3 H 2.58 0.03 2
85 . 13 SER C C 175.0 0.30 1
86 . 14 ARG N N 119.3 0.30 1
87 . 14 ARG H H 7.70 0.03 1
88 . 14 ARG CA C 56.4 0.30 1
89 . 14 ARG HA H 3.69 0.03 1
90 . 14 ARG CB C 27.0 0.30 1
91 . 14 ARG HB2 H 1.59 0.03 1
92 . 14 ARG HB3 H 1.59 0.03 1
93 . 14 ARG CG C 24.4 0.30 1
94 . 14 ARG HG2 H 1.16 0.03 2
95 . 14 ARG HG3 H 1.25 0.03 2
96 . 14 ARG CD C 40.5 0.30 1
97 . 14 ARG HD2 H 2.78 0.03 2
98 . 14 ARG HD3 H 2.85 0.03 2
99 . 14 ARG C C 177.0 0.30 1
100 . 15 MET N N 119.4 0.30 1
101 . 15 MET H H 7.66 0.03 1
102 . 15 MET CA C 56.6 0.30 1
103 . 15 MET HA H 3.96 0.03 1
104 . 15 MET CB C 31.0 0.30 1
105 . 15 MET HB2 H 2.23 0.03 2
106 . 15 MET HB3 H 1.99 0.03 2
107 . 15 MET CG C 29.8 0.30 1
108 . 15 MET HG2 H 2.23 0.03 2
109 . 15 MET HG3 H 2.40 0.03 2
110 . 15 MET HE H 1.89 0.03 1
111 . 15 MET CE C 14.8 0.30 1
112 . 15 MET C C 176.6 0.30 1
113 . 16 ILE N N 117.3 0.30 1
114 . 16 ILE H H 7.18 0.03 1
115 . 16 ILE CA C 58.4 0.30 1
116 . 16 ILE HA H 3.71 0.03 1
117 . 16 ILE CB C 32.3 0.30 1
118 . 16 ILE HB H 2.36 0.03 1
119 . 16 ILE HG2 H 0.67 0.03 1
120 . 16 ILE CG2 C 15.8 0.30 1
121 . 16 ILE CG1 C 24.7 0.30 1
122 . 16 ILE HG12 H 1.55 0.03 2
123 . 16 ILE HG13 H 2.16 0.03 2
124 . 16 ILE HD1 H 0.65 0.03 1
125 . 16 ILE CD1 C 6.7 0.30 1
126 . 16 ILE C C 177.8 0.30 1
127 . 17 ASP N N 125.6 0.30 1
128 . 17 ASP H H 8.45 0.03 1
129 . 17 ASP CA C 55.3 0.30 1
130 . 17 ASP HA H 3.86 0.03 1
131 . 17 ASP CB C 37.1 0.30 1
132 . 17 ASP HB2 H 2.38 0.03 2
133 . 17 ASP HB3 H 2.50 0.03 2
134 . 17 ASP C C 177.0 0.30 1
135 . 18 ALA N N 118.9 0.30 1
136 . 18 ALA H H 7.80 0.03 1
137 . 18 ALA CA C 52.8 0.30 1
138 . 18 ALA HA H 4.06 0.03 1
139 . 18 ALA HB H 1.42 0.03 1
140 . 18 ALA CB C 16.0 0.30 1
141 . 18 ALA C C 178.6 0.30 1
142 . 19 VAL N N 105.9 0.30 1
143 . 19 VAL H H 6.91 0.03 1
144 . 19 VAL CA C 59.0 0.30 1
145 . 19 VAL HA H 4.47 0.03 1
146 . 19 VAL CB C 28.7 0.30 1
147 . 19 VAL HB H 2.28 0.03 1
148 . 19 VAL HG1 H 0.79 0.03 2
149 . 19 VAL HG2 H 0.94 0.03 2
150 . 19 VAL CG1 C 20.2 0.30 2
151 . 19 VAL CG2 C 17.8 0.30 2
152 . 19 VAL C C 172.5 0.30 1
153 . 20 THR N N 110.8 0.30 1
154 . 20 THR H H 7.45 0.03 1
155 . 20 THR CA C 57.1 0.30 1
156 . 20 THR HA H 4.56 0.03 1
157 . 20 THR CB C 66.5 0.30 1
158 . 20 THR HB H 4.54 0.03 1
159 . 20 THR HG2 H 0.89 0.03 1
160 . 20 THR HG1 H 5.09 0.03 1
161 . 20 THR CG2 C 19.4 0.30 1
162 . 20 THR C C 170.7 0.30 1
163 . 21 SER N N 116.7 0.30 1
164 . 21 SER H H 7.10 0.03 1
165 . 21 SER CA C 56.1 0.30 1
166 . 21 SER HA H 4.14 0.03 1
167 . 21 SER CB C 62.2 0.30 1
168 . 21 SER HB2 H 3.88 0.03 2
169 . 21 SER HB3 H 3.97 0.03 2
170 . 21 SER C C 172.7 0.30 1
171 . 24 ASP CA C 51.8 0.30 1
172 . 24 ASP HA H 4.43 0.03 1
173 . 24 ASP CB C 36.7 0.30 1
174 . 24 ASP HB2 H 2.40 0.03 2
175 . 24 ASP HB3 H 2.66 0.03 2
176 . 24 ASP C C 173.0 0.30 1
177 . 25 LYS N N 122.1 0.30 1
178 . 25 LYS H H 7.84 0.03 1
179 . 25 LYS CA C 53.5 0.30 1
180 . 25 LYS HA H 4.24 0.03 1
181 . 25 LYS CB C 32.6 0.30 1
182 . 25 LYS HB2 H 1.49 0.03 2
183 . 25 LYS HB3 H 1.53 0.03 2
184 . 25 LYS CG C 22.2 0.30 1
185 . 25 LYS HG2 H 1.23 0.03 1
186 . 25 LYS HG3 H 1.23 0.03 1
187 . 25 LYS CD C 26.9 0.30 1
188 . 25 LYS CE C 39.7 0.30 1
189 . 25 LYS HE2 H 2.85 0.03 1
190 . 25 LYS HE3 H 2.85 0.03 1
191 . 25 LYS C C 173.6 0.30 1
192 . 26 VAL N N 120.8 0.30 1
193 . 26 VAL H H 8.19 0.03 1
194 . 26 VAL CA C 59.5 0.30 1
195 . 26 VAL HA H 3.90 0.03 1
196 . 26 VAL CB C 30.3 0.30 1
197 . 26 VAL HB H 1.98 0.03 1
198 . 26 VAL HG1 H 0.81 0.03 2
199 . 26 VAL HG2 H 0.91 0.03 2
200 . 26 VAL CG1 C 17.4 0.30 2
201 . 26 VAL CG2 C 19.1 0.30 2
202 . 26 VAL C C 174.0 0.30 1
203 . 27 ALA N N 127.6 0.30 1
204 . 27 ALA H H 8.64 0.03 1
205 . 27 ALA CA C 47.8 0.30 1
206 . 27 ALA HA H 4.49 0.03 1
207 . 27 ALA HB H 1.18 0.03 1
208 . 27 ALA CB C 15.1 0.30 1
209 . 27 ALA C C 172.9 0.30 1
210 . 28 PRO CD C 48.3 0.30 1
211 . 28 PRO CA C 59.8 0.30 1
212 . 28 PRO HA H 4.40 0.03 1
213 . 28 PRO CB C 30.0 0.30 1
214 . 28 PRO HB2 H 1.43 0.03 2
215 . 28 PRO HB3 H 2.28 0.03 2
216 . 28 PRO CG C 25.6 0.30 1
217 . 28 PRO HG2 H 1.63 0.03 2
218 . 28 PRO HG3 H 1.99 0.03 2
219 . 28 PRO HD2 H 3.27 0.03 2
220 . 28 PRO HD3 H 3.87 0.03 2
221 . 28 PRO C C 175.8 0.30 1
222 . 29 VAL N N 123.4 0.30 1
223 . 29 VAL H H 8.50 0.03 1
224 . 29 VAL CA C 64.4 0.30 1
225 . 29 VAL HA H 3.26 0.03 1
226 . 29 VAL CB C 29.3 0.30 1
227 . 29 VAL HB H 2.05 0.03 1
228 . 29 VAL HG1 H 0.94 0.03 2
229 . 29 VAL HG2 H 1.00 0.03 2
230 . 29 VAL CG1 C 19.1 0.30 2
231 . 29 VAL CG2 C 20.5 0.30 2
232 . 29 VAL C C 175.9 0.30 1
233 . 30 TYR N N 115.3 0.30 1
234 . 30 TYR H H 8.03 0.03 1
235 . 30 TYR CA C 57.9 0.30 1
236 . 30 TYR HA H 4.31 0.03 1
237 . 30 TYR CB C 33.9 0.30 1
238 . 30 TYR HB2 H 2.96 0.03 2
239 . 30 TYR HB3 H 3.10 0.03 2
240 . 30 TYR HD1 H 7.06 0.03 1
241 . 30 TYR HD2 H 7.06 0.03 1
242 . 30 TYR HE1 H 6.75 0.03 1
243 . 30 TYR HE2 H 6.75 0.03 1
244 . 30 TYR CD1 C 131.4 0.30 1
245 . 30 TYR CE1 C 116.3 0.30 1
246 . 30 TYR CE2 C 116.3 0.30 1
247 . 30 TYR CD2 C 131.4 0.30 1
248 . 30 TYR C C 176.0 0.30 1
249 . 31 LYS N N 119.4 0.30 1
250 . 31 LYS H H 6.47 0.03 1
251 . 31 LYS CA C 55.3 0.30 1
252 . 31 LYS HA H 3.99 0.03 1
253 . 31 LYS CB C 29.9 0.30 1
254 . 31 LYS HB2 H 1.44 0.03 2
255 . 31 LYS HB3 H 1.55 0.03 2
256 . 31 LYS CG C 22.9 0.30 1
257 . 31 LYS HG2 H 0.87 0.03 1
258 . 31 LYS HG3 H 0.87 0.03 1
259 . 31 LYS CD C 25.9 0.30 1
260 . 31 LYS HD2 H 1.36 0.03 2
261 . 31 LYS HD3 H 1.53 0.03 2
262 . 31 LYS CE C 39.4 0.30 1
263 . 31 LYS HE2 H 2.85 0.03 2
264 . 31 LYS HE3 H 2.90 0.03 2
265 . 31 LYS C C 177.3 0.30 1
266 . 32 LEU N N 120.3 0.30 1
267 . 32 LEU H H 7.04 0.03 1
268 . 32 LEU CA C 55.9 0.30 1
269 . 32 LEU HA H 3.73 0.03 1
270 . 32 LEU CB C 38.0 0.30 1
271 . 32 LEU HB2 H 0.65 0.03 2
272 . 32 LEU HB3 H 1.37 0.03 2
273 . 32 LEU CG C 23.9 0.30 1
274 . 32 LEU HG H 1.27 0.03 1
275 . 32 LEU HD1 H 0.17 0.03 2
276 . 32 LEU HD2 H 0.46 0.03 2
277 . 32 LEU CD1 C 22.2 0.30 2
278 . 32 LEU CD2 C 20.5 0.30 2
279 . 32 LEU C C 177.3 0.30 1
280 . 33 GLU N N 118.7 0.30 1
281 . 33 GLU H H 8.50 0.03 1
282 . 33 GLU CA C 57.2 0.30 1
283 . 33 GLU HA H 3.88 0.03 1
284 . 33 GLU CB C 27.2 0.30 1
285 . 33 GLU HB2 H 2.00 0.03 2
286 . 33 GLU HB3 H 2.12 0.03 2
287 . 33 GLU CG C 33.7 0.30 1
288 . 33 GLU HG2 H 2.29 0.03 2
289 . 33 GLU HG3 H 2.56 0.03 2
290 . 33 GLU C C 175.7 0.30 1
291 . 34 GLU N N 117.7 0.30 1
292 . 34 GLU H H 7.25 0.03 1
293 . 34 GLU CA C 57.0 0.30 1
294 . 34 GLU HA H 3.98 0.03 1
295 . 34 GLU CB C 27.6 0.30 1
296 . 34 GLU HB2 H 1.97 0.03 2
297 . 34 GLU HB3 H 2.08 0.03 2
298 . 34 GLU CG C 34.0 0.30 1
299 . 34 GLU HG2 H 2.08 0.03 2
300 . 34 GLU HG3 H 2.46 0.03 2
301 . 34 GLU C C 176.9 0.30 1
302 . 35 ILE N N 118.2 0.30 1
303 . 35 ILE H H 6.90 0.03 1
304 . 35 ILE CA C 62.6 0.30 1
305 . 35 ILE HA H 3.32 0.03 1
306 . 35 ILE CB C 35.0 0.30 1
307 . 35 ILE HB H 1.81 0.03 1
308 . 35 ILE HG2 H 0.32 0.03 1
309 . 35 ILE CG2 C 14.1 0.30 1
310 . 35 ILE CG1 C 27.6 0.30 1
311 . 35 ILE HG12 H 0.90 0.03 2
312 . 35 ILE HG13 H 1.69 0.03 2
313 . 35 ILE HD1 H 0.66 0.03 1
314 . 35 ILE CD1 C 12.6 0.30 1
315 . 35 ILE C C 174.6 0.30 1
316 . 36 CYS N N 118.3 0.30 1
317 . 36 CYS H H 7.72 0.03 1
318 . 36 CYS CA C 60.9 0.30 1
319 . 36 CYS HA H 3.96 0.03 1
320 . 36 CYS CB C 24.5 0.30 1
321 . 36 CYS HB2 H 3.19 0.03 2
322 . 36 CYS HB3 H 2.55 0.03 2
323 . 36 CYS C C 174.2 0.30 1
324 . 37 ASP N N 117.6 0.30 1
325 . 37 ASP H H 8.14 0.03 1
326 . 37 ASP CA C 55.0 0.30 1
327 . 37 ASP HA H 4.21 0.03 1
328 . 37 ASP CB C 38.4 0.30 1
329 . 37 ASP HB2 H 2.58 0.03 2
330 . 37 ASP HB3 H 2.68 0.03 2
331 . 37 ASP C C 176.9 0.30 1
332 . 38 LEU N N 120.5 0.30 1
333 . 38 LEU H H 7.48 0.03 1
334 . 38 LEU CA C 55.4 0.30 1
335 . 38 LEU HA H 4.03 0.03 1
336 . 38 LEU CB C 40.1 0.30 1
337 . 38 LEU HB2 H 1.37 0.03 2
338 . 38 LEU HB3 H 1.73 0.03 2
339 . 38 LEU CG C 23.5 0.30 1
340 . 38 LEU HG H 0.96 0.03 1
341 . 38 LEU HD1 H 0.91 0.03 1
342 . 38 LEU HD2 H 0.91 0.03 1
343 . 38 LEU CD1 C 22.3 0.30 2
344 . 38 LEU CD2 C 21.8 0.30 2
345 . 38 LEU C C 178.5 0.30 1
346 . 39 LEU N N 122.3 0.30 1
347 . 39 LEU H H 8.49 0.03 1
348 . 39 LEU CA C 56.1 0.30 1
349 . 39 LEU HA H 3.66 0.03 1
350 . 39 LEU CB C 40.1 0.30 1
351 . 39 LEU HB2 H 1.05 0.03 2
352 . 39 LEU HB3 H 1.92 0.03 2
353 . 39 LEU CG C 23.9 0.30 1
354 . 39 LEU HG H 1.12 0.03 1
355 . 39 LEU HD1 H -0.36 0.03 2
356 . 39 LEU HD2 H 0.42 0.03 2
357 . 39 LEU CD1 C 21.6 0.30 2
358 . 39 LEU CD2 C 21.8 0.30 2
359 . 39 LEU C C 176.1 0.30 1
360 . 40 ARG N N 115.7 0.30 1
361 . 40 ARG H H 7.99 0.03 1
362 . 40 ARG CA C 56.6 0.30 1
363 . 40 ARG HA H 3.94 0.03 1
364 . 40 ARG CB C 28.9 0.30 1
365 . 40 ARG HB2 H 1.71 0.03 2
366 . 40 ARG HB3 H 1.91 0.03 2
367 . 40 ARG CG C 26.3 0.30 1
368 . 40 ARG HG2 H 1.55 0.03 1
369 . 40 ARG HG3 H 1.55 0.03 1
370 . 40 ARG CD C 41.1 0.30 1
371 . 40 ARG HD2 H 3.25 0.03 1
372 . 40 ARG HD3 H 3.25 0.03 1
373 . 40 ARG C C 175.7 0.30 1
374 . 41 SER N N 109.4 0.30 1
375 . 41 SER H H 7.36 0.03 1
376 . 41 SER CA C 55.9 0.30 1
377 . 41 SER HA H 4.60 0.03 1
378 . 41 SER CB C 62.4 0.30 1
379 . 41 SER HB2 H 3.89 0.03 2
380 . 41 SER HB3 H 3.99 0.03 2
381 . 41 SER C C 172.6 0.30 1
382 . 42 SER N N 117.2 0.30 1
383 . 42 SER H H 7.14 0.03 1
384 . 42 SER CA C 57.7 0.30 1
385 . 42 SER HA H 4.68 0.03 1
386 . 42 SER CB C 63.5 0.30 1
387 . 42 SER HB2 H 3.81 0.03 2
388 . 42 SER HB3 H 3.98 0.03 2
389 . 42 SER HG H 5.93 0.03 1
390 . 42 SER C C 170.5 0.30 1
391 . 43 HIS N N 121.8 0.30 1
392 . 43 HIS H H 8.65 0.03 1
393 . 43 HIS CA C 55.7 0.30 1
394 . 43 HIS HA H 4.36 0.03 1
395 . 43 HIS CB C 29.9 0.30 1
396 . 43 HIS HB2 H 2.82 0.03 2
397 . 43 HIS HB3 H 3.35 0.03 2
398 . 43 HIS CD2 C 116.8 0.30 1
399 . 43 HIS CE1 C 137.0 0.30 1
400 . 43 HIS HD2 H 7.23 0.03 1
401 . 43 HIS HE1 H 7.83 0.03 1
402 . 43 HIS C C 174.8 0.30 1
403 . 44 VAL N N 126.4 0.30 1
404 . 44 VAL H H 8.17 0.03 1
405 . 44 VAL CA C 63.8 0.30 1
406 . 44 VAL HA H 3.70 0.03 1
407 . 44 VAL CB C 28.9 0.30 1
408 . 44 VAL HB H 1.97 0.03 1
409 . 44 VAL HG1 H 0.70 0.03 2
410 . 44 VAL HG2 H 0.85 0.03 2
411 . 44 VAL CG1 C 17.1 0.30 2
412 . 44 VAL CG2 C 19.5 0.30 2
413 . 44 VAL C C 173.7 0.30 1
414 . 45 SER N N 119.8 0.30 1
415 . 45 SER H H 9.49 0.03 1
416 . 45 SER CA C 59.6 0.30 1
417 . 45 SER HA H 4.10 0.03 1
418 . 45 SER CB C 59.9 0.30 1
419 . 45 SER HB2 H 3.88 0.03 2
420 . 45 SER HB3 H 4.12 0.03 2
421 . 45 SER C C 174.9 0.30 1
422 . 46 ILE N N 125.7 0.30 1
423 . 46 ILE H H 7.58 0.03 1
424 . 46 ILE CA C 60.8 0.30 1
425 . 46 ILE HA H 3.83 0.03 1
426 . 46 ILE CB C 35.3 0.30 1
427 . 46 ILE HB H 2.27 0.03 1
428 . 46 ILE HG2 H 0.94 0.03 1
429 . 46 ILE CG2 C 15.6 0.30 1
430 . 46 ILE CG1 C 26.8 0.30 1
431 . 46 ILE HG12 H 1.19 0.03 2
432 . 46 ILE HG13 H 1.62 0.03 2
433 . 46 ILE HD1 H 0.82 0.03 1
434 . 46 ILE CD1 C 9.4 0.30 1
435 . 46 ILE C C 175.8 0.30 1
436 . 47 VAL N N 122.3 0.30 1
437 . 47 VAL H H 7.94 0.03 1
438 . 47 VAL CA C 65.7 0.30 1
439 . 47 VAL HA H 3.60 0.03 1
440 . 47 VAL CB C 28.9 0.30 1
441 . 47 VAL HB H 2.29 0.03 1
442 . 47 VAL HG1 H 1.12 0.03 2
443 . 47 VAL HG2 H 0.94 0.03 2
444 . 47 VAL CG1 C 21.5 0.30 2
445 . 47 VAL CG2 C 18.8 0.30 2
446 . 47 VAL C C 177.3 0.30 1
447 . 48 LYS N N 120.5 0.30 1
448 . 48 LYS H H 8.57 0.03 1
449 . 48 LYS CA C 58.1 0.30 1
450 . 48 LYS HA H 3.77 0.03 1
451 . 48 LYS CB C 29.6 0.30 1
452 . 48 LYS HB2 H 1.82 0.03 1
453 . 48 LYS HB3 H 1.82 0.03 1
454 . 48 LYS CG C 23.2 0.30 1
455 . 48 LYS HG2 H 1.25 0.03 2
456 . 48 LYS HG3 H 1.44 0.03 2
457 . 48 LYS CD C 26.7 0.30 1
458 . 48 LYS HD2 H 1.46 0.03 1
459 . 48 LYS HD3 H 1.46 0.03 1
460 . 48 LYS CE C 39.7 0.30 1
461 . 48 LYS HE2 H 2.84 0.03 1
462 . 48 LYS HE3 H 2.84 0.03 1
463 . 48 LYS C C 175.6 0.30 1
464 . 49 GLU N N 121.0 0.30 1
465 . 49 GLU H H 7.34 0.03 1
466 . 49 GLU CA C 57.6 0.30 1
467 . 49 GLU HA H 3.70 0.03 1
468 . 49 GLU CB C 27.6 0.30 1
469 . 49 GLU HB2 H 1.89 0.03 1
470 . 49 GLU HB3 H 1.89 0.03 1
471 . 49 GLU CG C 35.0 0.30 1
472 . 49 GLU HG2 H 1.48 0.03 2
473 . 49 GLU HG3 H 1.81 0.03 2
474 . 49 GLU C C 175.8 0.30 1
475 . 50 PHE N N 115.6 0.30 1
476 . 50 PHE H H 8.63 0.03 1
477 . 50 PHE CA C 60.8 0.30 1
478 . 50 PHE HA H 4.19 0.03 1
479 . 50 PHE CB C 38.0 0.30 1
480 . 50 PHE HB2 H 2.79 0.03 2
481 . 50 PHE HB3 H 3.15 0.03 2
482 . 50 PHE HD1 H 7.17 0.03 1
483 . 50 PHE HD2 H 7.17 0.03 1
484 . 50 PHE HE1 H 7.17 0.03 1
485 . 50 PHE HE2 H 7.17 0.03 1
486 . 50 PHE CD1 C 128.9 0.30 1
487 . 50 PHE CE1 C 128.9 0.30 1
488 . 50 PHE CE2 C 128.9 0.30 1
489 . 50 PHE CD2 C 128.9 0.30 1
490 . 50 PHE C C 176.8 0.30 1
491 . 51 SER N N 113.3 0.30 1
492 . 51 SER H H 8.44 0.03 1
493 . 51 SER CA C 61.5 0.30 1
494 . 51 SER HA H 4.01 0.03 1
495 . 51 SER CB C 60.3 0.30 1
496 . 51 SER HB2 H 3.60 0.03 2
497 . 51 SER HB3 H 4.03 0.03 2
498 . 51 SER C C 172.6 0.30 1
499 . 52 GLU N N 121.0 0.30 1
500 . 52 GLU H H 7.94 0.03 1
501 . 52 GLU CA C 57.4 0.30 1
502 . 52 GLU HA H 3.88 0.03 1
503 . 52 GLU CB C 26.5 0.30 1
504 . 52 GLU HB2 H 1.82 0.03 2
505 . 52 GLU HB3 H 1.96 0.03 2
506 . 52 GLU CG C 34.1 0.30 1
507 . 52 GLU HG2 H 2.24 0.03 1
508 . 52 GLU HG3 H 2.24 0.03 1
509 . 52 GLU C C 177.5 0.30 1
510 . 53 PHE N N 117.5 0.30 1
511 . 53 PHE H H 8.00 0.03 1
512 . 53 PHE CA C 56.5 0.30 1
513 . 53 PHE HA H 4.60 0.03 1
514 . 53 PHE CB C 35.3 0.30 1
515 . 53 PHE HB2 H 3.30 0.03 1
516 . 53 PHE HB3 H 3.30 0.03 1
517 . 53 PHE HD1 H 6.93 0.03 1
518 . 53 PHE HD2 H 6.93 0.03 1
519 . 53 PHE HE1 H 7.12 0.03 1
520 . 53 PHE HE2 H 7.12 0.03 1
521 . 53 PHE CD1 C 127.5 0.30 1
522 . 53 PHE CE1 C 129.4 0.30 1
523 . 53 PHE CZ C 127.8 0.30 1
524 . 53 PHE HZ H 7.07 0.03 1
525 . 53 PHE CE2 C 129.4 0.30 1
526 . 53 PHE CD2 C 127.5 0.30 1
527 . 53 PHE C C 177.7 0.30 1
528 . 54 ILE N N 120.3 0.30 1
529 . 54 ILE H H 8.64 0.03 1
530 . 54 ILE CA C 64.5 0.30 1
531 . 54 ILE HA H 3.36 0.03 1
532 . 54 ILE CB C 36.0 0.30 1
533 . 54 ILE HB H 2.01 0.03 1
534 . 54 ILE HG2 H 0.84 0.03 1
535 . 54 ILE CG2 C 14.7 0.30 1
536 . 54 ILE CG1 C 28.3 0.30 1
537 . 54 ILE HG12 H 2.19 0.03 1
538 . 54 ILE HG13 H 2.19 0.03 1
539 . 54 ILE HD1 H 0.85 0.03 1
540 . 54 ILE CD1 C 11.4 0.30 1
541 . 54 ILE C C 175.1 0.30 1
542 . 55 LEU N N 118.8 0.30 1
543 . 55 LEU H H 8.51 0.03 1
544 . 55 LEU CA C 55.6 0.30 1
545 . 55 LEU HA H 3.87 0.03 1
546 . 55 LEU CB C 38.4 0.30 1
547 . 55 LEU HB2 H 1.35 0.03 2
548 . 55 LEU HB3 H 1.83 0.03 2
549 . 55 LEU CG C 25.2 0.30 1
550 . 55 LEU HG H 1.72 0.03 1
551 . 55 LEU HD1 H 0.67 0.03 1
552 . 55 LEU HD2 H 0.67 0.03 1
553 . 55 LEU CD1 C 23.5 0.30 2
554 . 55 LEU CD2 C 19.8 0.30 2
555 . 55 LEU C C 178.3 0.30 1
556 . 56 LYS N N 119.2 0.30 1
557 . 56 LYS H H 8.10 0.03 1
558 . 56 LYS CA C 56.5 0.30 1
559 . 56 LYS HA H 4.15 0.03 1
560 . 56 LYS CB C 29.6 0.30 1
561 . 56 LYS HB2 H 1.88 0.03 2
562 . 56 LYS HB3 H 1.94 0.03 2
563 . 56 LYS CG C 23.2 0.30 1
564 . 56 LYS HG2 H 1.50 0.03 2
565 . 56 LYS HG3 H 1.60 0.03 2
566 . 56 LYS CD C 26.6 0.30 1
567 . 56 LYS HD2 H 1.68 0.03 1
568 . 56 LYS HD3 H 1.68 0.03 1
569 . 56 LYS CE C 39.8 0.30 1
570 . 56 LYS HE2 H 2.94 0.03 1
571 . 56 LYS HE3 H 2.94 0.03 1
572 . 56 LYS C C 178.6 0.30 1
573 . 57 ARG N N 118.7 0.30 1
574 . 57 ARG H H 7.67 0.03 1
575 . 57 ARG CA C 54.1 0.30 1
576 . 57 ARG HA H 4.07 0.03 1
577 . 57 ARG CB C 24.9 0.30 1
578 . 57 ARG HB2 H 2.06 0.03 1
579 . 57 ARG HB3 H 2.06 0.03 1
580 . 57 ARG C C 176.2 0.30 1
581 . 58 LEU N N 115.7 0.30 1
582 . 58 LEU H H 7.58 0.03 1
583 . 58 LEU CA C 54.9 0.30 1
584 . 58 LEU HA H 3.84 0.03 1
585 . 58 LEU CB C 38.7 0.30 1
586 . 58 LEU HB2 H 1.62 0.03 2
587 . 58 LEU HB3 H 1.77 0.03 2
588 . 58 LEU CG C 23.9 0.30 1
589 . 58 LEU HG H 1.71 0.03 1
590 . 58 LEU HD1 H 0.68 0.03 2
591 . 58 LEU HD2 H 0.74 0.03 2
592 . 58 LEU CD1 C 22.5 0.30 2
593 . 58 LEU CD2 C 23.9 0.30 2
594 . 58 LEU C C 174.3 0.30 1
595 . 59 ASP N N 114.6 0.30 1
596 . 59 ASP H H 7.06 0.03 1
597 . 59 ASP CA C 51.8 0.30 1
598 . 59 ASP HA H 4.55 0.03 1
599 . 59 ASP CB C 39.4 0.30 1
600 . 59 ASP HB2 H 2.60 0.03 2
601 . 59 ASP HB3 H 2.75 0.03 2
602 . 59 ASP C C 173.7 0.30 1
603 . 60 ASN N N 120.9 0.30 1
604 . 60 ASN H H 7.42 0.03 1
605 . 60 ASN CA C 52.8 0.30 1
606 . 60 ASN HA H 4.24 0.03 1
607 . 60 ASN CB C 39.7 0.30 1
608 . 60 ASN HB2 H 2.43 0.03 2
609 . 60 ASN HB3 H 3.00 0.03 2
610 . 60 ASN ND2 N 112.9 0.30 1
611 . 60 ASN HD21 H 6.93 0.03 2
612 . 60 ASN HD22 H 7.76 0.03 2
613 . 60 ASN C C 172.9 0.30 1
614 . 61 LYS N N 122.7 0.30 1
615 . 61 LYS H H 8.63 0.03 1
616 . 61 LYS CA C 55.9 0.30 1
617 . 61 LYS HA H 4.07 0.03 1
618 . 61 LYS CB C 30.3 0.30 1
619 . 61 LYS HB2 H 1.84 0.03 1
620 . 61 LYS HB3 H 1.84 0.03 1
621 . 61 LYS CG C 22.5 0.30 1
622 . 61 LYS HG2 H 1.46 0.03 1
623 . 61 LYS HG3 H 1.46 0.03 1
624 . 61 LYS CD C 26.9 0.30 1
625 . 61 LYS HD2 H 1.66 0.03 1
626 . 61 LYS HD3 H 1.66 0.03 1
627 . 61 LYS CE C 39.7 0.30 1
628 . 61 LYS HE2 H 2.98 0.03 1
629 . 61 LYS HE3 H 2.98 0.03 1
630 . 61 LYS C C 175.5 0.30 1
631 . 62 SER N N 115.0 0.30 1
632 . 62 SER H H 8.75 0.03 1
633 . 62 SER CA C 51.8 0.30 1
634 . 62 SER HA H 5.00 0.03 1
635 . 62 SER CB C 61.0 0.30 1
636 . 62 SER HB2 H 3.86 0.03 2
637 . 62 SER HB3 H 4.14 0.03 2
638 . 62 SER C C 172.4 0.30 1
639 . 63 PRO CD C 48.7 0.30 1
640 . 63 PRO CA C 62.0 0.30 1
641 . 63 PRO HA H 4.02 0.03 1
642 . 63 PRO CB C 29.3 0.30 1
643 . 63 PRO HB2 H 1.80 0.03 2
644 . 63 PRO HB3 H 2.48 0.03 2
645 . 63 PRO CG C 25.2 0.30 1
646 . 63 PRO HG2 H 1.98 0.03 2
647 . 63 PRO HG3 H 2.52 0.03 2
648 . 63 PRO HD2 H 4.01 0.03 2
649 . 63 PRO HD3 H 4.33 0.03 2
650 . 63 PRO C C 177.1 0.30 1
651 . 64 ILE N N 123.5 0.30 1
652 . 64 ILE H H 7.52 0.03 1
653 . 64 ILE CA C 62.6 0.30 1
654 . 64 ILE HA H 3.67 0.03 1
655 . 64 ILE CB C 35.7 0.30 1
656 . 64 ILE HB H 1.66 0.03 1
657 . 64 ILE HG2 H 0.84 0.03 1
658 . 64 ILE CG2 C 15.2 0.30 1
659 . 64 ILE CG1 C 27.1 0.30 1
660 . 64 ILE HG12 H 1.04 0.03 2
661 . 64 ILE HG13 H 1.53 0.03 2
662 . 64 ILE HD1 H 0.75 0.03 1
663 . 64 ILE CD1 C 10.2 0.30 1
664 . 64 ILE C C 175.0 0.30 1
665 . 65 VAL N N 120.6 0.30 1
666 . 65 VAL H H 6.76 0.03 1
667 . 65 VAL CA C 64.1 0.30 1
668 . 65 VAL HA H 3.23 0.03 1
669 . 65 VAL CB C 29.3 0.30 1
670 . 65 VAL HB H 1.99 0.03 1
671 . 65 VAL HG1 H 0.92 0.03 2
672 . 65 VAL HG2 H 0.98 0.03 2
673 . 65 VAL CG1 C 19.1 0.30 1
674 . 65 VAL CG2 C 19.1 0.30 1
675 . 65 VAL C C 176.0 0.30 1
676 . 66 LYS N N 114.3 0.30 1
677 . 66 LYS H H 7.90 0.03 1
678 . 66 LYS CA C 59.0 0.30 1
679 . 66 LYS HA H 3.71 0.03 1
680 . 66 LYS CB C 33.0 0.30 1
681 . 66 LYS HB2 H 1.32 0.03 2
682 . 66 LYS HB3 H 1.70 0.03 2
683 . 66 LYS CG C 22.2 0.30 1
684 . 66 LYS HG2 H 1.57 0.03 2
685 . 66 LYS HG3 H 1.78 0.03 2
686 . 66 LYS CD C 28.4 0.30 1
687 . 66 LYS HD2 H 0.87 0.03 2
688 . 66 LYS HD3 H 1.22 0.03 2
689 . 66 LYS CE C 39.6 0.30 1
690 . 66 LYS HE2 H 2.83 0.03 2
691 . 66 LYS HE3 H 2.97 0.03 2
692 . 66 LYS C C 175.9 0.30 1
693 . 67 GLN N N 116.4 0.30 1
694 . 67 GLN H H 7.70 0.03 1
695 . 67 GLN CA C 58.6 0.30 1
696 . 67 GLN HA H 3.67 0.03 1
697 . 67 GLN CB C 25.2 0.30 1
698 . 67 GLN HB2 H 1.93 0.03 2
699 . 67 GLN HB3 H 2.41 0.03 2
700 . 67 GLN CG C 31.8 0.30 1
701 . 67 GLN HG2 H 2.39 0.03 2
702 . 67 GLN HG3 H 2.12 0.03 2
703 . 67 GLN NE2 N 108.5 0.30 1
704 . 67 GLN HE21 H 6.54 0.03 2
705 . 67 GLN HE22 H 7.02 0.03 2
706 . 67 GLN C C 175.8 0.30 1
707 . 68 LYS N N 117.9 0.30 1
708 . 68 LYS H H 8.34 0.03 1
709 . 68 LYS CA C 58.2 0.30 1
710 . 68 LYS HA H 3.78 0.03 1
711 . 68 LYS CB C 31.3 0.30 1
712 . 68 LYS HB2 H 1.72 0.03 2
713 . 68 LYS HB3 H 2.16 0.03 2
714 . 68 LYS CG C 24.9 0.30 1
715 . 68 LYS HG2 H 1.39 0.03 2
716 . 68 LYS HG3 H 2.06 0.03 2
717 . 68 LYS CD C 28.3 0.30 1
718 . 68 LYS HD2 H 1.70 0.03 2
719 . 68 LYS HD3 H 1.89 0.03 2
720 . 68 LYS CE C 40.7 0.30 1
721 . 68 LYS HE2 H 2.98 0.03 1
722 . 68 LYS HE3 H 2.98 0.03 1
723 . 68 LYS C C 178.1 0.30 1
724 . 69 ALA N N 125.1 0.30 1
725 . 69 ALA H H 8.77 0.03 1
726 . 69 ALA CA C 53.3 0.30 1
727 . 69 ALA HA H 3.90 0.03 1
728 . 69 ALA HB H 1.35 0.03 1
729 . 69 ALA CB C 15.3 0.30 1
730 . 69 ALA C C 176.2 0.30 1
731 . 70 LEU N N 118.2 0.30 1
732 . 70 LEU H H 8.06 0.03 1
733 . 70 LEU CA C 55.8 0.30 1
734 . 70 LEU HA H 3.87 0.03 1
735 . 70 LEU CB C 40.1 0.30 1
736 . 70 LEU HB2 H 1.42 0.03 2
737 . 70 LEU HB3 H 2.05 0.03 2
738 . 70 LEU CG C 25.3 0.30 1
739 . 70 LEU HG H 0.79 0.03 1
740 . 70 LEU HD1 H 1.85 0.03 2
741 . 70 LEU HD2 H 0.86 0.03 2
742 . 70 LEU CD1 C 23.3 0.30 2
743 . 70 LEU CD2 C 23.2 0.30 2
744 . 70 LEU C C 175.6 0.30 1
745 . 71 ARG N N 118.4 0.30 1
746 . 71 ARG H H 8.62 0.03 1
747 . 71 ARG CA C 57.8 0.30 1
748 . 71 ARG HA H 3.69 0.03 1
749 . 71 ARG CB C 27.2 0.30 1
750 . 71 ARG HB2 H 1.74 0.03 2
751 . 71 ARG HB3 H 1.95 0.03 2
752 . 71 ARG CG C 25.6 0.30 1
753 . 71 ARG HG2 H 1.55 0.03 2
754 . 71 ARG HG3 H 1.85 0.03 2
755 . 71 ARG CD C 41.4 0.30 1
756 . 71 ARG HD2 H 3.12 0.03 1
757 . 71 ARG HD3 H 3.12 0.03 1
758 . 71 ARG C C 176.3 0.30 1
759 . 72 LEU N N 119.7 0.30 1
760 . 72 LEU H H 7.81 0.03 1
761 . 72 LEU CA C 56.4 0.30 1
762 . 72 LEU HA H 3.95 0.03 1
763 . 72 LEU CB C 38.4 0.30 1
764 . 72 LEU HB2 H 1.36 0.03 2
765 . 72 LEU HB3 H 2.20 0.03 2
766 . 72 LEU CG C 24.7 0.30 1
767 . 72 LEU HG H 0.81 0.03 1
768 . 72 LEU CD1 C 21.2 0.30 1
769 . 72 LEU CD2 C 21.2 0.30 1
770 . 72 LEU HD1 H 0.80 0.03 1
771 . 72 LEU HD2 H 0.80 0.03 1
772 . 72 LEU C C 174.6 0.30 1
773 . 73 ILE N N 118.3 0.30 1
774 . 73 ILE H H 7.98 0.03 1
775 . 73 ILE CA C 65.1 0.30 1
776 . 73 ILE HA H 3.40 0.03 1
777 . 73 ILE CB C 36.0 0.30 1
778 . 73 ILE HB H 1.89 0.03 1
779 . 73 ILE HG2 H 0.61 0.03 1
780 . 73 ILE CG2 C 15.4 0.30 1
781 . 73 ILE CG1 C 26.5 0.30 1
782 . 73 ILE HG12 H 1.04 0.03 2
783 . 73 ILE HG13 H 1.99 0.03 2
784 . 73 ILE HD1 H 0.69 0.03 1
785 . 73 ILE CD1 C 11.7 0.30 1
786 . 73 ILE C C 174.5 0.30 1
787 . 74 LYS N N 118.0 0.30 1
788 . 74 LYS H H 8.70 0.03 1
789 . 74 LYS CA C 57.7 0.30 1
790 . 74 LYS HA H 3.62 0.03 1
791 . 74 LYS CB C 29.9 0.30 1
792 . 74 LYS HB2 H 1.91 0.03 2
793 . 74 LYS HB3 H 2.15 0.03 2
794 . 74 LYS CG C 22.5 0.30 1
795 . 74 LYS HG2 H 1.28 0.03 2
796 . 74 LYS HG3 H 1.36 0.03 2
797 . 74 LYS CD C 27.6 0.30 1
798 . 74 LYS HD2 H 1.52 0.03 2
799 . 74 LYS HD3 H 1.58 0.03 2
800 . 74 LYS CE C 39.4 0.30 1
801 . 74 LYS HE2 H 2.94 0.03 2
802 . 74 LYS HE3 H 2.92 0.03 2
803 . 74 LYS C C 174.7 0.30 1
804 . 75 TYR N N 118.2 0.30 1
805 . 75 TYR H H 8.54 0.03 1
806 . 75 TYR CA C 58.8 0.30 1
807 . 75 TYR HA H 3.86 0.03 1
808 . 75 TYR CB C 37.7 0.30 1
809 . 75 TYR HB2 H 2.92 0.03 2
810 . 75 TYR HB3 H 3.02 0.03 2
811 . 75 TYR HD1 H 6.65 0.03 1
812 . 75 TYR HD2 H 6.65 0.03 1
813 . 75 TYR HE1 H 6.58 0.03 1
814 . 75 TYR HE2 H 6.58 0.03 1
815 . 75 TYR CD1 C 130.7 0.30 1
816 . 75 TYR CE1 C 115.5 0.30 1
817 . 75 TYR CE2 C 115.5 0.30 1
818 . 75 TYR CD2 C 130.7 0.30 1
819 . 75 TYR C C 175.4 0.30 1
820 . 76 ALA N N 116.5 0.30 1
821 . 76 ALA H H 8.73 0.03 1
822 . 76 ALA CA C 51.8 0.30 1
823 . 76 ALA HA H 4.36 0.03 1
824 . 76 ALA HB H 1.17 0.03 1
825 . 76 ALA CB C 17.4 0.30 1
826 . 76 ALA C C 180.6 0.30 1
827 . 77 VAL N N 118.0 0.30 1
828 . 77 VAL H H 8.93 0.03 1
829 . 77 VAL CA C 63.3 0.30 1
830 . 77 VAL HA H 4.19 0.03 1
831 . 77 VAL CB C 28.9 0.30 1
832 . 77 VAL HB H 2.37 0.03 1
833 . 77 VAL HG1 H 0.90 0.03 2
834 . 77 VAL HG2 H 0.85 0.03 2
835 . 77 VAL CG1 C 20.8 0.30 2
836 . 77 VAL CG2 C 18.1 0.30 2
837 . 77 VAL C C 173.6 0.30 1
838 . 78 GLY N N 107.6 0.30 1
839 . 78 GLY H H 7.92 0.03 1
840 . 78 GLY CA C 43.2 0.30 1
841 . 78 GLY HA2 H 3.69 0.03 2
842 . 78 GLY HA3 H 4.27 0.03 2
843 . 78 GLY C C 172.8 0.30 1
844 . 79 LYS N N 114.7 0.30 1
845 . 79 LYS H H 7.45 0.03 1
846 . 79 LYS CA C 53.9 0.30 1
847 . 79 LYS HA H 4.83 0.03 1
848 . 79 LYS CB C 32.6 0.30 1
849 . 79 LYS HB2 H 1.74 0.03 1
850 . 79 LYS HB3 H 1.74 0.03 1
851 . 79 LYS CG C 21.2 0.30 1
852 . 79 LYS HG2 H 1.07 0.03 2
853 . 79 LYS HG3 H 1.25 0.03 2
854 . 79 LYS CD C 26.9 0.30 1
855 . 79 LYS HD2 H 1.38 0.03 2
856 . 79 LYS HD3 H 1.52 0.03 2
857 . 79 LYS CE C 39.1 0.30 1
858 . 79 LYS HE2 H 2.60 0.03 2
859 . 79 LYS HE3 H 2.68 0.03 2
860 . 79 LYS C C 174.3 0.30 1
861 . 80 SER N N 116.7 0.30 1
862 . 80 SER H H 7.82 0.03 1
863 . 80 SER CA C 57.3 0.30 1
864 . 80 SER HA H 4.65 0.03 1
865 . 80 SER CB C 61.1 0.30 1
866 . 80 SER HB2 H 3.71 0.03 2
867 . 80 SER HB3 H 3.83 0.03 2
868 . 80 SER C C 171.7 0.30 1
869 . 81 GLY N N 107.0 0.30 1
870 . 81 GLY H H 8.18 0.03 1
871 . 81 GLY CA C 41.8 0.30 1
872 . 81 GLY HA2 H 3.82 0.03 1
873 . 81 GLY HA3 H 3.82 0.03 1
874 . 81 GLY C C 173.5 0.30 1
875 . 82 SER CA C 59.2 0.30 1
876 . 82 SER HA H 4.10 0.03 1
877 . 82 SER CB C 60.9 0.30 1
878 . 82 SER HB2 H 3.84 0.03 1
879 . 82 SER HB3 H 3.84 0.03 1
880 . 82 SER C C 174.4 0.30 1
881 . 83 GLU N N 122.9 0.30 1
882 . 83 GLU H H 8.62 0.03 1
883 . 83 GLU CA C 57.1 0.30 1
884 . 83 GLU HA H 4.16 0.03 1
885 . 83 GLU CB C 26.1 0.30 1
886 . 83 GLU HB2 H 1.93 0.03 2
887 . 83 GLU HB3 H 2.08 0.03 2
888 . 83 GLU CG C 33.3 0.30 1
889 . 83 GLU HG2 H 2.25 0.03 2
890 . 83 GLU HG3 H 2.36 0.03 2
891 . 83 GLU C C 176.9 0.30 1
892 . 84 PHE N N 121.3 0.30 1
893 . 84 PHE H H 9.30 0.03 1
894 . 84 PHE CA C 59.4 0.30 1
895 . 84 PHE HA H 3.84 0.03 1
896 . 84 PHE CB C 35.7 0.30 1
897 . 84 PHE HB2 H 2.75 0.03 2
898 . 84 PHE HB3 H 2.92 0.03 2
899 . 84 PHE HD1 H 7.20 0.03 1
900 . 84 PHE HD2 H 7.20 0.03 1
901 . 84 PHE HE1 H 6.90 0.03 1
902 . 84 PHE HE2 H 6.90 0.03 1
903 . 84 PHE CD1 C 129.9 0.30 1
904 . 84 PHE CE1 C 128.1 0.30 1
905 . 84 PHE CE2 C 128.1 0.30 1
906 . 84 PHE CD2 C 129.9 0.30 1
907 . 84 PHE C C 174.2 0.30 1
908 . 85 ARG N N 117.3 0.30 1
909 . 85 ARG H H 7.06 0.03 1
910 . 85 ARG CA C 58.1 0.30 1
911 . 85 ARG HA H 3.45 0.03 1
912 . 85 ARG CB C 27.2 0.30 1
913 . 85 ARG HB2 H 1.78 0.03 2
914 . 85 ARG HB3 H 1.90 0.03 2
915 . 85 ARG CG C 25.5 0.30 1
916 . 85 ARG HG2 H 1.28 0.03 2
917 . 85 ARG HG3 H 1.36 0.03 2
918 . 85 ARG CD C 41.1 0.30 1
919 . 85 ARG HD2 H 3.13 0.03 2
920 . 85 ARG HD3 H 3.22 0.03 2
921 . 85 ARG C C 175.4 0.30 1
922 . 86 ARG N N 118.2 0.30 1
923 . 86 ARG H H 8.06 0.03 1
924 . 86 ARG CA C 57.4 0.30 1
925 . 86 ARG HA H 3.81 0.03 1
926 . 86 ARG CB C 27.6 0.30 1
927 . 86 ARG HB2 H 1.85 0.03 2
928 . 86 ARG HB3 H 1.89 0.03 2
929 . 86 ARG CG C 25.2 0.30 1
930 . 86 ARG HG2 H 1.55 0.03 2
931 . 86 ARG HG3 H 1.70 0.03 2
932 . 86 ARG CD C 41.1 0.30 1
933 . 86 ARG HD2 H 3.12 0.03 1
934 . 86 ARG HD3 H 3.12 0.03 1
935 . 86 ARG C C 176.9 0.30 1
936 . 87 GLU N N 119.3 0.30 1
937 . 87 GLU H H 7.94 0.03 1
938 . 87 GLU CA C 56.4 0.30 1
939 . 87 GLU HA H 3.95 0.03 1
940 . 87 GLU CB C 26.9 0.30 1
941 . 87 GLU HB2 H 1.83 0.03 1
942 . 87 GLU HB3 H 1.83 0.03 1
943 . 87 GLU CG C 34.0 0.30 1
944 . 87 GLU HG2 H 2.05 0.03 2
945 . 87 GLU HG3 H 2.28 0.03 2
946 . 87 GLU C C 177.5 0.30 1
947 . 88 MET N N 118.4 0.30 1
948 . 88 MET H H 7.89 0.03 1
949 . 88 MET CA C 54.1 0.30 1
950 . 88 MET HA H 4.20 0.03 1
951 . 88 MET CB C 31.6 0.30 1
952 . 88 MET HB2 H 1.12 0.03 2
953 . 88 MET HB3 H 1.74 0.03 2
954 . 88 MET CG C 30.5 0.30 1
955 . 88 MET HG2 H 1.73 0.03 2
956 . 88 MET HG3 H 1.13 0.03 2
957 . 88 MET HE H 1.68 0.03 1
958 . 88 MET CE C 17.5 0.30 1
959 . 88 MET C C 175.9 0.30 1
960 . 89 GLN N N 117.7 0.30 1
961 . 89 GLN H H 8.11 0.03 1
962 . 89 GLN CA C 57.3 0.30 1
963 . 89 GLN HA H 3.38 0.03 1
964 . 89 GLN CB C 24.4 0.30 1
965 . 89 GLN HB2 H 1.81 0.03 2
966 . 89 GLN HB3 H 2.06 0.03 2
967 . 89 GLN CG C 32.3 0.30 1
968 . 89 GLN HG2 H 1.09 0.03 2
969 . 89 GLN HG3 H 2.25 0.03 2
970 . 89 GLN NE2 N 108.6 0.30 1
971 . 89 GLN HE21 H 6.69 0.03 2
972 . 89 GLN HE22 H 6.92 0.03 2
973 . 89 GLN C C 178.0 0.30 1
974 . 90 ARG N N 119.7 0.30 1
975 . 90 ARG H H 8.35 0.03 1
976 . 90 ARG CA C 56.8 0.30 1
977 . 90 ARG HA H 4.08 0.03 1
978 . 90 ARG CB C 28.1 0.30 1
979 . 90 ARG HB2 H 1.79 0.03 2
980 . 90 ARG HB3 H 1.86 0.03 2
981 . 90 ARG CG C 25.2 0.30 1
982 . 90 ARG HG2 H 1.57 0.03 2
983 . 90 ARG HG3 H 1.68 0.03 2
984 . 90 ARG CD C 41.1 0.30 1
985 . 90 ARG HD2 H 3.10 0.03 1
986 . 90 ARG HD3 H 3.10 0.03 1
987 . 90 ARG C C 175.6 0.30 1
988 . 91 ASN N N 115.4 0.30 1
989 . 91 ASN H H 7.23 0.03 1
990 . 91 ASN CA C 51.4 0.30 1
991 . 91 ASN HA H 4.92 0.03 1
992 . 91 ASN CB C 38.0 0.30 1
993 . 91 ASN HB2 H 2.34 0.03 2
994 . 91 ASN HB3 H 3.04 0.03 2
995 . 91 ASN ND2 N 116.1 0.30 1
996 . 91 ASN HD21 H 6.81 0.03 2
997 . 91 ASN HD22 H 7.56 0.03 2
998 . 91 ASN C C 172.5 0.30 1
999 . 92 SER N N 113.9 0.30 1
1000 . 92 SER H H 7.28 0.03 1
1001 . 92 SER CA C 60.7 0.30 1
1002 . 92 SER HA H 4.45 0.03 1
1003 . 92 SER CB C 60.5 0.30 1
1004 . 92 SER HB2 H 3.77 0.03 2
1005 . 92 SER HB3 H 3.93 0.03 2
1006 . 92 SER C C 174.1 0.30 1
1007 . 93 VAL N N 125.3 0.30 1
1008 . 93 VAL H H 8.41 0.03 1
1009 . 93 VAL CA C 63.6 0.30 1
1010 . 93 VAL HA H 3.61 0.03 1
1011 . 93 VAL CB C 28.6 0.30 1
1012 . 93 VAL HB H 2.02 0.03 1
1013 . 93 VAL HG1 H 0.93 0.03 2
1014 . 93 VAL HG2 H 0.85 0.03 2
1015 . 93 VAL CG1 C 20.0 0.30 2
1016 . 93 VAL CG2 C 17.8 0.30 2
1017 . 93 VAL C C 173.3 0.30 1
1018 . 94 ALA N N 121.2 0.30 1
1019 . 94 ALA H H 7.55 0.03 1
1020 . 94 ALA CA C 52.3 0.30 1
1021 . 94 ALA HA H 3.99 0.03 1
1022 . 94 ALA HB H 1.36 0.03 1
1023 . 94 ALA CB C 16.4 0.30 1
1024 . 94 ALA C C 177.1 0.30 1
1025 . 95 VAL N N 113.8 0.30 1
1026 . 95 VAL H H 6.91 0.03 1
1027 . 95 VAL CA C 62.9 0.30 1
1028 . 95 VAL HA H 3.50 0.03 1
1029 . 95 VAL CB C 29.6 0.30 1
1030 . 95 VAL HB H 2.05 0.03 1
1031 . 95 VAL HG1 H 0.68 0.03 2
1032 . 95 VAL HG2 H 0.90 0.03 2
1033 . 95 VAL CG1 C 18.8 0.30 2
1034 . 95 VAL CG2 C 21.5 0.30 2
1035 . 95 VAL C C 175.2 0.30 1
1036 . 96 ARG N N 119.1 0.30 1
1037 . 96 ARG H H 7.94 0.03 1
1038 . 96 ARG CA C 56.3 0.30 1
1039 . 96 ARG HA H 2.60 0.03 1
1040 . 96 ARG CB C 27.2 0.30 1
1041 . 96 ARG HB2 H 1.38 0.03 1
1042 . 96 ARG HB3 H 1.38 0.03 1
1043 . 96 ARG CG C 25.6 0.30 1
1044 . 96 ARG HG2 H 1.14 0.03 2
1045 . 96 ARG HG3 H 1.07 0.03 2
1046 . 96 ARG CD C 40.7 0.30 1
1047 . 96 ARG HD2 H 2.84 0.03 2
1048 . 96 ARG HD3 H 2.99 0.03 2
1049 . 96 ARG C C 177.2 0.30 1
1050 . 97 ASN N N 116.5 0.30 1
1051 . 97 ASN H H 8.37 0.03 1
1052 . 97 ASN CA C 52.6 0.30 1
1053 . 97 ASN HA H 4.37 0.03 1
1054 . 97 ASN CB C 35.3 0.30 1
1055 . 97 ASN HB2 H 2.65 0.03 2
1056 . 97 ASN HB3 H 2.73 0.03 2
1057 . 97 ASN ND2 N 110.5 0.30 1
1058 . 97 ASN HD21 H 6.74 0.03 2
1059 . 97 ASN HD22 H 7.54 0.03 2
1060 . 97 ASN C C 175.3 0.30 1
1061 . 98 LEU N N 118.3 0.30 1
1062 . 98 LEU H H 7.47 0.03 1
1063 . 98 LEU CA C 53.1 0.30 1
1064 . 98 LEU HA H 4.30 0.03 1
1065 . 98 LEU CB C 38.4 0.30 1
1066 . 98 LEU HB2 H 1.99 0.03 2
1067 . 98 LEU HB3 H 1.43 0.03 2
1068 . 98 LEU CG C 25.2 0.30 1
1069 . 98 LEU HG H 0.89 0.03 1
1070 . 98 LEU CD1 C 20.8 0.30 1
1071 . 98 LEU CD2 C 20.8 0.30 1
1072 . 98 LEU HD1 H 0.75 0.03 1
1073 . 98 LEU HD2 H 0.75 0.03 1
1074 . 98 LEU C C 175.0 0.30 1
1075 . 99 PHE N N 119.0 0.30 1
1076 . 99 PHE H H 7.81 0.03 1
1077 . 99 PHE CA C 55.8 0.30 1
1078 . 99 PHE HA H 4.17 0.03 1
1079 . 99 PHE CB C 35.0 0.30 1
1080 . 99 PHE HB2 H 2.74 0.03 2
1081 . 99 PHE HB3 H 2.88 0.03 2
1082 . 99 PHE HD1 H 6.86 0.03 1
1083 . 99 PHE HD2 H 6.86 0.03 1
1084 . 99 PHE HE1 H 6.99 0.03 1
1085 . 99 PHE HE2 H 6.99 0.03 1
1086 . 99 PHE CD1 C 127.2 0.30 1
1087 . 99 PHE CE1 C 128.2 0.30 1
1088 . 99 PHE CZ C 126.1 0.30 1
1089 . 99 PHE HZ H 7.01 0.03 1
1090 . 99 PHE CE2 C 128.2 0.30 1
1091 . 99 PHE CD2 C 127.2 0.30 1
1092 . 99 PHE C C 174.5 0.30 1
1093 . 100 HIS N N 111.7 0.30 1
1094 . 100 HIS H H 7.12 0.03 1
1095 . 100 HIS CA C 51.6 0.30 1
1096 . 100 HIS HA H 4.80 0.03 1
1097 . 100 HIS CB C 27.9 0.30 1
1098 . 100 HIS HB2 H 2.88 0.03 2
1099 . 100 HIS HB3 H 3.29 0.03 2
1100 . 100 HIS CD2 C 118.1 0.30 1
1101 . 100 HIS HD2 H 7.00 0.03 1
1102 . 100 HIS C C 173.0 0.30 1
1103 . 101 TYR N N 121.3 0.30 1
1104 . 101 TYR H H 7.03 0.03 1
1105 . 101 TYR CA C 57.6 0.30 1
1106 . 101 TYR HA H 4.17 0.03 1
1107 . 101 TYR CB C 37.4 0.30 1
1108 . 101 TYR HB2 H 2.68 0.03 2
1109 . 101 TYR HB3 H 3.12 0.03 2
1110 . 101 TYR HD1 H 7.07 0.03 1
1111 . 101 TYR HD2 H 7.07 0.03 1
1112 . 101 TYR HE1 H 7.01 0.03 1
1113 . 101 TYR HE2 H 7.01 0.03 1
1114 . 101 TYR CD1 C 130.9 0.30 1
1115 . 101 TYR CE1 C 115.7 0.30 1
1116 . 101 TYR CE2 C 115.7 0.30 1
1117 . 101 TYR CD2 C 130.9 0.30 1
1118 . 101 TYR C C 171.5 0.30 1
1119 . 102 LYS N N 129.0 0.30 1
1120 . 102 LYS H H 7.90 0.03 1
1121 . 102 LYS CA C 53.7 0.30 1
1122 . 102 LYS HA H 3.99 0.03 1
1123 . 102 LYS CB C 31.6 0.30 1
1124 . 102 LYS HB2 H 1.56 0.03 1
1125 . 102 LYS HB3 H 1.56 0.03 1
1126 . 102 LYS CG C 22.2 0.30 1
1127 . 102 LYS HG2 H 1.27 0.03 2
1128 . 102 LYS HG3 H 1.36 0.03 2
1129 . 102 LYS CD C 26.6 0.30 1
1130 . 102 LYS HD2 H 1.57 0.03 1
1131 . 102 LYS HD3 H 1.57 0.03 1
1132 . 102 LYS CE C 39.7 0.30 1
1133 . 102 LYS HE2 H 2.92 0.03 2
1134 . 102 LYS HE3 H 2.95 0.03 2
1135 . 102 LYS C C 174.5 0.30 1
1136 . 103 GLY N N 104.7 0.30 1
1137 . 103 GLY H H 6.88 0.03 1
1138 . 103 GLY CA C 43.1 0.30 1
1139 . 103 GLY HA2 H 3.27 0.03 2
1140 . 103 GLY HA3 H 3.50 0.03 2
1141 . 103 GLY C C 170.1 0.30 1
1142 . 104 HIS N N 120.2 0.30 1
1143 . 104 HIS H H 8.29 0.03 1
1144 . 104 HIS CA C 51.4 0.30 1
1145 . 104 HIS HA H 4.97 0.03 1
1146 . 104 HIS CB C 29.6 0.30 1
1147 . 104 HIS HB2 H 2.86 0.03 2
1148 . 104 HIS HB3 H 3.06 0.03 2
1149 . 104 HIS CD2 C 119.1 0.30 1
1150 . 104 HIS HD2 H 6.96 0.03 1
1151 . 104 HIS C C 171.4 0.30 1
1152 . 105 PRO CD C 48.2 0.30 1
1153 . 105 PRO CA C 60.8 0.30 1
1154 . 105 PRO HA H 4.37 0.03 1
1155 . 105 PRO CB C 29.3 0.30 1
1156 . 105 PRO HB2 H 1.73 0.03 2
1157 . 105 PRO HB3 H 2.15 0.03 2
1158 . 105 PRO CG C 25.2 0.30 1
1159 . 105 PRO HG2 H 1.91 0.03 2
1160 . 105 PRO HG3 H 2.00 0.03 2
1161 . 105 PRO HD2 H 3.51 0.03 2
1162 . 105 PRO HD3 H 3.75 0.03 2
1163 . 105 PRO C C 174.1 0.30 1
1164 . 106 ASP N N 125.3 0.30 1
1165 . 106 ASP H H 8.95 0.03 1
1166 . 106 ASP CA C 49.2 0.30 1
1167 . 106 ASP HA H 5.21 0.03 1
1168 . 106 ASP CB C 42.7 0.30 1
1169 . 106 ASP HB2 H 2.62 0.03 2
1170 . 106 ASP HB3 H 2.87 0.03 2
1171 . 106 ASP C C 173.8 0.30 1
1172 . 107 PRO CD C 49.1 0.30 1
1173 . 107 PRO CA C 63.0 0.30 1
1174 . 107 PRO HA H 4.27 0.03 1
1175 . 107 PRO CB C 29.9 0.30 1
1176 . 107 PRO HB2 H 1.92 0.03 2
1177 . 107 PRO HB3 H 2.37 0.03 2
1178 . 107 PRO CG C 25.2 0.30 1
1179 . 107 PRO HG2 H 2.04 0.03 1
1180 . 107 PRO HG3 H 2.04 0.03 1
1181 . 107 PRO HD2 H 3.79 0.03 2
1182 . 107 PRO HD3 H 3.87 0.03 2
1183 . 107 PRO C C 174.1 0.30 1
1184 . 108 LEU N N 115.4 0.30 1
1185 . 108 LEU H H 7.90 0.03 1
1186 . 108 LEU CA C 53.5 0.30 1
1187 . 108 LEU HA H 4.61 0.03 1
1188 . 108 LEU CB C 41.3 0.30 1
1189 . 108 LEU HB2 H 1.55 0.03 2
1190 . 108 LEU HB3 H 1.75 0.03 2
1191 . 108 LEU CG C 25.6 0.30 1
1192 . 108 LEU HG H 1.55 0.03 1
1193 . 108 LEU CD1 C 21.5 0.30 1
1194 . 108 LEU CD2 C 21.5 0.30 1
1195 . 108 LEU HD1 H 0.85 0.03 1
1196 . 108 LEU HD2 H 0.85 0.03 1
1197 . 108 LEU C C 176.9 0.30 1
1198 . 109 LYS N N 117.2 0.30 1
1199 . 109 LYS H H 9.48 0.03 1
1200 . 109 LYS CA C 53.4 0.30 1
1201 . 109 LYS HA H 4.41 0.03 1
1202 . 109 LYS CB C 31.0 0.30 1
1203 . 109 LYS HB2 H 1.48 0.03 2
1204 . 109 LYS HB3 H 2.03 0.03 2
1205 . 109 LYS CG C 23.2 0.30 1
1206 . 109 LYS HG2 H 1.31 0.03 2
1207 . 109 LYS HG3 H 1.38 0.03 2
1208 . 109 LYS CD C 27.2 0.30 1
1209 . 109 LYS HD2 H 1.49 0.03 2
1210 . 109 LYS HD3 H 1.57 0.03 2
1211 . 109 LYS CE C 39.7 0.30 1
1212 . 109 LYS HE2 H 2.90 0.03 1
1213 . 109 LYS HE3 H 2.90 0.03 1
1214 . 109 LYS C C 175.5 0.30 1
1215 . 110 GLY N N 112.5 0.30 1
1216 . 110 GLY H H 8.38 0.03 1
1217 . 110 GLY CA C 45.3 0.30 1
1218 . 110 GLY HA2 H 3.89 0.03 2
1219 . 110 GLY HA3 H 3.97 0.03 2
1220 . 110 GLY C C 173.5 0.30 1
1221 . 111 ASP CA C 51.9 0.30 1
1222 . 111 ASP HA H 5.12 0.03 1
1223 . 111 ASP CB C 41.1 0.30 1
1224 . 111 ASP HB2 H 2.48 0.03 2
1225 . 111 ASP HB3 H 2.56 0.03 2
1226 . 111 ASP C C 175.6 0.30 1
1227 . 112 ALA N N 120.5 0.30 1
1228 . 112 ALA H H 7.90 0.03 1
1229 . 112 ALA CA C 54.3 0.30 1
1230 . 112 ALA HA H 3.99 0.03 1
1231 . 112 ALA HB H 1.52 0.03 1
1232 . 112 ALA CB C 17.6 0.30 1
1233 . 112 ALA C C 178.4 0.30 1
1234 . 113 LEU N N 116.3 0.30 1
1235 . 113 LEU H H 8.91 0.03 1
1236 . 113 LEU CA C 54.8 0.30 1
1237 . 113 LEU HA H 4.08 0.03 1
1238 . 113 LEU CB C 37.7 0.30 1
1239 . 113 LEU HB2 H 1.33 0.03 2
1240 . 113 LEU HB3 H 1.82 0.03 2
1241 . 113 LEU CG C 24.9 0.30 1
1242 . 113 LEU HG H 1.55 0.03 1
1243 . 113 LEU HD1 H 0.90 0.03 2
1244 . 113 LEU HD2 H 0.76 0.03 2
1245 . 113 LEU CD1 C 22.9 0.30 2
1246 . 113 LEU CD2 C 20.1 0.30 2
1247 . 113 LEU C C 177.7 0.30 1
1248 . 114 ASN N N 120.2 0.30 1
1249 . 114 ASN H H 7.37 0.03 1
1250 . 114 ASN CA C 54.0 0.30 1
1251 . 114 ASN HA H 4.49 0.03 1
1252 . 114 ASN CB C 35.7 0.30 1
1253 . 114 ASN HB2 H 2.47 0.03 2
1254 . 114 ASN HB3 H 2.91 0.03 2
1255 . 114 ASN ND2 N 114.2 0.30 1
1256 . 114 ASN HD21 H 6.69 0.03 2
1257 . 114 ASN HD22 H 7.65 0.03 2
1258 . 114 ASN C C 175.4 0.30 1
1259 . 115 LYS N N 120.8 0.30 1
1260 . 115 LYS H H 8.33 0.03 1
1261 . 115 LYS CA C 57.6 0.30 1
1262 . 115 LYS HA H 3.79 0.03 1
1263 . 115 LYS CB C 30.6 0.30 1
1264 . 115 LYS HB2 H 1.77 0.03 2
1265 . 115 LYS HB3 H 1.81 0.03 2
1266 . 115 LYS CG C 22.5 0.30 1
1267 . 115 LYS HG2 H 1.29 0.03 2
1268 . 115 LYS HG3 H 1.46 0.03 2
1269 . 115 LYS CD C 27.6 0.30 1
1270 . 115 LYS HD2 H 1.70 0.03 1
1271 . 115 LYS HD3 H 1.70 0.03 1
1272 . 115 LYS CE C 39.7 0.30 1
1273 . 115 LYS HE2 H 2.95 0.03 1
1274 . 115 LYS HE3 H 2.95 0.03 1
1275 . 115 LYS C C 175.4 0.30 1
1276 . 116 ALA N N 117.8 0.30 1
1277 . 116 ALA H H 7.48 0.03 1
1278 . 116 ALA CA C 52.6 0.30 1
1279 . 116 ALA HA H 4.33 0.03 1
1280 . 116 ALA HB H 1.45 0.03 1
1281 . 116 ALA CB C 15.7 0.30 1
1282 . 116 ALA C C 179.3 0.30 1
1283 . 117 VAL N N 120.2 0.30 1
1284 . 117 VAL H H 7.40 0.03 1
1285 . 117 VAL CA C 66.0 0.30 1
1286 . 117 VAL HA H 3.19 0.03 1
1287 . 117 VAL CB C 29.3 0.30 1
1288 . 117 VAL HB H 2.49 0.03 1
1289 . 117 VAL HG1 H 0.55 0.03 2
1290 . 117 VAL HG2 H 1.00 0.03 2
1291 . 117 VAL CG1 C 20.0 0.30 2
1292 . 117 VAL CG2 C 22.9 0.30 2
1293 . 117 VAL C C 174.0 0.30 1
1294 . 118 ARG N N 117.5 0.30 1
1295 . 118 ARG H H 7.49 0.03 1
1296 . 118 ARG CA C 58.3 0.30 1
1297 . 118 ARG HA H 4.20 0.03 1
1298 . 118 ARG CB C 29.6 0.30 1
1299 . 118 ARG HB2 H 1.85 0.03 2
1300 . 118 ARG HB3 H 2.22 0.03 2
1301 . 118 ARG CG C 27.2 0.30 1
1302 . 118 ARG HG2 H 2.00 0.03 2
1303 . 118 ARG HG3 H 2.05 0.03 2
1304 . 118 ARG CD C 42.3 0.30 1
1305 . 118 ARG HD2 H 3.15 0.03 2
1306 . 118 ARG HD3 H 3.64 0.03 2
1307 . 118 ARG C C 177.5 0.30 1
1308 . 119 GLU N N 116.4 0.30 1
1309 . 119 GLU H H 8.84 0.03 1
1310 . 119 GLU CA C 57.3 0.30 1
1311 . 119 GLU HA H 3.99 0.03 1
1312 . 119 GLU CB C 27.2 0.30 1
1313 . 119 GLU HB2 H 2.00 0.03 1
1314 . 119 GLU HB3 H 2.00 0.03 1
1315 . 119 GLU CG C 34.7 0.30 1
1316 . 119 GLU HG2 H 2.21 0.03 2
1317 . 119 GLU HG3 H 2.47 0.03 2
1318 . 119 GLU C C 178.3 0.30 1
1319 . 120 THR N N 115.1 0.30 1
1320 . 120 THR H H 8.26 0.03 1
1321 . 120 THR CA C 64.2 0.30 1
1322 . 120 THR HA H 4.08 0.03 1
1323 . 120 THR CB C 65.1 0.30 1
1324 . 120 THR HB H 4.23 0.03 1
1325 . 120 THR HG2 H 1.25 0.03 1
1326 . 120 THR HG1 H 5.92 0.03 1
1327 . 120 THR CG2 C 19.6 0.30 1
1328 . 120 THR C C 175.4 0.30 1
1329 . 121 ALA N N 128.8 0.30 1
1330 . 121 ALA H H 8.99 0.03 1
1331 . 121 ALA CA C 55.0 0.30 1
1332 . 121 ALA HA H 3.92 0.03 1
1333 . 121 ALA HB H 1.60 0.03 1
1334 . 121 ALA CB C 15.3 0.30 1
1335 . 121 ALA C C 177.1 0.30 1
1336 . 122 HIS N N 116.8 0.30 1
1337 . 122 HIS H H 7.53 0.03 1
1338 . 122 HIS CA C 58.3 0.30 1
1339 . 122 HIS HA H 4.02 0.03 1
1340 . 122 HIS CB C 27.2 0.30 1
1341 . 122 HIS HB2 H 2.96 0.03 2
1342 . 122 HIS HB3 H 3.05 0.03 2
1343 . 122 HIS CD2 C 119.0 0.30 1
1344 . 122 HIS HD2 H 6.61 0.03 1
1345 . 122 HIS C C 176.4 0.30 1
1346 . 123 GLU N N 117.9 0.30 1
1347 . 123 GLU H H 7.49 0.03 1
1348 . 123 GLU CA C 56.6 0.30 1
1349 . 123 GLU HA H 4.12 0.03 1
1350 . 123 GLU CB C 27.9 0.30 1
1351 . 123 GLU HB2 H 1.98 0.03 2
1352 . 123 GLU HB3 H 2.26 0.03 2
1353 . 123 GLU CG C 33.7 0.30 1
1354 . 123 GLU HG2 H 2.27 0.03 2
1355 . 123 GLU HG3 H 2.54 0.03 2
1356 . 123 GLU C C 177.4 0.30 1
1357 . 124 THR N N 118.6 0.30 1
1358 . 124 THR H H 8.68 0.03 1
1359 . 124 THR CA C 66.1 0.30 1
1360 . 124 THR HA H 3.68 0.03 1
1361 . 124 THR CB C 64.9 0.30 1
1362 . 124 THR HB H 4.24 0.03 1
1363 . 124 THR HG2 H 1.14 0.03 1
1364 . 124 THR CG2 C 20.1 0.30 1
1365 . 124 THR C C 174.0 0.30 1
1366 . 125 ILE N N 122.7 0.30 1
1367 . 125 ILE H H 8.12 0.03 1
1368 . 125 ILE CA C 60.0 0.30 1
1369 . 125 ILE HA H 4.00 0.03 1
1370 . 125 ILE CB C 33.7 0.30 1
1371 . 125 ILE HB H 2.31 0.03 1
1372 . 125 ILE HG2 H 1.18 0.03 1
1373 . 125 ILE CG2 C 15.8 0.30 1
1374 . 125 ILE CG1 C 25.9 0.30 1
1375 . 125 ILE HG12 H 1.56 0.03 2
1376 . 125 ILE HG13 H 1.75 0.03 2
1377 . 125 ILE HD1 H 0.91 0.03 1
1378 . 125 ILE CD1 C 9.1 0.30 1
1379 . 125 ILE C C 175.0 0.30 1
1380 . 126 SER N N 114.1 0.30 1
1381 . 126 SER H H 7.39 0.03 1
1382 . 126 SER CA C 59.3 0.30 1
1383 . 126 SER HA H 4.25 0.03 1
1384 . 126 SER CB C 60.2 0.30 1
1385 . 126 SER HB2 H 3.92 0.03 1
1386 . 126 SER HB3 H 3.92 0.03 1
1387 . 126 SER C C 173.9 0.30 1
1388 . 127 ALA N N 121.5 0.30 1
1389 . 127 ALA H H 7.45 0.03 1
1390 . 127 ALA CA C 52.6 0.30 1
1391 . 127 ALA HA H 4.18 0.03 1
1392 . 127 ALA HB H 1.50 0.03 1
1393 . 127 ALA CB C 16.9 0.30 1
1394 . 127 ALA C C 177.7 0.30 1
1395 . 128 ILE N N 117.9 0.30 1
1396 . 128 ILE H H 8.35 0.03 1
1397 . 128 ILE CA C 63.3 0.30 1
1398 . 128 ILE HA H 3.28 0.03 1
1399 . 128 ILE CB C 36.4 0.30 1
1400 . 128 ILE HB H 1.66 0.03 1
1401 . 128 ILE HG2 H -0.08 0.03 1
1402 . 128 ILE CG2 C 16.3 0.30 1
1403 . 128 ILE CG1 C 26.9 0.30 1
1404 . 128 ILE HG12 H 0.41 0.03 2
1405 . 128 ILE HG13 H 1.84 0.03 2
1406 . 128 ILE HD1 H 0.58 0.03 1
1407 . 128 ILE CD1 C 12.2 0.30 1
1408 . 128 ILE C C 174.0 0.30 1
1409 . 129 PHE N N 114.3 0.30 1
1410 . 129 PHE H H 7.36 0.03 1
1411 . 129 PHE CA C 56.3 0.30 1
1412 . 129 PHE HA H 4.54 0.03 1
1413 . 129 PHE CB C 36.2 0.30 1
1414 . 129 PHE HB2 H 2.66 0.03 2
1415 . 129 PHE HB3 H 3.44 0.03 2
1416 . 129 PHE HD1 H 7.43 0.03 1
1417 . 129 PHE HD2 H 7.43 0.03 1
1418 . 129 PHE HE1 H 7.18 0.03 1
1419 . 129 PHE HE2 H 7.18 0.03 1
1420 . 129 PHE CD1 C 130.2 0.30 1
1421 . 129 PHE CE1 C 128.6 0.30 1
1422 . 129 PHE CZ C 126.9 0.30 1
1423 . 129 PHE HZ H 7.32 0.03 1
1424 . 129 PHE CE2 C 128.6 0.30 1
1425 . 129 PHE CD2 C 130.2 0.30 1
1426 . 129 PHE C C 172.7 0.30 1
1427 . 130 SER N N 115.5 0.30 1
1428 . 130 SER H H 7.17 0.03 1
1429 . 130 SER CA C 57.0 0.30 1
1430 . 130 SER HA H 4.37 0.03 1
1431 . 130 SER CB C 61.4 0.30 1
1432 . 130 SER HB2 H 3.94 0.03 2
1433 . 130 SER HB3 H 4.00 0.03 2
1434 . 130 SER C C 172.5 0.30 1
1435 . 131 GLU N N 122.6 0.30 1
1436 . 131 GLU H H 8.55 0.03 1
1437 . 131 GLU CA C 54.1 0.30 1
1438 . 131 GLU HA H 4.31 0.03 1
1439 . 131 GLU CB C 27.9 0.30 1
1440 . 131 GLU HB2 H 1.83 0.03 2
1441 . 131 GLU HB3 H 2.05 0.03 2
1442 . 131 GLU CG C 34.0 0.30 1
1443 . 131 GLU HG2 H 2.17 0.03 2
1444 . 131 GLU HG3 H 2.23 0.03 2
1445 . 131 GLU C C 174.3 0.30 1
1446 . 132 GLU N N 121.5 0.30 1
1447 . 132 GLU H H 8.40 0.03 1
1448 . 132 GLU CA C 54.6 0.30 1
1449 . 132 GLU HA H 4.23 0.03 1
1450 . 132 GLU CB C 27.6 0.30 1
1451 . 132 GLU HB2 H 2.00 0.03 2
1452 . 132 GLU HB3 H 2.10 0.03 2
1453 . 132 GLU CG C 34.0 0.30 1
1454 . 132 GLU HG2 H 2.20 0.03 1
1455 . 132 GLU HG3 H 2.20 0.03 1
1456 . 132 GLU C C 174.1 0.30 1
1457 . 133 ASN N N 119.2 0.30 1
1458 . 133 ASN H H 8.47 0.03 1
1459 . 133 ASN CA C 51.1 0.30 1
1460 . 133 ASN HA H 4.69 0.03 1
1461 . 133 ASN CB C 36.7 0.30 1
1462 . 133 ASN HB2 H 2.79 0.03 2
1463 . 133 ASN HB3 H 2.73 0.03 2
1464 . 133 ASN C C 173.6 0.30 1
1465 . 134 GLY N N 109.1 0.30 1
1466 . 134 GLY H H 8.32 0.03 1
1467 . 134 GLY CA C 43.1 0.30 1
1468 . 134 GLY HA2 H 3.89 0.03 2
1469 . 134 GLY HA3 H 3.94 0.03 2
1470 . 134 GLY C C 172.0 0.30 1
1471 . 135 SER N N 115.4 0.30 1
1472 . 135 SER H H 8.21 0.03 1
1473 . 135 SER CA C 56.0 0.30 1
1474 . 135 SER HA H 4.43 0.03 1
1475 . 135 SER CB C 61.9 0.30 1
1476 . 135 SER HB2 H 3.84 0.03 1
1477 . 135 SER HB3 H 3.84 0.03 1
1478 . 136 GLY N N 110.4 0.30 1
1479 . 136 GLY H H 8.24 0.03 1
1480 . 136 GLY CA C 42.3 0.30 1
1481 . 136 GLY HA2 H 4.06 0.03 2
1482 . 136 GLY HA3 H 4.01 0.03 2
1483 . 137 PRO CD C 47.5 0.30 1
1484 . 137 PRO CA C 60.9 0.30 1
1485 . 137 PRO HA H 4.41 0.03 1
1486 . 137 PRO CB C 29.7 0.30 1
1487 . 137 PRO HB2 H 2.23 0.03 1
1488 . 137 PRO HB3 H 2.23 0.03 1
1489 . 137 PRO CG C 24.8 0.30 1
1490 . 137 PRO HG2 H 1.93 0.03 1
1491 . 137 PRO HG3 H 1.93 0.03 1
1492 . 137 PRO HD2 H 3.56 0.03 1
1493 . 137 PRO HD3 H 3.56 0.03 1
1494 . 140 GLY N N 116.4 0.30 1
1495 . 140 GLY H H 7.96 0.03 1
1496 . 140 GLY CA C 43.9 0.30 1
1497 . 140 GLY HA2 H 3.70 0.03 1
1498 . 140 GLY HA3 H 3.70 0.03 1
stop_
save_