data_11083
#######################
# Entry information #
#######################
save_entry_information
_Saveframe_category entry_information
_Entry_title
;
Solution structure of the Leucine Rich Repeat of human Acidic leucine-rich
nuclear phosphoprotein 32 family member B
;
_BMRB_accession_number 11083
_BMRB_flat_file_name bmr11083.str
_Entry_type original
_Submission_date 2009-12-16
_Accession_date 2009-12-16
_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 Tochio N. . .
2 Koshiba S. . .
3 Watanabe S. . .
4 Harada T. . .
5 Umehara T. . .
6 Tanaka A. . .
7 Kigawa T. . .
8 Yokoyama S. . .
stop_
loop_
_Saveframe_category_type
_Saveframe_category_type_count
assigned_chemical_shifts 1
stop_
loop_
_Data_type
_Data_type_count
"1H chemical shifts" 983
"13C chemical shifts" 739
"15N chemical shifts" 173
stop_
loop_
_Revision_date
_Revision_keyword
_Revision_author
_Revision_detail
2010-05-27 original author .
stop_
_Original_release_date 2010-05-27
save_
#############################
# Citation for this entry #
#############################
save_citation_1
_Saveframe_category entry_citation
_Citation_full .
_Citation_title
;
Solution structure of the Leucine Rich Repeat of human Acidic leucine-rich
nuclear phosphoprotein 32 family member B
;
_Citation_status 'in preparation'
_Citation_type journal
_CAS_abstract_code .
_MEDLINE_UI_code .
_PubMed_ID ?
loop_
_Author_ordinal
_Author_family_name
_Author_given_name
_Author_middle_initials
_Author_family_title
1 Tochio N. . .
2 Koshiba S. . .
3 Watanabe S. . .
4 Harada T. . .
5 Umehara T. . .
6 Tanaka A. . .
7 Kigawa T. . .
8 Yokoyama S. . .
stop_
_Journal_abbreviation .
_Journal_volume .
_Journal_issue .
_Journal_CSD .
_Book_chapter_title .
_Book_volume .
_Book_series .
_Book_ISBN .
_Conference_state_province .
_Conference_abstract_number .
_Page_first .
_Page_last .
_Year .
_Details .
save_
##################################
# Molecular system description #
##################################
save_assembly
_Saveframe_category molecular_system
_Mol_system_name 'Acidic leucine-rich nuclear phosphoprotein 32 family member B'
_Enzyme_commission_number .
loop_
_Mol_system_component_name
_Mol_label
'LRR_1 domain' $LRR_1_domain
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_LRR_1_domain
_Saveframe_category monomeric_polymer
_Mol_type polymer
_Mol_polymer_class protein
_Name_common 'LRR_1 domain'
_Molecular_mass .
_Mol_thiol_state 'all free'
_Details .
##############################
# Polymer residue sequence #
##############################
_Residue_count 168
_Mol_residue_sequence
;
GSSGSSGMDMKRRIHLELRN
RTPAAVRELVLDNCKSNDGK
IEGLTAEFVNLEFLSLINVG
LISVSNLPKLPKLKKLELSE
NRIFGGLDMLAEKLPNLTHL
NLSGNKLKDISTLEPLKKLE
CLKSLDLFNCEVTNLNDYRE
SVFKLLPQLTYLDGYDREDQ
EAPDSDAE
;
loop_
_Residue_seq_code
_Residue_label
1 GLY 2 SER 3 SER 4 GLY 5 SER
6 SER 7 GLY 8 MET 9 ASP 10 MET
11 LYS 12 ARG 13 ARG 14 ILE 15 HIS
16 LEU 17 GLU 18 LEU 19 ARG 20 ASN
21 ARG 22 THR 23 PRO 24 ALA 25 ALA
26 VAL 27 ARG 28 GLU 29 LEU 30 VAL
31 LEU 32 ASP 33 ASN 34 CYS 35 LYS
36 SER 37 ASN 38 ASP 39 GLY 40 LYS
41 ILE 42 GLU 43 GLY 44 LEU 45 THR
46 ALA 47 GLU 48 PHE 49 VAL 50 ASN
51 LEU 52 GLU 53 PHE 54 LEU 55 SER
56 LEU 57 ILE 58 ASN 59 VAL 60 GLY
61 LEU 62 ILE 63 SER 64 VAL 65 SER
66 ASN 67 LEU 68 PRO 69 LYS 70 LEU
71 PRO 72 LYS 73 LEU 74 LYS 75 LYS
76 LEU 77 GLU 78 LEU 79 SER 80 GLU
81 ASN 82 ARG 83 ILE 84 PHE 85 GLY
86 GLY 87 LEU 88 ASP 89 MET 90 LEU
91 ALA 92 GLU 93 LYS 94 LEU 95 PRO
96 ASN 97 LEU 98 THR 99 HIS 100 LEU
101 ASN 102 LEU 103 SER 104 GLY 105 ASN
106 LYS 107 LEU 108 LYS 109 ASP 110 ILE
111 SER 112 THR 113 LEU 114 GLU 115 PRO
116 LEU 117 LYS 118 LYS 119 LEU 120 GLU
121 CYS 122 LEU 123 LYS 124 SER 125 LEU
126 ASP 127 LEU 128 PHE 129 ASN 130 CYS
131 GLU 132 VAL 133 THR 134 ASN 135 LEU
136 ASN 137 ASP 138 TYR 139 ARG 140 GLU
141 SER 142 VAL 143 PHE 144 LYS 145 LEU
146 LEU 147 PRO 148 GLN 149 LEU 150 THR
151 TYR 152 LEU 153 ASP 154 GLY 155 TYR
156 ASP 157 ARG 158 GLU 159 ASP 160 GLN
161 GLU 162 ALA 163 PRO 164 ASP 165 SER
166 ASP 167 ALA 168 GLU
stop_
_Sequence_homology_query_date .
_Sequence_homology_query_revised_last_date 2015-10-07
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 2ELL "Solution Structure Of The Leucine Rich Repeat Of Human Acidic Leucine- Rich Nuclear Phosphoprotein 32 Family Member B" 100.00 168 100.00 100.00 6.06e-114
PDB 2RR6 "Solution Structure Of The Leucine Rich Repeat Of Human Acidic Leucine- Rich Nuclear Phosphoprotein 32 Family Member B" 100.00 168 100.00 100.00 6.06e-114
DBJ BAD97174 "acidic (leucine-rich) nuclear phosphoprotein 32 family, member B variant [Homo sapiens]" 95.83 250 100.00 100.00 1.31e-109
DBJ BAG36474 "unnamed protein product [Homo sapiens]" 95.83 251 100.00 100.00 1.21e-109
EMBL CAA68855 "PHAPI2a protein [Homo sapiens]" 95.83 251 100.00 100.00 1.21e-109
EMBL CAA68856 "PHAPI2b protein [Homo sapiens]" 95.83 195 100.00 100.00 1.82e-108
EMBL CAA69265 "APRIL [Homo sapiens]" 94.64 249 100.00 100.00 6.41e-108
EMBL CAH04953 "hypothetical protein [Ovis aries]" 95.83 261 97.52 98.76 4.60e-106
GB AAB37579 "silver-stainable protein SSP29 [Homo sapiens]" 95.83 251 100.00 100.00 1.21e-109
GB AAH13003 "Acidic (leucine-rich) nuclear phosphoprotein 32 family, member B [Homo sapiens]" 95.83 251 100.00 100.00 1.21e-109
GB AAH19658 "Acidic (leucine-rich) nuclear phosphoprotein 32 family, member B [Homo sapiens]" 95.83 251 100.00 100.00 1.21e-109
GB AAI02955 "Acidic (leucine-rich) nuclear phosphoprotein 32 family, member B [Bos taurus]" 95.83 261 98.14 99.38 6.61e-107
GB EAW58864 "acidic (leucine-rich) nuclear phosphoprotein 32 family, member B, isoform CRA_a [Homo sapiens]" 95.83 230 100.00 100.00 2.35e-109
REF NP_001030246 "acidic leucine-rich nuclear phosphoprotein 32 family member B [Bos taurus]" 95.83 261 98.14 99.38 6.61e-107
REF NP_001253837 "acidic leucine-rich nuclear phosphoprotein 32 family member B [Macaca mulatta]" 95.83 251 100.00 100.00 1.21e-109
REF NP_006392 "acidic leucine-rich nuclear phosphoprotein 32 family member B [Homo sapiens]" 95.83 251 100.00 100.00 1.21e-109
REF XP_001156957 "PREDICTED: acidic leucine-rich nuclear phosphoprotein 32 family member B isoform X2 [Pan troglodytes]" 95.83 251 100.00 100.00 1.28e-109
REF XP_002743164 "PREDICTED: acidic leucine-rich nuclear phosphoprotein 32 family member B isoform X2 [Callithrix jacchus]" 95.83 251 99.38 99.38 6.36e-109
SP Q3SZC6 "RecName: Full=Acidic leucine-rich nuclear phosphoprotein 32 family member B" 95.83 261 98.14 99.38 6.61e-107
SP Q6A1I3 "RecName: Full=Acidic leucine-rich nuclear phosphoprotein 32 family member B; AltName: Full=Acidic protein rich in leucines; Alt" 95.83 261 97.52 98.76 4.60e-106
SP Q92688 "RecName: Full=Acidic leucine-rich nuclear phosphoprotein 32 family member B; AltName: Full=Acidic protein rich in leucines; Alt" 95.83 251 100.00 100.00 1.21e-109
TPG DAA26785 "TPA: acidic (leucine-rich) nuclear phosphoprotein 32 family, member B-like [Bos taurus]" 85.71 234 97.22 98.61 6.23e-90
stop_
save_
####################
# Natural source #
####################
save_natural_source
_Saveframe_category natural_source
loop_
_Mol_label
_Organism_name_common
_NCBI_taxonomy_ID
_Superkingdom
_Kingdom
_Genus
_Species
$LRR_1_domain human 9606 Eukaryota Metazoa Homo sapiens
stop_
save_
#########################
# Experimental source #
#########################
save_experimental_source
_Saveframe_category experimental_source
loop_
_Mol_label
_Production_method
_Host_organism_name_common
_Genus
_Species
_Strain
_Vector_name
$LRR_1_domain 'E. coli - cell free' . Escherichia coli . P060227-01
stop_
save_
#####################################
# Sample contents and methodology #
#####################################
########################
# Sample description #
########################
save_sample_1
_Saveframe_category sample
_Sample_type solution
_Details
;
1.3mM sample [U-15N, 13C], 20mM d-Tris-HCl, 100mM NaCl, 1mM d-DTT,
0.02% NaN3, 90% H2O, 10% D2O
;
loop_
_Mol_label
_Concentration_value
_Concentration_value_units
_Isotopic_labeling
$LRR_1_domain 1.3 mM '[U-13C; U-15N]'
TRIS 20 mM [U-2H]
'sodium chloride' 100 mM 'natural abundance'
DTT 1 mM [U-2H]
'sodium azide' 0.02 % 'natural abundance'
H2O 90 % .
D2O 10 % .
stop_
save_
############################
# Computer software used #
############################
save_XWINNMR
_Saveframe_category software
_Name xwinnmr
_Version 3.5
loop_
_Vendor
_Address
_Electronic_address
Bruker . .
stop_
loop_
_Task
collection
stop_
_Details .
save_
save_NMRPipe
_Saveframe_category software
_Name NMRPipe
_Version 20030801
loop_
_Vendor
_Address
_Electronic_address
'Delaglio, F.' . .
stop_
loop_
_Task
processing
stop_
_Details .
save_
save_NMRVIEW
_Saveframe_category software
_Name NMRView
_Version 5.0.4
loop_
_Vendor
_Address
_Electronic_address
'Johnson, B.A.' . .
stop_
loop_
_Task
'data analysis'
stop_
_Details .
save_
save_Kujira
_Saveframe_category software
_Name Kujira
_Version 0.9820
loop_
_Vendor
_Address
_Electronic_address
'Kobayashi, N.' . .
stop_
loop_
_Task
'data analysis'
stop_
_Details .
save_
save_CYANA
_Saveframe_category software
_Name CYANA
_Version 2.0.17
loop_
_Vendor
_Address
_Electronic_address
'Guntert, P.' . .
stop_
loop_
_Task
refinement
stop_
_Details .
save_
#########################
# Experimental detail #
#########################
##################################
# NMR Spectrometer definitions #
##################################
save_spectrometer_1
_Saveframe_category NMR_spectrometer
_Manufacturer Bruker
_Model AVANCE
_Field_strength 900
_Details .
save_
#############################
# NMR applied experiments #
#############################
save_3D_15N-separated_NOESY_1
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D 15N-separated NOESY'
_Sample_label $sample_1
save_
save_3D_13C-separated_NOESY_2
_Saveframe_category NMR_applied_experiment
_Experiment_name '3D 13C-separated NOESY'
_Sample_label $sample_1
save_
#######################
# Sample conditions #
#######################
save_condition_1
_Saveframe_category sample_conditions
_Details .
loop_
_Variable_type
_Variable_value
_Variable_value_error
_Variable_value_units
'ionic strength' 120 0.1 mM
pH 7.0 0.05 pH
pressure 1 0.001 atm
temperature 296 0.1 K
stop_
save_
####################
# NMR parameters #
####################
##############################
# Assigned chemical shifts #
##############################
################################
# Chemical shift referencing #
################################
save_reference_1
_Saveframe_category chemical_shift_reference
_Details
;
Chemical shift reference of 1H was based on the proton of water (4.784ppm at
298K) 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 0.0 . indirect . . . 0.251449530
DSS H 1 'methyl protons' ppm 0.0 . indirect . . . 1.0
DSS N 15 'methyl protons' ppm 0.0 . 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_chemical_shift_1
_Saveframe_category assigned_chemical_shifts
_Details .
loop_
_Software_label
$XWINNMR
$NMRPipe
$NMRVIEW
$Kujira
$CYANA
stop_
loop_
_Experiment_label
'3D 15N-separated NOESY'
'3D 13C-separated NOESY'
stop_
loop_
_Sample_label
$sample_1
stop_
_Sample_conditions_label $condition_1
_Chem_shift_reference_set_label $reference_1
_Mol_system_component_name 'LRR_1 domain'
_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 6 6 SER HA H 4.421 0.030 1
2 6 6 SER HB2 H 3.902 0.030 2
3 6 6 SER C C 175.102 0.300 1
4 6 6 SER CA C 58.748 0.300 1
5 6 6 SER CB C 63.428 0.300 1
6 7 7 GLY H H 8.548 0.030 1
7 7 7 GLY HA2 H 4.004 0.030 2
8 7 7 GLY HA3 H 3.903 0.030 2
9 7 7 GLY C C 173.285 0.300 1
10 7 7 GLY CA C 45.434 0.300 1
11 7 7 GLY N N 110.920 0.300 1
12 8 8 MET H H 7.895 0.030 1
13 8 8 MET HA H 4.394 0.030 1
14 8 8 MET HB2 H 2.130 0.030 2
15 8 8 MET HB3 H 1.991 0.030 2
16 8 8 MET HE H 2.077 0.030 1
17 8 8 MET HG2 H 2.677 0.030 2
18 8 8 MET HG3 H 2.548 0.030 2
19 8 8 MET C C 175.409 0.300 1
20 8 8 MET CA C 55.630 0.300 1
21 8 8 MET CB C 34.880 0.300 1
22 8 8 MET CE C 16.913 0.300 1
23 8 8 MET CG C 31.881 0.300 1
24 8 8 MET N N 120.124 0.300 1
25 9 9 ASP H H 8.576 0.030 1
26 9 9 ASP HA H 4.798 0.030 1
27 9 9 ASP HB2 H 2.870 0.030 2
28 9 9 ASP HB3 H 2.780 0.030 2
29 9 9 ASP C C 176.915 0.300 1
30 9 9 ASP CA C 54.795 0.300 1
31 9 9 ASP CB C 41.872 0.300 1
32 9 9 ASP N N 124.003 0.300 1
33 10 10 MET H H 8.165 0.030 1
34 10 10 MET HA H 4.021 0.030 1
35 10 10 MET HB2 H 2.206 0.030 1
36 10 10 MET HB3 H 2.206 0.030 1
37 10 10 MET HE H 1.829 0.030 1
38 10 10 MET HG2 H 2.538 0.030 2
39 10 10 MET HG3 H 2.817 0.030 2
40 10 10 MET C C 177.011 0.300 1
41 10 10 MET CA C 60.525 0.300 1
42 10 10 MET CB C 32.860 0.300 1
43 10 10 MET CE C 16.376 0.300 1
44 10 10 MET CG C 31.589 0.300 1
45 10 10 MET N N 123.084 0.300 1
46 11 11 LYS H H 9.037 0.030 1
47 11 11 LYS HA H 3.891 0.030 1
48 11 11 LYS HB2 H 1.752 0.030 1
49 11 11 LYS HB3 H 1.752 0.030 1
50 11 11 LYS HD2 H 1.667 0.030 2
51 11 11 LYS HE2 H 2.964 0.030 2
52 11 11 LYS HG2 H 1.366 0.030 2
53 11 11 LYS C C 178.911 0.300 1
54 11 11 LYS CA C 60.939 0.300 1
55 11 11 LYS CB C 32.011 0.300 1
56 11 11 LYS CD C 29.534 0.300 1
57 11 11 LYS CE C 41.912 0.300 1
58 11 11 LYS CG C 25.426 0.300 1
59 11 11 LYS N N 118.041 0.300 1
60 12 12 ARG H H 7.549 0.030 1
61 12 12 ARG HA H 4.177 0.030 1
62 12 12 ARG HB2 H 1.969 0.030 1
63 12 12 ARG HB3 H 1.969 0.030 1
64 12 12 ARG HD2 H 3.314 0.030 2
65 12 12 ARG HD3 H 3.254 0.030 2
66 12 12 ARG HG2 H 1.764 0.030 2
67 12 12 ARG HG3 H 1.902 0.030 2
68 12 12 ARG C C 178.631 0.300 1
69 12 12 ARG CA C 58.787 0.300 1
70 12 12 ARG CB C 30.021 0.300 1
71 12 12 ARG CD C 43.415 0.300 1
72 12 12 ARG CG C 27.877 0.300 1
73 12 12 ARG N N 119.798 0.300 1
74 13 13 ARG H H 8.594 0.030 1
75 13 13 ARG HA H 4.234 0.030 1
76 13 13 ARG HB2 H 2.263 0.030 2
77 13 13 ARG HB3 H 1.643 0.030 2
78 13 13 ARG HD2 H 3.471 0.030 2
79 13 13 ARG HD3 H 3.292 0.030 2
80 13 13 ARG HE H 9.121 0.030 1
81 13 13 ARG HG2 H 1.591 0.030 2
82 13 13 ARG C C 178.135 0.300 1
83 13 13 ARG CA C 57.772 0.300 1
84 13 13 ARG CB C 29.034 0.300 1
85 13 13 ARG CD C 42.446 0.300 1
86 13 13 ARG N N 121.555 0.300 1
87 13 13 ARG NE N 86.180 0.300 1
88 14 14 ILE H H 8.710 0.030 1
89 14 14 ILE HA H 3.398 0.030 1
90 14 14 ILE HB H 1.888 0.030 1
91 14 14 ILE HD1 H 0.723 0.030 1
92 14 14 ILE HG12 H 1.918 0.030 2
93 14 14 ILE HG13 H 0.716 0.030 2
94 14 14 ILE HG2 H 0.968 0.030 1
95 14 14 ILE C C 176.762 0.300 1
96 14 14 ILE CA C 66.908 0.300 1
97 14 14 ILE CB C 38.317 0.300 1
98 14 14 ILE CD1 C 14.355 0.300 1
99 14 14 ILE CG1 C 32.461 0.300 1
100 14 14 ILE CG2 C 17.049 0.300 1
101 14 14 ILE N N 120.149 0.300 1
102 15 15 HIS H H 7.472 0.030 1
103 15 15 HIS HA H 4.221 0.030 1
104 15 15 HIS HB2 H 3.346 0.030 2
105 15 15 HIS HB3 H 3.244 0.030 2
106 15 15 HIS HD2 H 7.012 0.030 1
107 15 15 HIS C C 178.479 0.300 1
108 15 15 HIS CA C 60.714 0.300 1
109 15 15 HIS CB C 30.404 0.300 1
110 15 15 HIS CD2 C 119.473 0.300 1
111 15 15 HIS N N 117.746 0.300 1
112 16 16 LEU H H 8.186 0.030 1
113 16 16 LEU HA H 4.107 0.030 1
114 16 16 LEU HB2 H 1.908 0.030 2
115 16 16 LEU HB3 H 1.854 0.030 2
116 16 16 LEU HD1 H 0.907 0.030 1
117 16 16 LEU HD2 H 0.952 0.030 1
118 16 16 LEU HG H 1.711 0.030 1
119 16 16 LEU C C 180.789 0.300 1
120 16 16 LEU CA C 58.182 0.300 1
121 16 16 LEU CB C 42.341 0.300 1
122 16 16 LEU CD1 C 24.790 0.300 2
123 16 16 LEU CD2 C 25.165 0.300 2
124 16 16 LEU CG C 27.093 0.300 1
125 16 16 LEU N N 120.477 0.300 1
126 17 17 GLU H H 8.643 0.030 1
127 17 17 GLU HA H 4.064 0.030 1
128 17 17 GLU HB2 H 2.158 0.030 2
129 17 17 GLU HB3 H 1.911 0.030 2
130 17 17 GLU HG2 H 2.539 0.030 2
131 17 17 GLU HG3 H 2.387 0.030 2
132 17 17 GLU C C 179.401 0.300 1
133 17 17 GLU CA C 57.676 0.300 1
134 17 17 GLU CB C 29.597 0.300 1
135 17 17 GLU CG C 35.767 0.300 1
136 17 17 GLU N N 118.642 0.300 1
137 18 18 LEU H H 8.410 0.030 1
138 18 18 LEU HA H 3.895 0.030 1
139 18 18 LEU HB2 H 1.945 0.030 2
140 18 18 LEU HB3 H 1.691 0.030 2
141 18 18 LEU HD1 H 0.960 0.030 1
142 18 18 LEU HD2 H 0.866 0.030 1
143 18 18 LEU HG H 1.962 0.030 1
144 18 18 LEU C C 179.347 0.300 1
145 18 18 LEU CA C 57.941 0.300 1
146 18 18 LEU CB C 41.542 0.300 1
147 18 18 LEU CD1 C 25.408 0.300 2
148 18 18 LEU CD2 C 23.885 0.300 2
149 18 18 LEU CG C 27.468 0.300 1
150 18 18 LEU N N 118.794 0.300 1
151 19 19 ARG H H 7.548 0.030 1
152 19 19 ARG HA H 3.996 0.030 1
153 19 19 ARG HB2 H 1.917 0.030 2
154 19 19 ARG HB3 H 1.826 0.030 2
155 19 19 ARG HD2 H 3.252 0.030 2
156 19 19 ARG HD3 H 3.161 0.030 2
157 19 19 ARG HG2 H 1.836 0.030 2
158 19 19 ARG HG3 H 1.627 0.030 2
159 19 19 ARG C C 175.597 0.300 1
160 19 19 ARG CA C 57.610 0.300 1
161 19 19 ARG CB C 28.598 0.300 1
162 19 19 ARG CD C 43.788 0.300 1
163 19 19 ARG CG C 27.824 0.300 1
164 19 19 ARG N N 117.430 0.300 1
165 20 20 ASN H H 8.834 0.030 1
166 20 20 ASN HA H 4.308 0.030 1
167 20 20 ASN HB2 H 3.037 0.030 2
168 20 20 ASN HB3 H 2.954 0.030 2
169 20 20 ASN HD21 H 7.574 0.030 2
170 20 20 ASN HD22 H 6.911 0.030 2
171 20 20 ASN C C 174.736 0.300 1
172 20 20 ASN CA C 54.691 0.300 1
173 20 20 ASN CB C 37.866 0.300 1
174 20 20 ASN N N 111.547 0.300 1
175 20 20 ASN ND2 N 113.156 0.300 1
176 21 21 ARG H H 7.656 0.030 1
177 21 21 ARG HA H 4.458 0.030 1
178 21 21 ARG HB2 H 1.822 0.030 2
179 21 21 ARG HB3 H 1.782 0.030 2
180 21 21 ARG HD2 H 3.379 0.030 2
181 21 21 ARG HD3 H 2.994 0.030 2
182 21 21 ARG HE H 6.977 0.030 1
183 21 21 ARG HG2 H 1.801 0.030 2
184 21 21 ARG HG3 H 1.802 0.030 2
185 21 21 ARG C C 175.860 0.300 1
186 21 21 ARG CA C 55.538 0.300 1
187 21 21 ARG CB C 32.165 0.300 1
188 21 21 ARG CD C 44.391 0.300 1
189 21 21 ARG CG C 26.192 0.300 1
190 21 21 ARG N N 119.008 0.300 1
191 21 21 ARG NE N 83.855 0.300 1
192 22 22 THR H H 8.040 0.030 1
193 22 22 THR HA H 4.601 0.030 1
194 22 22 THR HB H 4.329 0.030 1
195 22 22 THR HG2 H 1.257 0.030 1
196 22 22 THR C C 174.287 0.300 1
197 22 22 THR CA C 59.292 0.300 1
198 22 22 THR CB C 68.991 0.300 1
199 22 22 THR CG2 C 21.921 0.300 1
200 22 22 THR N N 113.259 0.300 1
201 23 23 PRO HA H 3.469 0.030 1
202 23 23 PRO HB2 H 0.971 0.030 2
203 23 23 PRO HB3 H 0.121 0.030 2
204 23 23 PRO HD2 H 3.646 0.030 2
205 23 23 PRO HD3 H 3.768 0.030 2
206 23 23 PRO HG2 H 1.782 0.030 2
207 23 23 PRO HG3 H 1.417 0.030 2
208 23 23 PRO C C 178.271 0.300 1
209 23 23 PRO CA C 66.128 0.300 1
210 23 23 PRO CB C 30.944 0.300 1
211 23 23 PRO CD C 50.410 0.300 1
212 23 23 PRO CG C 27.597 0.300 1
213 24 24 ALA H H 8.045 0.030 1
214 24 24 ALA HA H 4.045 0.030 1
215 24 24 ALA HB H 1.387 0.030 1
216 24 24 ALA C C 177.034 0.300 1
217 24 24 ALA CA C 54.582 0.300 1
218 24 24 ALA CB C 18.700 0.300 1
219 24 24 ALA N N 116.464 0.300 1
220 25 25 ALA H H 7.889 0.030 1
221 25 25 ALA HA H 4.324 0.030 1
222 25 25 ALA HB H 1.515 0.030 1
223 25 25 ALA C C 177.963 0.300 1
224 25 25 ALA CA C 52.454 0.300 1
225 25 25 ALA CB C 19.741 0.300 1
226 25 25 ALA N N 117.877 0.300 1
227 26 26 VAL H H 7.240 0.030 1
228 26 26 VAL HA H 3.865 0.030 1
229 26 26 VAL HB H 2.326 0.030 1
230 26 26 VAL HG1 H 0.996 0.030 1
231 26 26 VAL HG2 H 1.000 0.030 1
232 26 26 VAL C C 174.823 0.300 1
233 26 26 VAL CA C 63.600 0.300 1
234 26 26 VAL CB C 32.707 0.300 1
235 26 26 VAL CG1 C 22.769 0.300 2
236 26 26 VAL CG2 C 21.711 0.300 2
237 26 26 VAL N N 118.109 0.300 1
238 27 27 ARG H H 8.809 0.030 1
239 27 27 ARG HA H 4.888 0.030 1
240 27 27 ARG HB2 H 2.027 0.030 2
241 27 27 ARG HB3 H 1.854 0.030 2
242 27 27 ARG HD2 H 3.230 0.030 1
243 27 27 ARG HD3 H 3.230 0.030 1
244 27 27 ARG HG2 H 1.757 0.030 2
245 27 27 ARG HG3 H 1.716 0.030 2
246 27 27 ARG C C 176.799 0.300 1
247 27 27 ARG CA C 57.083 0.300 1
248 27 27 ARG CB C 32.476 0.300 1
249 27 27 ARG CD C 43.485 0.300 1
250 27 27 ARG CG C 28.029 0.300 1
251 27 27 ARG N N 125.314 0.300 1
252 28 28 GLU H H 7.812 0.030 1
253 28 28 GLU HA H 5.500 0.030 1
254 28 28 GLU HB2 H 2.146 0.030 2
255 28 28 GLU HB3 H 2.092 0.030 2
256 28 28 GLU HG2 H 2.312 0.030 2
257 28 28 GLU HG3 H 2.230 0.030 2
258 28 28 GLU C C 173.729 0.300 1
259 28 28 GLU CA C 54.549 0.300 1
260 28 28 GLU CB C 33.382 0.300 1
261 28 28 GLU CG C 35.825 0.300 1
262 28 28 GLU N N 119.323 0.300 1
263 29 29 LEU H H 8.086 0.030 1
264 29 29 LEU HA H 4.637 0.030 1
265 29 29 LEU HB2 H 1.445 0.030 2
266 29 29 LEU HB3 H 1.203 0.030 2
267 29 29 LEU HD1 H 0.704 0.030 1
268 29 29 LEU HD2 H 0.580 0.030 1
269 29 29 LEU HG H 1.210 0.030 1
270 29 29 LEU C C 173.277 0.300 1
271 29 29 LEU CA C 54.238 0.300 1
272 29 29 LEU CB C 46.459 0.300 1
273 29 29 LEU CD1 C 24.473 0.300 2
274 29 29 LEU CD2 C 25.764 0.300 2
275 29 29 LEU CG C 26.971 0.300 1
276 29 29 LEU N N 122.592 0.300 1
277 30 30 VAL H H 9.226 0.030 1
278 30 30 VAL HA H 4.101 0.030 1
279 30 30 VAL HB H 2.060 0.030 1
280 30 30 VAL HG1 H 0.866 0.030 1
281 30 30 VAL HG2 H 0.839 0.030 1
282 30 30 VAL C C 174.732 0.300 1
283 30 30 VAL CA C 62.376 0.300 1
284 30 30 VAL CB C 32.202 0.300 1
285 30 30 VAL CG1 C 21.446 0.300 2
286 30 30 VAL CG2 C 20.201 0.300 2
287 30 30 VAL N N 128.318 0.300 1
288 31 31 LEU H H 8.808 0.030 1
289 31 31 LEU HA H 4.397 0.030 1
290 31 31 LEU HB2 H 1.739 0.030 1
291 31 31 LEU HB3 H 1.739 0.030 1
292 31 31 LEU HD1 H 0.679 0.030 1
293 31 31 LEU HD2 H 0.679 0.030 1
294 31 31 LEU HG H 1.334 0.030 1
295 31 31 LEU C C 175.048 0.300 1
296 31 31 LEU CA C 52.635 0.300 1
297 31 31 LEU CB C 41.641 0.300 1
298 31 31 LEU CD1 C 25.782 0.300 1
299 31 31 LEU CD2 C 25.782 0.300 1
300 31 31 LEU CG C 27.174 0.300 1
301 31 31 LEU N N 124.700 0.300 1
302 32 32 ASP H H 7.046 0.030 1
303 32 32 ASP HA H 4.559 0.030 1
304 32 32 ASP HB2 H 2.445 0.030 2
305 32 32 ASP HB3 H 2.374 0.030 2
306 32 32 ASP C C 177.119 0.300 1
307 32 32 ASP CA C 54.725 0.300 1
308 32 32 ASP CB C 41.274 0.300 1
309 32 32 ASP N N 117.374 0.300 1
310 33 33 ASN H H 8.732 0.030 1
311 33 33 ASN HA H 4.645 0.030 1
312 33 33 ASN HB2 H 3.321 0.030 2
313 33 33 ASN HB3 H 2.979 0.030 2
314 33 33 ASN HD21 H 7.504 0.030 2
315 33 33 ASN HD22 H 6.943 0.030 2
316 33 33 ASN C C 175.952 0.300 1
317 33 33 ASN CA C 55.376 0.300 1
318 33 33 ASN CB C 37.591 0.300 1
319 33 33 ASN N N 112.964 0.300 1
320 33 33 ASN ND2 N 115.143 0.300 1
321 34 34 CYS H H 7.685 0.030 1
322 34 34 CYS HA H 4.930 0.030 1
323 34 34 CYS HB2 H 3.305 0.030 2
324 34 34 CYS HB3 H 2.944 0.030 2
325 34 34 CYS C C 170.955 0.300 1
326 34 34 CYS CA C 58.437 0.300 1
327 34 34 CYS CB C 27.183 0.300 1
328 34 34 CYS N N 116.886 0.300 1
329 35 35 LYS H H 8.309 0.030 1
330 35 35 LYS HA H 4.595 0.030 1
331 35 35 LYS HB2 H 1.701 0.030 2
332 35 35 LYS HB3 H 1.540 0.030 2
333 35 35 LYS HD2 H 1.666 0.030 1
334 35 35 LYS HD3 H 1.666 0.030 1
335 35 35 LYS HE2 H 3.011 0.030 2
336 35 35 LYS HG2 H 1.417 0.030 1
337 35 35 LYS HG3 H 1.417 0.030 1
338 35 35 LYS C C 176.967 0.300 1
339 35 35 LYS CA C 55.248 0.300 1
340 35 35 LYS CB C 34.126 0.300 1
341 35 35 LYS CD C 29.260 0.300 1
342 35 35 LYS CE C 42.117 0.300 1
343 35 35 LYS CG C 24.525 0.300 1
344 35 35 LYS N N 117.375 0.300 1
345 36 36 SER H H 8.379 0.030 1
346 36 36 SER HA H 4.405 0.030 1
347 36 36 SER HB2 H 3.957 0.030 2
348 36 36 SER HB3 H 3.665 0.030 2
349 36 36 SER C C 173.553 0.300 1
350 36 36 SER CA C 58.653 0.300 1
351 36 36 SER CB C 63.707 0.300 1
352 36 36 SER N N 119.822 0.300 1
353 37 37 ASN H H 9.047 0.030 1
354 37 37 ASN HA H 4.817 0.030 1
355 37 37 ASN HB2 H 2.799 0.030 1
356 37 37 ASN HB3 H 2.799 0.030 1
357 37 37 ASN HD21 H 7.916 0.030 2
358 37 37 ASN HD22 H 6.901 0.030 2
359 37 37 ASN C C 175.391 0.300 1
360 37 37 ASN CA C 53.049 0.300 1
361 37 37 ASN CB C 38.103 0.300 1
362 37 37 ASN N N 120.296 0.300 1
363 37 37 ASN ND2 N 112.646 0.300 1
364 38 38 ASP H H 8.877 0.030 1
365 38 38 ASP HA H 4.376 0.030 1
366 38 38 ASP HB2 H 2.909 0.030 2
367 38 38 ASP HB3 H 2.523 0.030 2
368 38 38 ASP C C 175.836 0.300 1
369 38 38 ASP CA C 54.812 0.300 1
370 38 38 ASP CB C 40.050 0.300 1
371 38 38 ASP N N 124.760 0.300 1
372 39 39 GLY H H 7.392 0.030 1
373 39 39 GLY HA2 H 4.151 0.030 2
374 39 39 GLY HA3 H 4.282 0.030 2
375 39 39 GLY C C 174.368 0.300 1
376 39 39 GLY CA C 46.064 0.300 1
377 39 39 GLY N N 102.257 0.300 1
378 40 40 LYS H H 7.472 0.030 1
379 40 40 LYS HA H 4.915 0.030 1
380 40 40 LYS HB2 H 1.850 0.030 2
381 40 40 LYS HB3 H 1.754 0.030 2
382 40 40 LYS HE2 H 2.991 0.030 2
383 40 40 LYS HG2 H 1.354 0.030 2
384 40 40 LYS HG3 H 1.417 0.030 2
385 40 40 LYS C C 176.305 0.300 1
386 40 40 LYS CA C 54.581 0.300 1
387 40 40 LYS CB C 34.994 0.300 1
388 40 40 LYS CD C 28.994 0.300 1
389 40 40 LYS CE C 41.912 0.300 1
390 40 40 LYS CG C 24.570 0.300 1
391 40 40 LYS N N 117.784 0.300 1
392 41 41 ILE H H 8.732 0.030 1
393 41 41 ILE HA H 3.718 0.030 1
394 41 41 ILE HB H 1.608 0.030 1
395 41 41 ILE HD1 H 0.709 0.030 1
396 41 41 ILE HG12 H 1.764 0.030 2
397 41 41 ILE HG13 H 0.895 0.030 2
398 41 41 ILE HG2 H 0.808 0.030 1
399 41 41 ILE C C 175.143 0.300 1
400 41 41 ILE CA C 61.789 0.300 1
401 41 41 ILE CB C 38.733 0.300 1
402 41 41 ILE CD1 C 13.679 0.300 1
403 41 41 ILE CG1 C 29.180 0.300 1
404 41 41 ILE CG2 C 18.029 0.300 1
405 41 41 ILE N N 121.614 0.300 1
406 42 42 GLU H H 7.765 0.030 1
407 42 42 GLU HA H 4.588 0.030 1
408 42 42 GLU HB2 H 2.031 0.030 2
409 42 42 GLU HB3 H 1.878 0.030 2
410 42 42 GLU HG2 H 2.178 0.030 2
411 42 42 GLU C C 174.568 0.300 1
412 42 42 GLU CA C 55.750 0.300 1
413 42 42 GLU CB C 34.165 0.300 1
414 42 42 GLU CG C 36.810 0.300 1
415 42 42 GLU N N 126.950 0.300 1
416 43 43 GLY H H 8.491 0.030 1
417 43 43 GLY HA2 H 4.079 0.030 2
418 43 43 GLY HA3 H 3.652 0.030 2
419 43 43 GLY C C 172.999 0.300 1
420 43 43 GLY CA C 45.273 0.300 1
421 43 43 GLY N N 107.230 0.300 1
422 44 44 LEU H H 6.828 0.030 1
423 44 44 LEU HA H 4.320 0.030 1
424 44 44 LEU HB2 H 1.303 0.030 2
425 44 44 LEU HB3 H 1.052 0.030 2
426 44 44 LEU HD1 H 0.368 0.030 1
427 44 44 LEU HD2 H 0.406 0.030 1
428 44 44 LEU HG H 1.247 0.030 1
429 44 44 LEU C C 175.239 0.300 1
430 44 44 LEU CA C 53.788 0.300 1
431 44 44 LEU CB C 43.085 0.300 1
432 44 44 LEU CD1 C 24.532 0.300 2
433 44 44 LEU CD2 C 25.381 0.300 2
434 44 44 LEU CG C 26.760 0.300 1
435 44 44 LEU N N 119.226 0.300 1
436 45 45 THR H H 6.902 0.030 1
437 45 45 THR HA H 4.790 0.030 1
438 45 45 THR HB H 4.700 0.030 1
439 45 45 THR HG2 H 1.209 0.030 1
440 45 45 THR C C 173.846 0.300 1
441 45 45 THR CA C 59.939 0.300 1
442 45 45 THR CB C 72.324 0.300 1
443 45 45 THR CG2 C 20.838 0.300 1
444 45 45 THR N N 113.466 0.300 1
445 46 46 ALA H H 8.818 0.030 1
446 46 46 ALA HA H 4.296 0.030 1
447 46 46 ALA HB H 1.608 0.030 1
448 46 46 ALA C C 177.921 0.300 1
449 46 46 ALA CA C 52.680 0.300 1
450 46 46 ALA CB C 18.191 0.300 1
451 46 46 ALA N N 118.859 0.300 1
452 47 47 GLU H H 8.161 0.030 1
453 47 47 GLU HA H 4.082 0.030 1
454 47 47 GLU HB2 H 1.573 0.030 2
455 47 47 GLU HB3 H 1.923 0.030 2
456 47 47 GLU HG2 H 2.301 0.030 2
457 47 47 GLU HG3 H 2.226 0.030 2
458 47 47 GLU C C 178.493 0.300 1
459 47 47 GLU CA C 57.999 0.300 1
460 47 47 GLU CB C 30.355 0.300 1
461 47 47 GLU CG C 37.058 0.300 1
462 47 47 GLU N N 116.679 0.300 1
463 48 48 PHE H H 7.267 0.030 1
464 48 48 PHE HA H 4.305 0.030 1
465 48 48 PHE HB2 H 3.349 0.030 2
466 48 48 PHE HB3 H 2.842 0.030 2
467 48 48 PHE HD1 H 7.540 0.030 1
468 48 48 PHE HD2 H 7.540 0.030 1
469 48 48 PHE HE1 H 7.351 0.030 1
470 48 48 PHE HE2 H 7.351 0.030 1
471 48 48 PHE HZ H 7.201 0.030 1
472 48 48 PHE C C 176.992 0.300 1
473 48 48 PHE CA C 58.355 0.300 1
474 48 48 PHE CB C 36.433 0.300 1
475 48 48 PHE CD1 C 132.527 0.300 1
476 48 48 PHE CD2 C 132.527 0.300 1
477 48 48 PHE CE1 C 130.598 0.300 1
478 48 48 PHE CE2 C 130.598 0.300 1
479 48 48 PHE CZ C 129.428 0.300 1
480 48 48 PHE N N 121.472 0.300 1
481 49 49 VAL H H 7.663 0.030 1
482 49 49 VAL HA H 3.947 0.030 1
483 49 49 VAL HB H 2.247 0.030 1
484 49 49 VAL HG1 H 1.050 0.030 1
485 49 49 VAL HG2 H 0.904 0.030 1
486 49 49 VAL C C 175.860 0.300 1
487 49 49 VAL CA C 63.861 0.300 1
488 49 49 VAL CB C 31.968 0.300 1
489 49 49 VAL CG1 C 21.874 0.300 2
490 49 49 VAL CG2 C 18.789 0.300 2
491 49 49 VAL N N 112.320 0.300 1
492 50 50 ASN H H 8.636 0.030 1
493 50 50 ASN HA H 5.130 0.030 1
494 50 50 ASN HB2 H 2.739 0.030 2
495 50 50 ASN HB3 H 2.628 0.030 2
496 50 50 ASN HD21 H 7.112 0.030 2
497 50 50 ASN HD22 H 8.533 0.030 2
498 50 50 ASN C C 174.678 0.300 1
499 50 50 ASN CA C 52.565 0.300 1
500 50 50 ASN CB C 39.918 0.300 1
501 50 50 ASN N N 117.034 0.300 1
502 50 50 ASN ND2 N 116.974 0.300 1
503 51 51 LEU H H 7.016 0.030 1
504 51 51 LEU HA H 4.072 0.030 1
505 51 51 LEU HB2 H 1.830 0.030 2
506 51 51 LEU HB3 H 1.608 0.030 2
507 51 51 LEU HD1 H 0.763 0.030 1
508 51 51 LEU HD2 H 0.778 0.030 1
509 51 51 LEU C C 175.785 0.300 1
510 51 51 LEU CA C 56.803 0.300 1
511 51 51 LEU CB C 43.920 0.300 1
512 51 51 LEU CD1 C 25.408 0.300 2
513 51 51 LEU CD2 C 26.993 0.300 2
514 51 51 LEU N N 122.525 0.300 1
515 52 52 GLU H H 9.301 0.030 1
516 52 52 GLU HA H 5.054 0.030 1
517 52 52 GLU HB2 H 2.170 0.030 2
518 52 52 GLU HB3 H 2.092 0.030 2
519 52 52 GLU HG2 H 2.636 0.030 2
520 52 52 GLU HG3 H 2.315 0.030 2
521 52 52 GLU C C 177.387 0.300 1
522 52 52 GLU CA C 57.383 0.300 1
523 52 52 GLU CB C 33.194 0.300 1
524 52 52 GLU CG C 36.936 0.300 1
525 52 52 GLU N N 123.884 0.300 1
526 53 53 PHE H H 7.771 0.030 1
527 53 53 PHE HA H 5.727 0.030 1
528 53 53 PHE HB2 H 3.369 0.030 2
529 53 53 PHE HB3 H 2.892 0.030 2
530 53 53 PHE HD1 H 7.188 0.030 1
531 53 53 PHE HD2 H 7.188 0.030 1
532 53 53 PHE HE1 H 7.187 0.030 1
533 53 53 PHE HE2 H 7.187 0.030 1
534 53 53 PHE HZ H 7.344 0.030 1
535 53 53 PHE C C 171.914 0.300 1
536 53 53 PHE CA C 55.089 0.300 1
537 53 53 PHE CB C 41.787 0.300 1
538 53 53 PHE CD1 C 131.395 0.300 1
539 53 53 PHE CD2 C 131.395 0.300 1
540 53 53 PHE CE1 C 131.158 0.300 1
541 53 53 PHE CE2 C 131.158 0.300 1
542 53 53 PHE CZ C 129.645 0.300 1
543 53 53 PHE N N 121.645 0.300 1
544 54 54 LEU H H 7.911 0.030 1
545 54 54 LEU HA H 4.995 0.030 1
546 54 54 LEU HB2 H 1.745 0.030 2
547 54 54 LEU HB3 H 1.140 0.030 2
548 54 54 LEU HD1 H 0.732 0.030 1
549 54 54 LEU HD2 H 0.541 0.030 1
550 54 54 LEU HG H 1.134 0.030 1
551 54 54 LEU C C 172.407 0.300 1
552 54 54 LEU CA C 52.698 0.300 1
553 54 54 LEU CB C 46.060 0.300 1
554 54 54 LEU CD1 C 22.822 0.300 2
555 54 54 LEU CD2 C 26.327 0.300 2
556 54 54 LEU CG C 27.481 0.300 1
557 54 54 LEU N N 129.365 0.300 1
558 55 55 SER H H 8.328 0.030 1
559 55 55 SER HA H 4.888 0.030 1
560 55 55 SER HB2 H 3.197 0.030 2
561 55 55 SER HB3 H 3.917 0.030 2
562 55 55 SER C C 173.337 0.300 1
563 55 55 SER CA C 57.228 0.300 1
564 55 55 SER CB C 64.695 0.300 1
565 55 55 SER N N 121.105 0.300 1
566 56 56 LEU H H 9.088 0.030 1
567 56 56 LEU HA H 4.299 0.030 1
568 56 56 LEU HB2 H 1.767 0.030 2
569 56 56 LEU HB3 H 1.592 0.030 2
570 56 56 LEU HD1 H 0.617 0.030 1
571 56 56 LEU HD2 H 0.775 0.030 1
572 56 56 LEU HG H 1.330 0.030 1
573 56 56 LEU C C 173.771 0.300 1
574 56 56 LEU CA C 52.330 0.300 1
575 56 56 LEU CB C 43.004 0.300 1
576 56 56 LEU CD1 C 26.922 0.300 2
577 56 56 LEU CD2 C 26.935 0.300 2
578 56 56 LEU CG C 26.467 0.300 1
579 56 56 LEU N N 133.228 0.300 1
580 57 57 ILE H H 7.605 0.030 1
581 57 57 ILE HA H 4.216 0.030 1
582 57 57 ILE HB H 1.244 0.030 1
583 57 57 ILE HD1 H 0.749 0.030 1
584 57 57 ILE HG12 H 1.621 0.030 2
585 57 57 ILE HG13 H 0.918 0.030 2
586 57 57 ILE HG2 H 0.690 0.030 1
587 57 57 ILE C C 177.958 0.300 1
588 57 57 ILE CA C 62.420 0.300 1
589 57 57 ILE CB C 38.476 0.300 1
590 57 57 ILE CD1 C 13.573 0.300 1
591 57 57 ILE CG1 C 28.516 0.300 1
592 57 57 ILE CG2 C 15.830 0.300 1
593 57 57 ILE N N 122.466 0.300 1
594 58 58 ASN H H 8.211 0.030 1
595 58 58 ASN HA H 4.861 0.030 1
596 58 58 ASN HB2 H 3.574 0.030 2
597 58 58 ASN HB3 H 2.307 0.030 2
598 58 58 ASN HD21 H 6.630 0.030 2
599 58 58 ASN HD22 H 7.842 0.030 2
600 58 58 ASN C C 175.410 0.300 1
601 58 58 ASN CA C 54.302 0.300 1
602 58 58 ASN CB C 37.051 0.300 1
603 58 58 ASN N N 121.460 0.300 1
604 58 58 ASN ND2 N 111.112 0.300 1
605 59 59 VAL H H 7.996 0.030 1
606 59 59 VAL HA H 5.371 0.030 1
607 59 59 VAL HB H 2.260 0.030 1
608 59 59 VAL HG1 H 0.713 0.030 1
609 59 59 VAL HG2 H 0.746 0.030 1
610 59 59 VAL C C 177.283 0.300 1
611 59 59 VAL CA C 59.405 0.300 1
612 59 59 VAL CB C 32.232 0.300 1
613 59 59 VAL CG1 C 22.705 0.300 2
614 59 59 VAL CG2 C 21.574 0.300 2
615 59 59 VAL N N 110.283 0.300 1
616 60 60 GLY H H 8.742 0.030 1
617 60 60 GLY HA2 H 4.076 0.030 2
618 60 60 GLY HA3 H 3.750 0.030 2
619 60 60 GLY C C 175.562 0.300 1
620 60 60 GLY CA C 45.969 0.300 1
621 60 60 GLY N N 114.658 0.300 1
622 61 61 LEU H H 8.649 0.030 1
623 61 61 LEU HA H 3.788 0.030 1
624 61 61 LEU HB2 H 1.352 0.030 2
625 61 61 LEU HB3 H 1.226 0.030 2
626 61 61 LEU HD1 H 0.709 0.030 1
627 61 61 LEU HD2 H 0.661 0.030 1
628 61 61 LEU HG H 1.609 0.030 1
629 61 61 LEU C C 176.487 0.300 1
630 61 61 LEU CA C 55.927 0.300 1
631 61 61 LEU CB C 43.059 0.300 1
632 61 61 LEU CD1 C 24.953 0.300 2
633 61 61 LEU CD2 C 25.625 0.300 2
634 61 61 LEU CG C 27.254 0.300 1
635 61 61 LEU N N 120.488 0.300 1
636 62 62 ILE H H 9.510 0.030 1
637 62 62 ILE HA H 4.247 0.030 1
638 62 62 ILE HB H 1.905 0.030 1
639 62 62 ILE HD1 H 0.959 0.030 1
640 62 62 ILE HG12 H 1.604 0.030 2
641 62 62 ILE HG13 H 1.159 0.030 2
642 62 62 ILE HG2 H 1.031 0.030 1
643 62 62 ILE C C 175.089 0.300 1
644 62 62 ILE CA C 61.446 0.300 1
645 62 62 ILE CB C 40.942 0.300 1
646 62 62 ILE CD1 C 13.930 0.300 1
647 62 62 ILE CG1 C 27.588 0.300 1
648 62 62 ILE CG2 C 17.840 0.300 1
649 62 62 ILE N N 120.098 0.300 1
650 63 63 SER H H 7.547 0.030 1
651 63 63 SER HA H 4.982 0.030 1
652 63 63 SER HB2 H 3.919 0.030 2
653 63 63 SER HB3 H 3.496 0.030 2
654 63 63 SER C C 175.763 0.300 1
655 63 63 SER CA C 55.496 0.300 1
656 63 63 SER CB C 65.365 0.300 1
657 63 63 SER N N 112.496 0.300 1
658 64 64 VAL H H 8.723 0.030 1
659 64 64 VAL HA H 4.515 0.030 1
660 64 64 VAL HB H 2.488 0.030 1
661 64 64 VAL HG1 H 0.771 0.030 1
662 64 64 VAL HG2 H 0.756 0.030 1
663 64 64 VAL C C 175.868 0.300 1
664 64 64 VAL CA C 60.227 0.300 1
665 64 64 VAL CB C 30.691 0.300 1
666 64 64 VAL CG1 C 21.923 0.300 2
667 64 64 VAL CG2 C 18.933 0.300 2
668 64 64 VAL N N 117.909 0.300 1
669 65 65 SER H H 8.356 0.030 1
670 65 65 SER HA H 4.119 0.030 1
671 65 65 SER HB2 H 3.911 0.030 2
672 65 65 SER HB3 H 3.870 0.030 2
673 65 65 SER C C 174.176 0.300 1
674 65 65 SER CA C 61.507 0.300 1
675 65 65 SER CB C 63.185 0.300 1
676 65 65 SER N N 116.657 0.300 1
677 66 66 ASN HA H 4.844 0.030 1
678 66 66 ASN HB2 H 2.774 0.030 2
679 66 66 ASN HB3 H 2.968 0.030 2
680 66 66 ASN HD21 H 6.988 0.030 2
681 66 66 ASN HD22 H 7.706 0.030 2
682 66 66 ASN C C 175.299 0.300 1
683 66 66 ASN CA C 52.432 0.300 1
684 66 66 ASN CB C 38.022 0.300 1
685 66 66 ASN ND2 N 111.399 0.300 1
686 67 67 LEU H H 7.284 0.030 1
687 67 67 LEU HA H 4.102 0.030 1
688 67 67 LEU HB2 H 1.518 0.030 2
689 67 67 LEU HB3 H 1.477 0.030 2
690 67 67 LEU HD1 H 0.732 0.030 1
691 67 67 LEU HD2 H 0.685 0.030 1
692 67 67 LEU HG H 1.795 0.030 1
693 67 67 LEU C C 173.863 0.300 1
694 67 67 LEU CA C 53.482 0.300 1
695 67 67 LEU CB C 42.950 0.300 1
696 67 67 LEU CD1 C 25.713 0.300 2
697 67 67 LEU CD2 C 25.065 0.300 2
698 67 67 LEU CG C 26.147 0.300 1
699 67 67 LEU N N 121.612 0.300 1
700 68 68 PRO HA H 4.677 0.030 1
701 68 68 PRO HB2 H 2.040 0.030 2
702 68 68 PRO HB3 H 1.710 0.030 2
703 68 68 PRO HD2 H 3.260 0.030 2
704 68 68 PRO HD3 H 3.517 0.030 2
705 68 68 PRO HG2 H 1.500 0.030 2
706 68 68 PRO HG3 H 1.544 0.030 2
707 68 68 PRO C C 173.446 0.300 1
708 68 68 PRO CA C 61.401 0.300 1
709 68 68 PRO CB C 32.024 0.300 1
710 68 68 PRO CD C 49.060 0.300 1
711 68 68 PRO CG C 26.022 0.300 1
712 69 69 LYS H H 7.925 0.030 1
713 69 69 LYS HA H 4.484 0.030 1
714 69 69 LYS HB2 H 1.893 0.030 2
715 69 69 LYS HB3 H 1.701 0.030 2
716 69 69 LYS HD2 H 1.771 0.030 1
717 69 69 LYS HD3 H 1.771 0.030 1
718 69 69 LYS HE2 H 2.937 0.030 2
719 69 69 LYS HG2 H 1.525 0.030 2
720 69 69 LYS HG3 H 1.374 0.030 2
721 69 69 LYS C C 176.674 0.300 1
722 69 69 LYS CA C 57.273 0.300 1
723 69 69 LYS CB C 32.352 0.300 1
724 69 69 LYS CD C 29.596 0.300 1
725 69 69 LYS CE C 42.322 0.300 1
726 69 69 LYS CG C 25.567 0.300 1
727 69 69 LYS N N 115.690 0.300 1
728 70 70 LEU H H 7.976 0.030 1
729 70 70 LEU HA H 4.998 0.030 1
730 70 70 LEU HB2 H 1.531 0.030 2
731 70 70 LEU HB3 H 1.818 0.030 2
732 70 70 LEU HD1 H 0.718 0.030 1
733 70 70 LEU HD2 H 0.961 0.030 1
734 70 70 LEU HG H 1.512 0.030 1
735 70 70 LEU C C 176.633 0.300 1
736 70 70 LEU CA C 52.111 0.300 1
737 70 70 LEU CB C 42.805 0.300 1
738 70 70 LEU CD1 C 27.093 0.300 2
739 70 70 LEU CD2 C 24.449 0.300 2
740 70 70 LEU CG C 25.273 0.300 1
741 70 70 LEU N N 127.008 0.300 1
742 71 71 PRO HA H 4.135 0.030 1
743 71 71 PRO HB2 H 2.336 0.030 2
744 71 71 PRO HB3 H 2.107 0.030 2
745 71 71 PRO HD2 H 3.868 0.030 2
746 71 71 PRO HD3 H 3.567 0.030 2
747 71 71 PRO HG2 H 2.027 0.030 2
748 71 71 PRO HG3 H 2.143 0.030 2
749 71 71 PRO C C 176.575 0.300 1
750 71 71 PRO CA C 65.034 0.300 1
751 71 71 PRO CB C 32.770 0.300 1
752 71 71 PRO CD C 51.175 0.300 1
753 71 71 PRO CG C 27.085 0.300 1
754 72 72 LYS H H 8.519 0.030 1
755 72 72 LYS HA H 4.441 0.030 1
756 72 72 LYS HB2 H 1.896 0.030 2
757 72 72 LYS HB3 H 1.547 0.030 2
758 72 72 LYS HD2 H 1.839 0.030 2
759 72 72 LYS HE2 H 3.040 0.030 2
760 72 72 LYS HG2 H 1.654 0.030 2
761 72 72 LYS HG3 H 1.373 0.030 2
762 72 72 LYS C C 176.405 0.300 1
763 72 72 LYS CA C 55.026 0.300 1
764 72 72 LYS CB C 32.734 0.300 1
765 72 72 LYS CD C 29.397 0.300 1
766 72 72 LYS CE C 42.391 0.300 1
767 72 72 LYS CG C 26.593 0.300 1
768 72 72 LYS N N 116.485 0.300 1
769 73 73 LEU H H 6.984 0.030 1
770 73 73 LEU HA H 4.083 0.030 1
771 73 73 LEU HB2 H 1.851 0.030 2
772 73 73 LEU HB3 H 1.386 0.030 2
773 73 73 LEU HD1 H 0.717 0.030 1
774 73 73 LEU HD2 H 0.957 0.030 1
775 73 73 LEU HG H 1.434 0.030 1
776 73 73 LEU C C 176.547 0.300 1
777 73 73 LEU CA C 57.912 0.300 1
778 73 73 LEU CB C 42.580 0.300 1
779 73 73 LEU CD1 C 26.110 0.300 2
780 73 73 LEU CD2 C 28.264 0.300 2
781 73 73 LEU N N 122.028 0.300 1
782 74 74 LYS H H 8.917 0.030 1
783 74 74 LYS HA H 4.915 0.030 1
784 74 74 LYS HB2 H 2.143 0.030 2
785 74 74 LYS HB3 H 1.911 0.030 2
786 74 74 LYS HD2 H 1.447 0.030 2
787 74 74 LYS HE2 H 3.071 0.030 2
788 74 74 LYS HG2 H 1.738 0.030 2
789 74 74 LYS HG3 H 1.642 0.030 2
790 74 74 LYS C C 176.536 0.300 1
791 74 74 LYS CA C 56.872 0.300 1
792 74 74 LYS CB C 35.390 0.300 1
793 74 74 LYS CD C 27.991 0.300 1
794 74 74 LYS CE C 42.186 0.300 1
795 74 74 LYS CG C 24.741 0.300 1
796 74 74 LYS N N 124.755 0.300 1
797 75 75 LYS H H 7.953 0.030 1
798 75 75 LYS HA H 5.567 0.030 1
799 75 75 LYS HB2 H 1.885 0.030 2
800 75 75 LYS HB3 H 1.864 0.030 2
801 75 75 LYS HD2 H 1.349 0.030 2
802 75 75 LYS HD3 H 1.233 0.030 2
803 75 75 LYS HE2 H 2.441 0.030 2
804 75 75 LYS HE3 H 2.372 0.030 2
805 75 75 LYS HG2 H 1.235 0.030 2
806 75 75 LYS HG3 H 1.422 0.030 2
807 75 75 LYS C C 173.127 0.300 1
808 75 75 LYS CA C 55.387 0.300 1
809 75 75 LYS CB C 35.817 0.300 1
810 75 75 LYS CD C 29.453 0.300 1
811 75 75 LYS CE C 41.542 0.300 1
812 75 75 LYS CG C 25.444 0.300 1
813 75 75 LYS N N 119.836 0.300 1
814 76 76 LEU H H 8.293 0.030 1
815 76 76 LEU HA H 5.386 0.030 1
816 76 76 LEU HB2 H 1.972 0.030 2
817 76 76 LEU HB3 H 1.250 0.030 2
818 76 76 LEU HD1 H 0.801 0.030 1
819 76 76 LEU HD2 H 0.704 0.030 1
820 76 76 LEU HG H 1.260 0.030 1
821 76 76 LEU C C 173.957 0.300 1
822 76 76 LEU CA C 53.213 0.300 1
823 76 76 LEU CB C 45.869 0.300 1
824 76 76 LEU CD1 C 23.242 0.300 2
825 76 76 LEU CD2 C 27.345 0.300 2
826 76 76 LEU CG C 27.598 0.300 1
827 76 76 LEU N N 126.035 0.300 1
828 77 77 GLU H H 8.672 0.030 1
829 77 77 GLU HA H 4.718 0.030 1
830 77 77 GLU HB2 H 2.525 0.030 2
831 77 77 GLU HB3 H 2.092 0.030 2
832 77 77 GLU HG2 H 2.596 0.030 2
833 77 77 GLU HG3 H 2.422 0.030 2
834 77 77 GLU C C 175.169 0.300 1
835 77 77 GLU CA C 56.552 0.300 1
836 77 77 GLU CB C 32.453 0.300 1
837 77 77 GLU CG C 37.283 0.300 1
838 77 77 GLU N N 130.902 0.300 1
839 78 78 LEU H H 8.585 0.030 1
840 78 78 LEU HA H 4.471 0.030 1
841 78 78 LEU HB2 H 1.931 0.030 2
842 78 78 LEU HB3 H 1.553 0.030 2
843 78 78 LEU HD1 H 0.685 0.030 1
844 78 78 LEU HD2 H 0.741 0.030 1
845 78 78 LEU HG H 1.405 0.030 1
846 78 78 LEU C C 177.590 0.300 1
847 78 78 LEU CA C 52.478 0.300 1
848 78 78 LEU CB C 43.790 0.300 1
849 78 78 LEU CD1 C 26.677 0.300 2
850 78 78 LEU CD2 C 24.931 0.300 2
851 78 78 LEU N N 124.759 0.300 1
852 79 79 SER H H 8.030 0.030 1
853 79 79 SER HA H 4.611 0.030 1
854 79 79 SER HB2 H 3.794 0.030 1
855 79 79 SER HB3 H 3.794 0.030 1
856 79 79 SER C C 172.900 0.300 1
857 79 79 SER CA C 59.492 0.300 1
858 79 79 SER CB C 64.221 0.300 1
859 79 79 SER N N 119.201 0.300 1
860 80 80 GLU H H 8.808 0.030 1
861 80 80 GLU HA H 4.032 0.030 1
862 80 80 GLU HB2 H 2.253 0.030 2
863 80 80 GLU HB3 H 2.064 0.030 2
864 80 80 GLU HG2 H 2.210 0.030 2
865 80 80 GLU HG3 H 2.086 0.030 2
866 80 80 GLU C C 175.916 0.300 1
867 80 80 GLU CA C 56.379 0.300 1
868 80 80 GLU CB C 26.327 0.300 1
869 80 80 GLU CG C 35.893 0.300 1
870 80 80 GLU N N 110.565 0.300 1
871 81 81 ASN H H 6.671 0.030 1
872 81 81 ASN HA H 5.154 0.030 1
873 81 81 ASN HB2 H 3.244 0.030 2
874 81 81 ASN HB3 H 3.166 0.030 2
875 81 81 ASN HD21 H 6.956 0.030 2
876 81 81 ASN HD22 H 8.297 0.030 2
877 81 81 ASN C C 173.496 0.300 1
878 81 81 ASN CA C 53.592 0.300 1
879 81 81 ASN CB C 42.418 0.300 1
880 81 81 ASN N N 116.775 0.300 1
881 81 81 ASN ND2 N 119.600 0.300 1
882 82 82 ARG H H 8.751 0.030 1
883 82 82 ARG HA H 4.689 0.030 1
884 82 82 ARG HB2 H 2.092 0.030 2
885 82 82 ARG HB3 H 1.582 0.030 2
886 82 82 ARG HD2 H 3.129 0.030 1
887 82 82 ARG HD3 H 3.129 0.030 1
888 82 82 ARG HG2 H 1.495 0.030 2
889 82 82 ARG HG3 H 1.436 0.030 2
890 82 82 ARG C C 175.279 0.300 1
891 82 82 ARG CA C 54.285 0.300 1
892 82 82 ARG CB C 30.318 0.300 1
893 82 82 ARG CD C 43.851 0.300 1
894 82 82 ARG CG C 27.048 0.300 1
895 82 82 ARG N N 118.497 0.300 1
896 83 83 ILE H H 8.541 0.030 1
897 83 83 ILE HA H 3.821 0.030 1
898 83 83 ILE HB H 1.526 0.030 1
899 83 83 ILE HD1 H 0.724 0.030 1
900 83 83 ILE HG12 H 0.737 0.030 2
901 83 83 ILE HG13 H 1.502 0.030 2
902 83 83 ILE HG2 H 0.875 0.030 1
903 83 83 ILE C C 176.484 0.300 1
904 83 83 ILE CA C 62.630 0.300 1
905 83 83 ILE CB C 38.553 0.300 1
906 83 83 ILE CD1 C 14.696 0.300 1
907 83 83 ILE CG1 C 28.168 0.300 1
908 83 83 ILE CG2 C 17.443 0.300 1
909 83 83 ILE N N 121.353 0.300 1
910 84 84 PHE H H 8.522 0.030 1
911 84 84 PHE HA H 5.077 0.030 1
912 84 84 PHE HB2 H 3.495 0.030 2
913 84 84 PHE HB3 H 2.814 0.030 2
914 84 84 PHE HD1 H 7.374 0.030 1
915 84 84 PHE HD2 H 7.374 0.030 1
916 84 84 PHE HE1 H 7.411 0.030 1
917 84 84 PHE HE2 H 7.411 0.030 1
918 84 84 PHE C C 174.635 0.300 1
919 84 84 PHE CA C 55.960 0.300 1
920 84 84 PHE CB C 41.761 0.300 1
921 84 84 PHE CD1 C 133.016 0.300 1
922 84 84 PHE CD2 C 133.016 0.300 1
923 84 84 PHE CE1 C 131.495 0.300 1
924 84 84 PHE CE2 C 131.495 0.300 1
925 84 84 PHE N N 122.291 0.300 1
926 85 85 GLY H H 7.223 0.030 1
927 85 85 GLY HA2 H 4.063 0.030 2
928 85 85 GLY HA3 H 3.772 0.030 2
929 85 85 GLY C C 172.070 0.300 1
930 85 85 GLY CA C 45.356 0.300 1
931 85 85 GLY N N 109.786 0.300 1
932 86 86 GLY H H 8.555 0.030 1
933 86 86 GLY HA2 H 3.989 0.030 2
934 86 86 GLY HA3 H 3.932 0.030 2
935 86 86 GLY C C 176.648 0.300 1
936 86 86 GLY CA C 46.756 0.300 1
937 86 86 GLY N N 108.146 0.300 1
938 87 87 LEU H H 9.127 0.030 1
939 87 87 LEU HA H 3.974 0.030 1
940 87 87 LEU HB2 H 1.722 0.030 2
941 87 87 LEU HB3 H 1.468 0.030 2
942 87 87 LEU HD1 H 0.813 0.030 1
943 87 87 LEU HD2 H 0.611 0.030 1
944 87 87 LEU HG H 1.477 0.030 1
945 87 87 LEU C C 177.523 0.300 1
946 87 87 LEU CA C 55.791 0.300 1
947 87 87 LEU CB C 39.468 0.300 1
948 87 87 LEU CD1 C 25.615 0.300 2
949 87 87 LEU CD2 C 21.537 0.300 2
950 87 87 LEU CG C 27.014 0.300 1
951 87 87 LEU N N 117.033 0.300 1
952 88 88 ASP H H 9.138 0.030 1
953 88 88 ASP HA H 4.106 0.030 1
954 88 88 ASP HB2 H 2.606 0.030 2
955 88 88 ASP HB3 H 2.549 0.030 2
956 88 88 ASP C C 177.536 0.300 1
957 88 88 ASP CA C 56.735 0.300 1
958 88 88 ASP CB C 39.724 0.300 1
959 88 88 ASP N N 118.245 0.300 1
960 89 89 MET H H 7.927 0.030 1
961 89 89 MET HA H 4.473 0.030 1
962 89 89 MET HB2 H 1.915 0.030 2
963 89 89 MET HB3 H 2.020 0.030 2
964 89 89 MET HE H 2.097 0.030 1
965 89 89 MET HG2 H 2.608 0.030 1
966 89 89 MET HG3 H 2.608 0.030 1
967 89 89 MET C C 177.756 0.300 1
968 89 89 MET CA C 56.188 0.300 1
969 89 89 MET CB C 32.174 0.300 1
970 89 89 MET CE C 17.291 0.300 1
971 89 89 MET CG C 32.208 0.300 1
972 89 89 MET N N 116.318 0.300 1
973 90 90 LEU H H 7.328 0.030 1
974 90 90 LEU HA H 3.764 0.030 1
975 90 90 LEU HB2 H 1.846 0.030 2
976 90 90 LEU HB3 H 1.309 0.030 2
977 90 90 LEU HD1 H 0.775 0.030 1
978 90 90 LEU HD2 H 0.647 0.030 1
979 90 90 LEU HG H 1.683 0.030 1
980 90 90 LEU C C 177.470 0.300 1
981 90 90 LEU CA C 58.451 0.300 1
982 90 90 LEU CB C 41.067 0.300 1
983 90 90 LEU CD1 C 26.981 0.300 2
984 90 90 LEU CD2 C 23.422 0.300 2
985 90 90 LEU CG C 27.121 0.300 1
986 90 90 LEU N N 116.428 0.300 1
987 91 91 ALA H H 7.525 0.030 1
988 91 91 ALA HA H 3.916 0.030 1
989 91 91 ALA HB H 1.276 0.030 1
990 91 91 ALA C C 178.428 0.300 1
991 91 91 ALA CA C 54.331 0.300 1
992 91 91 ALA CB C 18.833 0.300 1
993 91 91 ALA N N 117.407 0.300 1
994 92 92 GLU H H 7.360 0.030 1
995 92 92 GLU HA H 4.044 0.030 1
996 92 92 GLU HB2 H 2.019 0.030 2
997 92 92 GLU HB3 H 2.054 0.030 2
998 92 92 GLU HG2 H 2.263 0.030 2
999 92 92 GLU HG3 H 2.194 0.030 2
1000 92 92 GLU C C 177.951 0.300 1
1001 92 92 GLU CA C 58.011 0.300 1
1002 92 92 GLU CB C 30.287 0.300 1
1003 92 92 GLU CG C 36.318 0.300 1
1004 92 92 GLU N N 114.110 0.300 1
1005 93 93 LYS H H 7.356 0.030 1
1006 93 93 LYS HA H 4.200 0.030 1
1007 93 93 LYS HB2 H 2.165 0.030 2
1008 93 93 LYS HB3 H 1.612 0.030 2
1009 93 93 LYS HD2 H 1.267 0.030 2
1010 93 93 LYS HD3 H 1.434 0.030 2
1011 93 93 LYS HE2 H 3.044 0.030 2
1012 93 93 LYS HE3 H 2.987 0.030 2
1013 93 93 LYS HG2 H 0.704 0.030 2
1014 93 93 LYS HG3 H 1.376 0.030 2
1015 93 93 LYS C C 175.430 0.300 1
1016 93 93 LYS CA C 56.422 0.300 1
1017 93 93 LYS CB C 33.364 0.300 1
1018 93 93 LYS CD C 27.980 0.300 1
1019 93 93 LYS CE C 42.814 0.300 1
1020 93 93 LYS CG C 25.137 0.300 1
1021 93 93 LYS N N 114.625 0.300 1
1022 94 94 LEU H H 7.647 0.030 1
1023 94 94 LEU HA H 5.004 0.030 1
1024 94 94 LEU HB2 H 1.334 0.030 2
1025 94 94 LEU HB3 H 2.172 0.030 2
1026 94 94 LEU HD1 H 0.939 0.030 1
1027 94 94 LEU HD2 H 1.027 0.030 1
1028 94 94 LEU HG H 1.701 0.030 1
1029 94 94 LEU C C 173.681 0.300 1
1030 94 94 LEU CA C 51.493 0.300 1
1031 94 94 LEU CB C 41.572 0.300 1
1032 94 94 LEU CD1 C 29.805 0.300 2
1033 94 94 LEU CD2 C 25.868 0.300 2
1034 94 94 LEU CG C 26.625 0.300 1
1035 94 94 LEU N N 116.294 0.300 1
1036 95 95 PRO HA H 4.281 0.030 1
1037 95 95 PRO HB2 H 2.360 0.030 2
1038 95 95 PRO HB3 H 1.923 0.030 2
1039 95 95 PRO HD2 H 3.456 0.030 2
1040 95 95 PRO HD3 H 3.144 0.030 2
1041 95 95 PRO HG2 H 1.906 0.030 2
1042 95 95 PRO HG3 H 1.990 0.030 2
1043 95 95 PRO C C 179.163 0.300 1
1044 95 95 PRO CA C 64.536 0.300 1
1045 95 95 PRO CB C 31.912 0.300 1
1046 95 95 PRO CD C 49.913 0.300 1
1047 95 95 PRO CG C 27.399 0.300 1
1048 96 96 ASN H H 8.722 0.030 1
1049 96 96 ASN HA H 5.071 0.030 1
1050 96 96 ASN HB2 H 2.808 0.030 2
1051 96 96 ASN HB3 H 2.490 0.030 2
1052 96 96 ASN HD21 H 8.110 0.030 2
1053 96 96 ASN HD22 H 6.993 0.030 2
1054 96 96 ASN C C 174.531 0.300 1
1055 96 96 ASN CA C 52.904 0.300 1
1056 96 96 ASN CB C 39.429 0.300 1
1057 96 96 ASN N N 117.274 0.300 1
1058 96 96 ASN ND2 N 114.718 0.300 1
1059 97 97 LEU H H 7.152 0.030 1
1060 97 97 LEU HA H 4.059 0.030 1
1061 97 97 LEU HB2 H 1.690 0.030 2
1062 97 97 LEU HB3 H 1.671 0.030 2
1063 97 97 LEU HD1 H 0.837 0.030 1
1064 97 97 LEU HD2 H 0.894 0.030 1
1065 97 97 LEU HG H 1.652 0.030 1
1066 97 97 LEU C C 176.677 0.300 1
1067 97 97 LEU CA C 57.567 0.300 1
1068 97 97 LEU CB C 43.674 0.300 1
1069 97 97 LEU CD1 C 25.805 0.300 2
1070 97 97 LEU CD2 C 26.955 0.300 2
1071 97 97 LEU CG C 26.719 0.300 1
1072 97 97 LEU N N 121.089 0.300 1
1073 98 98 THR H H 9.630 0.030 1
1074 98 98 THR HA H 5.177 0.030 1
1075 98 98 THR HB H 4.345 0.030 1
1076 98 98 THR HG2 H 1.338 0.030 1
1077 98 98 THR C C 175.509 0.300 1
1078 98 98 THR CA C 62.573 0.300 1
1079 98 98 THR CB C 71.145 0.300 1
1080 98 98 THR CG2 C 21.417 0.300 1
1081 98 98 THR N N 115.995 0.300 1
1082 99 99 HIS H H 8.490 0.030 1
1083 99 99 HIS HA H 5.481 0.030 1
1084 99 99 HIS HB2 H 3.126 0.030 2
1085 99 99 HIS HB3 H 2.899 0.030 2
1086 99 99 HIS HD2 H 6.960 0.030 1
1087 99 99 HIS HE1 H 7.826 0.030 1
1088 99 99 HIS C C 173.118 0.300 1
1089 99 99 HIS CA C 56.014 0.300 1
1090 99 99 HIS CB C 33.718 0.300 1
1091 99 99 HIS CD2 C 118.393 0.300 1
1092 99 99 HIS CE1 C 138.474 0.300 1
1093 99 99 HIS N N 124.100 0.300 1
1094 100 100 LEU H H 8.253 0.030 1
1095 100 100 LEU HA H 5.240 0.030 1
1096 100 100 LEU HB2 H 1.941 0.030 2
1097 100 100 LEU HB3 H 1.243 0.030 2
1098 100 100 LEU HD1 H 0.897 0.030 1
1099 100 100 LEU HD2 H 0.710 0.030 1
1100 100 100 LEU HG H 1.326 0.030 1
1101 100 100 LEU C C 173.467 0.300 1
1102 100 100 LEU CA C 53.068 0.300 1
1103 100 100 LEU CB C 46.163 0.300 1
1104 100 100 LEU CD1 C 23.111 0.300 2
1105 100 100 LEU CD2 C 27.342 0.300 2
1106 100 100 LEU CG C 27.498 0.300 1
1107 100 100 LEU N N 125.162 0.300 1
1108 101 101 ASN H H 8.252 0.030 1
1109 101 101 ASN HA H 5.377 0.030 1
1110 101 101 ASN HB2 H 3.384 0.030 2
1111 101 101 ASN HB3 H 2.883 0.030 2
1112 101 101 ASN HD21 H 8.812 0.030 2
1113 101 101 ASN HD22 H 7.039 0.030 2
1114 101 101 ASN C C 174.706 0.300 1
1115 101 101 ASN CA C 51.978 0.300 1
1116 101 101 ASN CB C 39.030 0.300 1
1117 101 101 ASN N N 124.873 0.300 1
1118 101 101 ASN ND2 N 114.623 0.300 1
1119 102 102 LEU H H 9.047 0.030 1
1120 102 102 LEU HA H 4.148 0.030 1
1121 102 102 LEU HB2 H 1.504 0.030 2
1122 102 102 LEU HB3 H 1.896 0.030 2
1123 102 102 LEU HD1 H 0.762 0.030 1
1124 102 102 LEU HD2 H 0.745 0.030 1
1125 102 102 LEU HG H 1.339 0.030 1
1126 102 102 LEU C C 175.928 0.300 1
1127 102 102 LEU CA C 53.452 0.300 1
1128 102 102 LEU CB C 43.797 0.300 1
1129 102 102 LEU CD1 C 26.807 0.300 2
1130 102 102 LEU CD2 C 24.696 0.300 2
1131 102 102 LEU CG C 27.361 0.300 1
1132 102 102 LEU N N 125.957 0.300 1
1133 103 103 SER H H 8.388 0.030 1
1134 103 103 SER HA H 4.272 0.030 1
1135 103 103 SER HB2 H 4.089 0.030 2
1136 103 103 SER HB3 H 3.870 0.030 2
1137 103 103 SER C C 175.219 0.300 1
1138 103 103 SER CA C 61.104 0.300 1
1139 103 103 SER CB C 63.288 0.300 1
1140 103 103 SER N N 119.104 0.300 1
1141 104 104 GLY H H 9.110 0.030 1
1142 104 104 GLY HA2 H 4.045 0.030 2
1143 104 104 GLY HA3 H 3.801 0.030 2
1144 104 104 GLY C C 173.757 0.300 1
1145 104 104 GLY CA C 47.219 0.300 1
1146 104 104 GLY N N 109.702 0.300 1
1147 105 105 ASN H H 7.303 0.030 1
1148 105 105 ASN HA H 5.315 0.030 1
1149 105 105 ASN HB2 H 3.050 0.030 2
1150 105 105 ASN HB3 H 2.701 0.030 2
1151 105 105 ASN HD21 H 6.460 0.030 2
1152 105 105 ASN HD22 H 7.529 0.030 2
1153 105 105 ASN C C 174.832 0.300 1
1154 105 105 ASN CA C 52.950 0.300 1
1155 105 105 ASN CB C 40.067 0.300 1
1156 105 105 ASN N N 116.587 0.300 1
1157 105 105 ASN ND2 N 112.341 0.300 1
1158 106 106 LYS H H 8.061 0.030 1
1159 106 106 LYS HA H 4.808 0.030 1
1160 106 106 LYS HB2 H 2.070 0.030 2
1161 106 106 LYS HB3 H 1.405 0.030 2
1162 106 106 LYS HD2 H 1.638 0.030 1
1163 106 106 LYS HD3 H 1.638 0.030 1
1164 106 106 LYS HE2 H 2.982 0.030 2
1165 106 106 LYS HG2 H 1.474 0.030 2
1166 106 106 LYS HG3 H 1.304 0.030 2
1167 106 106 LYS C C 174.977 0.300 1
1168 106 106 LYS CA C 54.640 0.300 1
1169 106 106 LYS CB C 31.295 0.300 1
1170 106 106 LYS CD C 28.516 0.300 1
1171 106 106 LYS CE C 41.979 0.300 1
1172 106 106 LYS CG C 24.336 0.300 1
1173 106 106 LYS N N 121.309 0.300 1
1174 107 107 LEU H H 6.414 0.030 1
1175 107 107 LEU HA H 4.450 0.030 1
1176 107 107 LEU HB2 H 1.736 0.030 2
1177 107 107 LEU HB3 H 1.265 0.030 2
1178 107 107 LEU HD1 H 0.919 0.030 1
1179 107 107 LEU HD2 H 0.722 0.030 1
1180 107 107 LEU HG H 1.612 0.030 1
1181 107 107 LEU C C 175.736 0.300 1
1182 107 107 LEU CA C 54.758 0.300 1
1183 107 107 LEU CB C 41.949 0.300 1
1184 107 107 LEU CD1 C 27.346 0.300 2
1185 107 107 LEU CD2 C 23.663 0.300 2
1186 107 107 LEU CG C 27.228 0.300 1
1187 107 107 LEU N N 118.560 0.300 1
1188 108 108 LYS H H 8.872 0.030 1
1189 108 108 LYS HA H 4.209 0.030 1
1190 108 108 LYS HB2 H 1.772 0.030 1
1191 108 108 LYS HB3 H 1.772 0.030 1
1192 108 108 LYS HD2 H 1.681 0.030 2
1193 108 108 LYS HE2 H 3.000 0.030 2
1194 108 108 LYS HG2 H 1.370 0.030 1
1195 108 108 LYS HG3 H 1.370 0.030 1
1196 108 108 LYS C C 174.224 0.300 1
1197 108 108 LYS CA C 57.759 0.300 1
1198 108 108 LYS CB C 35.247 0.300 1
1199 108 108 LYS CD C 29.336 0.300 1
1200 108 108 LYS CE C 41.911 0.300 1
1201 108 108 LYS CG C 24.415 0.300 1
1202 108 108 LYS N N 122.533 0.300 1
1203 109 109 ASP H H 7.290 0.030 1
1204 109 109 ASP HA H 4.992 0.030 1
1205 109 109 ASP HB2 H 2.792 0.030 1
1206 109 109 ASP HB3 H 2.792 0.030 1
1207 109 109 ASP C C 175.877 0.300 1
1208 109 109 ASP CA C 52.683 0.300 1
1209 109 109 ASP CB C 43.960 0.300 1
1210 109 109 ASP N N 115.897 0.300 1
1211 110 110 ILE H H 8.818 0.030 1
1212 110 110 ILE HA H 3.697 0.030 1
1213 110 110 ILE HB H 1.904 0.030 1
1214 110 110 ILE HD1 H 0.732 0.030 1
1215 110 110 ILE HG12 H 1.465 0.030 2
1216 110 110 ILE HG13 H 1.396 0.030 2
1217 110 110 ILE HG2 H 0.880 0.030 1
1218 110 110 ILE C C 177.508 0.300 1
1219 110 110 ILE CA C 63.100 0.300 1
1220 110 110 ILE CB C 37.046 0.300 1
1221 110 110 ILE CD1 C 12.250 0.300 1
1222 110 110 ILE CG1 C 28.050 0.300 1
1223 110 110 ILE CG2 C 17.595 0.300 1
1224 110 110 ILE N N 123.008 0.300 1
1225 111 111 SER H H 8.429 0.030 1
1226 111 111 SER HA H 4.240 0.030 1
1227 111 111 SER HB2 H 3.953 0.030 2
1228 111 111 SER HB3 H 4.109 0.030 2
1229 111 111 SER C C 177.979 0.300 1
1230 111 111 SER CA C 61.356 0.300 1
1231 111 111 SER CB C 62.392 0.300 1
1232 111 111 SER N N 115.688 0.300 1
1233 112 112 THR H H 7.670 0.030 1
1234 112 112 THR HA H 4.064 0.030 1
1235 112 112 THR HB H 4.141 0.030 1
1236 112 112 THR HG2 H 1.514 0.030 1
1237 112 112 THR C C 174.710 0.300 1
1238 112 112 THR CA C 65.122 0.300 1
1239 112 112 THR CB C 69.130 0.300 1
1240 112 112 THR CG2 C 23.595 0.300 1
1241 112 112 THR N N 116.513 0.300 1
1242 113 113 LEU H H 7.777 0.030 1
1243 113 113 LEU HA H 4.161 0.030 1
1244 113 113 LEU HB2 H 1.992 0.030 2
1245 113 113 LEU HB3 H 1.366 0.030 2
1246 113 113 LEU HD1 H 0.807 0.030 1
1247 113 113 LEU HD2 H 0.657 0.030 1
1248 113 113 LEU HG H 1.776 0.030 1
1249 113 113 LEU C C 177.403 0.300 1
1250 113 113 LEU CA C 54.228 0.300 1
1251 113 113 LEU CB C 41.899 0.300 1
1252 113 113 LEU CD1 C 26.942 0.300 2
1253 113 113 LEU CD2 C 22.105 0.300 2
1254 113 113 LEU CG C 26.727 0.300 1
1255 113 113 LEU N N 115.895 0.300 1
1256 114 114 GLU H H 7.392 0.030 1
1257 114 114 GLU HA H 3.878 0.030 1
1258 114 114 GLU HB2 H 2.208 0.030 2
1259 114 114 GLU HB3 H 2.173 0.030 2
1260 114 114 GLU HG2 H 2.434 0.030 2
1261 114 114 GLU HG3 H 2.300 0.030 2
1262 114 114 GLU C C 175.199 0.300 1
1263 114 114 GLU CA C 61.492 0.300 1
1264 114 114 GLU CB C 27.655 0.300 1
1265 114 114 GLU CG C 36.785 0.300 1
1266 114 114 GLU N N 119.759 0.300 1
1267 115 115 PRO HA H 4.364 0.030 1
1268 115 115 PRO HB2 H 2.366 0.030 2
1269 115 115 PRO HB3 H 1.183 0.030 2
1270 115 115 PRO HD2 H 3.463 0.030 2
1271 115 115 PRO HD3 H 3.784 0.030 2
1272 115 115 PRO HG2 H 2.014 0.030 2
1273 115 115 PRO HG3 H 1.941 0.030 2
1274 115 115 PRO C C 178.255 0.300 1
1275 115 115 PRO CA C 65.504 0.300 1
1276 115 115 PRO CB C 32.228 0.300 1
1277 115 115 PRO CD C 50.796 0.300 1
1278 115 115 PRO CG C 28.410 0.300 1
1279 116 116 LEU H H 8.078 0.030 1
1280 116 116 LEU HA H 3.922 0.030 1
1281 116 116 LEU HB2 H 1.379 0.030 2
1282 116 116 LEU HB3 H 2.152 0.030 2
1283 116 116 LEU HD1 H 0.782 0.030 1
1284 116 116 LEU HD2 H 0.690 0.030 1
1285 116 116 LEU HG H 1.685 0.030 1
1286 116 116 LEU C C 178.151 0.300 1
1287 116 116 LEU CA C 55.987 0.300 1
1288 116 116 LEU CB C 39.394 0.300 1
1289 116 116 LEU CD1 C 26.870 0.300 2
1290 116 116 LEU CD2 C 22.747 0.300 2
1291 116 116 LEU CG C 27.219 0.300 1
1292 116 116 LEU N N 112.917 0.300 1
1293 117 117 LYS H H 8.148 0.030 1
1294 117 117 LYS HA H 3.876 0.030 1
1295 117 117 LYS HB2 H 1.902 0.030 1
1296 117 117 LYS HB3 H 1.902 0.030 1
1297 117 117 LYS HD2 H 1.846 0.030 2
1298 117 117 LYS HD3 H 1.758 0.030 2
1299 117 117 LYS HE2 H 3.035 0.030 1
1300 117 117 LYS HE3 H 3.035 0.030 1
1301 117 117 LYS HG2 H 1.578 0.030 2
1302 117 117 LYS HG3 H 1.759 0.030 2
1303 117 117 LYS C C 177.224 0.300 1
1304 117 117 LYS CA C 59.545 0.300 1
1305 117 117 LYS CB C 32.913 0.300 1
1306 117 117 LYS CD C 29.751 0.300 1
1307 117 117 LYS CE C 41.914 0.300 1
1308 117 117 LYS CG C 25.525 0.300 1
1309 117 117 LYS N N 119.959 0.300 1
1310 118 118 LYS H H 7.015 0.030 1
1311 118 118 LYS HA H 4.145 0.030 1
1312 118 118 LYS HB2 H 2.022 0.030 2
1313 118 118 LYS HB3 H 1.639 0.030 2
1314 118 118 LYS HD2 H 1.699 0.030 1
1315 118 118 LYS HD3 H 1.699 0.030 1
1316 118 118 LYS HE2 H 2.981 0.030 1
1317 118 118 LYS HE3 H 2.981 0.030 1
1318 118 118 LYS HG2 H 1.511 0.030 2
1319 118 118 LYS HG3 H 1.424 0.030 2
1320 118 118 LYS C C 176.105 0.300 1
1321 118 118 LYS CA C 56.640 0.300 1
1322 118 118 LYS CB C 32.939 0.300 1
1323 118 118 LYS CD C 28.994 0.300 1
1324 118 118 LYS CE C 42.022 0.300 1
1325 118 118 LYS CG C 25.804 0.300 1
1326 118 118 LYS N N 114.240 0.300 1
1327 119 119 LEU H H 7.164 0.030 1
1328 119 119 LEU HA H 4.591 0.030 1
1329 119 119 LEU HB2 H 2.036 0.030 2
1330 119 119 LEU HB3 H 1.714 0.030 2
1331 119 119 LEU HD1 H 0.930 0.030 1
1332 119 119 LEU HD2 H 0.943 0.030 1
1333 119 119 LEU HG H 1.455 0.030 1
1334 119 119 LEU C C 177.308 0.300 1
1335 119 119 LEU CA C 53.768 0.300 1
1336 119 119 LEU CB C 40.886 0.300 1
1337 119 119 LEU CD1 C 28.529 0.300 2
1338 119 119 LEU CD2 C 25.435 0.300 2
1339 119 119 LEU CG C 27.120 0.300 1
1340 119 119 LEU N N 120.196 0.300 1
1341 120 120 GLU H H 8.643 0.030 1
1342 120 120 GLU HA H 3.899 0.030 1
1343 120 120 GLU HB2 H 2.142 0.030 2
1344 120 120 GLU HB3 H 2.053 0.030 2
1345 120 120 GLU HG2 H 2.425 0.030 2
1346 120 120 GLU HG3 H 2.282 0.030 2
1347 120 120 GLU C C 178.013 0.300 1
1348 120 120 GLU CA C 59.680 0.300 1
1349 120 120 GLU CB C 30.240 0.300 1
1350 120 120 GLU CG C 36.780 0.300 1
1351 120 120 GLU N N 125.133 0.300 1
1352 121 121 CYS H H 9.167 0.030 1
1353 121 121 CYS HA H 4.427 0.030 1
1354 121 121 CYS HB2 H 3.014 0.030 2
1355 121 121 CYS HB3 H 2.739 0.030 2
1356 121 121 CYS C C 174.274 0.300 1
1357 121 121 CYS CA C 57.344 0.300 1
1358 121 121 CYS CB C 27.656 0.300 1
1359 121 121 CYS N N 115.360 0.300 1
1360 122 122 LEU H H 7.030 0.030 1
1361 122 122 LEU HA H 3.962 0.030 1
1362 122 122 LEU HB2 H 1.853 0.030 2
1363 122 122 LEU HB3 H 1.384 0.030 2
1364 122 122 LEU HD1 H 0.737 0.030 1
1365 122 122 LEU HD2 H 0.853 0.030 1
1366 122 122 LEU C C 174.214 0.300 1
1367 122 122 LEU CA C 57.483 0.300 1
1368 122 122 LEU CB C 42.612 0.300 1
1369 122 122 LEU CD1 C 23.309 0.300 2
1370 122 122 LEU CD2 C 27.149 0.300 2
1371 122 122 LEU N N 122.045 0.300 1
1372 123 123 LYS H H 9.256 0.030 1
1373 123 123 LYS HA H 4.991 0.030 1
1374 123 123 LYS HB2 H 1.859 0.030 2
1375 123 123 LYS HB3 H 1.829 0.030 2
1376 123 123 LYS HD2 H 1.822 0.030 2
1377 123 123 LYS HE2 H 3.056 0.030 2
1378 123 123 LYS HG2 H 1.579 0.030 1
1379 123 123 LYS HG3 H 1.579 0.030 1
1380 123 123 LYS C C 177.369 0.300 1
1381 123 123 LYS CA C 56.218 0.300 1
1382 123 123 LYS CB C 36.093 0.300 1
1383 123 123 LYS CD C 29.199 0.300 1
1384 123 123 LYS CE C 42.389 0.300 1
1385 123 123 LYS CG C 24.732 0.300 1
1386 123 123 LYS N N 127.028 0.300 1
1387 124 124 SER H H 8.007 0.030 1
1388 124 124 SER HA H 5.658 0.030 1
1389 124 124 SER HB2 H 3.521 0.030 2
1390 124 124 SER HB3 H 3.412 0.030 2
1391 124 124 SER C C 171.423 0.300 1
1392 124 124 SER CA C 56.661 0.300 1
1393 124 124 SER CB C 65.059 0.300 1
1394 124 124 SER N N 115.286 0.300 1
1395 125 125 LEU H H 8.301 0.030 1
1396 125 125 LEU HA H 5.455 0.030 1
1397 125 125 LEU HB2 H 1.799 0.030 2
1398 125 125 LEU HB3 H 1.116 0.030 2
1399 125 125 LEU HD1 H 0.857 0.030 1
1400 125 125 LEU HD2 H 0.598 0.030 1
1401 125 125 LEU HG H 1.259 0.030 1
1402 125 125 LEU C C 173.106 0.300 1
1403 125 125 LEU CA C 53.049 0.300 1
1404 125 125 LEU CB C 47.731 0.300 1
1405 125 125 LEU CD1 C 23.525 0.300 2
1406 125 125 LEU CD2 C 27.048 0.300 2
1407 125 125 LEU CG C 27.685 0.300 1
1408 125 125 LEU N N 128.413 0.300 1
1409 126 126 ASP H H 8.023 0.030 1
1410 126 126 ASP HA H 5.585 0.030 1
1411 126 126 ASP HB2 H 2.724 0.030 2
1412 126 126 ASP HB3 H 2.617 0.030 2
1413 126 126 ASP C C 175.197 0.300 1
1414 126 126 ASP CA C 53.185 0.300 1
1415 126 126 ASP CB C 44.562 0.300 1
1416 126 126 ASP N N 125.079 0.300 1
1417 127 127 LEU H H 10.033 0.030 1
1418 127 127 LEU HA H 4.227 0.030 1
1419 127 127 LEU HB2 H 2.161 0.030 2
1420 127 127 LEU HB3 H 1.399 0.030 2
1421 127 127 LEU HD1 H 0.950 0.030 1
1422 127 127 LEU HD2 H 0.784 0.030 1
1423 127 127 LEU HG H 1.259 0.030 1
1424 127 127 LEU C C 175.036 0.300 1
1425 127 127 LEU CA C 53.024 0.300 1
1426 127 127 LEU CB C 43.446 0.300 1
1427 127 127 LEU CD1 C 27.228 0.300 2
1428 127 127 LEU CD2 C 26.215 0.300 2
1429 127 127 LEU N N 124.123 0.300 1
1430 128 128 PHE H H 7.111 0.030 1
1431 128 128 PHE HA H 4.197 0.030 1
1432 128 128 PHE HB2 H 3.108 0.030 2
1433 128 128 PHE HB3 H 3.041 0.030 2
1434 128 128 PHE HD1 H 7.441 0.030 1
1435 128 128 PHE HD2 H 7.441 0.030 1
1436 128 128 PHE HE1 H 7.434 0.030 1
1437 128 128 PHE HE2 H 7.434 0.030 1
1438 128 128 PHE HZ H 7.277 0.030 1
1439 128 128 PHE C C 176.330 0.300 1
1440 128 128 PHE CA C 59.658 0.300 1
1441 128 128 PHE CB C 39.338 0.300 1
1442 128 128 PHE CD1 C 131.989 0.300 1
1443 128 128 PHE CD2 C 131.989 0.300 1
1444 128 128 PHE CE1 C 131.852 0.300 1
1445 128 128 PHE CE2 C 131.852 0.300 1
1446 128 128 PHE CZ C 130.285 0.300 1
1447 128 128 PHE N N 117.088 0.300 1
1448 129 129 ASN H H 9.299 0.030 1
1449 129 129 ASN HA H 4.227 0.030 1
1450 129 129 ASN HB2 H 3.060 0.030 1
1451 129 129 ASN HB3 H 3.060 0.030 1
1452 129 129 ASN HD21 H 7.867 0.030 2
1453 129 129 ASN HD22 H 6.927 0.030 2
1454 129 129 ASN C C 175.893 0.300 1
1455 129 129 ASN CA C 55.104 0.300 1
1456 129 129 ASN CB C 37.379 0.300 1
1457 129 129 ASN N N 114.718 0.300 1
1458 129 129 ASN ND2 N 114.194 0.300 1
1459 130 130 CYS H H 8.286 0.030 1
1460 130 130 CYS HA H 4.778 0.030 1
1461 130 130 CYS HB2 H 3.092 0.030 2
1462 130 130 CYS HB3 H 3.479 0.030 2
1463 130 130 CYS C C 176.675 0.300 1
1464 130 130 CYS CA C 59.682 0.300 1
1465 130 130 CYS CB C 29.014 0.300 1
1466 130 130 CYS N N 117.323 0.300 1
1467 131 131 GLU H H 9.646 0.030 1
1468 131 131 GLU HA H 3.927 0.030 1
1469 131 131 GLU HB2 H 2.028 0.030 2
1470 131 131 GLU HB3 H 1.974 0.030 2
1471 131 131 GLU HG2 H 2.372 0.030 2
1472 131 131 GLU HG3 H 2.305 0.030 2
1473 131 131 GLU C C 178.215 0.300 1
1474 131 131 GLU CA C 60.175 0.300 1
1475 131 131 GLU CB C 29.680 0.300 1
1476 131 131 GLU CG C 36.950 0.300 1
1477 131 131 GLU N N 128.905 0.300 1
1478 132 132 VAL H H 8.136 0.030 1
1479 132 132 VAL HA H 3.828 0.030 1
1480 132 132 VAL HB H 1.580 0.030 1
1481 132 132 VAL HG1 H 0.669 0.030 1
1482 132 132 VAL HG2 H 0.810 0.030 1
1483 132 132 VAL C C 173.581 0.300 1
1484 132 132 VAL CA C 63.716 0.300 1
1485 132 132 VAL CB C 31.610 0.300 1
1486 132 132 VAL CG1 C 20.246 0.300 2
1487 132 132 VAL CG2 C 21.597 0.300 2
1488 132 132 VAL N N 117.615 0.300 1
1489 133 133 THR H H 7.161 0.030 1
1490 133 133 THR HA H 2.330 0.030 1
1491 133 133 THR HB H 3.746 0.030 1
1492 133 133 THR HG2 H 0.969 0.030 1
1493 133 133 THR C C 175.080 0.300 1
1494 133 133 THR CA C 62.527 0.300 1
1495 133 133 THR CB C 69.429 0.300 1
1496 133 133 THR CG2 C 22.688 0.300 1
1497 133 133 THR N N 107.987 0.300 1
1498 134 134 ASN H H 7.653 0.030 1
1499 134 134 ASN HA H 4.669 0.030 1
1500 134 134 ASN HB2 H 2.913 0.030 2
1501 134 134 ASN HB3 H 2.745 0.030 2
1502 134 134 ASN HD21 H 7.416 0.030 2
1503 134 134 ASN HD22 H 6.912 0.030 2
1504 134 134 ASN C C 176.028 0.300 1
1505 134 134 ASN CA C 53.100 0.300 1
1506 134 134 ASN CB C 39.046 0.300 1
1507 134 134 ASN N N 117.591 0.300 1
1508 134 134 ASN ND2 N 112.854 0.300 1
1509 135 135 LEU H H 7.335 0.030 1
1510 135 135 LEU HA H 4.234 0.030 1
1511 135 135 LEU HB2 H 1.814 0.030 2
1512 135 135 LEU HB3 H 1.615 0.030 2
1513 135 135 LEU HD1 H 1.136 0.030 1
1514 135 135 LEU HD2 H 1.002 0.030 1
1515 135 135 LEU HG H 1.943 0.030 1
1516 135 135 LEU C C 178.601 0.300 1
1517 135 135 LEU CA C 55.310 0.300 1
1518 135 135 LEU CB C 42.628 0.300 1
1519 135 135 LEU CD1 C 26.192 0.300 2
1520 135 135 LEU CD2 C 23.051 0.300 2
1521 135 135 LEU CG C 26.979 0.300 1
1522 135 135 LEU N N 121.552 0.300 1
1523 136 136 ASN H H 8.973 0.030 1
1524 136 136 ASN HA H 4.438 0.030 1
1525 136 136 ASN HB2 H 2.760 0.030 1
1526 136 136 ASN HB3 H 2.760 0.030 1
1527 136 136 ASN HD21 H 7.718 0.030 2
1528 136 136 ASN HD22 H 6.979 0.030 2
1529 136 136 ASN C C 175.794 0.300 1
1530 136 136 ASN CA C 55.469 0.300 1
1531 136 136 ASN CB C 38.283 0.300 1
1532 136 136 ASN N N 122.220 0.300 1
1533 136 136 ASN ND2 N 113.340 0.300 1
1534 137 137 ASP H H 8.805 0.030 1
1535 137 137 ASP HA H 4.700 0.030 1
1536 137 137 ASP HB2 H 2.726 0.030 2
1537 137 137 ASP HB3 H 2.769 0.030 2
1538 137 137 ASP C C 175.959 0.300 1
1539 137 137 ASP CA C 53.666 0.300 1
1540 137 137 ASP CB C 39.364 0.300 1
1541 137 137 ASP N N 118.384 0.300 1
1542 138 138 TYR H H 7.280 0.030 1
1543 138 138 TYR HA H 4.033 0.030 1
1544 138 138 TYR HB2 H 3.625 0.030 2
1545 138 138 TYR HB3 H 2.720 0.030 2
1546 138 138 TYR HD1 H 6.786 0.030 1
1547 138 138 TYR HD2 H 6.786 0.030 1
1548 138 138 TYR HE1 H 6.474 0.030 1
1549 138 138 TYR HE2 H 6.474 0.030 1
1550 138 138 TYR C C 175.308 0.300 1
1551 138 138 TYR CA C 61.005 0.300 1
1552 138 138 TYR CB C 39.277 0.300 1
1553 138 138 TYR N N 121.112 0.300 1
1554 139 139 ARG H H 8.306 0.030 1
1555 139 139 ARG HA H 2.793 0.030 1
1556 139 139 ARG HB2 H 1.620 0.030 2
1557 139 139 ARG HB3 H 1.698 0.030 2
1558 139 139 ARG HD2 H 3.529 0.030 2
1559 139 139 ARG HD3 H 3.205 0.030 2
1560 139 139 ARG HE H 8.045 0.030 1
1561 139 139 ARG HG2 H 1.328 0.030 2
1562 139 139 ARG HG3 H 1.741 0.030 2
1563 139 139 ARG C C 177.982 0.300 1
1564 139 139 ARG CA C 60.624 0.300 1
1565 139 139 ARG CB C 29.312 0.300 1
1566 139 139 ARG CD C 42.864 0.300 1
1567 139 139 ARG CG C 28.246 0.300 1
1568 139 139 ARG N N 118.702 0.300 1
1569 139 139 ARG NE N 81.207 0.300 1
1570 140 140 GLU H H 8.385 0.030 1
1571 140 140 GLU HA H 4.007 0.030 1
1572 140 140 GLU HB2 H 2.053 0.030 2
1573 140 140 GLU HB3 H 1.923 0.030 2
1574 140 140 GLU HG2 H 2.289 0.030 2
1575 140 140 GLU C C 179.926 0.300 1
1576 140 140 GLU CA C 59.493 0.300 1
1577 140 140 GLU CB C 29.654 0.300 1
1578 140 140 GLU CG C 36.648 0.300 1
1579 140 140 GLU N N 116.540 0.300 1
1580 141 141 SER H H 8.470 0.030 1
1581 141 141 SER HA H 4.109 0.030 1
1582 141 141 SER HB2 H 3.706 0.030 2
1583 141 141 SER HB3 H 4.023 0.030 2
1584 141 141 SER C C 176.885 0.300 1
1585 141 141 SER CA C 62.353 0.300 1
1586 141 141 SER CB C 62.744 0.300 1
1587 141 141 SER N N 114.352 0.300 1
1588 142 142 VAL H H 8.105 0.030 1
1589 142 142 VAL HA H 3.318 0.030 1
1590 142 142 VAL HB H 1.463 0.030 1
1591 142 142 VAL HG1 H 0.411 0.030 1
1592 142 142 VAL HG2 H 0.651 0.030 1
1593 142 142 VAL C C 177.171 0.300 1
1594 142 142 VAL CA C 67.654 0.300 1
1595 142 142 VAL CB C 30.076 0.300 1
1596 142 142 VAL CG1 C 22.327 0.300 2
1597 142 142 VAL CG2 C 24.005 0.300 2
1598 142 142 VAL N N 124.869 0.300 1
1599 143 143 PHE H H 8.098 0.030 1
1600 143 143 PHE HA H 4.219 0.030 1
1601 143 143 PHE HB2 H 2.938 0.030 2
1602 143 143 PHE HB3 H 2.795 0.030 2
1603 143 143 PHE HD1 H 7.136 0.030 1
1604 143 143 PHE HD2 H 7.136 0.030 1
1605 143 143 PHE HE1 H 6.897 0.030 1
1606 143 143 PHE HE2 H 6.897 0.030 1
1607 143 143 PHE HZ H 7.165 0.030 1
1608 143 143 PHE C C 178.633 0.300 1
1609 143 143 PHE CA C 61.544 0.300 1
1610 143 143 PHE CB C 38.170 0.300 1
1611 143 143 PHE CD1 C 131.609 0.300 1
1612 143 143 PHE CD2 C 131.609 0.300 1
1613 143 143 PHE CE1 C 130.582 0.300 1
1614 143 143 PHE CE2 C 130.582 0.300 1
1615 143 143 PHE CZ C 129.698 0.300 1
1616 143 143 PHE N N 117.174 0.300 1
1617 144 144 LYS H H 7.740 0.030 1
1618 144 144 LYS HA H 4.011 0.030 1
1619 144 144 LYS HB2 H 1.828 0.030 1
1620 144 144 LYS HB3 H 1.828 0.030 1
1621 144 144 LYS HD2 H 1.658 0.030 2
1622 144 144 LYS HE2 H 2.938 0.030 2
1623 144 144 LYS HG2 H 1.406 0.030 2
1624 144 144 LYS HG3 H 1.567 0.030 2
1625 144 144 LYS C C 177.917 0.300 1
1626 144 144 LYS CA C 58.743 0.300 1
1627 144 144 LYS CB C 32.807 0.300 1
1628 144 144 LYS CD C 29.426 0.300 1
1629 144 144 LYS CE C 42.048 0.300 1
1630 144 144 LYS CG C 25.645 0.300 1
1631 144 144 LYS N N 117.284 0.300 1
1632 145 145 LEU H H 7.403 0.030 1
1633 145 145 LEU HA H 4.031 0.030 1
1634 145 145 LEU HB2 H 1.858 0.030 2
1635 145 145 LEU HB3 H 1.553 0.030 2
1636 145 145 LEU HD1 H 0.911 0.030 1
1637 145 145 LEU HD2 H 0.709 0.030 1
1638 145 145 LEU HG H 1.570 0.030 1
1639 145 145 LEU C C 175.847 0.300 1
1640 145 145 LEU CA C 57.037 0.300 1
1641 145 145 LEU CB C 43.793 0.300 1
1642 145 145 LEU CD1 C 24.165 0.300 2
1643 145 145 LEU CD2 C 26.517 0.300 2
1644 145 145 LEU CG C 26.467 0.300 1
1645 145 145 LEU N N 121.000 0.300 1
1646 146 146 LEU H H 7.870 0.030 1
1647 146 146 LEU HA H 4.895 0.030 1
1648 146 146 LEU HB2 H 1.930 0.030 2
1649 146 146 LEU HB3 H 0.889 0.030 2
1650 146 146 LEU HD1 H 0.658 0.030 1
1651 146 146 LEU HD2 H 0.692 0.030 1
1652 146 146 LEU HG H 1.447 0.030 1
1653 146 146 LEU C C 173.499 0.300 1
1654 146 146 LEU CA C 50.756 0.300 1
1655 146 146 LEU CB C 41.485 0.300 1
1656 146 146 LEU CD1 C 26.857 0.300 2
1657 146 146 LEU CD2 C 24.129 0.300 2
1658 146 146 LEU CG C 26.309 0.300 1
1659 146 146 LEU N N 115.235 0.300 1
1660 147 147 PRO HA H 4.448 0.030 1
1661 147 147 PRO HB2 H 2.323 0.030 2
1662 147 147 PRO HB3 H 1.990 0.030 2
1663 147 147 PRO HD2 H 3.783 0.030 2
1664 147 147 PRO HD3 H 3.461 0.030 2
1665 147 147 PRO HG2 H 1.995 0.030 2
1666 147 147 PRO C C 177.487 0.300 1
1667 147 147 PRO CA C 64.241 0.300 1
1668 147 147 PRO CB C 31.858 0.300 1
1669 147 147 PRO CD C 50.735 0.300 1
1670 147 147 PRO CG C 27.272 0.300 1
1671 148 148 GLN H H 9.920 0.030 1
1672 148 148 GLN HA H 4.311 0.030 1
1673 148 148 GLN HB2 H 2.265 0.030 2
1674 148 148 GLN HB3 H 1.931 0.030 2
1675 148 148 GLN HE21 H 6.076 0.030 2
1676 148 148 GLN HE22 H 7.619 0.030 2
1677 148 148 GLN HG2 H 2.606 0.030 2
1678 148 148 GLN HG3 H 2.513 0.030 2
1679 148 148 GLN C C 175.222 0.300 1
1680 148 148 GLN CA C 55.815 0.300 1
1681 148 148 GLN CB C 27.481 0.300 1
1682 148 148 GLN CG C 33.021 0.300 1
1683 148 148 GLN N N 120.709 0.300 1
1684 148 148 GLN NE2 N 110.892 0.300 1
1685 149 149 LEU H H 7.645 0.030 1
1686 149 149 LEU HA H 4.093 0.030 1
1687 149 149 LEU HB2 H 1.751 0.030 2
1688 149 149 LEU HB3 H 1.429 0.030 2
1689 149 149 LEU HD1 H 0.622 0.030 1
1690 149 149 LEU HD2 H 0.563 0.030 1
1691 149 149 LEU HG H 1.557 0.030 1
1692 149 149 LEU C C 177.144 0.300 1
1693 149 149 LEU CA C 55.693 0.300 1
1694 149 149 LEU CB C 44.905 0.300 1
1695 149 149 LEU CD1 C 25.638 0.300 2
1696 149 149 LEU CD2 C 25.786 0.300 2
1697 149 149 LEU CG C 26.719 0.300 1
1698 149 149 LEU N N 123.184 0.300 1
1699 150 150 THR H H 8.345 0.030 1
1700 150 150 THR HA H 4.300 0.030 1
1701 150 150 THR HB H 3.648 0.030 1
1702 150 150 THR HG2 H 0.412 0.030 1
1703 150 150 THR C C 173.583 0.300 1
1704 150 150 THR CA C 65.203 0.300 1
1705 150 150 THR CB C 69.627 0.300 1
1706 150 150 THR CG2 C 21.786 0.300 1
1707 150 150 THR N N 118.745 0.300 1
1708 151 151 TYR H H 8.602 0.030 1
1709 151 151 TYR HA H 4.796 0.030 1
1710 151 151 TYR HB2 H 2.762 0.030 2
1711 151 151 TYR HB3 H 2.690 0.030 2
1712 151 151 TYR HD1 H 6.802 0.030 1
1713 151 151 TYR HD2 H 6.802 0.030 1
1714 151 151 TYR HE1 H 6.793 0.030 1
1715 151 151 TYR HE2 H 6.793 0.030 1
1716 151 151 TYR C C 172.979 0.300 1
1717 151 151 TYR CA C 57.531 0.300 1
1718 151 151 TYR CB C 41.897 0.300 1
1719 151 151 TYR CD1 C 133.187 0.300 1
1720 151 151 TYR CD2 C 133.187 0.300 1
1721 151 151 TYR CE1 C 118.447 0.300 1
1722 151 151 TYR CE2 C 118.447 0.300 1
1723 151 151 TYR N N 117.652 0.300 1
1724 152 152 LEU H H 8.871 0.030 1
1725 152 152 LEU HA H 5.527 0.030 1
1726 152 152 LEU HB2 H 0.517 0.030 2
1727 152 152 LEU HB3 H 1.505 0.030 2
1728 152 152 LEU HD1 H 0.701 0.030 1
1729 152 152 LEU HD2 H -0.045 0.030 1
1730 152 152 LEU HG H 1.083 0.030 1
1731 152 152 LEU C C 177.006 0.300 1
1732 152 152 LEU CA C 52.684 0.300 1
1733 152 152 LEU CB C 46.358 0.300 1
1734 152 152 LEU CD1 C 22.236 0.300 2
1735 152 152 LEU CD2 C 26.598 0.300 2
1736 152 152 LEU CG C 27.697 0.300 1
1737 152 152 LEU N N 124.102 0.300 1
1738 153 153 ASP H H 10.011 0.030 1
1739 153 153 ASP HA H 4.591 0.030 1
1740 153 153 ASP HB2 H 2.842 0.030 1
1741 153 153 ASP HB3 H 2.842 0.030 1
1742 153 153 ASP C C 176.878 0.300 1
1743 153 153 ASP CA C 55.959 0.300 1
1744 153 153 ASP CB C 39.583 0.300 1
1745 153 153 ASP N N 131.866 0.300 1
1746 154 154 GLY H H 8.926 0.030 1
1747 154 154 GLY HA2 H 4.234 0.030 2
1748 154 154 GLY HA3 H 3.540 0.030 2
1749 154 154 GLY C C 174.322 0.300 1
1750 154 154 GLY CA C 45.509 0.300 1
1751 154 154 GLY N N 102.766 0.300 1
1752 155 155 TYR H H 8.081 0.030 1
1753 155 155 TYR HA H 5.439 0.030 1
1754 155 155 TYR HB2 H 2.951 0.030 2
1755 155 155 TYR HB3 H 2.908 0.030 2
1756 155 155 TYR HD1 H 6.998 0.030 1
1757 155 155 TYR HD2 H 6.998 0.030 1
1758 155 155 TYR HE1 H 6.912 0.030 1
1759 155 155 TYR HE2 H 6.912 0.030 1
1760 155 155 TYR C C 177.127 0.300 1
1761 155 155 TYR CA C 57.306 0.300 1
1762 155 155 TYR CB C 44.042 0.300 1
1763 155 155 TYR CD1 C 133.250 0.300 1
1764 155 155 TYR CD2 C 133.250 0.300 1
1765 155 155 TYR CE1 C 118.266 0.300 1
1766 155 155 TYR CE2 C 118.266 0.300 1
1767 155 155 TYR N N 117.799 0.300 1
1768 156 156 ASP H H 9.493 0.030 1
1769 156 156 ASP HA H 5.528 0.030 1
1770 156 156 ASP HB2 H 3.257 0.030 2
1771 156 156 ASP HB3 H 2.600 0.030 2
1772 156 156 ASP C C 178.029 0.300 1
1773 156 156 ASP CA C 52.698 0.300 1
1774 156 156 ASP CB C 41.922 0.300 1
1775 156 156 ASP N N 126.174 0.300 1
1776 157 157 ARG H H 8.242 0.030 1
1777 157 157 ARG HA H 3.553 0.030 1
1778 157 157 ARG HB2 H 1.157 0.030 2
1779 157 157 ARG HB3 H 1.078 0.030 2
1780 157 157 ARG HD2 H 2.738 0.030 1
1781 157 157 ARG HD3 H 2.738 0.030 1
1782 157 157 ARG HE H 7.138 0.030 1
1783 157 157 ARG HG2 H 0.573 0.030 2
1784 157 157 ARG HG3 H 0.664 0.030 2
1785 157 157 ARG C C 177.659 0.300 1
1786 157 157 ARG CA C 58.567 0.300 1
1787 157 157 ARG CB C 29.856 0.300 1
1788 157 157 ARG CD C 43.320 0.300 1
1789 157 157 ARG CG C 26.807 0.300 1
1790 157 157 ARG N N 116.656 0.300 1
1791 157 157 ARG NE N 85.064 0.300 1
1792 158 158 GLU H H 8.149 0.030 1
1793 158 158 GLU HA H 4.375 0.030 1
1794 158 158 GLU HB2 H 2.317 0.030 2
1795 158 158 GLU HB3 H 1.887 0.030 2
1796 158 158 GLU HG2 H 2.069 0.030 1
1797 158 158 GLU HG3 H 2.069 0.030 1
1798 158 158 GLU C C 175.267 0.300 1
1799 158 158 GLU CA C 55.419 0.300 1
1800 158 158 GLU CB C 29.066 0.300 1
1801 158 158 GLU CG C 36.659 0.300 1
1802 158 158 GLU N N 119.335 0.300 1
1803 159 159 ASP H H 8.377 0.030 1
1804 159 159 ASP HA H 4.338 0.030 1
1805 159 159 ASP HB2 H 2.890 0.030 1
1806 159 159 ASP HB3 H 2.890 0.030 1
1807 159 159 ASP C C 174.779 0.300 1
1808 159 159 ASP CA C 56.719 0.300 1
1809 159 159 ASP CB C 38.843 0.300 1
1810 159 159 ASP N N 115.659 0.300 1
1811 160 160 GLN H H 8.823 0.030 1
1812 160 160 GLN HA H 4.671 0.030 1
1813 160 160 GLN HB2 H 2.400 0.030 2
1814 160 160 GLN HB3 H 2.144 0.030 2
1815 160 160 GLN HE21 H 7.766 0.030 2
1816 160 160 GLN HE22 H 6.897 0.030 2
1817 160 160 GLN HG2 H 2.442 0.030 2
1818 160 160 GLN HG3 H 2.276 0.030 2
1819 160 160 GLN C C 176.536 0.300 1
1820 160 160 GLN CA C 54.444 0.300 1
1821 160 160 GLN CB C 29.489 0.300 1
1822 160 160 GLN CG C 34.255 0.300 1
1823 160 160 GLN N N 117.910 0.300 1
1824 160 160 GLN NE2 N 114.010 0.300 1
1825 161 161 GLU H H 8.876 0.030 1
1826 161 161 GLU HA H 3.868 0.030 1
1827 161 161 GLU HB2 H 1.818 0.030 2
1828 161 161 GLU HB3 H 1.765 0.030 2
1829 161 161 GLU HG2 H 2.159 0.030 2
1830 161 161 GLU HG3 H 2.017 0.030 2
1831 161 161 GLU C C 176.681 0.300 1
1832 161 161 GLU CA C 56.289 0.300 1
1833 161 161 GLU CB C 30.687 0.300 1
1834 161 161 GLU CG C 36.499 0.300 1
1835 161 161 GLU N N 123.995 0.300 1
1836 162 162 ALA H H 7.800 0.030 1
1837 162 162 ALA HA H 3.970 0.030 1
1838 162 162 ALA HB H 0.438 0.030 1
1839 162 162 ALA C C 175.521 0.300 1
1840 162 162 ALA CA C 50.550 0.300 1
1841 162 162 ALA CB C 16.408 0.300 1
1842 162 162 ALA N N 126.970 0.300 1
1843 163 163 PRO HA H 4.401 0.030 1
1844 163 163 PRO HB2 H 2.251 0.030 2
1845 163 163 PRO HB3 H 1.909 0.030 2
1846 163 163 PRO HD2 H 3.776 0.030 2
1847 163 163 PRO HD3 H 3.381 0.030 2
1848 163 163 PRO HG2 H 2.034 0.030 2
1849 163 163 PRO HG3 H 1.937 0.030 2
1850 163 163 PRO C C 176.636 0.300 1
1851 163 163 PRO CA C 62.502 0.300 1
1852 163 163 PRO CB C 32.228 0.300 1
1853 163 163 PRO CD C 50.522 0.300 1
1854 163 163 PRO CG C 27.143 0.300 1
1855 164 164 ASP H H 8.379 0.030 1
1856 164 164 ASP HA H 4.426 0.030 1
1857 164 164 ASP HB2 H 2.629 0.030 2
1858 164 164 ASP HB3 H 2.585 0.030 2
1859 164 164 ASP C C 176.636 0.300 1
1860 164 164 ASP CA C 54.544 0.300 1
1861 164 164 ASP CB C 40.995 0.300 1
1862 164 164 ASP N N 120.691 0.300 1
1863 165 165 SER H H 8.117 0.030 1
1864 165 165 SER HA H 4.324 0.030 1
1865 165 165 SER HB2 H 3.827 0.030 2
1866 165 165 SER HB3 H 3.749 0.030 2
1867 165 165 SER C C 174.392 0.300 1
1868 165 165 SER CA C 58.553 0.300 1
1869 165 165 SER CB C 63.806 0.300 1
1870 165 165 SER N N 115.382 0.300 1
1871 166 166 ASP H H 8.309 0.030 1
1872 166 166 ASP HA H 4.609 0.030 1
1873 166 166 ASP HB2 H 2.657 0.030 2
1874 166 166 ASP HB3 H 2.562 0.030 2
1875 166 166 ASP C C 175.753 0.300 1
1876 166 166 ASP CA C 54.368 0.300 1
1877 166 166 ASP CB C 41.134 0.300 1
1878 166 166 ASP N N 122.168 0.300 1
1879 167 167 ALA H H 7.939 0.030 1
1880 167 167 ALA HA H 4.271 0.030 1
1881 167 167 ALA HB H 1.338 0.030 1
1882 167 167 ALA C C 176.777 0.300 1
1883 167 167 ALA CA C 52.490 0.300 1
1884 167 167 ALA CB C 19.534 0.300 1
1885 167 167 ALA N N 123.926 0.300 1
1886 168 168 GLU H H 7.874 0.030 1
1887 168 168 GLU HA H 4.052 0.030 1
1888 168 168 GLU HB2 H 1.848 0.030 2
1889 168 168 GLU HB3 H 2.001 0.030 2
1890 168 168 GLU HG2 H 2.175 0.030 2
1891 168 168 GLU C C 181.240 0.300 1
1892 168 168 GLU CA C 58.025 0.300 1
1893 168 168 GLU CB C 31.200 0.300 1
1894 168 168 GLU CG C 36.680 0.300 1
1895 168 168 GLU N N 125.194 0.300 1
stop_
save_