data_4064
#######################
# Entry information #
#######################
save_entry_information
_Saveframe_category entry_information
_Entry_title
;
Assignments, Secondary Structure and Dynamics of the Inhibitor-Free Catalytic
Fragment of Human Fibroblast Collagenase
;
_BMRB_accession_number 4064
_BMRB_flat_file_name bmr4064.str
_Entry_type original
_Submission_date 1997-01-28
_Accession_date 1997-10-05
_Entry_origination BMRB
_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 Moy Franklin J. .
2 Pisano Michael R. .
3 Chanda Pranab K. .
4 Urbano Charlotte . .
5 Killar Loran M. .
6 Sung Mei-Li . .
7 Powers Robert . .
stop_
loop_
_Saveframe_category_type
_Saveframe_category_type_count
assigned_chemical_shifts 1
stop_
loop_
_Data_type
_Data_type_count
"1H chemical shifts" 930
"13C chemical shifts" 716
"15N chemical shifts" 158
stop_
loop_
_Revision_date
_Revision_keyword
_Revision_author
_Revision_detail
1998-02-25 reformat BMRB 'converted to NMR-STAR version 2.1'
stop_
save_
#############################
# Citation for this entry #
#############################
save_entry_citation
_Saveframe_category entry_citation
_Citation_full
;
Moy, F. J., Pisano, M. R., Chanda, P. K., Urbano, C., Killar, L. M., Sung, M-L.,
and Powers, R., "Assignments, Secondary Structure and Dynamics of the Inhibitor-
Free Catalytic Fragment of Human Fibroblast Collagenase," J. Biomol. NMR, 10,
9-19 (1997).
;
_Citation_title
;
Assignments, Secondary Structure and Dynamics of the Inhibitor-Free Catalytic
Fragment of Human Fibroblast Collagenase
;
_Citation_status published
_Citation_type journal
_CAS_abstract_code .
_MEDLINE_UI_code 97475657
_PubMed_ID ?
loop_
_Author_ordinal
_Author_family_name
_Author_given_name
_Author_middle_initials
_Author_family_title
1 Moy Franklin J. .
2 Pisano Michael R. .
3 Chanda Pranab K. .
4 Urbano Charlotte . .
5 Killar Loran M. .
6 Sung Mei-Li . .
7 Powers Robert . .
stop_
_Journal_abbreviation 'J. Biomol. NMR'
_Journal_volume 10
_Journal_issue .
_Journal_CSD .
_Book_chapter_title .
_Book_volume .
_Book_series .
_Book_ISBN .
_Conference_state_province .
_Conference_abstract_number .
_Page_first 9
_Page_last 19
_Year 1997
_Details .
loop_
_Keyword
'Fibroblast collagenase'
'human fibroblast collagenase (MMP-1)'
'matrix metalloproteinase (MMP)'
'Multidimensional NMR'
stop_
save_
##################################
# Molecular system description #
##################################
save_system_MMP-1
_Saveframe_category molecular_system
_Mol_system_name 'human fibroblast collagenase'
_Abbreviation_common MMP-1
_Enzyme_commission_number .
loop_
_Mol_system_component_name
_Mol_label
collagenase $MMP-1
stop_
_System_molecular_weight .
_System_physical_state native
_System_oligomer_state monomer
_System_paramagnetic no
_System_thiol_state .
loop_
_Biological_function
'degradation of extracellular matrix associated with normal tissue remodeling'
stop_
_Database_query_date .
_Details .
save_
########################
# Monomeric polymers #
########################
save_MMP-1
_Saveframe_category monomeric_polymer
_Mol_type polymer
_Mol_polymer_class protein
_Name_common 'human fibroblast collagenase'
_Abbreviation_common MMP-1
_Molecular_mass 18700
_Mol_thiol_state .
_Details .
##############################
# Polymer residue sequence #
##############################
_Residue_count 169
_Mol_residue_sequence
;
VLTEGNPRWEQTHLTYRIEN
YTPDLPRADVDHAIEKAFQL
WSNVTPLTFTKVSEGQADIM
ISFVRGDHRDNSPFDGPGGN
LAHAFQPGPGIGGDAHFDED
ERWTNNFREYNLHRVAAHEL
GHSLGLSHSTDIGALMYPSY
TFSGDVQLAQDDIDGIQAIY
GRSQNPVQP
;
loop_
_Residue_seq_code
_Residue_label
1 VAL 2 LEU 3 THR 4 GLU 5 GLY
6 ASN 7 PRO 8 ARG 9 TRP 10 GLU
11 GLN 12 THR 13 HIS 14 LEU 15 THR
16 TYR 17 ARG 18 ILE 19 GLU 20 ASN
21 TYR 22 THR 23 PRO 24 ASP 25 LEU
26 PRO 27 ARG 28 ALA 29 ASP 30 VAL
31 ASP 32 HIS 33 ALA 34 ILE 35 GLU
36 LYS 37 ALA 38 PHE 39 GLN 40 LEU
41 TRP 42 SER 43 ASN 44 VAL 45 THR
46 PRO 47 LEU 48 THR 49 PHE 50 THR
51 LYS 52 VAL 53 SER 54 GLU 55 GLY
56 GLN 57 ALA 58 ASP 59 ILE 60 MET
61 ILE 62 SER 63 PHE 64 VAL 65 ARG
66 GLY 67 ASP 68 HIS 69 ARG 70 ASP
71 ASN 72 SER 73 PRO 74 PHE 75 ASP
76 GLY 77 PRO 78 GLY 79 GLY 80 ASN
81 LEU 82 ALA 83 HIS 84 ALA 85 PHE
86 GLN 87 PRO 88 GLY 89 PRO 90 GLY
91 ILE 92 GLY 93 GLY 94 ASP 95 ALA
96 HIS 97 PHE 98 ASP 99 GLU 100 ASP
101 GLU 102 ARG 103 TRP 104 THR 105 ASN
106 ASN 107 PHE 108 ARG 109 GLU 110 TYR
111 ASN 112 LEU 113 HIS 114 ARG 115 VAL
116 ALA 117 ALA 118 HIS 119 GLU 120 LEU
121 GLY 122 HIS 123 SER 124 LEU 125 GLY
126 LEU 127 SER 128 HIS 129 SER 130 THR
131 ASP 132 ILE 133 GLY 134 ALA 135 LEU
136 MET 137 TYR 138 PRO 139 SER 140 TYR
141 THR 142 PHE 143 SER 144 GLY 145 ASP
146 VAL 147 GLN 148 LEU 149 ALA 150 GLN
151 ASP 152 ASP 153 ILE 154 ASP 155 GLY
156 ILE 157 GLN 158 ALA 159 ILE 160 TYR
161 GLY 162 ARG 163 SER 164 GLN 165 ASN
166 PRO 167 VAL 168 GLN 169 PRO
stop_
_Sequence_homology_query_date .
_Sequence_homology_query_revised_last_date 2015-06-02
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 1AYK "Inhibitor-Free Catalytic Fragment Of Human Fibroblast Collagenase, Nmr, 30 Structures" 100.00 169 100.00 100.00 4.00e-121
PDB 1CGE "Crystal Structures Of Recombinant 19-Kda Human Fibroblast Collagenase Complexed To Itself" 99.41 168 99.40 99.40 2.18e-119
PDB 1CGF "Crystal Structures Of Recombinant 19-Kda Human Fibroblast Collagenase Complexed To Itself" 95.86 162 99.38 99.38 2.11e-114
PDB 1CGL "Structure Of The Catalytic Domain Of Fibroblast Collagenase Complexed With An Inhibitor" 100.00 169 98.22 98.82 1.97e-118
PDB 1HFC "1.56 Angstrom Structure Of Mature Truncated Human Fibroblast Collagenase" 100.00 169 100.00 100.00 4.00e-121
PDB 1SU3 "X-Ray Structure Of Human Prommp-1: New Insights Into Collagenase Action" 100.00 450 100.00 100.00 9.84e-119
PDB 2AYK "Inhibitor-Free Catalytic Fragment Of Human Fibroblast Collagenase, Nmr, Minimized Average Structure" 100.00 169 100.00 100.00 4.00e-121
PDB 2CLT "Crystal Structure Of The Active Form (Full-Length) Of Human Fibroblast Collagenase." 100.00 367 99.41 99.41 3.96e-118
PDB 2J0T "Crystal Structure Of The Catalytic Domain Of Mmp-1 In Complex With The Inhibitory Domain Of Timp-1" 100.00 170 100.00 100.00 4.52e-121
PDB 2TCL "Structure Of The Catalytic Domain Of Human Fibroblast Collagenase Complexed With An Inhibitor" 100.00 169 100.00 100.00 4.00e-121
PDB 3AYK "Catalytic Fragment Of Human Fibroblast Collagenase Complexed With Cgs-27023a, Nmr, Minimized Average Structure" 100.00 169 100.00 100.00 4.00e-121
PDB 3SHI "Crystal Structure Of Human Mmp1 Catalytic Domain At 2.2 A Resolution" 92.31 156 100.00 100.00 9.66e-111
PDB 4AUO "Crystal Structure Of Mmp-1(E200a) In Complex With A Triple- Helical Collagen Peptide" 100.00 367 99.41 99.41 3.96e-118
PDB 4AYK "Catalytic Fragment Of Human Fibroblast Collagenase Complexed With Cgs-27023a, Nmr, 30 Structures" 100.00 169 100.00 100.00 4.00e-121
PDB 966C "Crystal Structure Of Fibroblast Collagenase-1 Complexed To A Diphenyl-Ether Sulphone Based Hydroxamic Acid" 92.31 157 100.00 100.00 1.13e-110
DBJ BAD96754 "matrix metalloproteinase 1 preproprotein variant [Homo sapiens]" 100.00 390 99.41 99.41 7.46e-118
DBJ BAD96755 "matrix metalloproteinase 1 preproprotein variant [Homo sapiens]" 100.00 469 100.00 100.00 3.42e-118
DBJ BAD96756 "matrix metalloproteinase 1 preproprotein variant [Homo sapiens]" 81.66 338 100.00 100.00 8.98e-94
DBJ BAD96776 "matrix metalloproteinase 1 preproprotein variant [Homo sapiens]" 100.00 405 98.82 99.41 9.57e-118
DBJ BAD97001 "matrix metalloproteinase 1 preproprotein variant [Homo sapiens]" 100.00 469 100.00 100.00 2.78e-118
EMBL CAA28858 "unnamed protein product [Homo sapiens]" 100.00 469 98.82 98.82 4.00e-116
EMBL CAA38691 "type I interstitial collagenase [Homo sapiens]" 100.00 469 100.00 100.00 2.78e-118
GB AAA35699 "skin collagenase precursor [Homo sapiens]" 100.00 469 99.41 99.41 1.74e-117
GB AAB34887 "truncated mature collagenase, mCL-t [human, fibroblast, Peptide Recombinant Partial, 169 aa]" 100.00 169 100.00 100.00 4.00e-121
GB AAB36941 "collagenase [Homo sapiens]" 100.00 469 100.00 100.00 2.78e-118
GB AAH13875 "Matrix metallopeptidase 1 (interstitial collagenase) [Homo sapiens]" 100.00 469 100.00 100.00 2.78e-118
GB AAP35520 "matrix metalloproteinase 1 (interstitial collagenase) [Homo sapiens]" 100.00 469 100.00 100.00 2.78e-118
REF NP_001139410 "interstitial collagenase isoform 2 [Homo sapiens]" 100.00 403 100.00 100.00 9.25e-119
REF NP_002412 "interstitial collagenase isoform 1 preproprotein [Homo sapiens]" 100.00 469 100.00 100.00 2.78e-118
REF XP_002822446 "PREDICTED: interstitial collagenase [Pongo abelii]" 100.00 469 98.82 99.41 3.25e-116
REF XP_003253096 "PREDICTED: interstitial collagenase isoform X1 [Nomascus leucogenys]" 100.00 470 97.63 99.41 1.26e-115
REF XP_003253097 "PREDICTED: interstitial collagenase isoform X2 [Nomascus leucogenys]" 100.00 403 97.63 99.41 2.91e-116
SP P03956 "RecName: Full=Interstitial collagenase; AltName: Full=Fibroblast collagenase; AltName: Full=Matrix metalloproteinase-1; Short=M" 100.00 469 100.00 100.00 2.78e-118
stop_
save_
####################
# Natural source #
####################
save_natural_source
_Saveframe_category natural_source
loop_
_Mol_label
_Organism_name_common
_NCBI_taxonomy_ID
_Superkingdom
_Kingdom
_Genus
_Species
_Cell_type
$MMP-1 Human 9606 Eukaryota Metazoa Homo sapiens 'human fibroblast'
stop_
save_
#########################
# Experimental source #
#########################
save_experimental_source
_Saveframe_category experimental_source
loop_
_Mol_label
_Production_method
_Host_organism_name_common
_Genus
_Species
_Strain
_Vector_type
_Vector_name
$MMP-1 'recombinant technology' 'E. coli' Escherichia coli BL21(DE3) plasmid pNOT-3A
stop_
save_
#####################################
# Sample contents and methodology #
#####################################
########################
# Sample description #
########################
save_sample_one
_Saveframe_category sample
_Sample_type solution
_Details .
loop_
_Mol_label
_Concentration_value
_Concentration_value_units
_Isotopic_labeling
$MMP-1 1 mM [U-15N]
H2O 90 % .
D2O 10 % .
NaCl 100 mM .
CaCl2 5 mM .
ZnCl2 .1 mM .
NaN3 2 mM .
deuterated-DTT 10 mM .
deuterated-Tris_base 10 mM .
stop_
save_
save_sample_two
_Saveframe_category sample
_Sample_type solution
_Details .
loop_
_Mol_label
_Concentration_value
_Concentration_value_units
_Isotopic_labeling
$MMP-1 1 mM [U-13C;U-15N]
D2O 100 % .
NaCl 100 mM .
CaCl2 5 mM .
ZnCl2 .1 mM .
NaN3 2 mM .
deuterated-DTT 10 mM .
deuterated-Tris_base 10 mM .
stop_
save_
#########################
# Experimental detail #
#########################
##################################
# NMR Spectrometer definitions #
##################################
save_NMR_spectrometer_one
_Saveframe_category NMR_spectrometer
_Manufacturer Bruker
_Model AMX600
_Field_strength 600
_Details .
save_
#######################
# Sample conditions #
#######################
save_sample_conditions
_Saveframe_category sample_conditions
_Details .
loop_
_Variable_type
_Variable_value
_Variable_value_error
_Variable_value_units
pH 6.5 . n/a
temperature 308 . K
stop_
save_
####################
# NMR parameters #
####################
##############################
# Assigned chemical shifts #
##############################
################################
# Chemical shift referencing #
################################
save_chem_shift_reference
_Saveframe_category chemical_shift_reference
_Details .
loop_
_Mol_common_name
_Atom_type
_Atom_isotope_number
_Atom_group
_Chem_shift_units
_Chem_shift_value
_Reference_method
_Reference_type
_External_reference_sample_geometry
_External_reference_location
_External_reference_axis
TSP C 13 . ppm 0.0 . . . . .
TSP H 1 . ppm 0.0 . . . . .
'liquid NH3' N 15 . ppm 0.0 external . . . .
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_assignment
_Saveframe_category assigned_chemical_shifts
_Details .
loop_
_Sample_label
$sample_one
$sample_two
stop_
_Sample_conditions_label $sample_conditions
_Chem_shift_reference_set_label $chem_shift_reference
_Mol_system_component_name collagenase
_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 VAL HA H 3.86 . 1
2 . 1 VAL HB H 2.25 . 1
3 . 1 VAL HG1 H 1.06 . 1
4 . 1 VAL HG2 H 1.06 . 1
5 . 1 VAL C C 172.00 . 1
6 . 1 VAL CA C 60.8 . 1
7 . 1 VAL CB C 32.5 . 1
8 . 1 VAL CG1 C 19.4 . 2
9 . 1 VAL CG2 C 20.1 . 2
10 . 2 LEU HA H 4.53 . 1
11 . 2 LEU HB2 H 1.68 . 1
12 . 2 LEU HB3 H 1.68 . 1
13 . 2 LEU HG H 1.68 . 1
14 . 2 LEU HD1 H 0.98 . 2
15 . 2 LEU HD2 H 0.93 . 2
16 . 2 LEU C C 176.7 . 1
17 . 2 LEU CA C 55.00 . 1
18 . 2 LEU CB C 41.9 . 1
19 . 2 LEU CG C 26.9 . 1
20 . 2 LEU CD1 C 24.2 . 2
21 . 2 LEU CD2 C 23.6 . 2
22 . 3 THR H H 8.28 . 1
23 . 3 THR HA H 4.34 . 1
24 . 3 THR HB H 4.21 . 1
25 . 3 THR HG2 H 1.22 . 1
26 . 3 THR C C 173.9 . 1
27 . 3 THR CA C 61.5 . 1
28 . 3 THR CB C 69.4 . 1
29 . 3 THR CG2 C 21.3 . 1
30 . 3 THR N N 114.3 . 1
31 . 4 GLU H H 8.43 . 1
32 . 4 GLU HA H 4.31 . 1
33 . 4 GLU HB2 H 2.08 . 2
34 . 4 GLU HB3 H 1.99 . 2
35 . 4 GLU HG2 H 2.28 . 1
36 . 4 GLU HG3 H 2.28 . 1
37 . 4 GLU C C 176.3 . 1
38 . 4 GLU CA C 56.5 . 1
39 . 4 GLU CB C 30.1 . 1
40 . 4 GLU CG C 35.9 . 1
41 . 4 GLU N N 121.6 . 1
42 . 5 GLY H H 8.43 . 1
43 . 5 GLY HA2 H 4.00 . 2
44 . 5 GLY HA3 H 3.93 . 2
45 . 5 GLY C C 173.2 . 1
46 . 5 GLY CA C 44.7 . 1
47 . 5 GLY N N 107.9 . 1
48 . 6 ASN H H 8.27 . 1
49 . 6 ASN HA H 4.92 . 1
50 . 6 ASN HB2 H 2.87 . 2
51 . 6 ASN HB3 H 2.63 . 2
52 . 6 ASN C C 172.8 . 1
53 . 6 ASN CA C 51.4 . 1
54 . 6 ASN CB C 38.4 . 1
55 . 6 ASN N N 117.7 . 1
56 . 7 PRO HA H 4.4 . 1
57 . 7 PRO HB2 H 2.2 . 2
58 . 7 PRO HB3 H 1.76 . 2
59 . 7 PRO HG2 H 1.98 . 1
60 . 7 PRO HG3 H 1.98 . 1
61 . 7 PRO HD2 H 3.68 . 1
62 . 7 PRO HD3 H 3.68 . 1
63 . 7 PRO C C 174.5 . 1
64 . 7 PRO CA C 62.9 . 1
65 . 7 PRO CB C 32.2 . 1
66 . 7 PRO CG C 27.3 . 1
67 . 7 PRO CD C 50.1 . 1
68 . 8 ARG H H 7.82 . 1
69 . 8 ARG HA H 4.58 . 1
70 . 8 ARG HB2 H 1.76 . 2
71 . 8 ARG HB3 H 1.64 . 2
72 . 8 ARG HG2 H 1.65 . 2
73 . 8 ARG HG3 H 1.2 . 2
74 . 8 ARG HD2 H 3.14 . 2
75 . 8 ARG HD3 H 2.92 . 2
76 . 8 ARG C C 174.9 . 1
77 . 8 ARG CA C 53.8 . 1
78 . 8 ARG CB C 32.6 . 1
79 . 8 ARG CG C 24.3 . 1
80 . 8 ARG CD C 43.3 . 1
81 . 8 ARG N N 111.8 . 1
82 . 9 TRP H H 8.09 . 1
83 . 9 TRP HA H 4.71 . 1
84 . 9 TRP HB2 H 3.65 . 2
85 . 9 TRP HB3 H 3.24 . 2
86 . 9 TRP HD1 H 7.43 . 1
87 . 9 TRP HE1 H 10.47 . 1
88 . 9 TRP HE3 H 7.92 . 1
89 . 9 TRP HZ2 H 7.51 . 1
90 . 9 TRP C C 176.9 . 1
91 . 9 TRP CA C 56.9 . 1
92 . 9 TRP CB C 29.9 . 1
93 . 9 TRP CD1 C 126.7 . 1
94 . 9 TRP CZ2 C 112.9 . 1
95 . 9 TRP N N 120.1 . 1
96 . 9 TRP NE1 N 125.7 . 1
97 . 10 GLU H H 9.27 . 1
98 . 10 GLU HA H 4.4 . 1
99 . 10 GLU HB2 H 2.31 . 2
100 . 10 GLU HB3 H 2.11 . 2
101 . 10 GLU HG2 H 2.44 . 2
102 . 10 GLU HG3 H 2.37 . 2
103 . 10 GLU C C 176.1 . 1
104 . 10 GLU CA C 57.2 . 1
105 . 10 GLU CB C 29.7 . 1
106 . 10 GLU CG C 36.1 . 1
107 . 10 GLU N N 121.8 . 1
108 . 11 GLN H H 8.43 . 1
109 . 11 GLN HA H 4.71 . 1
110 . 11 GLN HB2 H 2.22 . 1
111 . 11 GLN HB3 H 2.22 . 1
112 . 11 GLN HG2 H 2.42 . 1
113 . 11 GLN HG3 H 2.42 . 1
114 . 11 GLN C C 174.1 . 1
115 . 11 GLN CA C 54.00 . 1
116 . 11 GLN CB C 29.8 . 1
117 . 11 GLN CG C 32.9 . 1
118 . 11 GLN N N 116.00 . 1
119 . 12 THR H H 7.97 . 1
120 . 12 THR HA H 4.29 . 1
121 . 12 THR HB H 4.32 . 1
122 . 12 THR HG2 H 1.2 . 1
123 . 12 THR C C 172.6 . 1
124 . 12 THR CA C 61.1 . 1
125 . 12 THR CB C 68.9 . 1
126 . 12 THR CG2 C 21.4 . 1
127 . 12 THR N N 103.7 . 1
128 . 13 HIS H H 7.31 . 1
129 . 13 HIS HA H 5.11 . 1
130 . 13 HIS HB2 H 3.02 . 2
131 . 13 HIS HB3 H 2.97 . 2
132 . 13 HIS HD2 H 7.01 . 1
133 . 13 HIS C C 173.3 . 1
134 . 13 HIS CA C 53.4 . 1
135 . 13 HIS CB C 28.7 . 1
136 . 13 HIS N N 117.4 . 1
137 . 14 LEU H H 8.23 . 1
138 . 14 LEU HA H 4.59 . 1
139 . 14 LEU HB2 H 1.46 . 2
140 . 14 LEU HB3 H 1.05 . 2
141 . 14 LEU HG H 0.92 . 1
142 . 14 LEU HD1 H 0.1 . 2
143 . 14 LEU HD2 H -0.1 . 2
144 . 14 LEU C C 176.3 . 1
145 . 14 LEU CA C 53.1 . 1
146 . 14 LEU CB C 45.5 . 1
147 . 14 LEU CG C 27.00 . 1
148 . 14 LEU CD1 C 24.6 . 2
149 . 14 LEU CD2 C 22.8 . 2
150 . 14 LEU N N 124.8 . 1
151 . 15 THR H H 9.27 . 1
152 . 15 THR HA H 5.58 . 1
153 . 15 THR HB H 4.22 . 1
154 . 15 THR HG2 H 1.14 . 1
155 . 15 THR C C 174.1 . 1
156 . 15 THR CA C 58.00 . 1
157 . 15 THR CB C 72.7 . 1
158 . 15 THR CG2 C 21.6 . 1
159 . 15 THR N N 109.1 . 1
160 . 16 TYR H H 8.57 . 1
161 . 16 TYR HA H 5.67 . 1
162 . 16 TYR HB2 H 3.18 . 2
163 . 16 TYR HB3 H 2.5 . 2
164 . 16 TYR HD1 H 7.59 . 1
165 . 16 TYR HD2 H 7.59 . 1
166 . 16 TYR C C 171.4 . 1
167 . 16 TYR CA C 54.9 . 1
168 . 16 TYR CB C 43.1 . 1
169 . 16 TYR N N 115.00 . 1
170 . 17 ARG H H 8.4 . 1
171 . 17 ARG HA H 4.66 . 1
172 . 17 ARG HB2 H 1.92 . 2
173 . 17 ARG HB3 H 1.52 . 2
174 . 17 ARG HG2 H 1.76 . 2
175 . 17 ARG HG3 H 1.05 . 2
176 . 17 ARG HD2 H 2.95 . 2
177 . 17 ARG HD3 H 2.81 . 2
178 . 17 ARG C C 173.6 . 1
179 . 17 ARG CA C 54.7 . 1
180 . 17 ARG CB C 34.3 . 1
181 . 17 ARG CG C 27.8 . 1
182 . 17 ARG CD C 44.1 . 1
183 . 17 ARG N N 117.00 . 1
184 . 18 ILE H H 9.21 . 1
185 . 18 ILE HA H 4.43 . 1
186 . 18 ILE HB H 1.78 . 1
187 . 18 ILE HG12 H 1.91 . 2
188 . 18 ILE HG13 H 0.84 . 2
189 . 18 ILE HG2 H 0.27 . 1
190 . 18 ILE HD1 H 1.2 . 1
191 . 18 ILE C C 174.9 . 1
192 . 18 ILE CA C 60.9 . 1
193 . 18 ILE CB C 37.00 . 1
194 . 18 ILE CG1 C 28.00 . 1
195 . 18 ILE CG2 C 17.1 . 1
196 . 18 ILE CD1 C 14.2 . 1
197 . 18 ILE N N 126.1 . 1
198 . 19 GLU H H 9.77 . 1
199 . 19 GLU HA H 3.91 . 1
200 . 19 GLU HB2 H 2.2 . 2
201 . 19 GLU HB3 H 2.06 . 2
202 . 19 GLU HG2 H 2.34 . 2
203 . 19 GLU HG3 H 2.17 . 2
204 . 19 GLU C C 175.3 . 1
205 . 19 GLU CA C 59.3 . 1
206 . 19 GLU CB C 31.3 . 1
207 . 19 GLU CG C 37.7 . 1
208 . 19 GLU N N 126.4 . 1
209 . 20 ASN H H 7.82 . 1
210 . 20 ASN HA H 4.74 . 1
211 . 20 ASN HB2 H 3.07 . 1
212 . 20 ASN HB3 H 3.07 . 1
213 . 20 ASN HD21 H 7.95 . 1
214 . 20 ASN HD22 H 7.95 . 1
215 . 20 ASN C C 169.7 . 1
216 . 20 ASN CA C 51.5 . 1
217 . 20 ASN CB C 39.1 . 1
218 . 20 ASN N N 112.4 . 1
219 . 20 ASN ND2 N 111.5 . 1
220 . 21 TYR H H 8.43 . 1
221 . 21 TYR HA H 4.2 . 1
222 . 21 TYR HB2 H 2.95 . 2
223 . 21 TYR HB3 H 2.66 . 2
224 . 21 TYR HD1 H 6.98 . 1
225 . 21 TYR HD2 H 6.98 . 1
226 . 21 TYR HE1 H 6.87 . 1
227 . 21 TYR HE2 H 6.87 . 1
228 . 21 TYR C C 173.8 . 1
229 . 21 TYR CA C 58.2 . 1
230 . 21 TYR CB C 40.7 . 1
231 . 21 TYR CD1 C 131.9 . 1
232 . 21 TYR CD2 C 131.9 . 1
233 . 21 TYR CE1 C 117.8 . 1
234 . 21 TYR CE2 C 117.8 . 1
235 . 21 TYR N N 111.9 . 1
236 . 22 THR HA H 4.94 . 1
237 . 22 THR HB H 3.59 . 1
238 . 22 THR HG2 H 0.53 . 1
239 . 22 THR C C 173.2 . 1
240 . 22 THR CA C 55.6 . 1
241 . 22 THR CB C 66.7 . 1
242 . 22 THR CG2 C 18.7 . 1
243 . 23 PRO HA H 4.67 . 1
244 . 23 PRO HB2 H 2.28 . 2
245 . 23 PRO HB3 H 2.1 . 2
246 . 23 PRO HG2 H 2.07 . 1
247 . 23 PRO HG3 H 2.07 . 1
248 . 23 PRO HD2 H 3.91 . 2
249 . 23 PRO HD3 H 3.71 . 2
250 . 23 PRO C C 176.9 . 1
251 . 23 PRO CA C 62.6 . 1
252 . 23 PRO CB C 31.3 . 1
253 . 23 PRO CG C 26.4 . 1
254 . 23 PRO CD C 50.1 . 1
255 . 24 ASP H H 8.99 . 1
256 . 24 ASP HA H 4.14 . 1
257 . 24 ASP HB2 H 3.25 . 2
258 . 24 ASP HB3 H 2.83 . 2
259 . 24 ASP C C 175.2 . 1
260 . 24 ASP CA C 55.6 . 1
261 . 24 ASP CB C 41.00 . 1
262 . 24 ASP N N 119.6 . 1
263 . 25 LEU H H 7.1 . 1
264 . 25 LEU HA H 4.93 . 1
265 . 25 LEU HB2 H 1.48 . 2
266 . 25 LEU HB3 H 1.24 . 2
267 . 25 LEU HG H 1.56 . 1
268 . 25 LEU HD1 H 0.63 . 2
269 . 25 LEU HD2 H 0.99 . 2
270 . 25 LEU C C 172.8 . 1
271 . 25 LEU CA C 51.00 . 1
272 . 25 LEU CB C 47.3 . 1
273 . 25 LEU CG C 25.9 . 1
274 . 25 LEU CD1 C 26.2 . 2
275 . 25 LEU CD2 C 24.6 . 2
276 . 25 LEU N N 114.5 . 1
277 . 26 PRO HA H 4.49 . 1
278 . 26 PRO HB2 H 2.5 . 2
279 . 26 PRO HB3 H 1.91 . 2
280 . 26 PRO HG2 H 2.07 . 1
281 . 26 PRO HG3 H 2.07 . 1
282 . 26 PRO HD2 H 3.91 . 2
283 . 26 PRO HD3 H 3.71 . 2
284 . 26 PRO C C 177.4 . 1
285 . 26 PRO CA C 62.1 . 1
286 . 26 PRO CB C 32.1 . 1
287 . 26 PRO CG C 26.4 . 1
288 . 26 PRO CD C 50.1 . 1
289 . 27 ARG H H 8.68 . 1
290 . 27 ARG HA H 3.81 . 1
291 . 27 ARG HB2 H 1.57 . 2
292 . 27 ARG HB3 H 1.45 . 2
293 . 27 ARG HG2 H 1.1 . 1
294 . 27 ARG HG3 H 1.1 . 1
295 . 27 ARG HD2 H 2.69 . 2
296 . 27 ARG HD3 H 2.6 . 2
297 . 27 ARG C C 177.9 . 1
298 . 27 ARG CA C 60.00 . 1
299 . 27 ARG CB C 29.6 . 1
300 . 27 ARG CG C 26.3 . 1
301 . 27 ARG CD C 43.1 . 1
302 . 27 ARG N N 123.5 . 1
303 . 28 ALA H H 8.78 . 1
304 . 28 ALA HA H 4.2 . 1
305 . 28 ALA HB H 1.41 . 1
306 . 28 ALA C C 180.00 . 1
307 . 28 ALA CA C 54.7 . 1
308 . 28 ALA CB C 18.2 . 1
309 . 28 ALA N N 115.00 . 1
310 . 29 ASP H H 7.32 . 1
311 . 29 ASP HA H 4.62 . 1
312 . 29 ASP HB2 H 2.85 . 2
313 . 29 ASP HB3 H 2.61 . 2
314 . 29 ASP C C 179.3 . 1
315 . 29 ASP CA C 57.00 . 1
316 . 29 ASP CB C 41.00 . 1
317 . 29 ASP N N 114.2 . 1
318 . 30 VAL H H 7.7 . 1
319 . 30 VAL HA H 3.55 . 1
320 . 30 VAL HB H 2.63 . 1
321 . 30 VAL HG1 H 0.95 . 2
322 . 30 VAL HG2 H 1.00 . 2
323 . 30 VAL C C 176.9 . 1
324 . 30 VAL CA C 66.4 . 1
325 . 30 VAL CB C 31.1 . 1
326 . 30 VAL CG1 C 23.9 . 1
327 . 30 VAL CG2 C 21.6 . 1
328 . 30 VAL N N 121.4 . 1
329 . 31 ASP H H 8.6 . 1
330 . 31 ASP HA H 4.47 . 1
331 . 31 ASP HB2 H 2.78 . 1
332 . 31 ASP HB3 H 2.78 . 1
333 . 31 ASP C C 179.3 . 1
334 . 31 ASP CA C 57.9 . 1
335 . 31 ASP CB C 40.00 . 1
336 . 31 ASP N N 116.2 . 1
337 . 32 HIS H H 8.35 . 1
338 . 32 HIS HA H 4.56 . 1
339 . 32 HIS HB2 H 3.39 . 2
340 . 32 HIS HB3 H 3.25 . 2
341 . 32 HIS HD2 H 7.23 . 1
342 . 32 HIS C C 176.00 . 1
343 . 32 HIS CA C 58.9 . 1
344 . 32 HIS CB C 29.6 . 1
345 . 32 HIS CD2 C 120.84 . 1
346 . 32 HIS N N 115.6 . 1
347 . 33 ALA H H 8.13 . 1
348 . 33 ALA HA H 4.03 . 1
349 . 33 ALA HB H 1.54 . 1
350 . 33 ALA C C 180.2 . 1
351 . 33 ALA CA C 54.9 . 1
352 . 33 ALA CB C 18.4 . 1
353 . 33 ALA N N 118.7 . 1
354 . 34 ILE H H 7.97 . 1
355 . 34 ILE HA H 3.67 . 1
356 . 34 ILE HB H 2.28 . 1
357 . 34 ILE HG12 H 1.64 . 2
358 . 34 ILE HG13 H 1.32 . 2
359 . 34 ILE HG2 H 0.88 . 1
360 . 34 ILE HD1 H 0.55 . 1
361 . 34 ILE C C 176.9 . 1
362 . 34 ILE CA C 62.3 . 1
363 . 34 ILE CB C 36.00 . 1
364 . 34 ILE CG1 C 28.3 . 1
365 . 34 ILE CG2 C 18.9 . 1
366 . 34 ILE CD1 C 9.7 . 1
367 . 34 ILE N N 113.9 . 1
368 . 35 GLU H H 8.81 . 1
369 . 35 GLU HA H 4.14 . 1
370 . 35 GLU HB2 H 2.37 . 2
371 . 35 GLU HB3 H 2.27 . 2
372 . 35 GLU HG2 H 2.54 . 2
373 . 35 GLU HG3 H 2.43 . 2
374 . 35 GLU C C 179.6 . 1
375 . 35 GLU CA C 60.1 . 1
376 . 35 GLU CB C 29.6 . 1
377 . 35 GLU CG C 36.00 . 1
378 . 35 GLU N N 119.3 . 1
379 . 36 LYS H H 8.6 . 1
380 . 36 LYS HA H 4.08 . 1
381 . 36 LYS HB2 H 1.46 . 1
382 . 36 LYS HB3 H 1.46 . 1
383 . 36 LYS HG2 H 1.32 . 2
384 . 36 LYS HG3 H 1.27 . 2
385 . 36 LYS HD2 H 1.32 . 2
386 . 36 LYS HD3 H 1.46 . 2
387 . 36 LYS HE2 H 2.8 . 2
388 . 36 LYS HE3 H 2.75 . 2
389 . 36 LYS C C 178.6 . 1
390 . 36 LYS CA C 57.9 . 1
391 . 36 LYS CB C 31.6 . 1
392 . 36 LYS CG C 24.7 . 1
393 . 36 LYS CD C 28.1 . 1
394 . 36 LYS CE C 41.5 . 1
395 . 36 LYS N N 114.7 . 1
396 . 37 ALA H H 7.57 . 1
397 . 37 ALA HA H 4.00 . 1
398 . 37 ALA HB H 1.38 . 1
399 . 37 ALA C C 177.5 . 1
400 . 37 ALA CA C 55.2 . 1
401 . 37 ALA CB C 17.8 . 1
402 . 37 ALA N N 120.3 . 1
403 . 38 PHE H H 7.81 . 1
404 . 38 PHE HA H 3.82 . 1
405 . 38 PHE HB2 H 2.71 . 1
406 . 38 PHE HB3 H 2.71 . 1
407 . 38 PHE HD1 H 5.72 . 1
408 . 38 PHE HD2 H 5.72 . 1
409 . 38 PHE HE1 H 5.94 . 1
410 . 38 PHE HE2 H 5.94 . 1
411 . 38 PHE HZ H 6.52 . 1
412 . 38 PHE C C 178.3 . 1
413 . 38 PHE CA C 63.3 . 1
414 . 38 PHE CB C 38.6 . 1
415 . 38 PHE CD1 C 130.4 . 1
416 . 38 PHE CD2 C 130.4 . 1
417 . 38 PHE CE1 C 129.4 . 1
418 . 38 PHE CE2 C 129.4 . 1
419 . 38 PHE CZ C 127.4 . 1
420 . 38 PHE N N 112.5 . 1
421 . 39 GLN H H 8.01 . 1
422 . 39 GLN HA H 4.28 . 1
423 . 39 GLN HB2 H 2.3 . 2
424 . 39 GLN HB3 H 2.26 . 2
425 . 39 GLN HG2 H 2.64 . 2
426 . 39 GLN HG3 H 2.54 . 2
427 . 39 GLN C C 177.1 . 1
428 . 39 GLN CA C 58.00 . 1
429 . 39 GLN CB C 28.2 . 1
430 . 39 GLN CG C 33.8 . 1
431 . 39 GLN N N 115.6 . 1
432 . 40 LEU H H 7.31 . 1
433 . 40 LEU HA H 3.97 . 1
434 . 40 LEU HB2 H 1.54 . 2
435 . 40 LEU HB3 H 0.82 . 2
436 . 40 LEU HG H 1.82 . 1
437 . 40 LEU HD1 H 0.64 . 2
438 . 40 LEU HD2 H 0.79 . 2
439 . 40 LEU C C 178.5 . 1
440 . 40 LEU CA C 57.3 . 1
441 . 40 LEU CB C 41.7 . 1
442 . 40 LEU CG C 25.9 . 1
443 . 40 LEU CD1 C 25.9 . 2
444 . 40 LEU CD2 C 23.5 . 2
445 . 40 LEU N N 114.5 . 1
446 . 41 TRP H H 6.78 . 1
447 . 41 TRP HA H 4.74 . 1
448 . 41 TRP HB2 H 3.27 . 2
449 . 41 TRP HB3 H 3.15 . 2
450 . 41 TRP HD1 H 7.03 . 1
451 . 41 TRP HE1 H 9.45 . 1
452 . 41 TRP HE3 H 7.45 . 1
453 . 41 TRP HZ2 H 7.28 . 1
454 . 41 TRP HZ3 H 6.89 . 1
455 . 41 TRP HH2 H 6.81 . 1
456 . 41 TRP C C 179.9 . 1
457 . 41 TRP CA C 58.00 . 1
458 . 41 TRP CB C 30.4 . 1
459 . 41 TRP CD1 C 127.2 . 1
460 . 41 TRP CE3 C 119.2 . 1
461 . 41 TRP CZ2 C 114.7 . 1
462 . 41 TRP CZ3 C 121.4 . 1
463 . 41 TRP CH2 C 124.1 . 1
464 . 41 TRP N N 113.2 . 1
465 . 41 TRP NE1 N 123.00 . 1
466 . 42 SER H H 9.07 . 1
467 . 42 SER HA H 4.41 . 1
468 . 42 SER HB2 H 4.41 . 2
469 . 42 SER HB3 H 4.17 . 2
470 . 42 SER C C 175.8 . 1
471 . 42 SER CA C 60.9 . 1
472 . 42 SER CB C 63.2 . 1
473 . 42 SER N N 114.3 . 1
474 . 43 ASN H H 8.15 . 1
475 . 43 ASN HA H 4.75 . 1
476 . 43 ASN HB2 H 3.11 . 2
477 . 43 ASN HB3 H 2.93 . 2
478 . 43 ASN C C 176.7 . 1
479 . 43 ASN CA C 54.8 . 1
480 . 43 ASN CB C 38.9 . 1
481 . 43 ASN N N 113.9 . 1
482 . 44 VAL H H 7.05 . 1
483 . 44 VAL HA H 4.96 . 1
484 . 44 VAL HB H 2.73 . 1
485 . 44 VAL HG1 H 1.2 . 2
486 . 44 VAL HG2 H 1.00 . 2
487 . 44 VAL C C 174.5 . 1
488 . 44 VAL CA C 60.00 . 1
489 . 44 VAL CB C 32.4 . 1
490 . 44 VAL CG1 C 21.4 . 2
491 . 44 VAL CG2 C 18.6 . 2
492 . 44 VAL N N 102.5 . 1
493 . 45 THR H H 7.6 . 1
494 . 45 THR HA H 5.42 . 1
495 . 45 THR HB H 4.2 . 1
496 . 45 THR HG2 H 1.64 . 1
497 . 45 THR C C 172.8 . 1
498 . 45 THR CA C 59.6 . 1
499 . 45 THR CB C 71.9 . 1
500 . 45 THR CG2 C 23.9 . 1
501 . 45 THR N N 108.4 . 1
502 . 46 PRO HA H 4.92 . 1
503 . 46 PRO HB2 H 2.37 . 2
504 . 46 PRO HB3 H 2.07 . 2
505 . 46 PRO HG2 H 2.04 . 2
506 . 46 PRO HG3 H 2.00 . 2
507 . 46 PRO HD2 H 3.57 . 2
508 . 46 PRO HD3 H 3.32 . 2
509 . 46 PRO C C 176.2 . 1
510 . 46 PRO CA C 62.00 . 1
511 . 46 PRO CB C 31.5 . 1
512 . 46 PRO CG C 27.4 . 1
513 . 46 PRO CD C 51.4 . 1
514 . 47 LEU H H 7.18 . 1
515 . 47 LEU HA H 4.54 . 1
516 . 47 LEU HB2 H 1.37 . 2
517 . 47 LEU HB3 H 0.62 . 2
518 . 47 LEU HG H 1.17 . 1
519 . 47 LEU HD1 H 0.42 . 1
520 . 47 LEU HD2 H 0.42 . 1
521 . 47 LEU C C 176.8 . 1
522 . 47 LEU CA C 54.7 . 1
523 . 47 LEU CB C 43.1 . 1
524 . 47 LEU CG C 27.3 . 1
525 . 47 LEU CD1 C 25.6 . 2
526 . 47 LEU CD2 C 21.8 . 2
527 . 47 LEU N N 114.8 . 1
528 . 48 THR H H 8.3 . 1
529 . 48 THR HA H 4.39 . 1
530 . 48 THR HB H 4.01 . 1
531 . 48 THR HG2 H 1.1 . 1
532 . 48 THR C C 171.4 . 1
533 . 48 THR CA C 59.6 . 1
534 . 48 THR CB C 71.7 . 1
535 . 48 THR CG2 C 21.2 . 1
536 . 48 THR N N 110.8 . 1
537 . 49 PHE H H 8.38 . 1
538 . 49 PHE HA H 5.42 . 1
539 . 49 PHE HB2 H 2.54 . 2
540 . 49 PHE HB3 H 2.19 . 2
541 . 49 PHE HD1 H 6.88 . 1
542 . 49 PHE HD2 H 6.88 . 1
543 . 49 PHE HE1 H 7.04 . 1
544 . 49 PHE HE2 H 7.04 . 1
545 . 49 PHE HZ H 7.03 . 1
546 . 49 PHE C C 175.6 . 1
547 . 49 PHE CA C 55.7 . 1
548 . 49 PHE CB C 41.7 . 1
549 . 49 PHE CD1 C 132.7 . 1
550 . 49 PHE CD2 C 132.7 . 1
551 . 49 PHE CE1 C 130.1 . 1
552 . 49 PHE CE2 C 130.1 . 1
553 . 49 PHE CZ C 133.00 . 1
554 . 49 PHE N N 116.3 . 1
555 . 50 THR H H 8.61 . 1
556 . 50 THR HA H 4.5 . 1
557 . 50 THR HB H 3.75 . 1
558 . 50 THR HG2 H 1.18 . 1
559 . 50 THR C C 171.3 . 1
560 . 50 THR CA C 61.4 . 1
561 . 50 THR CB C 71.5 . 1
562 . 50 THR CG2 C 21.3 . 1
563 . 50 THR N N 118.1 . 1
564 . 51 LYS H H 8.45 . 1
565 . 51 LYS HA H 3.39 . 1
566 . 51 LYS HB2 H 1.52 . 2
567 . 51 LYS HB3 H 1.25 . 2
568 . 51 LYS HG2 H 0.94 . 2
569 . 51 LYS HG3 H 0.86 . 2
570 . 51 LYS HD2 H 1.78 . 2
571 . 51 LYS HD3 H 1.62 . 2
572 . 51 LYS HE2 H 3.04 . 1
573 . 51 LYS HE3 H 3.04 . 1
574 . 51 LYS C C 176.00 . 1
575 . 51 LYS CA C 55.4 . 1
576 . 51 LYS CB C 33.1 . 1
577 . 51 LYS CG C 24.6 . 1
578 . 51 LYS CD C 29.8 . 1
579 . 51 LYS CE C 42.00 . 1
580 . 51 LYS N N 127.3 . 1
581 . 52 VAL H H 8.76 . 1
582 . 52 VAL HA H 4.67 . 1
583 . 52 VAL HB H 2.21 . 1
584 . 52 VAL HG1 H 0.92 . 2
585 . 52 VAL HG2 H 0.79 . 2
586 . 52 VAL C C 175.7 . 1
587 . 52 VAL CA C 59.4 . 1
588 . 52 VAL CB C 33.9 . 1
589 . 52 VAL CG1 C 21.3 . 2
590 . 52 VAL CG2 C 19.7 . 2
591 . 52 VAL N N 120.4 . 1
592 . 53 SER H H 8.82 . 1
593 . 53 SER HA H 4.55 . 1
594 . 53 SER HB2 H 3.98 . 2
595 . 53 SER HB3 H 3.95 . 2
596 . 53 SER C C 173.1 . 1
597 . 53 SER CA C 58.7 . 1
598 . 53 SER CB C 64.00 . 1
599 . 53 SER N N 114.00 . 1
600 . 54 GLU H H 7.53 . 1
601 . 54 GLU HA H 4.51 . 1
602 . 54 GLU HB2 H 2.1 . 2
603 . 54 GLU HB3 H 1.93 . 2
604 . 54 GLU HG2 H 2.17 . 1
605 . 54 GLU HG3 H 2.17 . 1
606 . 54 GLU C C 174.3 . 1
607 . 54 GLU CA C 54.4 . 1
608 . 54 GLU CB C 32.6 . 1
609 . 54 GLU CG C 34.9 . 1
610 . 54 GLU N N 115.8 . 1
611 . 55 GLY H H 8.56 . 1
612 . 55 GLY HA2 H 4.11 . 2
613 . 55 GLY HA3 H 3.82 . 2
614 . 55 GLY C C 172.9 . 1
615 . 55 GLY CA C 44.4 . 1
616 . 55 GLY N N 105.5 . 1
617 . 56 GLN H H 8.32 . 1
618 . 56 GLN HA H 4.34 . 1
619 . 56 GLN HB2 H 2.01 . 1
620 . 56 GLN HB3 H 2.01 . 1
621 . 56 GLN HG2 H 2.4 . 1
622 . 56 GLN HG3 H 2.4 . 1
623 . 56 GLN C C 174.4 . 1
624 . 56 GLN CA C 55.1 . 1
625 . 56 GLN CB C 29.1 . 1
626 . 56 GLN CG C 33.5 . 1
627 . 56 GLN N N 116.2 . 1
628 . 57 ALA H H 7.73 . 1
629 . 57 ALA HA H 4.56 . 1
630 . 57 ALA HB H 1.01 . 1
631 . 57 ALA C C 175.6 . 1
632 . 57 ALA CA C 49.4 . 1
633 . 57 ALA CB C 22.1 . 1
634 . 57 ALA N N 124.3 . 1
635 . 58 ASP H H 8.13 . 1
636 . 58 ASP HA H 4.48 . 1
637 . 58 ASP HB2 H 2.87 . 2
638 . 58 ASP HB3 H 2.25 . 2
639 . 58 ASP C C 177.1 . 1
640 . 58 ASP CA C 58.3 . 1
641 . 58 ASP CB C 41.00 . 1
642 . 58 ASP N N 118.8 . 1
643 . 59 ILE H H 8.82 . 1
644 . 59 ILE HA H 4.26 . 1
645 . 59 ILE HB H 1.99 . 1
646 . 59 ILE HG12 H 1.56 . 2
647 . 59 ILE HG13 H 1.48 . 2
648 . 59 ILE HG2 H 1.23 . 1
649 . 59 ILE HD1 H 1.00 . 1
650 . 59 ILE C C 173.6 . 1
651 . 59 ILE CA C 61.1 . 1
652 . 59 ILE CB C 39.3 . 1
653 . 59 ILE CG1 C 27.1 . 1
654 . 59 ILE CG2 C 15.2 . 1
655 . 59 ILE CD1 C 14.1 . 1
656 . 59 ILE N N 122.1 . 1
657 . 60 MET H H 7.59 . 1
658 . 60 MET HA H 5.3 . 1
659 . 60 MET HB2 H 2.41 . 2
660 . 60 MET HB3 H 2.14 . 2
661 . 60 MET HG2 H 2.81 . 2
662 . 60 MET HG3 H 2.68 . 2
663 . 60 MET HE H 2.17 . 1
664 . 60 MET C C 176.6 . 1
665 . 60 MET CA C 52.8 . 1
666 . 60 MET CB C 31.7 . 1
667 . 60 MET CG C 32.00 . 1
668 . 60 MET CE C 37.2 . 1
669 . 60 MET N N 124.3 . 1
670 . 61 ILE H H 9.27 . 1
671 . 61 ILE HA H 5.62 . 1
672 . 61 ILE HB H 1.97 . 1
673 . 61 ILE HG12 H 1.9 . 2
674 . 61 ILE HG13 H 1.16 . 2
675 . 61 ILE HG2 H 0.84 . 1
676 . 61 ILE HD1 H 1.04 . 1
677 . 61 ILE C C 174.2 . 1
678 . 61 ILE CA C 60.1 . 1
679 . 61 ILE CB C 40.3 . 1
680 . 61 ILE CG1 C 28.7 . 1
681 . 61 ILE CG2 C 17.00 . 1
682 . 61 ILE CD1 C 15.1 . 1
683 . 61 ILE N N 124.6 . 1
684 . 62 SER H H 8.65 . 1
685 . 62 SER HA H 5.09 . 1
686 . 62 SER HB2 H 3.94 . 2
687 . 62 SER HB3 H 3.68 . 2
688 . 62 SER C C 171.7 . 1
689 . 62 SER CA C 56.5 . 1
690 . 62 SER CB C 66.1 . 1
691 . 62 SER N N 115.7 . 1
692 . 63 PHE H H 9.18 . 1
693 . 63 PHE HA H 5.31 . 1
694 . 63 PHE HB2 H 3.09 . 2
695 . 63 PHE HB3 H 2.78 . 2
696 . 63 PHE HD1 H 7.05 . 1
697 . 63 PHE HD2 H 7.05 . 1
698 . 63 PHE HE1 H 6.25 . 1
699 . 63 PHE HE2 H 6.25 . 1
700 . 63 PHE HZ H 6.32 . 1
701 . 63 PHE C C 176.3 . 1
702 . 63 PHE CA C 56.6 . 1
703 . 63 PHE CB C 40.4 . 1
704 . 63 PHE CD1 C 133.3 . 1
705 . 63 PHE CD2 C 133.3 . 1
706 . 63 PHE CE1 C 131.8 . 1
707 . 63 PHE CE2 C 131.8 . 1
708 . 63 PHE CZ C 127.9 . 1
709 . 63 PHE N N 119.7 . 1
710 . 64 VAL H H 8.93 . 1
711 . 64 VAL HA H 4.88 . 1
712 . 64 VAL HB H 1.82 . 1
713 . 64 VAL HG1 H 0.74 . 2
714 . 64 VAL HG2 H 0.07 . 2
715 . 64 VAL C C 173.3 . 1
716 . 64 VAL CA C 58.7 . 1
717 . 64 VAL CB C 36.7 . 1
718 . 64 VAL CG1 C 21.7 . 2
719 . 64 VAL CG2 C 16.7 . 2
720 . 64 VAL N N 114.5 . 1
721 . 65 ARG H H 8.64 . 1
722 . 65 ARG HA H 5.25 . 1
723 . 65 ARG HB2 H 1.88 . 2
724 . 65 ARG HB3 H 1.75 . 2
725 . 65 ARG HG2 H 1.62 . 2
726 . 65 ARG HG3 H 1.58 . 2
727 . 65 ARG HD2 H 3.34 . 2
728 . 65 ARG HD3 H 3.26 . 2
729 . 65 ARG C C 175.7 . 1
730 . 65 ARG CA C 53.9 . 1
731 . 65 ARG CB C 33.9 . 1
732 . 65 ARG CG C 26.4 . 1
733 . 65 ARG CD C 43.1 . 1
734 . 65 ARG N N 115.4 . 1
735 . 66 GLY H H 9.35 . 1
736 . 66 GLY HA2 H 3.95 . 2
737 . 66 GLY HA3 H 3.82 . 2
738 . 66 GLY C C 175.6 . 1
739 . 66 GLY CA C 46.5 . 1
740 . 66 GLY N N 105.2 . 1
741 . 67 ASP H H 9.27 . 1
742 . 67 ASP HA H 4.55 . 1
743 . 67 ASP HB2 H 3.02 . 2
744 . 67 ASP HB3 H 2.72 . 2
745 . 67 ASP C C 174.9 . 1
746 . 67 ASP CA C 54.8 . 1
747 . 67 ASP CB C 40.1 . 1
748 . 67 ASP N N 126.9 . 1
749 . 68 HIS H H 9.35 . 1
750 . 68 HIS HA H 5.11 . 1
751 . 68 HIS HB2 H 3.45 . 2
752 . 68 HIS HB3 H 2.73 . 2
753 . 68 HIS HD2 H 6.58 . 1
754 . 68 HIS HE1 H 7.41 . 1
755 . 68 HIS C C 173.3 . 1
756 . 68 HIS CA C 53.6 . 1
757 . 68 HIS CB C 26.5 . 1
758 . 68 HIS CD2 C 127.6 . 1
759 . 68 HIS CE1 C 139.7 . 1
760 . 68 HIS N N 122.4 . 1
761 . 69 ARG H H 8.18 . 1
762 . 69 ARG HA H 3.97 . 1
763 . 69 ARG HB2 H 2.2 . 2
764 . 69 ARG HB3 H 2.07 . 2
765 . 69 ARG HG2 H 1.55 . 1
766 . 69 ARG HG3 H 1.55 . 1
767 . 69 ARG HD2 H 3.24 . 1
768 . 69 ARG HD3 H 3.24 . 1
769 . 69 ARG C C 175.2 . 1
770 . 69 ARG CA C 57.8 . 1
771 . 69 ARG CB C 26.1 . 1
772 . 69 ARG CG C 27.2 . 1
773 . 69 ARG CD C 42.9 . 1
774 . 69 ARG N N 109.3 . 1
775 . 70 ASP H H 7.18 . 1
776 . 70 ASP HA H 4.71 . 1
777 . 70 ASP HB2 H 3.18 . 2
778 . 70 ASP HB3 H 2.72 . 2
779 . 70 ASP C C 175.8 . 1
780 . 70 ASP CA C 52.00 . 1
781 . 70 ASP CB C 40.4 . 1
782 . 70 ASP N N 113.6 . 1
783 . 71 ASN H H 8.2 . 1
784 . 71 ASN HA H 4.52 . 1
785 . 71 ASN HB2 H 2.97 . 1
786 . 71 ASN HB3 H 2.97 . 1
787 . 71 ASN C C 174.3 . 1
788 . 71 ASN CA C 53.7 . 1
789 . 71 ASN CB C 37.7 . 1
790 . 71 ASN N N 111.4 . 1
791 . 72 SER H H 7.63 . 1
792 . 72 SER HA H 4.7 . 1
793 . 72 SER HB2 H 3.23 . 2
794 . 72 SER HB3 H 2.94 . 2
795 . 72 SER C C 174.1 . 1
796 . 72 SER CA C 54.2 . 1
797 . 72 SER CB C 63.6 . 1
798 . 72 SER N N 112.6 . 1
799 . 73 PRO HA H 4.54 . 1
800 . 73 PRO HB2 H 2.34 . 2
801 . 73 PRO HB3 H 1.98 . 2
802 . 73 PRO HG2 H 2.05 . 2
803 . 73 PRO HG3 H 1.95 . 2
804 . 73 PRO HD2 H 3.56 . 2
805 . 73 PRO HD3 H 3.29 . 2
806 . 73 PRO C C 179.2 . 1
807 . 73 PRO CA C 62.7 . 1
808 . 73 PRO CB C 31.5 . 1
809 . 73 PRO CG C 27.4 . 1
810 . 73 PRO CD C 49.3 . 1
811 . 74 PHE H H 8.23 . 1
812 . 74 PHE HA H 5.03 . 1
813 . 74 PHE HB2 H 4.05 . 2
814 . 74 PHE HB3 H 2.99 . 2
815 . 74 PHE HD1 H 7.09 . 1
816 . 74 PHE HD2 H 7.09 . 1
817 . 74 PHE HE1 H 6.23 . 1
818 . 74 PHE HE2 H 6.23 . 1
819 . 74 PHE HZ H 6.56 . 1
820 . 74 PHE C C 175.9 . 1
821 . 74 PHE CA C 58.3 . 1
822 . 74 PHE CB C 39.5 . 1
823 . 74 PHE N N 117.9 . 1
824 . 75 ASP H H 8.53 . 1
825 . 75 ASP HA H 4.72 . 1
826 . 75 ASP HB2 H 3.21 . 2
827 . 75 ASP HB3 H 2.8 . 2
828 . 75 ASP C C 177.00 . 1
829 . 75 ASP CA C 53.3 . 1
830 . 75 ASP CB C 40.9 . 1
831 . 75 ASP N N 113.6 . 1
832 . 76 GLY H H 8.84 . 1
833 . 76 GLY HA2 H 4.49 . 1
834 . 76 GLY HA3 H 4.49 . 1
835 . 76 GLY C C 170.2 . 1
836 . 76 GLY CA C 44.00 . 1
837 . 76 GLY N N 108.1 . 1
838 . 77 PRO HA H 4.06 . 1
839 . 77 PRO HB2 H 2.31 . 2
840 . 77 PRO HB3 H 1.89 . 2
841 . 77 PRO HG2 H 2.01 . 2
842 . 77 PRO HG3 H 1.87 . 2
843 . 77 PRO HD2 H 3.72 . 2
844 . 77 PRO HD3 H 3.5 . 2
845 . 77 PRO C C 177.9 . 1
846 . 77 PRO CA C 63.5 . 1
847 . 77 PRO CB C 31.2 . 1
848 . 77 PRO CG C 24.5 . 1
849 . 78 GLY H H 11.42 . 1
850 . 78 GLY HA2 H 4.24 . 2
851 . 78 GLY HA3 H 3.56 . 2
852 . 78 GLY C C 174.1 . 1
853 . 78 GLY CA C 43.00 . 1
854 . 78 GLY N N 117.2 . 1
855 . 79 GLY H H 8.6 . 1
856 . 79 GLY HA2 H 4.00 . 2
857 . 79 GLY HA3 H 3.5 . 2
858 . 79 GLY C C 175.1 . 1
859 . 79 GLY CA C 46.2 . 1
860 . 79 GLY N N 108.00 . 1
861 . 80 ASN H H 11.05 . 1
862 . 80 ASN HA H 4.67 . 1
863 . 80 ASN HB2 H 3.03 . 2
864 . 80 ASN HB3 H 2.94 . 2
865 . 80 ASN HD21 H 7.67 . 2
866 . 80 ASN HD22 H 7.12 . 2
867 . 80 ASN C C 175.4 . 1
868 . 80 ASN CA C 54.00 . 1
869 . 80 ASN CB C 38.6 . 1
870 . 80 ASN N N 126.6 . 1
871 . 80 ASN ND2 N 112.00 . 1
872 . 81 LEU H H 9.23 . 1
873 . 81 LEU HA H 4.51 . 1
874 . 81 LEU HB2 H 1.68 . 2
875 . 81 LEU HB3 H 1.46 . 2
876 . 81 LEU HG H 1.6 . 1
877 . 81 LEU HD1 H -0.22 . 2
878 . 81 LEU HD2 H 0.32 . 2
879 . 81 LEU C C 175.2 . 1
880 . 81 LEU CA C 55.6 . 1
881 . 81 LEU CB C 43.6 . 1
882 . 81 LEU CG C 25.7 . 1
883 . 81 LEU CD1 C 20.3 . 2
884 . 81 LEU CD2 C 25.6 . 2
885 . 81 LEU N N 122.7 . 1
886 . 82 ALA H H 7.47 . 1
887 . 82 ALA HA H 4.75 . 1
888 . 82 ALA HB H 1.1 . 1
889 . 82 ALA C C 174.7 . 1
890 . 82 ALA CA C 51.00 . 1
891 . 82 ALA CB C 21.4 . 1
892 . 82 ALA N N 112.00 . 1
893 . 83 HIS H H 8.82 . 1
894 . 83 HIS HA H 4.85 . 1
895 . 83 HIS HB2 H 3.44 . 2
896 . 83 HIS HB3 H 2.93 . 2
897 . 83 HIS HD2 H 6.4 . 1
898 . 83 HIS HE1 H 7.98 . 1
899 . 83 HIS C C 171.8 . 1
900 . 83 HIS CA C 54.2 . 1
901 . 83 HIS CB C 30.5 . 1
902 . 83 HIS CE1 C 140.8 . 1
903 . 83 HIS N N 109.8 . 1
904 . 84 ALA H H 7.93 . 1
905 . 84 ALA HA H 5.16 . 1
906 . 84 ALA HB H 1.36 . 1
907 . 84 ALA C C 175.6 . 1
908 . 84 ALA CA C 50.4 . 1
909 . 84 ALA CB C 23.6 . 1
910 . 84 ALA N N 118.00 . 1
911 . 85 PHE H H 8.19 . 1
912 . 85 PHE HA H 4.39 . 1
913 . 85 PHE HB2 H 3.11 . 2
914 . 85 PHE HB3 H 3.06 . 2
915 . 85 PHE HD1 H 7.1 . 1
916 . 85 PHE HD2 H 7.1 . 1
917 . 85 PHE HE1 H 6.78 . 1
918 . 85 PHE HE2 H 6.78 . 1
919 . 85 PHE HZ H 6.89 . 1
920 . 85 PHE C C 174.8 . 1
921 . 85 PHE CA C 56.9 . 1
922 . 85 PHE CB C 41.1 . 1
923 . 85 PHE CD1 C 132.2 . 1
924 . 85 PHE CD2 C 132.2 . 1
925 . 85 PHE CE1 C 130.1 . 1
926 . 85 PHE CE2 C 130.1 . 1
927 . 85 PHE CZ C 129.00 . 1
928 . 85 PHE N N 117.9 . 1
929 . 86 GLN H H 8.28 . 1
930 . 86 GLN HA H 4.36 . 1
931 . 86 GLN HB2 H 2.04 . 2
932 . 86 GLN HB3 H 1.81 . 2
933 . 86 GLN HG2 H 2.4 . 1
934 . 86 GLN HG3 H 2.4 . 1
935 . 86 GLN C C 173.9 . 1
936 . 86 GLN CA C 54.1 . 1
937 . 86 GLN CB C 26.6 . 1
938 . 86 GLN CG C 33.3 . 1
939 . 86 GLN N N 116.00 . 1
940 . 87 PRO HA H 2.94 . 1
941 . 87 PRO HB2 H 0.69 . 2
942 . 87 PRO HB3 H -0.12 . 2
943 . 87 PRO HD2 H 3.56 . 2
944 . 87 PRO HD3 H 3.29 . 2
945 . 87 PRO C C 173.5 . 1
946 . 87 PRO CA C 64.4 . 1
947 . 87 PRO CB C 31.6 . 1
948 . 87 PRO CD C 49.2 . 1
949 . 88 GLY H H 5.68 . 1
950 . 88 GLY HA2 H 4.23 . 2
951 . 88 GLY HA3 H 3.71 . 2
952 . 88 GLY C C 169.1 . 1
953 . 88 GLY CA C 43.9 . 1
954 . 88 GLY N N 105.2 . 1
955 . 89 PRO HA H 4.69 . 1
956 . 89 PRO HB2 H 2.45 . 2
957 . 89 PRO HB3 H 2.08 . 2
958 . 89 PRO HG2 H 2.1 . 2
959 . 89 PRO HG3 H 2.00 . 2
960 . 89 PRO HD2 H 3.57 . 1
961 . 89 PRO HD3 H 3.57 . 1
962 . 89 PRO C C 178.1 . 1
963 . 89 PRO CA C 62.2 . 1
964 . 89 PRO CB C 32.8 . 1
965 . 89 PRO CG C 26.5 . 1
966 . 89 PRO CD C 48.9 . 1
967 . 90 GLY H H 9.01 . 1
968 . 90 GLY HA2 H 4.03 . 2
969 . 90 GLY HA3 H 3.78 . 2
970 . 90 GLY C C 174.7 . 1
971 . 90 GLY CA C 47.00 . 1
972 . 90 GLY N N 108.8 . 1
973 . 91 ILE H H 9.09 . 1
974 . 91 ILE HA H 4.28 . 1
975 . 91 ILE HB H 1.53 . 1
976 . 91 ILE HG12 H 1.00 . 2
977 . 91 ILE HG13 H 0.52 . 2
978 . 91 ILE HG2 H 0.52 . 1
979 . 91 ILE HD1 H 0.52 . 1
980 . 91 ILE C C 173.9 . 1
981 . 91 ILE CA C 61.4 . 1
982 . 91 ILE CB C 38.1 . 1
983 . 91 ILE CG1 C 27.9 . 1
984 . 91 ILE CG2 C 16.1 . 1
985 . 91 ILE CD1 C 14.5 . 1
986 . 91 ILE N N 132.4 . 1
987 . 92 GLY H H 7.68 . 1
988 . 92 GLY HA2 H 3.3 . 2
989 . 92 GLY HA3 H 3.82 . 2
990 . 92 GLY C C 174.8 . 1
991 . 92 GLY CA C 46.5 . 1
992 . 92 GLY N N 104.1 . 1
993 . 93 GLY H H 7.65 . 1
994 . 93 GLY HA2 H 4.78 . 2
995 . 93 GLY HA3 H 4.29 . 2
996 . 93 GLY C C 171.7 . 1
997 . 93 GLY CA C 46.5 . 1
998 . 93 GLY N N 116.5 . 1
999 . 94 ASP H H 8.36 . 1
1000 . 94 ASP HA H 4.75 . 1
1001 . 94 ASP HB2 H 3.13 . 2
1002 . 94 ASP HB3 H 3.04 . 2
1003 . 94 ASP C C 173.6 . 1
1004 . 94 ASP CA C 55.7 . 1
1005 . 94 ASP CB C 39.8 . 1
1006 . 94 ASP N N 120.5 . 1
1007 . 95 ALA H H 8.42 . 1
1008 . 95 ALA HA H 4.96 . 1
1009 . 95 ALA HB H 1.06 . 1
1010 . 95 ALA C C 174.4 . 1
1011 . 95 ALA CA C 50.6 . 1
1012 . 95 ALA CB C 21.1 . 1
1013 . 95 ALA N N 116.5 . 1
1014 . 96 HIS H H 9.03 . 1
1015 . 96 HIS HA H 5.58 . 1
1016 . 96 HIS HB2 H 2.52 . 2
1017 . 96 HIS HB3 H 2.91 . 2
1018 . 96 HIS HD2 H 7.25 . 1
1019 . 96 HIS HE1 H 8.46 . 1
1020 . 96 HIS C C 172.9 . 1
1021 . 96 HIS CA C 50.6 . 1
1022 . 96 HIS CB C 33.5 . 1
1023 . 96 HIS CD2 C 117.2 . 1
1024 . 96 HIS CE1 C 141.1 . 1
1025 . 96 HIS N N 118.6 . 1
1026 . 97 PHE H H 8.9 . 1
1027 . 97 PHE HA H 4.28 . 1
1028 . 97 PHE HB2 H 2.25 . 2
1029 . 97 PHE HB3 H 1.96 . 2
1030 . 97 PHE HD1 H 6.25 . 1
1031 . 97 PHE HD2 H 6.25 . 1
1032 . 97 PHE HE1 H 6.59 . 1
1033 . 97 PHE HE2 H 6.59 . 1
1034 . 97 PHE HZ H 6.49 . 1
1035 . 97 PHE C C 173.9 . 1
1036 . 97 PHE CA C 56.2 . 1
1037 . 97 PHE CB C 41.1 . 1
1038 . 97 PHE CD1 C 131.8 . 1
1039 . 97 PHE CD2 C 131.8 . 1
1040 . 97 PHE CE1 C 128.7 . 1
1041 . 97 PHE CE2 C 128.7 . 1
1042 . 97 PHE CZ C 125.4 . 1
1043 . 97 PHE N N 119.7 . 1
1044 . 98 ASP H H 8.08 . 1
1045 . 98 ASP HA H 4.37 . 1
1046 . 98 ASP HB2 H 3.00 . 2
1047 . 98 ASP HB3 H 0.58 . 2
1048 . 98 ASP C C 179.1 . 1
1049 . 98 ASP CA C 53.8 . 1
1050 . 98 ASP CB C 39.9 . 1
1051 . 98 ASP N N 120.1 . 1
1052 . 99 GLU H H 9.93 . 1
1053 . 99 GLU HA H 4.55 . 1
1054 . 99 GLU HB2 H 2.11 . 2
1055 . 99 GLU HB3 H 1.78 . 2
1056 . 99 GLU HG2 H 2.75 . 2
1057 . 99 GLU HG3 H 2.41 . 2
1058 . 99 GLU C C 176.6 . 1
1059 . 99 GLU CA C 56.00 . 1
1060 . 99 GLU CB C 30.9 . 1
1061 . 99 GLU CG C 36.2 . 1
1062 . 99 GLU N N 128.9 . 1
1063 . 100 ASP H H 8.9 . 1
1064 . 100 ASP HA H 4.73 . 1
1065 . 100 ASP HB2 H 2.7 . 2
1066 . 100 ASP HB3 H 2.34 . 2
1067 . 100 ASP C C 176.5 . 1
1068 . 100 ASP CA C 56.2 . 1
1069 . 100 ASP CB C 38.9 . 1
1070 . 100 ASP N N 116.1 . 1
1071 . 101 GLU H H 7.45 . 1
1072 . 101 GLU HA H 4.71 . 1
1073 . 101 GLU HB2 H 1.23 . 2
1074 . 101 GLU HB3 H 0.63 . 2
1075 . 101 GLU HG2 H 2.57 . 2
1076 . 101 GLU HG3 H 1.79 . 2
1077 . 101 GLU C C 175.6 . 1
1078 . 101 GLU CA C 52.9 . 1
1079 . 101 GLU CB C 27.2 . 1
1080 . 101 GLU CG C 34.8 . 1
1081 . 101 GLU N N 113.3 . 1
1082 . 102 ARG H H 7.97 . 1
1083 . 102 ARG HA H 4.43 . 1
1084 . 102 ARG HB2 H 1.84 . 2
1085 . 102 ARG HB3 H 1.47 . 2
1086 . 102 ARG HG2 H 1.59 . 2
1087 . 102 ARG HG3 H 1.16 . 2
1088 . 102 ARG HD2 H 3.09 . 2
1089 . 102 ARG HD3 H 3.02 . 2
1090 . 102 ARG C C 173.1 . 1
1091 . 102 ARG CA C 54.3 . 1
1092 . 102 ARG CB C 28.9 . 1
1093 . 102 ARG CG C 26.2 . 1
1094 . 102 ARG CD C 42.6 . 1
1095 . 102 ARG N N 123.8 . 1
1096 . 103 TRP H H 9.27 . 1
1097 . 103 TRP HA H 5.5 . 1
1098 . 103 TRP HB2 H 3.22 . 2
1099 . 103 TRP HB3 H 3.11 . 2
1100 . 103 TRP HD1 H 7.41 . 1
1101 . 103 TRP HE1 H 9.46 . 1
1102 . 103 TRP HE3 H 7.62 . 1
1103 . 103 TRP HZ2 H 7.28 . 1
1104 . 103 TRP HZ3 H 6.87 . 1
1105 . 103 TRP HH2 H 7.03 . 1
1106 . 103 TRP C C 177.1 . 1
1107 . 103 TRP CA C 55.4 . 1
1108 . 103 TRP CB C 30.8 . 1
1109 . 103 TRP CE3 C 121.8 . 1
1110 . 103 TRP CZ3 C 119.9 . 1
1111 . 103 TRP CH2 C 123.1 . 1
1112 . 103 TRP N N 127.8 . 1
1113 . 103 TRP NE1 N 123.6 . 1
1114 . 104 THR H H 9.32 . 1
1115 . 104 THR HA H 4.85 . 1
1116 . 104 THR HB H 4.34 . 1
1117 . 104 THR HG2 H 0.73 . 1
1118 . 104 THR C C 174.8 . 1
1119 . 104 THR CA C 59.6 . 1
1120 . 104 THR CB C 71.3 . 1
1121 . 104 THR CG2 C 20.2 . 1
1122 . 104 THR N N 109.9 . 1
1123 . 105 ASN H H 8.42 . 1
1124 . 105 ASN HA H 5.06 . 1
1125 . 105 ASN HB2 H 3.13 . 2
1126 . 105 ASN HB3 H 2.7 . 2
1127 . 105 ASN C C 174.5 . 1
1128 . 105 ASN CA C 50.9 . 1
1129 . 105 ASN CB C 38.7 . 1
1130 . 105 ASN N N 115.2 . 1
1131 . 106 ASN H H 7.88 . 1
1132 . 106 ASN HA H 4.94 . 1
1133 . 106 ASN HB2 H 3.33 . 2
1134 . 106 ASN HB3 H 3.01 . 2
1135 . 106 ASN HD21 H 7.57 . 2
1136 . 106 ASN HD22 H 6.75 . 2
1137 . 106 ASN C C 173.3 . 1
1138 . 106 ASN CA C 52.1 . 1
1139 . 106 ASN CB C 38.00 . 1
1140 . 106 ASN N N 116.7 . 1
1141 . 106 ASN ND2 N 110.1 . 1
1142 . 107 PHE H H 7.57 . 1
1143 . 107 PHE HA H 4.46 . 1
1144 . 107 PHE HB2 H 2.63 . 2
1145 . 107 PHE HB3 H 2.67 . 2
1146 . 107 PHE HD1 H 7.00 . 1
1147 . 107 PHE HD2 H 7.00 . 1
1148 . 107 PHE HE1 H 7.23 . 1
1149 . 107 PHE HE2 H 7.23 . 1
1150 . 107 PHE HZ H 7.12 . 1
1151 . 107 PHE C C 177.2 . 1
1152 . 107 PHE CA C 58.2 . 1
1153 . 107 PHE CB C 38.5 . 1
1154 . 107 PHE CD1 C 131.5 . 1
1155 . 107 PHE CD2 C 131.5 . 1
1156 . 107 PHE CE1 C 130.7 . 1
1157 . 107 PHE CE2 C 130.7 . 1
1158 . 107 PHE CZ C 129.9 . 1
1159 . 107 PHE N N 110.1 . 1
1160 . 108 ARG H H 8.03 . 1
1161 . 108 ARG HA H 4.06 . 1
1162 . 108 ARG HB2 H 1.83 . 2
1163 . 108 ARG HB3 H 1.67 . 2
1164 . 108 ARG HG2 H 1.45 . 2
1165 . 108 ARG HG3 H 1.35 . 2
1166 . 108 ARG HD2 H 3.13 . 1
1167 . 108 ARG HD3 H 3.13 . 1
1168 . 108 ARG C C 175.00 . 1
1169 . 108 ARG CA C 55.8 . 1
1170 . 108 ARG CB C 29.7 . 1
1171 . 108 ARG CG C 27.4 . 1
1172 . 108 ARG CD C 43.1 . 1
1173 . 108 ARG N N 121.2 . 1
1174 . 109 GLU H H 8.56 . 1
1175 . 109 GLU HA H 3.79 . 1
1176 . 109 GLU HB2 H 1.16 . 2
1177 . 109 GLU HB3 H -0.05 . 2
1178 . 109 GLU HG2 H 2.19 . 2
1179 . 109 GLU HG3 H 1.97 . 2
1180 . 109 GLU C C 177.9 . 1
1181 . 109 GLU CA C 52.3 . 1
1182 . 109 GLU CB C 27.4 . 1
1183 . 109 GLU CG C 36.6 . 1
1184 . 109 GLU N N 119.00 . 1
1185 . 110 TYR H H 8.28 . 1
1186 . 110 TYR HA H 3.8 . 1
1187 . 110 TYR HB2 H 2.27 . 2
1188 . 110 TYR HB3 H 1.99 . 2
1189 . 110 TYR HD1 H 5.68 . 1
1190 . 110 TYR HD2 H 5.68 . 1
1191 . 110 TYR HE1 H 6.47 . 1
1192 . 110 TYR HE2 H 6.47 . 1
1193 . 110 TYR C C 173.2 . 1
1194 . 110 TYR CA C 61.9 . 1
1195 . 110 TYR CB C 41.2 . 1
1196 . 110 TYR CD1 C 137.8 . 1
1197 . 110 TYR CD2 C 137.8 . 1
1198 . 110 TYR CE1 C 118.5 . 1
1199 . 110 TYR CE2 C 118.5 . 1
1200 . 110 TYR N N 122.1 . 1
1201 . 111 ASN H H 8.45 . 1
1202 . 111 ASN HA H 4.89 . 1
1203 . 111 ASN HB2 H 2.26 . 1
1204 . 111 ASN HB3 H 2.26 . 1
1205 . 111 ASN C C 175.7 . 1
1206 . 111 ASN CA C 54.7 . 1
1207 . 111 ASN CB C 39.2 . 1
1208 . 111 ASN N N 121.5 . 1
1209 . 112 LEU H H 9.02 . 1
1210 . 112 LEU HA H 4.48 . 1
1211 . 112 LEU HB2 H 1.96 . 2
1212 . 112 LEU HB3 H 1.64 . 2
1213 . 112 LEU HG H 1.2 . 1
1214 . 112 LEU HD1 H 0.78 . 2
1215 . 112 LEU HD2 H -0.04 . 2
1216 . 112 LEU C C 176.9 . 1
1217 . 112 LEU CA C 58.00 . 1
1218 . 112 LEU CB C 41.2 . 1
1219 . 112 LEU CG C 27.2 . 1
1220 . 112 LEU CD1 C 27.8 . 2
1221 . 112 LEU CD2 C 21.8 . 2
1222 . 112 LEU N N 127.7 . 1
1223 . 113 HIS H H 9.05 . 1
1224 . 113 HIS HA H 4.09 . 1
1225 . 113 HIS HB2 H 3.79 . 2
1226 . 113 HIS HB3 H 3.19 . 2
1227 . 113 HIS HD2 H 7.9 . 1
1228 . 113 HIS HE1 H 8.06 . 1
1229 . 113 HIS C C 175.7 . 1
1230 . 113 HIS CA C 59.9 . 1
1231 . 113 HIS CB C 27.9 . 1
1232 . 113 HIS N N 117.7 . 1
1233 . 114 ARG H H 8.91 . 1
1234 . 114 ARG HA H 3.96 . 1
1235 . 114 ARG HB2 H 2.41 . 1
1236 . 114 ARG HB3 H 2.41 . 1
1237 . 114 ARG HG2 H 1.83 . 1
1238 . 114 ARG HG3 H 1.83 . 1
1239 . 114 ARG HD2 H 3.59 . 2
1240 . 114 ARG HD3 H 3.42 . 2
1241 . 114 ARG C C 178.5 . 1
1242 . 114 ARG CA C 58.00 . 1
1243 . 114 ARG CB C 29.1 . 1
1244 . 114 ARG CG C 26.00 . 1
1245 . 114 ARG CD C 42.00 . 1
1246 . 114 ARG N N 115.2 . 1
1247 . 115 VAL H H 8.18 . 1
1248 . 115 VAL HA H 4.05 . 1
1249 . 115 VAL HB H 2.51 . 1
1250 . 115 VAL HG1 H 1.65 . 2
1251 . 115 VAL HG2 H 1.36 . 2
1252 . 115 VAL C C 178.1 . 1
1253 . 115 VAL CA C 66.8 . 1
1254 . 115 VAL CB C 32.1 . 1
1255 . 115 VAL CG1 C 24.5 . 2
1256 . 115 VAL CG2 C 22.3 . 2
1257 . 115 VAL N N 116.8 . 1
1258 . 116 ALA H H 10.00 . 1
1259 . 116 ALA HA H 4.01 . 1
1260 . 116 ALA HB H 1.21 . 1
1261 . 116 ALA C C 178.00 . 1
1262 . 116 ALA CA C 55.6 . 1
1263 . 116 ALA CB C 17.5 . 1
1264 . 116 ALA N N 121.2 . 1
1265 . 117 ALA H H 8.57 . 1
1266 . 117 ALA HA H 3.84 . 1
1267 . 117 ALA HB H 1.2 . 1
1268 . 117 ALA C C 177.9 . 1
1269 . 117 ALA CA C 56.4 . 1
1270 . 117 ALA CB C 18.5 . 1
1271 . 117 ALA N N 115.5 . 1
1272 . 118 HIS H H 7.01 . 1
1273 . 118 HIS HA H 4.4 . 1
1274 . 118 HIS HB2 H 3.86 . 2
1275 . 118 HIS HB3 H 3.08 . 2
1276 . 118 HIS HD2 H 6.85 . 1
1277 . 118 HIS HE1 H 7.89 . 1
1278 . 118 HIS C C 175.9 . 1
1279 . 118 HIS CA C 58.7 . 1
1280 . 118 HIS CB C 28.2 . 1
1281 . 118 HIS CD2 C 127.00 . 1
1282 . 118 HIS CE1 C 137.1 . 1
1283 . 118 HIS N N 111.1 . 1
1284 . 119 GLU H H 8.94 . 1
1285 . 119 GLU HA H 4.08 . 1
1286 . 119 GLU HB2 H 1.97 . 2
1287 . 119 GLU HB3 H 1.75 . 2
1288 . 119 GLU HG2 H 2.93 . 1
1289 . 119 GLU HG3 H 2.93 . 1
1290 . 119 GLU C C 177.8 . 1
1291 . 119 GLU CA C 57.8 . 1
1292 . 119 GLU CB C 26.8 . 1
1293 . 119 GLU CG C 31.7 . 1
1294 . 119 GLU N N 113.5 . 1
1295 . 120 LEU H H 8.67 . 1
1296 . 120 LEU HA H 4.06 . 1
1297 . 120 LEU HB2 H 1.42 . 2
1298 . 120 LEU HB3 H 0.77 . 2
1299 . 120 LEU HG H 1.52 . 1
1300 . 120 LEU HD1 H -0.42 . 2
1301 . 120 LEU HD2 H 0.37 . 2
1302 . 120 LEU C C 177.7 . 1
1303 . 120 LEU CA C 56.00 . 1
1304 . 120 LEU CB C 40.1 . 1
1305 . 120 LEU CG C 26.3 . 1
1306 . 120 LEU CD1 C 22.8 . 2
1307 . 120 LEU CD2 C 21.2 . 2
1308 . 120 LEU N N 113.9 . 1
1309 . 121 GLY H H 7.22 . 1
1310 . 121 GLY HA2 H 3.89 . 2
1311 . 121 GLY HA3 H 2.44 . 2
1312 . 121 GLY C C 177.5 . 1
1313 . 121 GLY CA C 47.6 . 1
1314 . 121 GLY N N 103.1 . 1
1315 . 122 HIS H H 7.02 . 1
1316 . 122 HIS HA H 5.01 . 1
1317 . 122 HIS HB2 H 3.75 . 2
1318 . 122 HIS HB3 H 2.73 . 2
1319 . 122 HIS HD2 H 6.98 . 1
1320 . 122 HIS HE1 H 6.7 . 1
1321 . 122 HIS C C 179.3 . 1
1322 . 122 HIS CA C 57.5 . 1
1323 . 122 HIS CB C 27.2 . 1
1324 . 122 HIS CD2 C 127.5 . 1
1325 . 122 HIS CE1 C 137.8 . 1
1326 . 122 HIS N N 117.7 . 1
1327 . 123 SER H H 8.06 . 1
1328 . 123 SER HA H 4.33 . 1
1329 . 123 SER HB2 H 4.69 . 1
1330 . 123 SER HB3 H 4.69 . 1
1331 . 123 SER C C 174.6 . 1
1332 . 123 SER CA C 62.6 . 1
1333 . 123 SER N N 115.4 . 1
1334 . 124 LEU H H 7.17 . 1
1335 . 124 LEU HA H 4.59 . 1
1336 . 124 LEU HB2 H 1.73 . 2
1337 . 124 LEU HB3 H 1.6 . 2
1338 . 124 LEU HG H 2.06 . 1
1339 . 124 LEU HD1 H 0.42 . 2
1340 . 124 LEU HD2 H 0.94 . 2
1341 . 124 LEU C C 177.6 . 1
1342 . 124 LEU CA C 54.5 . 1
1343 . 124 LEU CB C 42.3 . 1
1344 . 124 LEU CG C 25.6 . 1
1345 . 124 LEU CD1 C 24.2 . 2
1346 . 124 LEU CD2 C 22.00 . 2
1347 . 124 LEU N N 111.7 . 1
1348 . 125 GLY H H 8.23 . 1
1349 . 125 GLY HA2 H 4.77 . 2
1350 . 125 GLY HA3 H 3.61 . 2
1351 . 125 GLY C C 173.8 . 1
1352 . 125 GLY CA C 44.3 . 1
1353 . 125 GLY N N 105.8 . 1
1354 . 126 LEU H H 8.36 . 1
1355 . 126 LEU HA H 4.56 . 1
1356 . 126 LEU HB2 H 1.6 . 2
1357 . 126 LEU HB3 H 1.21 . 2
1358 . 126 LEU HG H 1.45 . 1
1359 . 126 LEU HD1 H 0.91 . 2
1360 . 126 LEU HD2 H 0.82 . 2
1361 . 126 LEU C C 177.4 . 1
1362 . 126 LEU CA C 54.5 . 1
1363 . 126 LEU CB C 42.1 . 1
1364 . 126 LEU CG C 26.5 . 1
1365 . 126 LEU CD1 C 27.1 . 2
1366 . 126 LEU CD2 C 21.9 . 2
1367 . 126 LEU N N 117.5 . 1
1368 . 127 SER H H 8.58 . 1
1369 . 127 SER HA H 4.7 . 1
1370 . 127 SER HB2 H 4.01 . 2
1371 . 127 SER HB3 H 3.94 . 2
1372 . 127 SER C C 173.4 . 1
1373 . 127 SER CA C 56.3 . 1
1374 . 127 SER CB C 64.5 . 1
1375 . 127 SER N N 115.8 . 1
1376 . 128 HIS H H 8.48 . 1
1377 . 128 HIS HA H 5.18 . 1
1378 . 128 HIS HB2 H 2.97 . 2
1379 . 128 HIS HB3 H 2.31 . 2
1380 . 128 HIS HD2 H 7.36 . 1
1381 . 128 HIS C C 174.4 . 1
1382 . 128 HIS CA C 56.4 . 1
1383 . 128 HIS CB C 29.2 . 1
1384 . 128 HIS CD2 C 125.5 . 1
1385 . 128 HIS N N 114.4 . 1
1386 . 129 SER H H 7.12 . 1
1387 . 129 SER HA H 4.86 . 1
1388 . 129 SER HB2 H 4.34 . 2
1389 . 129 SER HB3 H 3.31 . 2
1390 . 129 SER C C 175.5 . 1
1391 . 129 SER CA C 54.9 . 1
1392 . 129 SER CB C 64.7 . 1
1393 . 129 SER N N 112.7 . 1
1394 . 130 THR H H 8.65 . 1
1395 . 130 THR HA H 4.62 . 1
1396 . 130 THR HB H 4.68 . 1
1397 . 130 THR HG2 H 1.36 . 1
1398 . 130 THR C C 174.00 . 1
1399 . 130 THR CA C 61.7 . 1
1400 . 130 THR CB C 68.8 . 1
1401 . 130 THR CG2 C 21.3 . 1
1402 . 130 THR N N 112.3 . 1
1403 . 131 ASP H H 8.85 . 1
1404 . 131 ASP HA H 4.64 . 1
1405 . 131 ASP HB2 H 2.96 . 2
1406 . 131 ASP HB3 H 2.46 . 2
1407 . 131 ASP C C 175.9 . 1
1408 . 131 ASP CA C 53.5 . 1
1409 . 131 ASP CB C 41.1 . 1
1410 . 131 ASP N N 123.2 . 1
1411 . 132 ILE H H 7.95 . 1
1412 . 132 ILE HA H 2.62 . 1
1413 . 132 ILE HB H 1.45 . 1
1414 . 132 ILE HG12 H 1.09 . 2
1415 . 132 ILE HG13 H 1.03 . 2
1416 . 132 ILE HG2 H 0.75 . 1
1417 . 132 ILE HD1 H 0.75 . 1
1418 . 132 ILE C C 176.3 . 1
1419 . 132 ILE CA C 62.5 . 1
1420 . 132 ILE CB C 38.2 . 1
1421 . 132 ILE CG1 C 27.5 . 1
1422 . 132 ILE CG2 C 16.6 . 1
1423 . 132 ILE CD1 C 13.9 . 1
1424 . 132 ILE N N 122.8 . 1
1425 . 133 GLY H H 8.65 . 1
1426 . 133 GLY HA2 H 4.17 . 2
1427 . 133 GLY HA3 H 3.57 . 2
1428 . 133 GLY C C 173.7 . 1
1429 . 133 GLY CA C 44.3 . 1
1430 . 133 GLY N N 107.2 . 1
1431 . 134 ALA H H 8.07 . 1
1432 . 134 ALA HA H 4.58 . 1
1433 . 134 ALA HB H 1.87 . 1
1434 . 134 ALA C C 179.2 . 1
1435 . 134 ALA CA C 51.3 . 1
1436 . 134 ALA CB C 18.8 . 1
1437 . 134 ALA N N 121.5 . 1
1438 . 135 LEU H H 12.26 . 1
1439 . 135 LEU HA H 4.34 . 1
1440 . 135 LEU HB2 H 1.75 . 2
1441 . 135 LEU HB3 H 1.65 . 2
1442 . 135 LEU HG H 1.77 . 1
1443 . 135 LEU HD1 H 0.69 . 2
1444 . 135 LEU HD2 H 0.92 . 2
1445 . 135 LEU C C 180.9 . 1
1446 . 135 LEU CA C 57.5 . 1
1447 . 135 LEU CB C 41.3 . 1
1448 . 135 LEU CG C 26.8 . 1
1449 . 135 LEU CD1 C 25.9 . 2
1450 . 135 LEU CD2 C 23.9 . 2
1451 . 135 LEU N N 130.6 . 1
1452 . 136 MET H H 8.55 . 1
1453 . 136 MET HA H 4.85 . 1
1454 . 136 MET HB2 H 2.45 . 1
1455 . 136 MET HB3 H 2.45 . 1
1456 . 136 MET HG2 H 2.86 . 2
1457 . 136 MET HG3 H 2.72 . 2
1458 . 136 MET HE H 0.6 . 1
1459 . 136 MET C C 177.5 . 1
1460 . 136 MET CA C 53.2 . 1
1461 . 136 MET CB C 26.9 . 1
1462 . 136 MET CG C 29.9 . 1
1463 . 136 MET CE C 32.2 . 1
1464 . 136 MET N N 110.00 . 1
1465 . 137 TYR H H 8.12 . 1
1466 . 137 TYR HA H 4.95 . 1
1467 . 137 TYR HB2 H 3.84 . 2
1468 . 137 TYR HB3 H 3.00 . 2
1469 . 137 TYR HD1 H 7.13 . 1
1470 . 137 TYR HD2 H 7.13 . 1
1471 . 137 TYR HE1 H 6.78 . 1
1472 . 137 TYR HE2 H 6.78 . 1
1473 . 137 TYR C C 176.5 . 1
1474 . 137 TYR CA C 57.7 . 1
1475 . 137 TYR CB C 38.7 . 1
1476 . 137 TYR CD1 C 134.1 . 1
1477 . 137 TYR CD2 C 134.1 . 1
1478 . 137 TYR CE1 C 117.7 . 1
1479 . 137 TYR CE2 C 117.7 . 1
1480 . 137 TYR N N 126.5 . 1
1481 . 138 PRO HA H 3.68 . 1
1482 . 138 PRO HB2 H 1.78 . 1
1483 . 138 PRO HB3 H 1.78 . 1
1484 . 138 PRO HG2 H 1.44 . 1
1485 . 138 PRO HG3 H 1.44 . 1
1486 . 138 PRO HD2 H 3.47 . 2
1487 . 138 PRO HD3 H 2.16 . 2
1488 . 138 PRO C C 175.2 . 1
1489 . 138 PRO CA C 64.1 . 1
1490 . 138 PRO CB C 29.1 . 1
1491 . 138 PRO CG C 26.9 . 1
1492 . 138 PRO CD C 50.3 . 1
1493 . 139 SER H H 7.07 . 1
1494 . 139 SER HA H 4.54 . 1
1495 . 139 SER HB2 H 3.96 . 2
1496 . 139 SER HB3 H 3.92 . 2
1497 . 139 SER C C 173.7 . 1
1498 . 139 SER CA C 57.7 . 1
1499 . 139 SER CB C 64.4 . 1
1500 . 139 SER N N 110.9 . 1
1501 . 140 TYR H H 9.19 . 1
1502 . 140 TYR HA H 4.38 . 1
1503 . 140 TYR HB2 H 3.2 . 2
1504 . 140 TYR HB3 H 2.99 . 2
1505 . 140 TYR HD1 H 7.25 . 1
1506 . 140 TYR HD2 H 7.25 . 1
1507 . 140 TYR HE1 H 7.06 . 1
1508 . 140 TYR HE2 H 7.06 . 1
1509 . 140 TYR C C 174.4 . 1
1510 . 140 TYR CA C 60.1 . 1
1511 . 140 TYR CB C 38.4 . 1
1512 . 140 TYR CD1 C 133.4 . 1
1513 . 140 TYR CD2 C 133.4 . 1
1514 . 140 TYR CE1 C 117.7 . 1
1515 . 140 TYR CE2 C 117.7 . 1
1516 . 140 TYR N N 124.1 . 1
1517 . 141 THR H H 6.68 . 1
1518 . 141 THR HA H 4.2 . 1
1519 . 141 THR HB H 4.11 . 1
1520 . 141 THR HG2 H 1.22 . 1
1521 . 141 THR C C 173.6 . 1
1522 . 141 THR CA C 60.00 . 1
1523 . 141 THR CB C 71.7 . 1
1524 . 141 THR CG2 C 21.3 . 1
1525 . 141 THR N N 117.8 . 1
1526 . 142 PHE HA H 4.47 . 1
1527 . 142 PHE HB2 H 3.27 . 1
1528 . 142 PHE HB3 H 3.27 . 1
1529 . 142 PHE HD1 H 7.37 . 1
1530 . 142 PHE HD2 H 7.37 . 1
1531 . 142 PHE C C 178.7 . 1
1532 . 142 PHE CA C 58.00 . 1
1533 . 142 PHE CB C 38.4 . 1
1534 . 143 SER HA H 4.56 . 1
1535 . 143 SER HB2 H 4.01 . 2
1536 . 143 SER HB3 H 3.76 . 2
1537 . 143 SER C C 173.8 . 1
1538 . 143 SER CA C 56.7 . 1
1539 . 143 SER CB C 63.8 . 1
1540 . 144 GLY HA2 H 4.36 . 2
1541 . 144 GLY HA3 H 2.93 . 2
1542 . 144 GLY C C 171.8 . 1
1543 . 144 GLY CA C 45.5 . 1
1544 . 145 ASP H H 7.63 . 1
1545 . 145 ASP HA H 4.81 . 1
1546 . 145 ASP HB2 H 2.51 . 1
1547 . 145 ASP HB3 H 2.51 . 1
1548 . 145 ASP C C 174.4 . 1
1549 . 145 ASP CA C 52.8 . 1
1550 . 145 ASP CB C 42.5 . 1
1551 . 145 ASP N N 118.2 . 1
1552 . 146 VAL H H 8.6 . 1
1553 . 146 VAL HA H 4.19 . 1
1554 . 146 VAL HB H 2.2 . 1
1555 . 146 VAL HG1 H 0.61 . 2
1556 . 146 VAL HG2 H 1.04 . 2
1557 . 146 VAL C C 173.5 . 1
1558 . 146 VAL CA C 62.1 . 1
1559 . 146 VAL CB C 32.1 . 1
1560 . 146 VAL CG1 C 21.8 . 2
1561 . 146 VAL CG2 C 22.3 . 2
1562 . 146 VAL N N 121.2 . 1
1563 . 147 GLN H H 8.39 . 1
1564 . 147 GLN HA H 4.58 . 1
1565 . 147 GLN HB2 H 2.06 . 2
1566 . 147 GLN HB3 H 1.73 . 2
1567 . 147 GLN HG2 H 2.24 . 1
1568 . 147 GLN HG3 H 2.24 . 1
1569 . 147 GLN C C 174.3 . 1
1570 . 147 GLN CA C 53.00 . 1
1571 . 147 GLN CB C 32.2 . 1
1572 . 147 GLN CG C 32.4 . 1
1573 . 147 GLN N N 122.00 . 1
1574 . 148 LEU H H 8.56 . 1
1575 . 148 LEU HA H 4.15 . 1
1576 . 148 LEU HB2 H 1.61 . 2
1577 . 148 LEU HB3 H 1.43 . 2
1578 . 148 LEU HG H 1.25 . 1
1579 . 148 LEU HD1 H 0.43 . 2
1580 . 148 LEU HD2 H -0.23 . 2
1581 . 148 LEU C C 177.2 . 1
1582 . 148 LEU CA C 54.7 . 1
1583 . 148 LEU CB C 41.5 . 1
1584 . 148 LEU CG C 26.2 . 1
1585 . 148 LEU CD1 C 26.9 . 2
1586 . 148 LEU CD2 C 22.00 . 2
1587 . 148 LEU N N 117.3 . 1
1588 . 149 ALA H H 9.94 . 1
1589 . 149 ALA HA H 4.74 . 1
1590 . 149 ALA HB H 1.63 . 1
1591 . 149 ALA C C 178.2 . 1
1592 . 149 ALA CA C 49.7 . 1
1593 . 149 ALA CB C 20.8 . 1
1594 . 149 ALA N N 124.3 . 1
1595 . 150 GLN H H 9.1 . 1
1596 . 150 GLN HA H 3.82 . 1
1597 . 150 GLN HB2 H 2.26 . 2
1598 . 150 GLN HB3 H 2.08 . 2
1599 . 150 GLN HG2 H 2.56 . 2
1600 . 150 GLN HG3 H 2.48 . 2
1601 . 150 GLN C C 177.5 . 1
1602 . 150 GLN CA C 59.00 . 1
1603 . 150 GLN CB C 27.3 . 1
1604 . 150 GLN CG C 33.00 . 1
1605 . 150 GLN N N 120.8 . 1
1606 . 151 ASP H H 8.78 . 1
1607 . 151 ASP HA H 4.44 . 1
1608 . 151 ASP HB2 H 2.95 . 2
1609 . 151 ASP HB3 H 2.3 . 2
1610 . 151 ASP C C 178.7 . 1
1611 . 151 ASP CA C 58.2 . 1
1612 . 151 ASP CB C 43.9 . 1
1613 . 151 ASP N N 112.8 . 1
1614 . 152 ASP H H 7.09 . 1
1615 . 152 ASP HA H 4.83 . 1
1616 . 152 ASP HB2 H 3.09 . 2
1617 . 152 ASP HB3 H 2.99 . 2
1618 . 152 ASP C C 177.3 . 1
1619 . 152 ASP CA C 57.00 . 1
1620 . 152 ASP CB C 44.1 . 1
1621 . 152 ASP N N 112.6 . 1
1622 . 153 ILE H H 7.93 . 1
1623 . 153 ILE HA H 3.64 . 1
1624 . 153 ILE HB H 1.88 . 1
1625 . 153 ILE HG12 H 1.82 . 1
1626 . 153 ILE HG13 H 1.82 . 1
1627 . 153 ILE HG2 H 0.96 . 1
1628 . 153 ILE HD1 H 0.83 . 1
1629 . 153 ILE C C 177.5 . 1
1630 . 153 ILE CA C 65.5 . 1
1631 . 153 ILE CB C 38.3 . 1
1632 . 153 ILE CG1 C 30.1 . 1
1633 . 153 ILE CG2 C 16.5 . 1
1634 . 153 ILE CD1 C 12.6 . 1
1635 . 153 ILE N N 117.6 . 1
1636 . 154 ASP H H 9.24 . 1
1637 . 154 ASP HA H 4.46 . 1
1638 . 154 ASP HB2 H 2.81 . 2
1639 . 154 ASP HB3 H 2.78 . 2
1640 . 154 ASP C C 180.00 . 1
1641 . 154 ASP CA C 57.00 . 1
1642 . 154 ASP CB C 39.6 . 1
1643 . 154 ASP N N 117.00 . 1
1644 . 155 GLY H H 8.1 . 1
1645 . 155 GLY HA2 H 4.08 . 2
1646 . 155 GLY HA3 H 3.97 . 2
1647 . 155 GLY C C 176.00 . 1
1648 . 155 GLY CA C 47.1 . 1
1649 . 155 GLY N N 104.8 . 1
1650 . 156 ILE H H 8.64 . 1
1651 . 156 ILE HA H 4.66 . 1
1652 . 156 ILE HB H 2.32 . 1
1653 . 156 ILE HG12 H 1.81 . 2
1654 . 156 ILE HG13 H 2.03 . 2
1655 . 156 ILE HG2 H 1.67 . 1
1656 . 156 ILE HD1 H 1.06 . 1
1657 . 156 ILE C C 178.1 . 1
1658 . 156 ILE CA C 60.8 . 1
1659 . 156 ILE CB C 38.7 . 1
1660 . 156 ILE CG1 C 30.9 . 1
1661 . 156 ILE CG2 C 20.3 . 1
1662 . 156 ILE CD1 C 15.2 . 1
1663 . 156 ILE N N 119.8 . 1
1664 . 157 GLN H H 8.85 . 1
1665 . 157 GLN HA H 4.45 . 1
1666 . 157 GLN HB2 H 2.36 . 2
1667 . 157 GLN HB3 H 1.79 . 2
1668 . 157 GLN HG2 H 2.88 . 2
1669 . 157 GLN HG3 H 3.07 . 2
1670 . 157 GLN C C 179.5 . 1
1671 . 157 GLN CA C 58.00 . 1
1672 . 157 GLN CB C 27.1 . 1
1673 . 157 GLN CG C 34.4 . 1
1674 . 157 GLN N N 121.5 . 1
1675 . 158 ALA H H 7.97 . 1
1676 . 158 ALA HA H 4.2 . 1
1677 . 158 ALA HB H 1.62 . 1
1678 . 158 ALA C C 178.1 . 1
1679 . 158 ALA CA C 54.3 . 1
1680 . 158 ALA CB C 17.7 . 1
1681 . 158 ALA N N 120.3 . 1
1682 . 159 ILE H H 7.01 . 1
1683 . 159 ILE HA H 3.84 . 1
1684 . 159 ILE HB H 1.61 . 1
1685 . 159 ILE HG12 H 1.87 . 1
1686 . 159 ILE HG13 H 1.87 . 1
1687 . 159 ILE HG2 H 0.12 . 1
1688 . 159 ILE HD1 H 0.87 . 1
1689 . 159 ILE C C 177.2 . 1
1690 . 159 ILE CA C 63.6 . 1
1691 . 159 ILE CB C 39.6 . 1
1692 . 159 ILE CG1 C 26.7 . 1
1693 . 159 ILE CG2 C 17.6 . 1
1694 . 159 ILE CD1 C 13.8 . 1
1695 . 159 ILE N N 112.00 . 1
1696 . 160 TYR H H 7.78 . 1
1697 . 160 TYR HA H 4.62 . 1
1698 . 160 TYR HB2 H 3.42 . 2
1699 . 160 TYR HB3 H 2.77 . 2
1700 . 160 TYR HD1 H 7.39 . 1
1701 . 160 TYR HD2 H 7.39 . 1
1702 . 160 TYR HE1 H 7.39 . 1
1703 . 160 TYR HE2 H 7.39 . 1
1704 . 160 TYR C C 175.5 . 1
1705 . 160 TYR CA C 59.7 . 1
1706 . 160 TYR CB C 40.7 . 1
1707 . 160 TYR CD1 C 133.4 . 1
1708 . 160 TYR CD2 C 133.4 . 1
1709 . 160 TYR CE1 C 118.00 . 1
1710 . 160 TYR CE2 C 118.00 . 1
1711 . 160 TYR N N 110.9 . 1
1712 . 161 GLY H H 8.35 . 1
1713 . 161 GLY HA2 H 4.47 . 2
1714 . 161 GLY HA3 H 3.96 . 2
1715 . 161 GLY C C 171.7 . 1
1716 . 161 GLY CA C 43.7 . 1
1717 . 161 GLY N N 106.7 . 1
1718 . 162 ARG H H 7.94 . 1
1719 . 162 ARG HA H 4.76 . 1
1720 . 162 ARG HB2 H 1.87 . 2
1721 . 162 ARG HB3 H 1.77 . 2
1722 . 162 ARG HG2 H 1.63 . 1
1723 . 162 ARG HG3 H 1.63 . 1
1724 . 162 ARG HD2 H 3.25 . 1
1725 . 162 ARG HD3 H 3.25 . 1
1726 . 162 ARG C C 176.6 . 1
1727 . 162 ARG CA C 54.9 . 1
1728 . 162 ARG CB C 31.9 . 1
1729 . 162 ARG CG C 26.8 . 1
1730 . 162 ARG CD C 43.4 . 1
1731 . 162 ARG N N 111.6 . 1
1732 . 163 SER H H 7.51 . 1
1733 . 163 SER HA H 4.13 . 1
1734 . 163 SER HB2 H 3.81 . 2
1735 . 163 SER HB3 H 3.73 . 2
1736 . 163 SER C C 174.3 . 1
1737 . 163 SER CA C 58.1 . 1
1738 . 163 SER CB C 63.3 . 1
1739 . 163 SER N N 111.7 . 1
1740 . 164 GLN H H 8.64 . 1
1741 . 164 GLN HA H 4.41 . 1
1742 . 164 GLN HB2 H 2.18 . 2
1743 . 164 GLN HB3 H 1.98 . 2
1744 . 164 GLN HG2 H 2.41 . 1
1745 . 164 GLN HG3 H 2.41 . 1
1746 . 164 GLN C C 175.00 . 1
1747 . 164 GLN CA C 55.3 . 1
1748 . 164 GLN CB C 29.2 . 1
1749 . 164 GLN CG C 33.5 . 1
1750 . 164 GLN N N 119.8 . 1
1751 . 165 ASN H H 8.44 . 1
1752 . 165 ASN HA H 5.02 . 1
1753 . 165 ASN HB2 H 2.88 . 2
1754 . 165 ASN HB3 H 2.71 . 2
1755 . 165 ASN C C 172.9 . 1
1756 . 165 ASN CA C 51.1 . 1
1757 . 165 ASN CB C 38.6 . 1
1758 . 165 ASN N N 118.6 . 1
1759 . 166 PRO HA H 4.52 . 1
1760 . 166 PRO HB2 H 2.33 . 2
1761 . 166 PRO HB3 H 1.96 . 2
1762 . 166 PRO HG2 H 2.04 . 1
1763 . 166 PRO HG3 H 2.04 . 1
1764 . 166 PRO HD2 H 3.81 . 1
1765 . 166 PRO HD3 H 3.81 . 1
1766 . 166 PRO C C 176.4 . 1
1767 . 166 PRO CA C 62.9 . 1
1768 . 166 PRO CB C 32.00 . 1
1769 . 166 PRO CG C 26.9 . 1
1770 . 166 PRO CD C 50.4 . 1
1771 . 167 VAL H H 8.19 . 1
1772 . 167 VAL HA H 4.11 . 1
1773 . 167 VAL HB H 2.08 . 1
1774 . 167 VAL HG1 H 0.98 . 2
1775 . 167 VAL HG2 H 1.02 . 2
1776 . 167 VAL C C 175.5 . 1
1777 . 167 VAL CA C 62.00 . 1
1778 . 167 VAL CB C 32.4 . 1
1779 . 167 VAL CG1 C 20.7 . 2
1780 . 167 VAL CG2 C 20.4 . 2
1781 . 167 VAL N N 118.3 . 1
1782 . 168 GLN H H 8.36 . 1
1783 . 168 GLN HA H 4.71 . 1
1784 . 168 GLN HB2 H 2.18 . 2
1785 . 168 GLN HB3 H 2.02 . 2
1786 . 168 GLN HG2 H 2.45 . 1
1787 . 168 GLN HG3 H 2.45 . 1
1788 . 168 GLN C C 175.7 . 1
1789 . 168 GLN CA C 52.9 . 1
1790 . 168 GLN CB C 29.00 . 1
1791 . 168 GLN CG C 33.3 . 1
1792 . 168 GLN N N 123.5 . 1
1793 . 169 PRO HA H 4.41 . 1
1794 . 169 PRO HB2 H 2.35 . 2
1795 . 169 PRO HB3 H 2.17 . 2
1796 . 169 PRO HG2 H 1.96 . 2
1797 . 169 PRO HG3 H 1.89 . 2
1798 . 169 PRO HD2 H 3.65 . 2
1799 . 169 PRO HD3 H 3.49 . 2
1800 . 169 PRO C C 181.00 . 1
1801 . 169 PRO CA C 64.4 . 1
1802 . 169 PRO CB C 33.9 . 1
1803 . 169 PRO CG C 24.6 . 1
1804 . 169 PRO CD C 49.5 . 1
stop_
save_