data_11078
#######################
# Entry information #
#######################
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 11078
_Entry.Title
;
Solution structure of the TIR domain of human MyD88
;
_Entry.Type macromolecule
_Entry.Version_type original
_Entry.Submission_date 2009-09-11
_Entry.Accession_date 2009-09-13
_Entry.Last_release_date 2010-03-12
_Entry.Original_release_date 2010-03-12
_Entry.Origination author
_Entry.NMR_STAR_version 3.1.1.61
_Entry.Original_NMR_STAR_version 3.0.9.14
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype SOLUTION
_Entry.Details .
_Entry.BMRB_internal_directory_name .
loop_
_Entry_author.Ordinal
_Entry_author.Given_name
_Entry_author.Family_name
_Entry_author.First_initial
_Entry_author.Middle_initials
_Entry_author.Family_title
_Entry_author.Entry_ID
1 H. Ohnishi H. . . 11078
2 H. Tochio H. . . 11078
3 H. Hiroaki H. . . 11078
4 N. Kondo N. . . 11078
5 Z. Kato Z. . . 11078
6 M. Shirakawa M. . . 11078
stop_
loop_
_Struct_keywords.Keywords
_Struct_keywords.Text
_Struct_keywords.Entry_ID
Cytoplasm . 11078
'Immune response' . 11078
'IMMUNE SYSTEM' . 11078
'Inflammatory response' . 11078
'signal transduction innate immunity' . 11078
stop_
loop_
_Data_set.Type
_Data_set.Count
_Data_set.Entry_ID
assigned_chemical_shifts 1 11078
stop_
loop_
_Datum.Type
_Datum.Count
_Datum.Entry_ID
'13C chemical shifts' 454 11078
'15N chemical shifts' 134 11078
'1H chemical shifts' 850 11078
stop_
loop_
_Release.Release_number
_Release.Format_type
_Release.Format_version
_Release.Date
_Release.Submission_date
_Release.Type
_Release.Author
_Release.Detail
_Release.Entry_ID
1 . . 2010-03-12 2009-09-11 original author . 11078
stop_
loop_
_Related_entries.Database_name
_Related_entries.Database_accession_code
_Related_entries.Relationship
_Related_entries.Entry_ID
PDB 2Z5V 'BMRB Entry Tracking System' 11078
stop_
save_
###############
# Citations #
###############
save_citations
_Citation.Sf_category citations
_Citation.Sf_framecode citations
_Citation.Entry_ID 11078
_Citation.ID 1
_Citation.Class 'entry citation'
_Citation.CAS_abstract_code .
_Citation.MEDLINE_UI_code .
_Citation.DOI 10.1073/pnas.0812956106
_Citation.PubMed_ID 19506249
_Citation.Full_citation .
_Citation.Title
;
Structural basis for the multiple interactions of the MyD88 TIR domain in TLR4
signaling.
;
_Citation.Status published
_Citation.Type journal
_Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U.S.A.'
_Citation.Journal_name_full 'Procedings of the National Academy of Sciences'
_Citation.Journal_volume 106
_Citation.Journal_issue 25
_Citation.Journal_ASTM PNASA6
_Citation.Journal_ISSN 1091-6490
_Citation.Journal_CSD .
_Citation.Book_title .
_Citation.Book_chapter_title .
_Citation.Book_volume .
_Citation.Book_series .
_Citation.Book_publisher .
_Citation.Book_publisher_city .
_Citation.Book_ISBN .
_Citation.Conference_title .
_Citation.Conference_site .
_Citation.Conference_state_province .
_Citation.Conference_country .
_Citation.Conference_start_date .
_Citation.Conference_end_date .
_Citation.Conference_abstract_number .
_Citation.Thesis_institution .
_Citation.Thesis_institution_city .
_Citation.Thesis_institution_country .
_Citation.WWW_URL .
_Citation.Page_first 10260
_Citation.Page_last 10265
_Citation.Year 2009
_Citation.Details .
loop_
_Citation_author.Ordinal
_Citation_author.Given_name
_Citation_author.Family_name
_Citation_author.First_initial
_Citation_author.Middle_initials
_Citation_author.Family_title
_Citation_author.Entry_ID
_Citation_author.Citation_ID
1 Hidenori Ohnishi . . . 11078 1
2 Hidehito Tochio . . . 11078 1
3 Zenichiro Kato . . . 11078 1
4 Kenji Orii . E. . 11078 1
5 Ailian Li . . . 11078 1
6 Takeshi Kimura . . . 11078 1
7 Hidekazu Hiroaki . . . 11078 1
8 Naomi Kondo . . . 11078 1
9 Masahiro Shirakawa . . . 11078 1
stop_
save_
#############################################
# Molecular system (assembly) description #
#############################################
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID 11078
_Assembly.ID 1
_Assembly.Name 'Myeloid differentiation primary response protein MyD88'
_Assembly.BMRB_code .
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Non_standard_bonds .
_Assembly.Ambiguous_conformational_states .
_Assembly.Ambiguous_chem_comp_sites .
_Assembly.Molecules_in_chemical_exchange .
_Assembly.Paramagnetic no
_Assembly.Thiol_state .
_Assembly.Molecular_mass .
_Assembly.Enzyme_commission_number .
_Assembly.Details .
_Assembly.DB_query_date .
_Assembly.DB_query_revised_last_date .
loop_
_Entity_assembly.ID
_Entity_assembly.Entity_assembly_name
_Entity_assembly.Entity_ID
_Entity_assembly.Entity_label
_Entity_assembly.Asym_ID
_Entity_assembly.PDB_chain_ID
_Entity_assembly.Experimental_data_reported
_Entity_assembly.Physical_state
_Entity_assembly.Conformational_isomer
_Entity_assembly.Chemical_exchange_state
_Entity_assembly.Magnetic_equivalence_group_code
_Entity_assembly.Role
_Entity_assembly.Details
_Entity_assembly.Entry_ID
_Entity_assembly.Assembly_ID
1 'MyD88 TIR domain' 1 $entity A . yes native no no . . . 11078 1
stop_
save_
####################################
# Biological polymers and ligands #
####################################
save_entity
_Entity.Sf_category entity
_Entity.Sf_framecode entity
_Entity.Entry_ID 11078
_Entity.ID 1
_Entity.BMRB_code .
_Entity.Name 'MyD88 TIR domain'
_Entity.Type polymer
_Entity.Polymer_common_type .
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_type_details .
_Entity.Polymer_strand_ID A
_Entity.Polymer_seq_one_letter_code_can .
_Entity.Polymer_seq_one_letter_code
;
TTLDDPLGHMPERFDAFICY
CPSDIQFVQEMIRQLEQTNY
RLKLCVSDRDVLPGTCVWSI
ASELIEKRCRRMVVVVSDDY
LQSKECDFQTKFALSLSPGA
HQKRLIPIKYKAMKKEFPSI
LRFITVCDYTNPCTKSWFWT
RLAKALSLP
;
_Entity.Target_identifier .
_Entity.Polymer_author_defined_seq .
_Entity.Polymer_author_seq_details .
_Entity.Ambiguous_conformational_states no
_Entity.Ambiguous_chem_comp_sites no
_Entity.Nstd_monomer no
_Entity.Nstd_chirality no
_Entity.Nstd_linkage no
_Entity.Nonpolymer_comp_ID .
_Entity.Nonpolymer_comp_label .
_Entity.Number_of_monomers 149
_Entity.Number_of_nonpolymer_components .
_Entity.Paramagnetic no
_Entity.Thiol_state 'all free'
_Entity.Src_method man
_Entity.Parent_entity_ID .
_Entity.Fragment .
_Entity.Mutation .
_Entity.EC_number .
_Entity.Calc_isoelectric_point .
_Entity.Formula_weight 17387.422
_Entity.Formula_weight_exptl .
_Entity.Formula_weight_exptl_meth .
_Entity.Details .
_Entity.DB_query_date .
_Entity.DB_query_revised_last_date 2015-11-26
loop_
_Entity_db_link.Ordinal
_Entity_db_link.Author_supplied
_Entity_db_link.Database_code
_Entity_db_link.Accession_code
_Entity_db_link.Entry_mol_code
_Entity_db_link.Entry_mol_name
_Entity_db_link.Entry_experimental_method
_Entity_db_link.Entry_structure_resolution
_Entity_db_link.Entry_relation_type
_Entity_db_link.Entry_details
_Entity_db_link.Chimera_segment_ID
_Entity_db_link.Seq_query_to_submitted_percent
_Entity_db_link.Seq_subject_length
_Entity_db_link.Seq_identity
_Entity_db_link.Seq_positive
_Entity_db_link.Seq_homology_expectation_val
_Entity_db_link.Seq_align_begin
_Entity_db_link.Seq_align_end
_Entity_db_link.Seq_difference_details
_Entity_db_link.Seq_alignment_details
_Entity_db_link.Entry_ID
_Entity_db_link.Entity_ID
1 no BMRB 15356 . HR2869A . . . . . 100.00 160 100.00 100.00 1.99e-105 . . . . 11078 1
2 no PDB 2JS7 . "Solution Nmr Structure Of Human Myeloid Differentiation Primary Response (Myd88). Northeast Structural Genomics Target Hr2869a" . . . . . 100.00 160 100.00 100.00 1.99e-105 . . . . 11078 1
3 no PDB 2Z5V . "Solution Structure Of The Tir Domain Of Human Myd88" . . . . . 100.00 149 100.00 100.00 2.92e-105 . . . . 11078 1
4 no PDB 4EO7 . "Crystal Structure Of The Tir Domain Of Human Myeloid Differentiation Primary Response Protein 88" . . . . . 93.96 144 99.29 99.29 3.36e-96 . . . . 11078 1
5 no DBJ BAE89833 . "unnamed protein product [Macaca fascicularis]" . . . . . 100.00 309 100.00 100.00 3.26e-105 . . . . 11078 1
6 no DBJ BAG55247 . "myeloid differentiation primary response gene 88 [Homo sapiens]" . . . . . 100.00 296 100.00 100.00 1.32e-105 . . . . 11078 1
7 no DBJ BAG55248 . "myeloid differentiation primary response gene 88 [Pan troglodytes]" . . . . . 100.00 296 100.00 100.00 1.75e-105 . . . . 11078 1
8 no DBJ BAG55249 . "myeloid differentiation primary response gene 88 [Pan paniscus]" . . . . . 100.00 296 100.00 100.00 2.04e-105 . . . . 11078 1
9 no DBJ BAG55250 . "myeloid differentiation primary response gene 88 [Gorilla gorilla]" . . . . . 100.00 296 100.00 100.00 1.83e-105 . . . . 11078 1
10 no GB AAB49967 . "MyD88 [Homo sapiens]" . . . . . 100.00 296 100.00 100.00 2.28e-105 . . . . 11078 1
11 no GB AAC50954 . "MyD88 [Homo sapiens]" . . . . . 100.00 296 100.00 100.00 1.32e-105 . . . . 11078 1
12 no GB AAH13589 . "Myeloid differentiation primary response gene (88) [Homo sapiens]" . . . . . 100.00 296 100.00 100.00 1.32e-105 . . . . 11078 1
13 no GB AAP36040 . "myeloid differentiation primary response gene (88) [Homo sapiens]" . . . . . 100.00 296 100.00 100.00 1.32e-105 . . . . 11078 1
14 no GB AAP36509 . "Homo sapiens myeloid differentiation primary response gene (88) [synthetic construct]" . . . . . 100.00 297 100.00 100.00 1.38e-105 . . . . 11078 1
15 no REF NP_001123935 . "myeloid differentiation primary response protein MyD88 [Pan troglodytes]" . . . . . 100.00 296 100.00 100.00 1.75e-105 . . . . 11078 1
16 no REF NP_001124153 . "myeloid differentiation primary response protein MyD88 [Macaca mulatta]" . . . . . 100.00 296 100.00 100.00 2.33e-105 . . . . 11078 1
17 no REF NP_001166039 . "myeloid differentiation primary response protein MyD88 isoform 3 [Homo sapiens]" . . . . . 98.66 264 97.28 97.96 2.15e-100 . . . . 11078 1
18 no REF NP_001266118 . "myeloid differentiation primary response protein MyD88 [Pan paniscus]" . . . . . 100.00 296 100.00 100.00 2.04e-105 . . . . 11078 1
19 no REF NP_001266529 . "myeloid differentiation primary response 88 [Gorilla gorilla]" . . . . . 100.00 296 100.00 100.00 1.83e-105 . . . . 11078 1
20 no SP B3Y678 . "RecName: Full=Myeloid differentiation primary response protein MyD88" . . . . . 100.00 296 100.00 100.00 1.75e-105 . . . . 11078 1
21 no SP B3Y679 . "RecName: Full=Myeloid differentiation primary response protein MyD88 [Pan paniscus]" . . . . . 100.00 296 100.00 100.00 2.04e-105 . . . . 11078 1
22 no SP B3Y680 . "RecName: Full=Myeloid differentiation primary response protein MyD88" . . . . . 100.00 296 100.00 100.00 1.83e-105 . . . . 11078 1
23 no SP B3Y681 . "RecName: Full=Myeloid differentiation primary response protein MyD88" . . . . . 100.00 296 100.00 100.00 1.83e-105 . . . . 11078 1
24 no SP B3Y682 . "RecName: Full=Myeloid differentiation primary response protein MyD88 [Macaca fascicularis]" . . . . . 100.00 296 100.00 100.00 2.33e-105 . . . . 11078 1
stop_
loop_
_Entity_comp_index.ID
_Entity_comp_index.Auth_seq_ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 148 THR . 11078 1
2 149 THR . 11078 1
3 150 LEU . 11078 1
4 151 ASP . 11078 1
5 152 ASP . 11078 1
6 153 PRO . 11078 1
7 154 LEU . 11078 1
8 155 GLY . 11078 1
9 156 HIS . 11078 1
10 157 MET . 11078 1
11 158 PRO . 11078 1
12 159 GLU . 11078 1
13 160 ARG . 11078 1
14 161 PHE . 11078 1
15 162 ASP . 11078 1
16 163 ALA . 11078 1
17 164 PHE . 11078 1
18 165 ILE . 11078 1
19 166 CYS . 11078 1
20 167 TYR . 11078 1
21 168 CYS . 11078 1
22 169 PRO . 11078 1
23 170 SER . 11078 1
24 171 ASP . 11078 1
25 172 ILE . 11078 1
26 173 GLN . 11078 1
27 174 PHE . 11078 1
28 175 VAL . 11078 1
29 176 GLN . 11078 1
30 177 GLU . 11078 1
31 178 MET . 11078 1
32 179 ILE . 11078 1
33 180 ARG . 11078 1
34 181 GLN . 11078 1
35 182 LEU . 11078 1
36 183 GLU . 11078 1
37 184 GLN . 11078 1
38 185 THR . 11078 1
39 186 ASN . 11078 1
40 187 TYR . 11078 1
41 188 ARG . 11078 1
42 189 LEU . 11078 1
43 190 LYS . 11078 1
44 191 LEU . 11078 1
45 192 CYS . 11078 1
46 193 VAL . 11078 1
47 194 SER . 11078 1
48 195 ASP . 11078 1
49 196 ARG . 11078 1
50 197 ASP . 11078 1
51 198 VAL . 11078 1
52 199 LEU . 11078 1
53 200 PRO . 11078 1
54 201 GLY . 11078 1
55 202 THR . 11078 1
56 203 CYS . 11078 1
57 204 VAL . 11078 1
58 205 TRP . 11078 1
59 206 SER . 11078 1
60 207 ILE . 11078 1
61 208 ALA . 11078 1
62 209 SER . 11078 1
63 210 GLU . 11078 1
64 211 LEU . 11078 1
65 212 ILE . 11078 1
66 213 GLU . 11078 1
67 214 LYS . 11078 1
68 215 ARG . 11078 1
69 216 CYS . 11078 1
70 217 ARG . 11078 1
71 218 ARG . 11078 1
72 219 MET . 11078 1
73 220 VAL . 11078 1
74 221 VAL . 11078 1
75 222 VAL . 11078 1
76 223 VAL . 11078 1
77 224 SER . 11078 1
78 225 ASP . 11078 1
79 226 ASP . 11078 1
80 227 TYR . 11078 1
81 228 LEU . 11078 1
82 229 GLN . 11078 1
83 230 SER . 11078 1
84 231 LYS . 11078 1
85 232 GLU . 11078 1
86 233 CYS . 11078 1
87 234 ASP . 11078 1
88 235 PHE . 11078 1
89 236 GLN . 11078 1
90 237 THR . 11078 1
91 238 LYS . 11078 1
92 239 PHE . 11078 1
93 240 ALA . 11078 1
94 241 LEU . 11078 1
95 242 SER . 11078 1
96 243 LEU . 11078 1
97 244 SER . 11078 1
98 245 PRO . 11078 1
99 246 GLY . 11078 1
100 247 ALA . 11078 1
101 248 HIS . 11078 1
102 249 GLN . 11078 1
103 250 LYS . 11078 1
104 251 ARG . 11078 1
105 252 LEU . 11078 1
106 253 ILE . 11078 1
107 254 PRO . 11078 1
108 255 ILE . 11078 1
109 256 LYS . 11078 1
110 257 TYR . 11078 1
111 258 LYS . 11078 1
112 259 ALA . 11078 1
113 260 MET . 11078 1
114 261 LYS . 11078 1
115 262 LYS . 11078 1
116 263 GLU . 11078 1
117 264 PHE . 11078 1
118 265 PRO . 11078 1
119 266 SER . 11078 1
120 267 ILE . 11078 1
121 268 LEU . 11078 1
122 269 ARG . 11078 1
123 270 PHE . 11078 1
124 271 ILE . 11078 1
125 272 THR . 11078 1
126 273 VAL . 11078 1
127 274 CYS . 11078 1
128 275 ASP . 11078 1
129 276 TYR . 11078 1
130 277 THR . 11078 1
131 278 ASN . 11078 1
132 279 PRO . 11078 1
133 280 CYS . 11078 1
134 281 THR . 11078 1
135 282 LYS . 11078 1
136 283 SER . 11078 1
137 284 TRP . 11078 1
138 285 PHE . 11078 1
139 286 TRP . 11078 1
140 287 THR . 11078 1
141 288 ARG . 11078 1
142 289 LEU . 11078 1
143 290 ALA . 11078 1
144 291 LYS . 11078 1
145 292 ALA . 11078 1
146 293 LEU . 11078 1
147 294 SER . 11078 1
148 295 LEU . 11078 1
149 296 PRO . 11078 1
stop_
loop_
_Entity_poly_seq.Hetero
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
. THR 1 1 11078 1
. THR 2 2 11078 1
. LEU 3 3 11078 1
. ASP 4 4 11078 1
. ASP 5 5 11078 1
. PRO 6 6 11078 1
. LEU 7 7 11078 1
. GLY 8 8 11078 1
. HIS 9 9 11078 1
. MET 10 10 11078 1
. PRO 11 11 11078 1
. GLU 12 12 11078 1
. ARG 13 13 11078 1
. PHE 14 14 11078 1
. ASP 15 15 11078 1
. ALA 16 16 11078 1
. PHE 17 17 11078 1
. ILE 18 18 11078 1
. CYS 19 19 11078 1
. TYR 20 20 11078 1
. CYS 21 21 11078 1
. PRO 22 22 11078 1
. SER 23 23 11078 1
. ASP 24 24 11078 1
. ILE 25 25 11078 1
. GLN 26 26 11078 1
. PHE 27 27 11078 1
. VAL 28 28 11078 1
. GLN 29 29 11078 1
. GLU 30 30 11078 1
. MET 31 31 11078 1
. ILE 32 32 11078 1
. ARG 33 33 11078 1
. GLN 34 34 11078 1
. LEU 35 35 11078 1
. GLU 36 36 11078 1
. GLN 37 37 11078 1
. THR 38 38 11078 1
. ASN 39 39 11078 1
. TYR 40 40 11078 1
. ARG 41 41 11078 1
. LEU 42 42 11078 1
. LYS 43 43 11078 1
. LEU 44 44 11078 1
. CYS 45 45 11078 1
. VAL 46 46 11078 1
. SER 47 47 11078 1
. ASP 48 48 11078 1
. ARG 49 49 11078 1
. ASP 50 50 11078 1
. VAL 51 51 11078 1
. LEU 52 52 11078 1
. PRO 53 53 11078 1
. GLY 54 54 11078 1
. THR 55 55 11078 1
. CYS 56 56 11078 1
. VAL 57 57 11078 1
. TRP 58 58 11078 1
. SER 59 59 11078 1
. ILE 60 60 11078 1
. ALA 61 61 11078 1
. SER 62 62 11078 1
. GLU 63 63 11078 1
. LEU 64 64 11078 1
. ILE 65 65 11078 1
. GLU 66 66 11078 1
. LYS 67 67 11078 1
. ARG 68 68 11078 1
. CYS 69 69 11078 1
. ARG 70 70 11078 1
. ARG 71 71 11078 1
. MET 72 72 11078 1
. VAL 73 73 11078 1
. VAL 74 74 11078 1
. VAL 75 75 11078 1
. VAL 76 76 11078 1
. SER 77 77 11078 1
. ASP 78 78 11078 1
. ASP 79 79 11078 1
. TYR 80 80 11078 1
. LEU 81 81 11078 1
. GLN 82 82 11078 1
. SER 83 83 11078 1
. LYS 84 84 11078 1
. GLU 85 85 11078 1
. CYS 86 86 11078 1
. ASP 87 87 11078 1
. PHE 88 88 11078 1
. GLN 89 89 11078 1
. THR 90 90 11078 1
. LYS 91 91 11078 1
. PHE 92 92 11078 1
. ALA 93 93 11078 1
. LEU 94 94 11078 1
. SER 95 95 11078 1
. LEU 96 96 11078 1
. SER 97 97 11078 1
. PRO 98 98 11078 1
. GLY 99 99 11078 1
. ALA 100 100 11078 1
. HIS 101 101 11078 1
. GLN 102 102 11078 1
. LYS 103 103 11078 1
. ARG 104 104 11078 1
. LEU 105 105 11078 1
. ILE 106 106 11078 1
. PRO 107 107 11078 1
. ILE 108 108 11078 1
. LYS 109 109 11078 1
. TYR 110 110 11078 1
. LYS 111 111 11078 1
. ALA 112 112 11078 1
. MET 113 113 11078 1
. LYS 114 114 11078 1
. LYS 115 115 11078 1
. GLU 116 116 11078 1
. PHE 117 117 11078 1
. PRO 118 118 11078 1
. SER 119 119 11078 1
. ILE 120 120 11078 1
. LEU 121 121 11078 1
. ARG 122 122 11078 1
. PHE 123 123 11078 1
. ILE 124 124 11078 1
. THR 125 125 11078 1
. VAL 126 126 11078 1
. CYS 127 127 11078 1
. ASP 128 128 11078 1
. TYR 129 129 11078 1
. THR 130 130 11078 1
. ASN 131 131 11078 1
. PRO 132 132 11078 1
. CYS 133 133 11078 1
. THR 134 134 11078 1
. LYS 135 135 11078 1
. SER 136 136 11078 1
. TRP 137 137 11078 1
. PHE 138 138 11078 1
. TRP 139 139 11078 1
. THR 140 140 11078 1
. ARG 141 141 11078 1
. LEU 142 142 11078 1
. ALA 143 143 11078 1
. LYS 144 144 11078 1
. ALA 145 145 11078 1
. LEU 146 146 11078 1
. SER 147 147 11078 1
. LEU 148 148 11078 1
. PRO 149 149 11078 1
stop_
save_
####################
# Natural source #
####################
save_natural_source
_Entity_natural_src_list.Sf_category natural_source
_Entity_natural_src_list.Sf_framecode natural_source
_Entity_natural_src_list.Entry_ID 11078
_Entity_natural_src_list.ID 1
loop_
_Entity_natural_src.ID
_Entity_natural_src.Entity_ID
_Entity_natural_src.Entity_label
_Entity_natural_src.Entity_chimera_segment_ID
_Entity_natural_src.NCBI_taxonomy_ID
_Entity_natural_src.Type
_Entity_natural_src.Common
_Entity_natural_src.Organism_name_scientific
_Entity_natural_src.Organism_name_common
_Entity_natural_src.Organism_acronym
_Entity_natural_src.ICTVdb_decimal_code
_Entity_natural_src.Superkingdom
_Entity_natural_src.Kingdom
_Entity_natural_src.Genus
_Entity_natural_src.Species
_Entity_natural_src.Strain
_Entity_natural_src.Variant
_Entity_natural_src.Subvariant
_Entity_natural_src.Organ
_Entity_natural_src.Tissue
_Entity_natural_src.Tissue_fraction
_Entity_natural_src.Cell_line
_Entity_natural_src.Cell_type
_Entity_natural_src.ATCC_number
_Entity_natural_src.Organelle
_Entity_natural_src.Cellular_location
_Entity_natural_src.Fragment
_Entity_natural_src.Fraction
_Entity_natural_src.Secretion
_Entity_natural_src.Plasmid
_Entity_natural_src.Plasmid_details
_Entity_natural_src.Gene_mnemonic
_Entity_natural_src.Dev_stage
_Entity_natural_src.Details
_Entity_natural_src.Citation_ID
_Entity_natural_src.Citation_label
_Entity_natural_src.Entry_ID
_Entity_natural_src.Entity_natural_src_list_ID
1 1 $entity . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . MYD88 . . . . 11078 1
stop_
save_
#########################
# Experimental source #
#########################
save_experimental_source
_Entity_experimental_src_list.Sf_category experimental_source
_Entity_experimental_src_list.Sf_framecode experimental_source
_Entity_experimental_src_list.Entry_ID 11078
_Entity_experimental_src_list.ID 1
loop_
_Entity_experimental_src.ID
_Entity_experimental_src.Entity_ID
_Entity_experimental_src.Entity_label
_Entity_experimental_src.Entity_chimera_segment_ID
_Entity_experimental_src.Production_method
_Entity_experimental_src.Host_org_scientific_name
_Entity_experimental_src.Host_org_name_common
_Entity_experimental_src.Host_org_details
_Entity_experimental_src.Host_org_NCBI_taxonomy_ID
_Entity_experimental_src.Host_org_genus
_Entity_experimental_src.Host_org_species
_Entity_experimental_src.Host_org_strain
_Entity_experimental_src.Host_org_variant
_Entity_experimental_src.Host_org_subvariant
_Entity_experimental_src.Host_org_organ
_Entity_experimental_src.Host_org_tissue
_Entity_experimental_src.Host_org_tissue_fraction
_Entity_experimental_src.Host_org_cell_line
_Entity_experimental_src.Host_org_cell_type
_Entity_experimental_src.Host_org_cellular_location
_Entity_experimental_src.Host_org_organelle
_Entity_experimental_src.Host_org_gene
_Entity_experimental_src.Host_org_culture_collection
_Entity_experimental_src.Host_org_ATCC_number
_Entity_experimental_src.Vector_type
_Entity_experimental_src.PDBview_host_org_vector_name
_Entity_experimental_src.PDBview_plasmid_name
_Entity_experimental_src.Vector_name
_Entity_experimental_src.Vector_details
_Entity_experimental_src.Vendor_name
_Entity_experimental_src.Host_org_dev_stage
_Entity_experimental_src.Details
_Entity_experimental_src.Citation_ID
_Entity_experimental_src.Citation_label
_Entity_experimental_src.Entry_ID
_Entity_experimental_src.Entity_experimental_src_list_ID
1 1 $entity . 'recombinant technology' 'Escherichia coli' 'E. coli' . 469008 Escherichia coli BL21(DE3) . . . . . . . . . . . . plasmid . . pGEX-5X-3 . . . . . . 11078 1
stop_
save_
#####################################
# Sample contents and methodology #
#####################################
########################
# Sample description #
########################
save_sample_1
_Sample.Sf_category sample
_Sample.Sf_framecode sample_1
_Sample.Entry_ID 11078
_Sample.ID 1
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details .
_Sample.Aggregate_sample_number .
_Sample.Solvent_system '95% H2O/5% D2O'
_Sample.Preparation_date .
_Sample.Preparation_expiration_date .
_Sample.Polycrystallization_protocol .
_Sample.Single_crystal_protocol .
_Sample.Crystal_grow_apparatus .
_Sample.Crystal_grow_atmosphere .
_Sample.Crystal_grow_details .
_Sample.Crystal_grow_method .
_Sample.Crystal_grow_method_cit_ID .
_Sample.Crystal_grow_pH .
_Sample.Crystal_grow_pH_range .
_Sample.Crystal_grow_pressure .
_Sample.Crystal_grow_pressure_esd .
_Sample.Crystal_grow_seeding .
_Sample.Crystal_grow_seeding_cit_ID .
_Sample.Crystal_grow_temp .
_Sample.Crystal_grow_temp_details .
_Sample.Crystal_grow_temp_esd .
_Sample.Crystal_grow_time .
_Sample.Oriented_sample_prep_protocol .
_Sample.Lyophilization_cryo_protectant .
_Sample.Storage_protocol .
loop_
_Sample_component.ID
_Sample_component.Mol_common_name
_Sample_component.Isotopic_labeling
_Sample_component.Assembly_ID
_Sample_component.Assembly_label
_Sample_component.Entity_ID
_Sample_component.Entity_label
_Sample_component.Product_ID
_Sample_component.Type
_Sample_component.Concentration_val
_Sample_component.Concentration_val_min
_Sample_component.Concentration_val_max
_Sample_component.Concentration_val_units
_Sample_component.Concentration_val_err
_Sample_component.Vendor
_Sample_component.Vendor_product_name
_Sample_component.Vendor_product_code
_Sample_component.Entry_ID
_Sample_component.Sample_ID
1 'MyD88 TIR domain' '[U-100% 13C; U-100% 15N]' . . 1 $entity . . 0.3 . . mM . . . . 11078 1
2 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 11078 1
3 DTT 'natural abundance' . . . . . . 10 . . mM . . . . 11078 1
4 EDTA 'natural abundance' . . . . . . 0.1 . . mM . . . . 11078 1
5 L-arginine 'natural abundance' . . . . . . 50 . . mM . . . . 11078 1
6 L-glutamate 'natural abundance' . . . . . . 50 . . mM . . . . 11078 1
7 H2O 'natural abundance' . . . . . . 95 . . % . . . . 11078 1
8 D2O 'natural abundance' . . . . . . 5 . . % . . . . 11078 1
stop_
save_
save_sample_2
_Sample.Sf_category sample
_Sample.Sf_framecode sample_2
_Sample.Entry_ID 11078
_Sample.ID 2
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details .
_Sample.Aggregate_sample_number .
_Sample.Solvent_system '95% H2O/5% D2O'
_Sample.Preparation_date .
_Sample.Preparation_expiration_date .
_Sample.Polycrystallization_protocol .
_Sample.Single_crystal_protocol .
_Sample.Crystal_grow_apparatus .
_Sample.Crystal_grow_atmosphere .
_Sample.Crystal_grow_details .
_Sample.Crystal_grow_method .
_Sample.Crystal_grow_method_cit_ID .
_Sample.Crystal_grow_pH .
_Sample.Crystal_grow_pH_range .
_Sample.Crystal_grow_pressure .
_Sample.Crystal_grow_pressure_esd .
_Sample.Crystal_grow_seeding .
_Sample.Crystal_grow_seeding_cit_ID .
_Sample.Crystal_grow_temp .
_Sample.Crystal_grow_temp_details .
_Sample.Crystal_grow_temp_esd .
_Sample.Crystal_grow_time .
_Sample.Oriented_sample_prep_protocol .
_Sample.Lyophilization_cryo_protectant .
_Sample.Storage_protocol .
loop_
_Sample_component.ID
_Sample_component.Mol_common_name
_Sample_component.Isotopic_labeling
_Sample_component.Assembly_ID
_Sample_component.Assembly_label
_Sample_component.Entity_ID
_Sample_component.Entity_label
_Sample_component.Product_ID
_Sample_component.Type
_Sample_component.Concentration_val
_Sample_component.Concentration_val_min
_Sample_component.Concentration_val_max
_Sample_component.Concentration_val_units
_Sample_component.Concentration_val_err
_Sample_component.Vendor
_Sample_component.Vendor_product_name
_Sample_component.Vendor_product_code
_Sample_component.Entry_ID
_Sample_component.Sample_ID
1 'MyD88 TIR domain' '[U-100% 13C; U-100% 15N]' . . 1 $entity . . 0.2 . . mM . . . . 11078 2
2 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 11078 2
3 DTT 'natural abundance' . . . . . . 10 . . mM . . . . 11078 2
4 EDTA 'natural abundance' . . . . . . 0.1 . . mM . . . . 11078 2
5 H2O 'natural abundance' . . . . . . 95 . . % . . . . 11078 2
6 D2O 'natural abundance' . . . . . . 5 . . % . . . . 11078 2
stop_
save_
#######################
# Sample conditions #
#######################
save_sample_conditions_1
_Sample_condition_list.Sf_category sample_conditions
_Sample_condition_list.Sf_framecode sample_conditions_1
_Sample_condition_list.Entry_ID 11078
_Sample_condition_list.ID 1
_Sample_condition_list.Details .
loop_
_Sample_condition_variable.Type
_Sample_condition_variable.Val
_Sample_condition_variable.Val_err
_Sample_condition_variable.Val_units
_Sample_condition_variable.Entry_ID
_Sample_condition_variable.Sample_condition_list_ID
'ionic strength' 120 . mM 11078 1
pH 6.0 . pH 11078 1
pressure 1 . atm 11078 1
temperature 298 . K 11078 1
stop_
save_
############################
# Computer software used #
############################
save_CNS
_Software.Sf_category software
_Software.Sf_framecode CNS
_Software.Entry_ID 11078
_Software.ID 1
_Software.Name CNS
_Software.Version 1.1
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Brunger, Adams, Clore, Gros, Nilges and Read' . . 11078 1
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
refinement 11078 1
stop_
save_
save_CYANA
_Software.Sf_category software
_Software.Sf_framecode CYANA
_Software.Entry_ID 11078
_Software.ID 2
_Software.Name CYANA
_Software.Version .
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Guntert, Mumenthaler and Wuthrich' . . 11078 2
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'structure solution' 11078 2
stop_
save_
#########################
# Experimental detail #
#########################
##################################
# NMR Spectrometer definitions #
##################################
save_spectrometer_1
_NMR_spectrometer.Sf_category NMR_spectrometer
_NMR_spectrometer.Sf_framecode spectrometer_1
_NMR_spectrometer.Entry_ID 11078
_NMR_spectrometer.ID 1
_NMR_spectrometer.Details .
_NMR_spectrometer.Manufacturer Bruker
_NMR_spectrometer.Model Avance
_NMR_spectrometer.Serial_number .
_NMR_spectrometer.Field_strength 800
save_
save_spectrometer_2
_NMR_spectrometer.Sf_category NMR_spectrometer
_NMR_spectrometer.Sf_framecode spectrometer_2
_NMR_spectrometer.Entry_ID 11078
_NMR_spectrometer.ID 2
_NMR_spectrometer.Details .
_NMR_spectrometer.Manufacturer Bruker
_NMR_spectrometer.Model DRX
_NMR_spectrometer.Serial_number .
_NMR_spectrometer.Field_strength 500
save_
save_spectrometer_3
_NMR_spectrometer.Sf_category NMR_spectrometer
_NMR_spectrometer.Sf_framecode spectrometer_3
_NMR_spectrometer.Entry_ID 11078
_NMR_spectrometer.ID 3
_NMR_spectrometer.Details .
_NMR_spectrometer.Manufacturer Varian
_NMR_spectrometer.Model INOVA
_NMR_spectrometer.Serial_number .
_NMR_spectrometer.Field_strength 900
save_
save_NMR_spectrometer_list
_NMR_spectrometer_list.Sf_category NMR_spectrometer_list
_NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list
_NMR_spectrometer_list.Entry_ID 11078
_NMR_spectrometer_list.ID 1
loop_
_NMR_spectrometer_view.ID
_NMR_spectrometer_view.Name
_NMR_spectrometer_view.Manufacturer
_NMR_spectrometer_view.Model
_NMR_spectrometer_view.Serial_number
_NMR_spectrometer_view.Field_strength
_NMR_spectrometer_view.Details
_NMR_spectrometer_view.Citation_ID
_NMR_spectrometer_view.Citation_label
_NMR_spectrometer_view.Entry_ID
_NMR_spectrometer_view.NMR_spectrometer_list_ID
1 spectrometer_1 Bruker Avance . 800 . . . 11078 1
2 spectrometer_2 Bruker DRX . 500 . . . 11078 1
3 spectrometer_3 Varian INOVA . 900 . . . 11078 1
stop_
save_
#############################
# NMR applied experiments #
#############################
save_experiment_list
_Experiment_list.Sf_category experiment_list
_Experiment_list.Sf_framecode experiment_list
_Experiment_list.Entry_ID 11078
_Experiment_list.ID 1
_Experiment_list.Details .
loop_
_Experiment.ID
_Experiment.Name
_Experiment.Raw_data_flag
_Experiment.NMR_spec_expt_ID
_Experiment.NMR_spec_expt_label
_Experiment.MS_expt_ID
_Experiment.MS_expt_label
_Experiment.SAXS_expt_ID
_Experiment.SAXS_expt_label
_Experiment.FRET_expt_ID
_Experiment.FRET_expt_label
_Experiment.EMR_expt_ID
_Experiment.EMR_expt_label
_Experiment.Sample_ID
_Experiment.Sample_label
_Experiment.Sample_state
_Experiment.Sample_volume
_Experiment.Sample_volume_units
_Experiment.Sample_condition_list_ID
_Experiment.Sample_condition_list_label
_Experiment.Sample_spinning_rate
_Experiment.Sample_angle
_Experiment.NMR_tube_type
_Experiment.NMR_spectrometer_ID
_Experiment.NMR_spectrometer_label
_Experiment.NMR_spectrometer_probe_ID
_Experiment.NMR_spectrometer_probe_label
_Experiment.NMR_spectral_processing_ID
_Experiment.NMR_spectral_processing_label
_Experiment.Mass_spectrometer_ID
_Experiment.Mass_spectrometer_label
_Experiment.Xray_instrument_ID
_Experiment.Xray_instrument_label
_Experiment.Fluorescence_instrument_ID
_Experiment.Fluorescence_instrument_label
_Experiment.EMR_instrument_ID
_Experiment.EMR_instrument_label
_Experiment.Chromatographic_system_ID
_Experiment.Chromatographic_system_label
_Experiment.Chromatographic_column_ID
_Experiment.Chromatographic_column_label
_Experiment.Entry_ID
_Experiment.Experiment_list_ID
1 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 11078 1
2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 11078 1
3 '3D CBCA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 11078 1
4 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 11078 1
5 '3D HNCA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 11078 1
6 '3D HN(CO)CA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 11078 1
7 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 11078 1
8 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11078 1
9 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11078 1
10 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11078 1
11 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 11078 1
12 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 11078 1
stop_
save_
####################
# NMR parameters #
####################
##############################
# Assigned chemical shifts #
##############################
################################
# Chemical shift referencing #
################################
save_chemical_shift_reference_1
_Chem_shift_reference.Sf_category chem_shift_reference
_Chem_shift_reference.Sf_framecode chemical_shift_reference_1
_Chem_shift_reference.Entry_ID 11078
_Chem_shift_reference.ID 1
_Chem_shift_reference.Details .
loop_
_Chem_shift_ref.Atom_type
_Chem_shift_ref.Atom_isotope_number
_Chem_shift_ref.Mol_common_name
_Chem_shift_ref.Atom_group
_Chem_shift_ref.Concentration_val
_Chem_shift_ref.Concentration_units
_Chem_shift_ref.Solvent
_Chem_shift_ref.Rank
_Chem_shift_ref.Chem_shift_units
_Chem_shift_ref.Chem_shift_val
_Chem_shift_ref.Ref_method
_Chem_shift_ref.Ref_type
_Chem_shift_ref.Indirect_shift_ratio
_Chem_shift_ref.External_ref_loc
_Chem_shift_ref.External_ref_sample_geometry
_Chem_shift_ref.External_ref_axis
_Chem_shift_ref.Indirect_shift_ratio_cit_ID
_Chem_shift_ref.Indirect_shift_ratio_cit_label
_Chem_shift_ref.Ref_correction_type
_Chem_shift_ref.Correction_val
_Chem_shift_ref.Correction_val_cit_ID
_Chem_shift_ref.Correction_val_cit_label
_Chem_shift_ref.Entry_ID
_Chem_shift_ref.Chem_shift_reference_ID
C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 11078 1
H 1 DSS 'methyl protons' . . . . ppm 0.00 external direct 1.000000000 . . . . . . . . . 11078 1
N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 11078 1
stop_
save_
###################################
# Assigned chemical shift lists #
###################################
###################################################################
# Chemical Shift Ambiguity Index Value Definitions #
# #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains. #
# #
# Index Value Definition #
# #
# 1 Unique (including isolated methyl protons, #
# geminal atoms, and geminal methyl #
# groups with identical chemical shifts) #
# (e.g. ILE HD11, HD12, HD13 protons) #
# 2 Ambiguity of geminal atoms or geminal methyl #
# proton groups (e.g. ASP HB2 and HB3 #
# protons, LEU CD1 and CD2 carbons, or #
# LEU HD11, HD12, HD13 and HD21, HD22, #
# HD23 methyl protons) #
# 3 Aromatic atoms on opposite sides of #
# symmetrical rings (e.g. TYR HE1 and HE2 #
# protons) #
# 4 Intraresidue ambiguities (e.g. LYS HG and #
# HD protons or TRP HZ2 and HZ3 protons) #
# 5 Interresidue ambiguities (LYS 12 vs. LYS 27) #
# 6 Intermolecular ambiguities (e.g. ASP 31 CA #
# in monomer 1 and ASP 31 CA in monomer 2 #
# of an asymmetrical homodimer, duplex #
# DNA assignments, or other assignments #
# that may apply to atoms in one or more #
# molecule in the molecular assembly) #
# 9 Ambiguous, specific ambiguity not defined #
# #
###################################################################
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 11078
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' 2 $sample_2 isotropic 11078 1
3 '3D CBCA(CO)NH' 2 $sample_2 isotropic 11078 1
4 '3D HNCACB' 2 $sample_2 isotropic 11078 1
5 '3D HNCA' 2 $sample_2 isotropic 11078 1
6 '3D HN(CO)CA' 2 $sample_2 isotropic 11078 1
8 '3D HCCH-TOCSY' 1 $sample_1 isotropic 11078 1
9 '3D 1H-13C NOESY' 1 $sample_1 isotropic 11078 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 THR HA H 1 3.947 0.009 . 1 . . . . 148 T HA . 11078 1
2 . 1 1 1 1 THR HB H 1 4.157 0.006 . 1 . . . . 148 T HB . 11078 1
3 . 1 1 1 1 THR HG21 H 1 1.254 0.007 . 1 . . . . 148 T QG2 . 11078 1
4 . 1 1 1 1 THR HG22 H 1 1.254 0.007 . 1 . . . . 148 T QG2 . 11078 1
5 . 1 1 1 1 THR HG23 H 1 1.254 0.007 . 1 . . . . 148 T QG2 . 11078 1
6 . 1 1 1 1 THR CA C 13 61.382 0.126 . 1 . . . . 148 T CA . 11078 1
7 . 1 1 1 1 THR CB C 13 69.260 0.176 . 1 . . . . 148 T CB . 11078 1
8 . 1 1 1 1 THR CG2 C 13 21.367 0.099 . 1 . . . . 148 T CG2 . 11078 1
9 . 1 1 2 2 THR H H 1 8.741 0.011 . 1 . . . . 149 T HN . 11078 1
10 . 1 1 2 2 THR HA H 1 4.351 0.008 . 1 . . . . 149 T HA . 11078 1
11 . 1 1 2 2 THR HB H 1 4.163 0.008 . 1 . . . . 149 T HB . 11078 1
12 . 1 1 2 2 THR HG21 H 1 1.175 0.006 . 1 . . . . 149 T QG2 . 11078 1
13 . 1 1 2 2 THR HG22 H 1 1.175 0.006 . 1 . . . . 149 T QG2 . 11078 1
14 . 1 1 2 2 THR HG23 H 1 1.175 0.006 . 1 . . . . 149 T QG2 . 11078 1
15 . 1 1 2 2 THR CA C 13 62.093 0.079 . 1 . . . . 149 T CA . 11078 1
16 . 1 1 2 2 THR CB C 13 70.004 0.223 . 1 . . . . 149 T CB . 11078 1
17 . 1 1 2 2 THR CG2 C 13 21.758 0.095 . 1 . . . . 149 T CG2 . 11078 1
18 . 1 1 2 2 THR N N 15 118.631 0.076 . 1 . . . . 149 T N . 11078 1
19 . 1 1 3 3 LEU H H 1 8.409 0.012 . 1 . . . . 150 L HN . 11078 1
20 . 1 1 3 3 LEU HA H 1 4.282 0.008 . 1 . . . . 150 L HA . 11078 1
21 . 1 1 3 3 LEU HB2 H 1 1.545 0.008 . 2 . . . . 150 L QB . 11078 1
22 . 1 1 3 3 LEU HG H 1 1.556 0.007 . 1 . . . . 150 L HG . 11078 1
23 . 1 1 3 3 LEU CA C 13 55.311 0.053 . 1 . . . . 150 L CA . 11078 1
24 . 1 1 3 3 LEU CB C 13 42.297 0.056 . 1 . . . . 150 L CB . 11078 1
25 . 1 1 3 3 LEU CD1 C 13 24.858 0.089 . 2 . . . . 150 L CD1 . 11078 1
26 . 1 1 3 3 LEU CD2 C 13 23.439 0.032 . 2 . . . . 150 L CD2 . 11078 1
27 . 1 1 3 3 LEU CG C 13 27.018 0.028 . 1 . . . . 150 L CG . 11078 1
28 . 1 1 3 3 LEU N N 15 124.612 0.100 . 1 . . . . 150 L N . 11078 1
29 . 1 1 4 4 ASP H H 1 8.211 0.011 . 1 . . . . 151 D HN . 11078 1
30 . 1 1 4 4 ASP HA H 1 4.513 0.008 . 1 . . . . 151 D HA . 11078 1
31 . 1 1 4 4 ASP CA C 13 54.190 0.078 . 1 . . . . 151 D CA . 11078 1
32 . 1 1 4 4 ASP CB C 13 41.204 0.114 . 1 . . . . 151 D CB . 11078 1
33 . 1 1 4 4 ASP N N 15 120.728 0.071 . 1 . . . . 151 D N . 11078 1
34 . 1 1 5 5 ASP H H 1 8.133 0.010 . 1 . . . . 152 D HN . 11078 1
35 . 1 1 5 5 ASP HA H 1 4.795 0.022 . 1 . . . . 152 D HA . 11078 1
36 . 1 1 5 5 ASP HB2 H 1 2.708 0.007 . 2 . . . . 152 D HB2 . 11078 1
37 . 1 1 5 5 ASP HB3 H 1 2.544 0.010 . 2 . . . . 152 D HB3 . 11078 1
38 . 1 1 5 5 ASP CA C 13 52.152 0.064 . 1 . . . . 152 D CA . 11078 1
39 . 1 1 5 5 ASP CB C 13 41.533 0.118 . 1 . . . . 152 D CB . 11078 1
40 . 1 1 5 5 ASP N N 15 121.591 0.053 . 1 . . . . 152 D N . 11078 1
41 . 1 1 6 6 PRO HA H 1 4.288 0.009 . 1 . . . . 153 P HA . 11078 1
42 . 1 1 6 6 PRO HB2 H 1 2.235 0.009 . 2 . . . . 153 P HB2 . 11078 1
43 . 1 1 6 6 PRO HB3 H 1 1.862 0.012 . 2 . . . . 153 P HB3 . 11078 1
44 . 1 1 6 6 PRO HD2 H 1 3.765 0.010 . 2 . . . . 153 P QD . 11078 1
45 . 1 1 6 6 PRO CA C 13 64.220 0.114 . 1 . . . . 153 P CA . 11078 1
46 . 1 1 6 6 PRO CB C 13 31.983 0.094 . 1 . . . . 153 P CB . 11078 1
47 . 1 1 6 6 PRO CD C 13 50.877 0.034 . 1 . . . . 153 P CD . 11078 1
48 . 1 1 6 6 PRO CG C 13 27.215 0.027 . 1 . . . . 153 P CG . 11078 1
49 . 1 1 7 7 LEU H H 1 8.311 0.012 . 1 . . . . 154 L HN . 11078 1
50 . 1 1 7 7 LEU HA H 1 4.283 0.012 . 1 . . . . 154 L HA . 11078 1
51 . 1 1 7 7 LEU HB2 H 1 1.653 0.007 . 2 . . . . 154 L HB2 . 11078 1
52 . 1 1 7 7 LEU HB3 H 1 1.493 0.011 . 2 . . . . 154 L HB3 . 11078 1
53 . 1 1 7 7 LEU HG H 1 1.517 0.010 . 1 . . . . 154 L HG . 11078 1
54 . 1 1 7 7 LEU CA C 13 55.438 0.107 . 1 . . . . 154 L CA . 11078 1
55 . 1 1 7 7 LEU CB C 13 41.391 0.078 . 1 . . . . 154 L CB . 11078 1
56 . 1 1 7 7 LEU CD1 C 13 24.990 0.123 . 2 . . . . 154 L CD1 . 11078 1
57 . 1 1 7 7 LEU CD2 C 13 22.902 0.048 . 2 . . . . 154 L CD2 . 11078 1
58 . 1 1 7 7 LEU CG C 13 27.058 0.075 . 1 . . . . 154 L CG . 11078 1
59 . 1 1 7 7 LEU N N 15 119.103 0.068 . 1 . . . . 154 L N . 11078 1
60 . 1 1 8 8 GLY H H 1 8.049 0.011 . 1 . . . . 155 G HN . 11078 1
61 . 1 1 8 8 GLY CA C 13 45.536 0.088 . 1 . . . . 155 G CA . 11078 1
62 . 1 1 8 8 GLY N N 15 107.683 0.064 . 1 . . . . 155 G N . 11078 1
63 . 1 1 9 9 HIS H H 1 8.200 0.011 . 1 . . . . 156 H HN . 11078 1
64 . 1 1 9 9 HIS HA H 1 4.642 0.009 . 1 . . . . 156 H HA . 11078 1
65 . 1 1 9 9 HIS HB2 H 1 3.200 0.012 . 2 . . . . 156 H HB2 . 11078 1
66 . 1 1 9 9 HIS HB3 H 1 3.109 0.009 . 2 . . . . 156 H HB3 . 11078 1
67 . 1 1 9 9 HIS CA C 13 54.905 0.084 . 1 . . . . 156 H CA . 11078 1
68 . 1 1 9 9 HIS CB C 13 29.345 0.180 . 1 . . . . 156 H CB . 11078 1
69 . 1 1 9 9 HIS N N 15 117.835 0.044 . 1 . . . . 156 H N . 11078 1
70 . 1 1 10 10 MET H H 1 8.413 0.011 . 1 . . . . 157 M HN . 11078 1
71 . 1 1 10 10 MET HA H 1 3.697 0.012 . 1 . . . . 157 M HA . 11078 1
72 . 1 1 10 10 MET HE1 H 1 2.237 0.006 . 1 . . . . 157 M QE . 11078 1
73 . 1 1 10 10 MET HE2 H 1 2.237 0.006 . 1 . . . . 157 M QE . 11078 1
74 . 1 1 10 10 MET HE3 H 1 2.237 0.006 . 1 . . . . 157 M QE . 11078 1
75 . 1 1 10 10 MET HG2 H 1 2.466 0.008 . 2 . . . . 157 M HG2 . 11078 1
76 . 1 1 10 10 MET HG3 H 1 2.232 0.010 . 2 . . . . 157 M HG3 . 11078 1
77 . 1 1 10 10 MET CA C 13 53.746 0.087 . 1 . . . . 157 M CA . 11078 1
78 . 1 1 10 10 MET CB C 13 33.043 0.068 . 1 . . . . 157 M CB . 11078 1
79 . 1 1 10 10 MET CE C 13 17.453 0.037 . 1 . . . . 157 M CE . 11078 1
80 . 1 1 10 10 MET CG C 13 31.351 0.085 . 1 . . . . 157 M CG . 11078 1
81 . 1 1 10 10 MET N N 15 124.217 0.114 . 1 . . . . 157 M N . 11078 1
82 . 1 1 11 11 PRO HA H 1 3.950 0.008 . 1 . . . . 158 P HA . 11078 1
83 . 1 1 11 11 PRO HD2 H 1 2.724 0.012 . 2 . . . . 158 P HD2 . 11078 1
84 . 1 1 11 11 PRO HD3 H 1 2.071 0.008 . 2 . . . . 158 P HD3 . 11078 1
85 . 1 1 11 11 PRO HG2 H 1 1.089 0.007 . 2 . . . . 158 P HG2 . 11078 1
86 . 1 1 11 11 PRO HG3 H 1 0.477 0.010 . 2 . . . . 158 P HG3 . 11078 1
87 . 1 1 11 11 PRO CA C 13 62.413 0.094 . 1 . . . . 158 P CA . 11078 1
88 . 1 1 11 11 PRO CB C 13 31.430 0.034 . 1 . . . . 158 P CB . 11078 1
89 . 1 1 11 11 PRO CD C 13 49.672 0.069 . 1 . . . . 158 P CD . 11078 1
90 . 1 1 11 11 PRO CG C 13 26.663 0.085 . 1 . . . . 158 P CG . 11078 1
91 . 1 1 12 12 GLU H H 1 8.279 0.015 . 1 . . . . 159 E HN . 11078 1
92 . 1 1 12 12 GLU HA H 1 3.819 0.008 . 1 . . . . 159 E HA . 11078 1
93 . 1 1 12 12 GLU CA C 13 58.135 0.098 . 1 . . . . 159 E CA . 11078 1
94 . 1 1 12 12 GLU CB C 13 30.085 0.104 . 1 . . . . 159 E CB . 11078 1
95 . 1 1 12 12 GLU CG C 13 36.391 0.040 . 1 . . . . 159 E CG . 11078 1
96 . 1 1 12 12 GLU N N 15 119.613 0.068 . 1 . . . . 159 E N . 11078 1
97 . 1 1 13 13 ARG H H 1 7.257 0.016 . 1 . . . . 160 R HN . 11078 1
98 . 1 1 13 13 ARG HA H 1 4.698 0.013 . 1 . . . . 160 R HA . 11078 1
99 . 1 1 13 13 ARG HB2 H 1 1.635 0.012 . 2 . . . . 160 R HB2 . 11078 1
100 . 1 1 13 13 ARG HB3 H 1 1.486 0.010 . 2 . . . . 160 R HB3 . 11078 1
101 . 1 1 13 13 ARG CA C 13 54.219 0.115 . 1 . . . . 160 R CA . 11078 1
102 . 1 1 13 13 ARG CB C 13 33.168 0.095 . 1 . . . . 160 R CB . 11078 1
103 . 1 1 13 13 ARG CD C 13 43.300 0.074 . 1 . . . . 160 R CD . 11078 1
104 . 1 1 13 13 ARG CG C 13 26.958 0.055 . 1 . . . . 160 R CG . 11078 1
105 . 1 1 13 13 ARG N N 15 115.748 0.051 . 1 . . . . 160 R N . 11078 1
106 . 1 1 14 14 PHE H H 1 9.112 0.012 . 1 . . . . 161 F HN . 11078 1
107 . 1 1 14 14 PHE HA H 1 4.424 0.011 . 1 . . . . 161 F HA . 11078 1
108 . 1 1 14 14 PHE HB2 H 1 3.052 0.014 . 2 . . . . 161 F HB2 . 11078 1
109 . 1 1 14 14 PHE HB3 H 1 2.896 0.010 . 2 . . . . 161 F HB3 . 11078 1
110 . 1 1 14 14 PHE HD1 H 1 6.779 0.000 . 3 . . . . 161 F QD . 11078 1
111 . 1 1 14 14 PHE HD2 H 1 6.779 0.000 . 3 . . . . 161 F QD . 11078 1
112 . 1 1 14 14 PHE CA C 13 57.206 0.160 . 1 . . . . 161 F CA . 11078 1
113 . 1 1 14 14 PHE CB C 13 41.567 0.240 . 1 . . . . 161 F CB . 11078 1
114 . 1 1 14 14 PHE N N 15 119.027 0.055 . 1 . . . . 161 F N . 11078 1
115 . 1 1 15 15 ASP H H 1 9.516 0.010 . 1 . . . . 162 D HN . 11078 1
116 . 1 1 15 15 ASP HA H 1 4.591 0.013 . 1 . . . . 162 D HA . 11078 1
117 . 1 1 15 15 ASP HB2 H 1 2.704 0.013 . 2 . . . . 162 D HB2 . 11078 1
118 . 1 1 15 15 ASP HB3 H 1 2.419 0.007 . 2 . . . . 162 D HB3 . 11078 1
119 . 1 1 15 15 ASP CA C 13 58.443 0.178 . 1 . . . . 162 D CA . 11078 1
120 . 1 1 15 15 ASP CB C 13 42.049 0.160 . 1 . . . . 162 D CB . 11078 1
121 . 1 1 15 15 ASP N N 15 122.704 0.122 . 1 . . . . 162 D N . 11078 1
122 . 1 1 16 16 ALA H H 1 7.645 0.012 . 1 . . . . 163 A HN . 11078 1
123 . 1 1 16 16 ALA HA H 1 5.408 0.010 . 1 . . . . 163 A HA . 11078 1
124 . 1 1 16 16 ALA HB1 H 1 1.149 0.010 . 1 . . . . 163 A QB . 11078 1
125 . 1 1 16 16 ALA HB2 H 1 1.149 0.010 . 1 . . . . 163 A QB . 11078 1
126 . 1 1 16 16 ALA HB3 H 1 1.149 0.010 . 1 . . . . 163 A QB . 11078 1
127 . 1 1 16 16 ALA CA C 13 51.822 0.120 . 1 . . . . 163 A CA . 11078 1
128 . 1 1 16 16 ALA CB C 13 22.193 0.104 . 1 . . . . 163 A CB . 11078 1
129 . 1 1 16 16 ALA N N 15 114.560 0.064 . 1 . . . . 163 A N . 11078 1
130 . 1 1 17 17 PHE H H 1 7.865 0.022 . 1 . . . . 164 F HN . 11078 1
131 . 1 1 17 17 PHE HA H 1 5.355 0.012 . 1 . . . . 164 F HA . 11078 1
132 . 1 1 17 17 PHE HB2 H 1 3.545 0.025 . 2 . . . . 164 F HB2 . 11078 1
133 . 1 1 17 17 PHE HB3 H 1 2.237 0.017 . 2 . . . . 164 F HB3 . 11078 1
134 . 1 1 17 17 PHE HD1 H 1 6.959 0.009 . 3 . . . . 164 F QD . 11078 1
135 . 1 1 17 17 PHE HD2 H 1 6.959 0.009 . 3 . . . . 164 F QD . 11078 1
136 . 1 1 17 17 PHE CA C 13 56.006 0.157 . 1 . . . . 164 F CA . 11078 1
137 . 1 1 17 17 PHE CB C 13 41.966 0.106 . 1 . . . . 164 F CB . 11078 1
138 . 1 1 17 17 PHE N N 15 120.858 0.112 . 1 . . . . 164 F N . 11078 1
139 . 1 1 18 18 ILE H H 1 7.933 0.012 . 1 . . . . 165 I HN . 11078 1
140 . 1 1 18 18 ILE HA H 1 4.305 0.010 . 1 . . . . 165 I HA . 11078 1
141 . 1 1 18 18 ILE HB H 1 1.667 0.006 . 1 . . . . 165 I HB . 11078 1
142 . 1 1 18 18 ILE HD11 H 1 0.513 0.006 . 1 . . . . 165 I QD1 . 11078 1
143 . 1 1 18 18 ILE HD12 H 1 0.513 0.006 . 1 . . . . 165 I QD1 . 11078 1
144 . 1 1 18 18 ILE HD13 H 1 0.513 0.006 . 1 . . . . 165 I QD1 . 11078 1
145 . 1 1 18 18 ILE HG12 H 1 1.266 0.012 . 2 . . . . 165 I HG12 . 11078 1
146 . 1 1 18 18 ILE HG13 H 1 0.777 0.010 . 2 . . . . 165 I HG13 . 11078 1
147 . 1 1 18 18 ILE HG21 H 1 0.499 0.009 . 1 . . . . 165 I QG2 . 11078 1
148 . 1 1 18 18 ILE HG22 H 1 0.499 0.009 . 1 . . . . 165 I QG2 . 11078 1
149 . 1 1 18 18 ILE HG23 H 1 0.499 0.009 . 1 . . . . 165 I QG2 . 11078 1
150 . 1 1 18 18 ILE CA C 13 60.455 0.123 . 1 . . . . 165 I CA . 11078 1
151 . 1 1 18 18 ILE CB C 13 37.138 0.159 . 1 . . . . 165 I CB . 11078 1
152 . 1 1 18 18 ILE CD1 C 13 12.872 0.059 . 1 . . . . 165 I CD1 . 11078 1
153 . 1 1 18 18 ILE CG1 C 13 26.670 0.083 . 1 . . . . 165 I CG1 . 11078 1
154 . 1 1 18 18 ILE CG2 C 13 17.957 0.054 . 1 . . . . 165 I CG2 . 11078 1
155 . 1 1 18 18 ILE N N 15 127.321 0.064 . 1 . . . . 165 I N . 11078 1
156 . 1 1 19 19 CYS H H 1 9.348 0.015 . 1 . . . . 166 C HN . 11078 1
157 . 1 1 19 19 CYS HA H 1 4.499 0.010 . 1 . . . . 166 C HA . 11078 1
158 . 1 1 19 19 CYS HB2 H 1 3.121 0.009 . 2 . . . . 166 C HB2 . 11078 1
159 . 1 1 19 19 CYS HB3 H 1 2.834 0.017 . 2 . . . . 166 C HB3 . 11078 1
160 . 1 1 19 19 CYS CA C 13 58.498 0.167 . 1 . . . . 166 C CA . 11078 1
161 . 1 1 19 19 CYS CB C 13 28.348 0.162 . 1 . . . . 166 C CB . 11078 1
162 . 1 1 19 19 CYS N N 15 129.097 0.074 . 1 . . . . 166 C N . 11078 1
163 . 1 1 20 20 TYR H H 1 7.760 0.012 . 1 . . . . 167 Y HN . 11078 1
164 . 1 1 20 20 TYR HA H 1 5.050 0.014 . 1 . . . . 167 Y HA . 11078 1
165 . 1 1 20 20 TYR HB2 H 1 3.006 0.020 . 2 . . . . 167 Y HB2 . 11078 1
166 . 1 1 20 20 TYR HB3 H 1 2.695 0.009 . 2 . . . . 167 Y HB3 . 11078 1
167 . 1 1 20 20 TYR HD1 H 1 6.863 0.012 . 3 . . . . 167 Y QD . 11078 1
168 . 1 1 20 20 TYR HD2 H 1 6.863 0.012 . 3 . . . . 167 Y QD . 11078 1
169 . 1 1 20 20 TYR HE1 H 1 6.484 0.016 . 3 . . . . 167 Y QE . 11078 1
170 . 1 1 20 20 TYR HE2 H 1 6.484 0.016 . 3 . . . . 167 Y QE . 11078 1
171 . 1 1 20 20 TYR CA C 13 54.953 0.174 . 1 . . . . 167 Y CA . 11078 1
172 . 1 1 20 20 TYR CB C 13 40.995 0.061 . 1 . . . . 167 Y CB . 11078 1
173 . 1 1 20 20 TYR CD1 C 13 133.992 0.000 . 3 . . . . 167 Y CD1 . 11078 1
174 . 1 1 20 20 TYR CE1 C 13 117.574 0.032 . 3 . . . . 167 Y CE1 . 11078 1
175 . 1 1 20 20 TYR N N 15 123.717 0.066 . 1 . . . . 167 Y N . 11078 1
176 . 1 1 21 21 CYS H H 1 10.508 0.010 . 1 . . . . 168 C HN . 11078 1
177 . 1 1 21 21 CYS HA H 1 5.187 0.007 . 1 . . . . 168 C HA . 11078 1
178 . 1 1 21 21 CYS CA C 13 53.941 0.083 . 1 . . . . 168 C CA . 11078 1
179 . 1 1 21 21 CYS CB C 13 29.271 0.044 . 1 . . . . 168 C CB . 11078 1
180 . 1 1 21 21 CYS N N 15 121.240 0.104 . 1 . . . . 168 C N . 11078 1
181 . 1 1 22 22 PRO HA H 1 4.250 0.008 . 1 . . . . 169 P HA . 11078 1
182 . 1 1 22 22 PRO HB2 H 1 2.512 0.011 . 2 . . . . 169 P HB2 . 11078 1
183 . 1 1 22 22 PRO HB3 H 1 1.967 0.015 . 2 . . . . 169 P HB3 . 11078 1
184 . 1 1 22 22 PRO CA C 13 66.198 0.066 . 1 . . . . 169 P CA . 11078 1
185 . 1 1 22 22 PRO CB C 13 32.198 0.043 . 1 . . . . 169 P CB . 11078 1
186 . 1 1 22 22 PRO CD C 13 50.912 0.266 . 1 . . . . 169 P CD . 11078 1
187 . 1 1 22 22 PRO CG C 13 27.938 0.132 . 1 . . . . 169 P CG . 11078 1
188 . 1 1 23 23 SER H H 1 7.906 0.009 . 1 . . . . 170 S HN . 11078 1
189 . 1 1 23 23 SER HA H 1 4.364 0.009 . 1 . . . . 170 S HA . 11078 1
190 . 1 1 23 23 SER HB2 H 1 3.914 0.015 . 2 . . . . 170 S HB2 . 11078 1
191 . 1 1 23 23 SER HB3 H 1 3.880 0.012 . 2 . . . . 170 S HB3 . 11078 1
192 . 1 1 23 23 SER CA C 13 61.293 0.136 . 1 . . . . 170 S CA . 11078 1
193 . 1 1 23 23 SER CB C 13 63.440 0.233 . 1 . . . . 170 S CB . 11078 1
194 . 1 1 23 23 SER N N 15 112.319 0.069 . 1 . . . . 170 S N . 11078 1
195 . 1 1 24 24 ASP H H 1 8.431 0.011 . 1 . . . . 171 D HN . 11078 1
196 . 1 1 24 24 ASP HA H 1 5.288 0.013 . 1 . . . . 171 D HA . 11078 1
197 . 1 1 24 24 ASP HB2 H 1 3.202 0.014 . 2 . . . . 171 D HB2 . 11078 1
198 . 1 1 24 24 ASP HB3 H 1 2.893 0.012 . 2 . . . . 171 D HB3 . 11078 1
199 . 1 1 24 24 ASP CA C 13 54.630 0.094 . 1 . . . . 171 D CA . 11078 1
200 . 1 1 24 24 ASP CB C 13 42.011 0.182 . 1 . . . . 171 D CB . 11078 1
201 . 1 1 24 24 ASP N N 15 118.257 0.061 . 1 . . . . 171 D N . 11078 1
202 . 1 1 25 25 ILE H H 1 7.546 0.013 . 1 . . . . 172 I HN . 11078 1
203 . 1 1 25 25 ILE HA H 1 3.676 0.009 . 1 . . . . 172 I HA . 11078 1
204 . 1 1 25 25 ILE HB H 1 2.108 0.010 . 1 . . . . 172 I HB . 11078 1
205 . 1 1 25 25 ILE HD11 H 1 0.968 0.010 . 1 . . . . 172 I QD1 . 11078 1
206 . 1 1 25 25 ILE HD12 H 1 0.968 0.010 . 1 . . . . 172 I QD1 . 11078 1
207 . 1 1 25 25 ILE HD13 H 1 0.968 0.010 . 1 . . . . 172 I QD1 . 11078 1
208 . 1 1 25 25 ILE HG12 H 1 1.403 0.006 . 2 . . . . 172 I HG12 . 11078 1
209 . 1 1 25 25 ILE HG13 H 1 1.164 0.009 . 2 . . . . 172 I HG13 . 11078 1
210 . 1 1 25 25 ILE HG21 H 1 1.040 0.009 . 1 . . . . 172 I QG2 . 11078 1
211 . 1 1 25 25 ILE HG22 H 1 1.040 0.009 . 1 . . . . 172 I QG2 . 11078 1
212 . 1 1 25 25 ILE HG23 H 1 1.040 0.009 . 1 . . . . 172 I QG2 . 11078 1
213 . 1 1 25 25 ILE CA C 13 65.011 0.085 . 1 . . . . 172 I CA . 11078 1
214 . 1 1 25 25 ILE CB C 13 38.845 0.081 . 1 . . . . 172 I CB . 11078 1
215 . 1 1 25 25 ILE CD1 C 13 14.370 0.085 . 1 . . . . 172 I CD1 . 11078 1
216 . 1 1 25 25 ILE CG1 C 13 29.995 0.092 . 1 . . . . 172 I CG1 . 11078 1
217 . 1 1 25 25 ILE CG2 C 13 16.999 0.073 . 1 . . . . 172 I CG2 . 11078 1
218 . 1 1 25 25 ILE N N 15 119.580 0.075 . 1 . . . . 172 I N . 11078 1
219 . 1 1 26 26 GLN H H 1 8.699 0.011 . 1 . . . . 173 Q HN . 11078 1
220 . 1 1 26 26 GLN HA H 1 4.047 0.007 . 1 . . . . 173 Q HA . 11078 1
221 . 1 1 26 26 GLN HB2 H 1 2.028 0.009 . 2 . . . . 173 Q QB . 11078 1
222 . 1 1 26 26 GLN HE21 H 1 6.904 0.003 . 2 . . . . 173 Q HE21 . 11078 1
223 . 1 1 26 26 GLN HE22 H 1 7.630 0.002 . 2 . . . . 173 Q HE22 . 11078 1
224 . 1 1 26 26 GLN HG2 H 1 2.441 0.010 . 2 . . . . 173 Q HG2 . 11078 1
225 . 1 1 26 26 GLN HG3 H 1 2.364 0.013 . 2 . . . . 173 Q HG3 . 11078 1
226 . 1 1 26 26 GLN CA C 13 59.709 0.111 . 1 . . . . 173 Q CA . 11078 1
227 . 1 1 26 26 GLN CB C 13 27.613 0.109 . 1 . . . . 173 Q CB . 11078 1
228 . 1 1 26 26 GLN CG C 13 34.651 0.170 . 1 . . . . 173 Q CG . 11078 1
229 . 1 1 26 26 GLN N N 15 121.585 0.080 . 1 . . . . 173 Q N . 11078 1
230 . 1 1 26 26 GLN NE2 N 15 112.332 0.027 . 1 . . . . 173 Q NE2 . 11078 1
231 . 1 1 27 27 PHE H H 1 7.794 0.013 . 1 . . . . 174 F HN . 11078 1
232 . 1 1 27 27 PHE HA H 1 4.009 0.012 . 1 . . . . 174 F HA . 11078 1
233 . 1 1 27 27 PHE HB2 H 1 2.406 0.010 . 2 . . . . 174 F HB2 . 11078 1
234 . 1 1 27 27 PHE HB3 H 1 2.034 0.008 . 2 . . . . 174 F HB3 . 11078 1
235 . 1 1 27 27 PHE CA C 13 60.982 0.167 . 1 . . . . 174 F CA . 11078 1
236 . 1 1 27 27 PHE CB C 13 38.472 0.107 . 1 . . . . 174 F CB . 11078 1
237 . 1 1 27 27 PHE N N 15 120.521 0.056 . 1 . . . . 174 F N . 11078 1
238 . 1 1 28 28 VAL H H 1 7.188 0.017 . 1 . . . . 175 V HN . 11078 1
239 . 1 1 28 28 VAL HA H 1 2.848 0.009 . 1 . . . . 175 V HA . 11078 1
240 . 1 1 28 28 VAL HB H 1 1.403 0.005 . 1 . . . . 175 V HB . 11078 1
241 . 1 1 28 28 VAL HG11 H 1 0.355 0.006 . 1 . . . . 175 V QG1 . 11078 1
242 . 1 1 28 28 VAL HG12 H 1 0.355 0.006 . 1 . . . . 175 V QG1 . 11078 1
243 . 1 1 28 28 VAL HG13 H 1 0.355 0.006 . 1 . . . . 175 V QG1 . 11078 1
244 . 1 1 28 28 VAL HG21 H 1 0.039 0.008 . 1 . . . . 175 V QG2 . 11078 1
245 . 1 1 28 28 VAL HG22 H 1 0.039 0.008 . 1 . . . . 175 V QG2 . 11078 1
246 . 1 1 28 28 VAL HG23 H 1 0.039 0.008 . 1 . . . . 175 V QG2 . 11078 1
247 . 1 1 28 28 VAL CA C 13 67.302 0.104 . 1 . . . . 175 V CA . 11078 1
248 . 1 1 28 28 VAL CB C 13 30.665 0.096 . 1 . . . . 175 V CB . 11078 1
249 . 1 1 28 28 VAL CG1 C 13 24.192 0.067 . 2 . . . . 175 V CG1 . 11078 1
250 . 1 1 28 28 VAL CG2 C 13 20.837 0.070 . 2 . . . . 175 V CG2 . 11078 1
251 . 1 1 28 28 VAL N N 15 119.677 0.066 . 1 . . . . 175 V N . 11078 1
252 . 1 1 29 29 GLN H H 1 8.321 0.012 . 1 . . . . 176 Q HN . 11078 1
253 . 1 1 29 29 GLN HA H 1 3.440 0.008 . 1 . . . . 176 Q HA . 11078 1
254 . 1 1 29 29 GLN HB2 H 1 2.110 0.011 . 2 . . . . 176 Q HB2 . 11078 1
255 . 1 1 29 29 GLN HB3 H 1 1.767 0.015 . 2 . . . . 176 Q HB3 . 11078 1
256 . 1 1 29 29 GLN HE21 H 1 6.736 0.006 . 2 . . . . 176 Q HE21 . 11078 1
257 . 1 1 29 29 GLN HE22 H 1 7.003 0.007 . 2 . . . . 176 Q HE22 . 11078 1
258 . 1 1 29 29 GLN HG2 H 1 2.297 0.013 . 2 . . . . 176 Q HG2 . 11078 1
259 . 1 1 29 29 GLN HG3 H 1 2.111 0.006 . 2 . . . . 176 Q HG3 . 11078 1
260 . 1 1 29 29 GLN CA C 13 59.760 0.057 . 1 . . . . 176 Q CA . 11078 1
261 . 1 1 29 29 GLN CB C 13 28.120 0.100 . 1 . . . . 176 Q CB . 11078 1
262 . 1 1 29 29 GLN CG C 13 34.861 0.084 . 1 . . . . 176 Q CG . 11078 1
263 . 1 1 29 29 GLN N N 15 117.745 0.046 . 1 . . . . 176 Q N . 11078 1
264 . 1 1 29 29 GLN NE2 N 15 109.462 0.069 . 1 . . . . 176 Q NE2 . 11078 1
265 . 1 1 30 30 GLU H H 1 7.120 0.012 . 1 . . . . 177 E HN . 11078 1
266 . 1 1 30 30 GLU HA H 1 3.822 0.015 . 1 . . . . 177 E HA . 11078 1
267 . 1 1 30 30 GLU HB2 H 1 1.913 0.000 . 2 . . . . 177 E QB . 11078 1
268 . 1 1 30 30 GLU CA C 13 58.540 0.124 . 1 . . . . 177 E CA . 11078 1
269 . 1 1 30 30 GLU CB C 13 27.814 0.446 . 1 . . . . 177 E CB . 11078 1
270 . 1 1 30 30 GLU N N 15 120.600 0.041 . 1 . . . . 177 E N . 11078 1
271 . 1 1 31 31 MET H H 1 8.322 0.015 . 1 . . . . 178 M HN . 11078 1
272 . 1 1 31 31 MET HB2 H 1 2.214 0.011 . 2 . . . . 178 M HB2 . 11078 1
273 . 1 1 31 31 MET HB3 H 1 1.839 0.005 . 2 . . . . 178 M HB3 . 11078 1
274 . 1 1 31 31 MET HE1 H 1 1.722 0.007 . 1 . . . . 178 M QE . 11078 1
275 . 1 1 31 31 MET HE2 H 1 1.722 0.007 . 1 . . . . 178 M QE . 11078 1
276 . 1 1 31 31 MET HE3 H 1 1.722 0.007 . 1 . . . . 178 M QE . 11078 1
277 . 1 1 31 31 MET CA C 13 57.799 0.061 . 1 . . . . 178 M CA . 11078 1
278 . 1 1 31 31 MET CB C 13 31.133 0.731 . 1 . . . . 178 M CB . 11078 1
279 . 1 1 31 31 MET CE C 13 16.852 0.032 . 1 . . . . 178 M CE . 11078 1
280 . 1 1 31 31 MET N N 15 119.457 0.077 . 1 . . . . 178 M N . 11078 1
281 . 1 1 32 32 ILE H H 1 8.109 0.011 . 1 . . . . 179 I HN . 11078 1
282 . 1 1 32 32 ILE HA H 1 3.106 0.012 . 1 . . . . 179 I HA . 11078 1
283 . 1 1 32 32 ILE HB H 1 1.471 0.008 . 1 . . . . 179 I HB . 11078 1
284 . 1 1 32 32 ILE HD11 H 1 0.448 0.014 . 1 . . . . 179 I QD1 . 11078 1
285 . 1 1 32 32 ILE HD12 H 1 0.448 0.014 . 1 . . . . 179 I QD1 . 11078 1
286 . 1 1 32 32 ILE HD13 H 1 0.448 0.014 . 1 . . . . 179 I QD1 . 11078 1
287 . 1 1 32 32 ILE HG12 H 1 1.371 0.008 . 2 . . . . 179 I HG12 . 11078 1
288 . 1 1 32 32 ILE HG13 H 1 0.736 0.010 . 2 . . . . 179 I HG13 . 11078 1
289 . 1 1 32 32 ILE HG21 H 1 0.641 0.008 . 1 . . . . 179 I QG2 . 11078 1
290 . 1 1 32 32 ILE HG22 H 1 0.641 0.008 . 1 . . . . 179 I QG2 . 11078 1
291 . 1 1 32 32 ILE HG23 H 1 0.641 0.008 . 1 . . . . 179 I QG2 . 11078 1
292 . 1 1 32 32 ILE CA C 13 65.492 0.199 . 1 . . . . 179 I CA . 11078 1
293 . 1 1 32 32 ILE CB C 13 37.188 0.092 . 1 . . . . 179 I CB . 11078 1
294 . 1 1 32 32 ILE CD1 C 13 13.994 0.065 . 1 . . . . 179 I CD1 . 11078 1
295 . 1 1 32 32 ILE CG1 C 13 29.031 0.058 . 1 . . . . 179 I CG1 . 11078 1
296 . 1 1 32 32 ILE CG2 C 13 18.387 0.054 . 1 . . . . 179 I CG2 . 11078 1
297 . 1 1 32 32 ILE N N 15 117.749 0.156 . 1 . . . . 179 I N . 11078 1
298 . 1 1 33 33 ARG H H 1 7.278 0.011 . 1 . . . . 180 R HN . 11078 1
299 . 1 1 33 33 ARG HA H 1 3.818 0.010 . 1 . . . . 180 R HA . 11078 1
300 . 1 1 33 33 ARG HD2 H 1 3.011 0.009 . 2 . . . . 180 R QD . 11078 1
301 . 1 1 33 33 ARG HG2 H 1 1.505 0.008 . 2 . . . . 180 R HG2 . 11078 1
302 . 1 1 33 33 ARG HG3 H 1 1.303 0.011 . 2 . . . . 180 R HG3 . 11078 1
303 . 1 1 33 33 ARG CA C 13 59.570 0.234 . 1 . . . . 180 R CA . 11078 1
304 . 1 1 33 33 ARG CB C 13 29.958 0.109 . 1 . . . . 180 R CB . 11078 1
305 . 1 1 33 33 ARG CD C 13 43.300 0.042 . 1 . . . . 180 R CD . 11078 1
306 . 1 1 33 33 ARG CG C 13 27.551 0.050 . 1 . . . . 180 R CG . 11078 1
307 . 1 1 33 33 ARG N N 15 118.517 0.063 . 1 . . . . 180 R N . 11078 1
308 . 1 1 34 34 GLN H H 1 8.079 0.013 . 1 . . . . 181 Q HN . 11078 1
309 . 1 1 34 34 GLN HA H 1 3.566 0.006 . 1 . . . . 181 Q HA . 11078 1
310 . 1 1 34 34 GLN HB2 H 1 1.808 0.009 . 2 . . . . 181 Q QB . 11078 1
311 . 1 1 34 34 GLN HE21 H 1 6.552 0.006 . 2 . . . . 181 Q HE21 . 11078 1
312 . 1 1 34 34 GLN HE22 H 1 7.387 0.004 . 2 . . . . 181 Q HE22 . 11078 1
313 . 1 1 34 34 GLN HG2 H 1 0.857 0.007 . 2 . . . . 181 Q HG2 . 11078 1
314 . 1 1 34 34 GLN HG3 H 1 0.824 0.015 . 2 . . . . 181 Q HG3 . 11078 1
315 . 1 1 34 34 GLN CA C 13 58.018 0.062 . 1 . . . . 181 Q CA . 11078 1
316 . 1 1 34 34 GLN CB C 13 25.195 0.369 . 1 . . . . 181 Q CB . 11078 1
317 . 1 1 34 34 GLN CG C 13 31.766 0.074 . 1 . . . . 181 Q CG . 11078 1
318 . 1 1 34 34 GLN N N 15 116.661 0.042 . 1 . . . . 181 Q N . 11078 1
319 . 1 1 34 34 GLN NE2 N 15 110.570 0.036 . 1 . . . . 181 Q NE2 . 11078 1
320 . 1 1 35 35 LEU H H 1 8.589 0.011 . 1 . . . . 182 L HN . 11078 1
321 . 1 1 35 35 LEU HA H 1 4.029 0.013 . 1 . . . . 182 L HA . 11078 1
322 . 1 1 35 35 LEU HB2 H 1 1.861 0.012 . 2 . . . . 182 L HB2 . 11078 1
323 . 1 1 35 35 LEU HB3 H 1 1.200 0.009 . 2 . . . . 182 L HB3 . 11078 1
324 . 1 1 35 35 LEU HD11 H 1 0.882 0.008 . 1 . . . . 182 L QD1 . 11078 1
325 . 1 1 35 35 LEU HD12 H 1 0.882 0.008 . 1 . . . . 182 L QD1 . 11078 1
326 . 1 1 35 35 LEU HD13 H 1 0.882 0.008 . 1 . . . . 182 L QD1 . 11078 1
327 . 1 1 35 35 LEU HD21 H 1 0.590 0.010 . 1 . . . . 182 L QD2 . 11078 1
328 . 1 1 35 35 LEU HD22 H 1 0.590 0.010 . 1 . . . . 182 L QD2 . 11078 1
329 . 1 1 35 35 LEU HD23 H 1 0.590 0.010 . 1 . . . . 182 L QD2 . 11078 1
330 . 1 1 35 35 LEU HG H 1 1.926 0.015 . 1 . . . . 182 L HG . 11078 1
331 . 1 1 35 35 LEU CA C 13 58.057 0.057 . 1 . . . . 182 L CA . 11078 1
332 . 1 1 35 35 LEU CB C 13 41.147 0.047 . 1 . . . . 182 L CB . 11078 1
333 . 1 1 35 35 LEU CD1 C 13 22.679 0.077 . 2 . . . . 182 L CD1 . 11078 1
334 . 1 1 35 35 LEU CD2 C 13 25.749 0.083 . 2 . . . . 182 L CD2 . 11078 1
335 . 1 1 35 35 LEU CG C 13 26.448 0.053 . 1 . . . . 182 L CG . 11078 1
336 . 1 1 35 35 LEU N N 15 120.289 0.053 . 1 . . . . 182 L N . 11078 1
337 . 1 1 36 36 GLU H H 1 8.418 0.006 . 1 . . . . 183 E HN . 11078 1
338 . 1 1 36 36 GLU HA H 1 4.048 0.009 . 1 . . . . 183 E HA . 11078 1
339 . 1 1 36 36 GLU HB2 H 1 2.064 0.023 . 2 . . . . 183 E QB . 11078 1
340 . 1 1 36 36 GLU HG2 H 1 2.193 0.014 . 2 . . . . 183 E QG . 11078 1
341 . 1 1 36 36 GLU CA C 13 59.471 0.071 . 1 . . . . 183 E CA . 11078 1
342 . 1 1 36 36 GLU CB C 13 29.024 0.102 . 1 . . . . 183 E CB . 11078 1
343 . 1 1 37 37 GLN H H 1 7.354 0.014 . 1 . . . . 184 Q HN . 11078 1
344 . 1 1 37 37 GLN HA H 1 4.324 0.008 . 1 . . . . 184 Q HA . 11078 1
345 . 1 1 37 37 GLN HB2 H 1 2.255 0.009 . 2 . . . . 184 Q HB2 . 11078 1
346 . 1 1 37 37 GLN HB3 H 1 2.006 0.011 . 2 . . . . 184 Q HB3 . 11078 1
347 . 1 1 37 37 GLN HE21 H 1 6.728 0.005 . 2 . . . . 184 Q HE21 . 11078 1
348 . 1 1 37 37 GLN HE22 H 1 7.220 0.005 . 2 . . . . 184 Q HE22 . 11078 1
349 . 1 1 37 37 GLN HG2 H 1 2.441 0.008 . 2 . . . . 184 Q HG2 . 11078 1
350 . 1 1 37 37 GLN HG3 H 1 2.407 0.009 . 2 . . . . 184 Q HG3 . 11078 1
351 . 1 1 37 37 GLN CA C 13 56.366 0.120 . 1 . . . . 184 Q CA . 11078 1
352 . 1 1 37 37 GLN CB C 13 28.916 0.088 . 1 . . . . 184 Q CB . 11078 1
353 . 1 1 37 37 GLN N N 15 116.099 0.058 . 1 . . . . 184 Q N . 11078 1
354 . 1 1 37 37 GLN NE2 N 15 111.332 0.054 . 1 . . . . 184 Q NE2 . 11078 1
355 . 1 1 42 42 LEU HA H 1 4.389 0.016 . 1 . . . . 189 L HA . 11078 1
356 . 1 1 42 42 LEU HB2 H 1 1.752 0.012 . 2 . . . . 189 L HB2 . 11078 1
357 . 1 1 42 42 LEU HB3 H 1 1.056 0.015 . 2 . . . . 189 L HB3 . 11078 1
358 . 1 1 42 42 LEU HD11 H 1 0.897 0.010 . 1 . . . . 189 L QD1 . 11078 1
359 . 1 1 42 42 LEU HD12 H 1 0.897 0.010 . 1 . . . . 189 L QD1 . 11078 1
360 . 1 1 42 42 LEU HD13 H 1 0.897 0.010 . 1 . . . . 189 L QD1 . 11078 1
361 . 1 1 42 42 LEU HD21 H 1 0.676 0.008 . 1 . . . . 189 L QD2 . 11078 1
362 . 1 1 42 42 LEU HD22 H 1 0.676 0.008 . 1 . . . . 189 L QD2 . 11078 1
363 . 1 1 42 42 LEU HD23 H 1 0.676 0.008 . 1 . . . . 189 L QD2 . 11078 1
364 . 1 1 42 42 LEU HG H 1 1.600 0.007 . 1 . . . . 189 L HG . 11078 1
365 . 1 1 42 42 LEU CA C 13 54.419 0.072 . 1 . . . . 189 L CA . 11078 1
366 . 1 1 42 42 LEU CB C 13 44.103 0.181 . 1 . . . . 189 L CB . 11078 1
367 . 1 1 42 42 LEU CD1 C 13 27.161 0.121 . 2 . . . . 189 L CD1 . 11078 1
368 . 1 1 42 42 LEU CD2 C 13 22.435 0.063 . 2 . . . . 189 L CD2 . 11078 1
369 . 1 1 42 42 LEU CG C 13 27.134 0.000 . 1 . . . . 189 L CG . 11078 1
370 . 1 1 43 43 LYS H H 1 10.181 0.028 . 1 . . . . 190 K HN . 11078 1
371 . 1 1 43 43 LYS HA H 1 4.985 0.010 . 1 . . . . 190 K HA . 11078 1
372 . 1 1 43 43 LYS HB2 H 1 1.969 0.017 . 2 . . . . 190 K HB2 . 11078 1
373 . 1 1 43 43 LYS HB3 H 1 1.659 0.013 . 2 . . . . 190 K HB3 . 11078 1
374 . 1 1 43 43 LYS HD2 H 1 1.821 0.015 . 2 . . . . 190 K QD . 11078 1
375 . 1 1 43 43 LYS HE2 H 1 2.945 0.034 . 2 . . . . 190 K QE . 11078 1
376 . 1 1 43 43 LYS HG2 H 1 1.531 0.010 . 2 . . . . 190 K HG2 . 11078 1
377 . 1 1 43 43 LYS HG3 H 1 1.436 0.011 . 2 . . . . 190 K HG3 . 11078 1
378 . 1 1 43 43 LYS CA C 13 55.536 0.058 . 1 . . . . 190 K CA . 11078 1
379 . 1 1 43 43 LYS CB C 13 33.445 0.134 . 1 . . . . 190 K CB . 11078 1
380 . 1 1 43 43 LYS CD C 13 31.661 0.080 . 1 . . . . 190 K CD . 11078 1
381 . 1 1 43 43 LYS CE C 13 42.152 0.080 . 1 . . . . 190 K CE . 11078 1
382 . 1 1 43 43 LYS CG C 13 25.326 0.102 . 1 . . . . 190 K CG . 11078 1
383 . 1 1 43 43 LYS N N 15 123.638 0.061 . 1 . . . . 190 K N . 11078 1
384 . 1 1 44 44 LEU H H 1 9.603 0.018 . 1 . . . . 191 L HN . 11078 1
385 . 1 1 44 44 LEU HA H 1 5.642 0.008 . 1 . . . . 191 L HA . 11078 1
386 . 1 1 44 44 LEU HB2 H 1 1.992 0.011 . 2 . . . . 191 L HB2 . 11078 1
387 . 1 1 44 44 LEU HB3 H 1 1.192 0.008 . 2 . . . . 191 L HB3 . 11078 1
388 . 1 1 44 44 LEU HG H 1 1.611 0.008 . 1 . . . . 191 L HG . 11078 1
389 . 1 1 44 44 LEU CA C 13 52.906 0.063 . 1 . . . . 191 L CA . 11078 1
390 . 1 1 44 44 LEU CB C 13 45.559 0.084 . 1 . . . . 191 L CB . 11078 1
391 . 1 1 44 44 LEU CD1 C 13 23.992 0.070 . 2 . . . . 191 L CD1 . 11078 1
392 . 1 1 44 44 LEU CD2 C 13 25.663 0.045 . 2 . . . . 191 L CD2 . 11078 1
393 . 1 1 44 44 LEU CG C 13 26.749 0.068 . 1 . . . . 191 L CG . 11078 1
394 . 1 1 44 44 LEU N N 15 126.817 0.058 . 1 . . . . 191 L N . 11078 1
395 . 1 1 45 45 CYS H H 1 8.446 0.016 . 1 . . . . 192 C HN . 11078 1
396 . 1 1 45 45 CYS HA H 1 5.749 0.007 . 1 . . . . 192 C HA . 11078 1
397 . 1 1 45 45 CYS HB2 H 1 2.183 0.016 . 2 . . . . 192 C HB2 . 11078 1
398 . 1 1 45 45 CYS HB3 H 1 1.974 0.014 . 2 . . . . 192 C HB3 . 11078 1
399 . 1 1 45 45 CYS CA C 13 54.607 0.061 . 1 . . . . 192 C CA . 11078 1
400 . 1 1 45 45 CYS CB C 13 32.400 0.108 . 1 . . . . 192 C CB . 11078 1
401 . 1 1 45 45 CYS N N 15 114.018 0.082 . 1 . . . . 192 C N . 11078 1
402 . 1 1 46 46 VAL H H 1 8.484 0.009 . 1 . . . . 193 V HN . 11078 1
403 . 1 1 46 46 VAL HA H 1 4.068 0.012 . 1 . . . . 193 V HA . 11078 1
404 . 1 1 46 46 VAL HB H 1 2.550 0.015 . 1 . . . . 193 V HB . 11078 1
405 . 1 1 46 46 VAL HG11 H 1 0.733 0.008 . 1 . . . . 193 V QG1 . 11078 1
406 . 1 1 46 46 VAL HG12 H 1 0.733 0.008 . 1 . . . . 193 V QG1 . 11078 1
407 . 1 1 46 46 VAL HG13 H 1 0.733 0.008 . 1 . . . . 193 V QG1 . 11078 1
408 . 1 1 46 46 VAL HG21 H 1 0.416 0.010 . 1 . . . . 193 V QG2 . 11078 1
409 . 1 1 46 46 VAL HG22 H 1 0.416 0.010 . 1 . . . . 193 V QG2 . 11078 1
410 . 1 1 46 46 VAL HG23 H 1 0.416 0.010 . 1 . . . . 193 V QG2 . 11078 1
411 . 1 1 46 46 VAL CA C 13 59.538 0.134 . 1 . . . . 193 V CA . 11078 1
412 . 1 1 46 46 VAL CB C 13 36.754 0.170 . 1 . . . . 193 V CB . 11078 1
413 . 1 1 46 46 VAL CG1 C 13 22.166 0.083 . 2 . . . . 193 V CG1 . 11078 1
414 . 1 1 46 46 VAL CG2 C 13 17.084 0.037 . 2 . . . . 193 V CG2 . 11078 1
415 . 1 1 46 46 VAL N N 15 111.168 0.064 . 1 . . . . 193 V N . 11078 1
416 . 1 1 47 47 SER H H 1 9.350 0.009 . 1 . . . . 194 S HN . 11078 1
417 . 1 1 47 47 SER HA H 1 4.627 0.007 . 1 . . . . 194 S HA . 11078 1
418 . 1 1 47 47 SER HB2 H 1 3.919 0.010 . 2 . . . . 194 S HB2 . 11078 1
419 . 1 1 47 47 SER HB3 H 1 3.869 0.015 . 2 . . . . 194 S HB3 . 11078 1
420 . 1 1 47 47 SER CA C 13 62.054 0.170 . 1 . . . . 194 S CA . 11078 1
421 . 1 1 47 47 SER CB C 13 63.390 0.126 . 1 . . . . 194 S CB . 11078 1
422 . 1 1 47 47 SER N N 15 116.476 0.084 . 1 . . . . 194 S N . 11078 1
423 . 1 1 51 51 VAL HA H 1 4.190 0.007 . 1 . . . . 198 V HA . 11078 1
424 . 1 1 51 51 VAL HB H 1 2.324 0.006 . 1 . . . . 198 V HB . 11078 1
425 . 1 1 51 51 VAL HG11 H 1 0.906 0.007 . 1 . . . . 198 V QG1 . 11078 1
426 . 1 1 51 51 VAL HG12 H 1 0.906 0.007 . 1 . . . . 198 V QG1 . 11078 1
427 . 1 1 51 51 VAL HG13 H 1 0.906 0.007 . 1 . . . . 198 V QG1 . 11078 1
428 . 1 1 51 51 VAL HG21 H 1 0.863 0.008 . 1 . . . . 198 V QG2 . 11078 1
429 . 1 1 51 51 VAL HG22 H 1 0.863 0.008 . 1 . . . . 198 V QG2 . 11078 1
430 . 1 1 51 51 VAL HG23 H 1 0.863 0.008 . 1 . . . . 198 V QG2 . 11078 1
431 . 1 1 51 51 VAL CA C 13 61.247 0.029 . 1 . . . . 198 V CA . 11078 1
432 . 1 1 51 51 VAL CB C 13 30.930 0.034 . 1 . . . . 198 V CB . 11078 1
433 . 1 1 51 51 VAL CG1 C 13 19.149 0.064 . 2 . . . . 198 V CG1 . 11078 1
434 . 1 1 51 51 VAL CG2 C 13 21.463 0.048 . 2 . . . . 198 V CG2 . 11078 1
435 . 1 1 52 52 LEU HA H 1 4.696 0.008 . 1 . . . . 199 L HA . 11078 1
436 . 1 1 52 52 LEU HB2 H 1 1.405 0.009 . 2 . . . . 199 L HB2 . 11078 1
437 . 1 1 52 52 LEU HB3 H 1 1.227 0.022 . 2 . . . . 199 L HB3 . 11078 1
438 . 1 1 52 52 LEU HD11 H 1 0.643 0.008 . 1 . . . . 199 L QD1 . 11078 1
439 . 1 1 52 52 LEU HD12 H 1 0.643 0.008 . 1 . . . . 199 L QD1 . 11078 1
440 . 1 1 52 52 LEU HD13 H 1 0.643 0.008 . 1 . . . . 199 L QD1 . 11078 1
441 . 1 1 52 52 LEU HD21 H 1 0.601 0.008 . 1 . . . . 199 L QD2 . 11078 1
442 . 1 1 52 52 LEU HD22 H 1 0.601 0.008 . 1 . . . . 199 L QD2 . 11078 1
443 . 1 1 52 52 LEU HD23 H 1 0.601 0.008 . 1 . . . . 199 L QD2 . 11078 1
444 . 1 1 52 52 LEU HG H 1 1.364 0.011 . 1 . . . . 199 L HG . 11078 1
445 . 1 1 52 52 LEU CA C 13 51.674 0.210 . 1 . . . . 199 L CA . 11078 1
446 . 1 1 52 52 LEU CB C 13 42.513 0.083 . 1 . . . . 199 L CB . 11078 1
447 . 1 1 52 52 LEU CD1 C 13 27.489 0.069 . 2 . . . . 199 L CD1 . 11078 1
448 . 1 1 52 52 LEU CD2 C 13 24.311 0.077 . 2 . . . . 199 L CD2 . 11078 1
449 . 1 1 52 52 LEU CG C 13 26.403 0.175 . 1 . . . . 199 L CG . 11078 1
450 . 1 1 53 53 PRO HA H 1 4.344 0.006 . 1 . . . . 200 P HA . 11078 1
451 . 1 1 53 53 PRO HB2 H 1 1.857 0.007 . 2 . . . . 200 P HB2 . 11078 1
452 . 1 1 53 53 PRO HB3 H 1 2.110 0.009 . 2 . . . . 200 P HB3 . 11078 1
453 . 1 1 53 53 PRO HD2 H 1 3.378 0.000 . 2 . . . . 200 P HD2 . 11078 1
454 . 1 1 53 53 PRO CA C 13 63.408 0.117 . 1 . . . . 200 P CA . 11078 1
455 . 1 1 53 53 PRO CB C 13 31.495 0.202 . 1 . . . . 200 P CB . 11078 1
456 . 1 1 53 53 PRO CD C 13 50.529 0.000 . 1 . . . . 200 P CD . 11078 1
457 . 1 1 54 54 GLY H H 1 8.643 0.012 . 1 . . . . 201 G HN . 11078 1
458 . 1 1 54 54 GLY HA2 H 1 3.948 0.005 . 2 . . . . 201 G HA2 . 11078 1
459 . 1 1 54 54 GLY HA3 H 1 3.718 0.009 . 2 . . . . 201 G HA3 . 11078 1
460 . 1 1 54 54 GLY CA C 13 45.464 0.085 . 1 . . . . 201 G CA . 11078 1
461 . 1 1 54 54 GLY N N 15 108.490 0.046 . 1 . . . . 201 G N . 11078 1
462 . 1 1 56 56 CYS HA H 1 4.417 0.006 . 1 . . . . 203 C HA . 11078 1
463 . 1 1 56 56 CYS HB2 H 1 2.951 0.007 . 2 . . . . 203 C HB2 . 11078 1
464 . 1 1 56 56 CYS HB3 H 1 2.821 0.010 . 2 . . . . 203 C HB3 . 11078 1
465 . 1 1 56 56 CYS CA C 13 57.928 0.100 . 1 . . . . 203 C CA . 11078 1
466 . 1 1 56 56 CYS CB C 13 26.784 0.088 . 1 . . . . 203 C CB . 11078 1
467 . 1 1 57 57 VAL H H 1 6.831 0.018 . 1 . . . . 204 V HN . 11078 1
468 . 1 1 57 57 VAL HA H 1 4.501 0.007 . 1 . . . . 204 V HA . 11078 1
469 . 1 1 57 57 VAL HB H 1 1.871 0.009 . 1 . . . . 204 V HB . 11078 1
470 . 1 1 57 57 VAL HG11 H 1 0.753 0.009 . 1 . . . . 204 V QG1 . 11078 1
471 . 1 1 57 57 VAL HG12 H 1 0.753 0.009 . 1 . . . . 204 V QG1 . 11078 1
472 . 1 1 57 57 VAL HG13 H 1 0.753 0.009 . 1 . . . . 204 V QG1 . 11078 1
473 . 1 1 57 57 VAL HG21 H 1 0.704 0.006 . 1 . . . . 204 V QG2 . 11078 1
474 . 1 1 57 57 VAL HG22 H 1 0.704 0.006 . 1 . . . . 204 V QG2 . 11078 1
475 . 1 1 57 57 VAL HG23 H 1 0.704 0.006 . 1 . . . . 204 V QG2 . 11078 1
476 . 1 1 57 57 VAL CA C 13 60.573 0.101 . 1 . . . . 204 V CA . 11078 1
477 . 1 1 57 57 VAL CB C 13 33.724 0.173 . 1 . . . . 204 V CB . 11078 1
478 . 1 1 57 57 VAL CG1 C 13 22.426 0.061 . 2 . . . . 204 V CG1 . 11078 1
479 . 1 1 57 57 VAL CG2 C 13 20.041 0.028 . 2 . . . . 204 V CG2 . 11078 1
480 . 1 1 57 57 VAL N N 15 116.075 0.122 . 1 . . . . 204 V N . 11078 1
481 . 1 1 58 58 TRP H H 1 8.103 0.012 . 1 . . . . 205 W HN . 11078 1
482 . 1 1 58 58 TRP HA H 1 4.650 0.009 . 1 . . . . 205 W HA . 11078 1
483 . 1 1 58 58 TRP HB2 H 1 3.472 0.012 . 2 . . . . 205 W HB2 . 11078 1
484 . 1 1 58 58 TRP HB3 H 1 2.913 0.020 . 2 . . . . 205 W HB3 . 11078 1
485 . 1 1 58 58 TRP HD1 H 1 7.637 0.005 . 1 . . . . 205 W HD1 . 11078 1
486 . 1 1 58 58 TRP HE1 H 1 10.285 0.007 . 1 . . . . 205 W HE1 . 11078 1
487 . 1 1 58 58 TRP HZ2 H 1 7.428 0.008 . 1 . . . . 205 W HZ2 . 11078 1
488 . 1 1 58 58 TRP CA C 13 58.209 0.096 . 1 . . . . 205 W CA . 11078 1
489 . 1 1 58 58 TRP CB C 13 32.738 0.105 . 1 . . . . 205 W CB . 11078 1
490 . 1 1 58 58 TRP CD1 C 13 127.728 0.001 . 1 . . . . 205 W CD1 . 11078 1
491 . 1 1 58 58 TRP CZ2 C 13 114.867 0.009 . 1 . . . . 205 W CZ2 . 11078 1
492 . 1 1 58 58 TRP N N 15 123.136 0.095 . 1 . . . . 205 W N . 11078 1
493 . 1 1 58 58 TRP NE1 N 15 130.089 0.058 . 1 . . . . 205 W NE1 . 11078 1
494 . 1 1 59 59 SER H H 1 8.739 0.012 . 1 . . . . 206 S HN . 11078 1
495 . 1 1 59 59 SER HA H 1 5.273 0.009 . 1 . . . . 206 S HA . 11078 1
496 . 1 1 59 59 SER HB2 H 1 3.843 0.003 . 2 . . . . 206 S HB2 . 11078 1
497 . 1 1 59 59 SER HB3 H 1 3.782 0.009 . 2 . . . . 206 S HB3 . 11078 1
498 . 1 1 59 59 SER CA C 13 57.580 0.120 . 1 . . . . 206 S CA . 11078 1
499 . 1 1 59 59 SER CB C 13 64.723 0.159 . 1 . . . . 206 S CB . 11078 1
500 . 1 1 59 59 SER N N 15 116.784 0.071 . 1 . . . . 206 S N . 11078 1
501 . 1 1 60 60 ILE H H 1 8.194 0.013 . 1 . . . . 207 I HN . 11078 1
502 . 1 1 60 60 ILE HA H 1 4.521 0.021 . 1 . . . . 207 I HA . 11078 1
503 . 1 1 60 60 ILE HB H 1 1.233 0.012 . 1 . . . . 207 I HB . 11078 1
504 . 1 1 60 60 ILE HD11 H 1 0.552 0.009 . 1 . . . . 207 I QD1 . 11078 1
505 . 1 1 60 60 ILE HD12 H 1 0.552 0.009 . 1 . . . . 207 I QD1 . 11078 1
506 . 1 1 60 60 ILE HD13 H 1 0.552 0.009 . 1 . . . . 207 I QD1 . 11078 1
507 . 1 1 60 60 ILE HG12 H 1 1.391 0.008 . 2 . . . . 207 I QG1 . 11078 1
508 . 1 1 60 60 ILE HG21 H 1 0.612 0.010 . 1 . . . . 207 I QG2 . 11078 1
509 . 1 1 60 60 ILE HG22 H 1 0.612 0.010 . 1 . . . . 207 I QG2 . 11078 1
510 . 1 1 60 60 ILE HG23 H 1 0.612 0.010 . 1 . . . . 207 I QG2 . 11078 1
511 . 1 1 60 60 ILE CA C 13 59.697 0.073 . 1 . . . . 207 I CA . 11078 1
512 . 1 1 60 60 ILE CB C 13 42.532 0.066 . 1 . . . . 207 I CB . 11078 1
513 . 1 1 60 60 ILE CD1 C 13 15.030 0.077 . 1 . . . . 207 I CD1 . 11078 1
514 . 1 1 60 60 ILE CG1 C 13 28.347 0.058 . 1 . . . . 207 I CG1 . 11078 1
515 . 1 1 60 60 ILE CG2 C 13 16.111 0.069 . 1 . . . . 207 I CG2 . 11078 1
516 . 1 1 60 60 ILE N N 15 120.684 0.086 . 1 . . . . 207 I N . 11078 1
517 . 1 1 61 61 ALA H H 1 7.905 0.011 . 1 . . . . 208 A HN . 11078 1
518 . 1 1 61 61 ALA HA H 1 4.304 0.007 . 1 . . . . 208 A HA . 11078 1
519 . 1 1 61 61 ALA HB1 H 1 1.403 0.007 . 1 . . . . 208 A QB . 11078 1
520 . 1 1 61 61 ALA HB2 H 1 1.403 0.007 . 1 . . . . 208 A QB . 11078 1
521 . 1 1 61 61 ALA HB3 H 1 1.403 0.007 . 1 . . . . 208 A QB . 11078 1
522 . 1 1 61 61 ALA CA C 13 52.073 0.099 . 1 . . . . 208 A CA . 11078 1
523 . 1 1 61 61 ALA CB C 13 21.044 8.368 . 1 . . . . 208 A CB . 11078 1
524 . 1 1 61 61 ALA N N 15 129.953 0.091 . 1 . . . . 208 A N . 11078 1
525 . 1 1 62 62 SER H H 1 8.638 0.010 . 1 . . . . 209 S HN . 11078 1
526 . 1 1 62 62 SER HA H 1 3.679 0.011 . 1 . . . . 209 S HA . 11078 1
527 . 1 1 62 62 SER HB2 H 1 3.573 0.010 . 2 . . . . 209 S QB . 11078 1
528 . 1 1 62 62 SER CA C 13 61.301 0.127 . 1 . . . . 209 S CA . 11078 1
529 . 1 1 62 62 SER CB C 13 62.582 0.119 . 1 . . . . 209 S CB . 11078 1
530 . 1 1 62 62 SER N N 15 118.777 0.042 . 1 . . . . 209 S N . 11078 1
531 . 1 1 63 63 GLU H H 1 9.384 0.008 . 1 . . . . 210 E HN . 11078 1
532 . 1 1 63 63 GLU HA H 1 4.211 0.008 . 1 . . . . 210 E HA . 11078 1
533 . 1 1 63 63 GLU HB2 H 1 2.040 0.008 . 2 . . . . 210 E QB . 11078 1
534 . 1 1 63 63 GLU CA C 13 58.469 0.121 . 1 . . . . 210 E CA . 11078 1
535 . 1 1 63 63 GLU CB C 13 28.160 0.194 . 1 . . . . 210 E CB . 11078 1
536 . 1 1 63 63 GLU CG C 13 35.897 0.085 . 1 . . . . 210 E CG . 11078 1
537 . 1 1 63 63 GLU N N 15 118.981 0.056 . 1 . . . . 210 E N . 11078 1
538 . 1 1 64 64 LEU H H 1 7.742 0.013 . 1 . . . . 211 L HN . 11078 1
539 . 1 1 64 64 LEU HA H 1 4.449 0.010 . 1 . . . . 211 L HA . 11078 1
540 . 1 1 64 64 LEU HB2 H 1 1.808 0.015 . 2 . . . . 211 L HB2 . 11078 1
541 . 1 1 64 64 LEU HB3 H 1 1.519 0.012 . 2 . . . . 211 L HB3 . 11078 1
542 . 1 1 64 64 LEU HD11 H 1 0.946 0.007 . 1 . . . . 211 L QD1 . 11078 1
543 . 1 1 64 64 LEU HD12 H 1 0.946 0.007 . 1 . . . . 211 L QD1 . 11078 1
544 . 1 1 64 64 LEU HD13 H 1 0.946 0.007 . 1 . . . . 211 L QD1 . 11078 1
545 . 1 1 64 64 LEU HD21 H 1 0.824 0.008 . 1 . . . . 211 L QD2 . 11078 1
546 . 1 1 64 64 LEU HD22 H 1 0.824 0.008 . 1 . . . . 211 L QD2 . 11078 1
547 . 1 1 64 64 LEU HD23 H 1 0.824 0.008 . 1 . . . . 211 L QD2 . 11078 1
548 . 1 1 64 64 LEU HG H 1 1.512 0.010 . 1 . . . . 211 L HG . 11078 1
549 . 1 1 64 64 LEU CA C 13 54.568 0.104 . 1 . . . . 211 L CA . 11078 1
550 . 1 1 64 64 LEU CB C 13 43.029 0.053 . 1 . . . . 211 L CB . 11078 1
551 . 1 1 64 64 LEU CD1 C 13 25.423 0.061 . 2 . . . . 211 L CD1 . 11078 1
552 . 1 1 64 64 LEU CD2 C 13 22.354 0.096 . 2 . . . . 211 L CD2 . 11078 1
553 . 1 1 64 64 LEU CG C 13 27.145 0.017 . 1 . . . . 211 L CG . 11078 1
554 . 1 1 64 64 LEU N N 15 118.329 0.094 . 1 . . . . 211 L N . 11078 1
555 . 1 1 65 65 ILE H H 1 7.117 0.022 . 1 . . . . 212 I HN . 11078 1
556 . 1 1 65 65 ILE HA H 1 3.300 0.010 . 1 . . . . 212 I HA . 11078 1
557 . 1 1 65 65 ILE HB H 1 1.503 0.009 . 1 . . . . 212 I HB . 11078 1
558 . 1 1 65 65 ILE HD11 H 1 -0.313 0.010 . 1 . . . . 212 I QD1 . 11078 1
559 . 1 1 65 65 ILE HD12 H 1 -0.313 0.010 . 1 . . . . 212 I QD1 . 11078 1
560 . 1 1 65 65 ILE HD13 H 1 -0.313 0.010 . 1 . . . . 212 I QD1 . 11078 1
561 . 1 1 65 65 ILE HG12 H 1 1.410 0.012 . 2 . . . . 212 I HG12 . 11078 1
562 . 1 1 65 65 ILE HG13 H 1 0.151 0.013 . 2 . . . . 212 I HG13 . 11078 1
563 . 1 1 65 65 ILE HG21 H 1 0.232 0.007 . 1 . . . . 212 I QG2 . 11078 1
564 . 1 1 65 65 ILE HG22 H 1 0.232 0.007 . 1 . . . . 212 I QG2 . 11078 1
565 . 1 1 65 65 ILE HG23 H 1 0.232 0.007 . 1 . . . . 212 I QG2 . 11078 1
566 . 1 1 65 65 ILE CA C 13 66.527 0.093 . 1 . . . . 212 I CA . 11078 1
567 . 1 1 65 65 ILE CB C 13 38.166 0.061 . 1 . . . . 212 I CB . 11078 1
568 . 1 1 65 65 ILE CD1 C 13 14.005 0.039 . 1 . . . . 212 I CD1 . 11078 1
569 . 1 1 65 65 ILE CG1 C 13 29.741 0.057 . 1 . . . . 212 I CG1 . 11078 1
570 . 1 1 65 65 ILE CG2 C 13 16.287 0.063 . 1 . . . . 212 I CG2 . 11078 1
571 . 1 1 65 65 ILE N N 15 119.673 0.066 . 1 . . . . 212 I N . 11078 1
572 . 1 1 66 66 GLU H H 1 8.795 0.012 . 1 . . . . 213 E HN . 11078 1
573 . 1 1 66 66 GLU HA H 1 3.883 0.007 . 1 . . . . 213 E HA . 11078 1
574 . 1 1 66 66 GLU HB2 H 1 2.190 0.004 . 2 . . . . 213 E HB2 . 11078 1
575 . 1 1 66 66 GLU HB3 H 1 1.980 0.007 . 2 . . . . 213 E HB3 . 11078 1
576 . 1 1 66 66 GLU HG2 H 1 2.293 0.009 . 2 . . . . 213 E HG2 . 11078 1
577 . 1 1 66 66 GLU HG3 H 1 1.954 0.006 . 2 . . . . 213 E HG3 . 11078 1
578 . 1 1 66 66 GLU CA C 13 60.903 0.121 . 1 . . . . 213 E CA . 11078 1
579 . 1 1 66 66 GLU CB C 13 28.016 0.164 . 1 . . . . 213 E CB . 11078 1
580 . 1 1 66 66 GLU CG C 13 36.968 0.047 . 1 . . . . 213 E CG . 11078 1
581 . 1 1 66 66 GLU N N 15 117.955 0.065 . 1 . . . . 213 E N . 11078 1
582 . 1 1 67 67 LYS H H 1 7.670 0.010 . 1 . . . . 214 K HN . 11078 1
583 . 1 1 67 67 LYS HA H 1 4.121 0.008 . 1 . . . . 214 K HA . 11078 1
584 . 1 1 67 67 LYS HB2 H 1 1.799 0.006 . 2 . . . . 214 K QB . 11078 1
585 . 1 1 67 67 LYS HD2 H 1 1.671 0.009 . 2 . . . . 214 K QD . 11078 1
586 . 1 1 67 67 LYS HE2 H 1 2.984 0.017 . 2 . . . . 214 K QE . 11078 1
587 . 1 1 67 67 LYS HG2 H 1 1.537 0.003 . 2 . . . . 214 K HG2 . 11078 1
588 . 1 1 67 67 LYS CA C 13 57.562 0.074 . 1 . . . . 214 K CA . 11078 1
589 . 1 1 67 67 LYS CB C 13 33.702 0.080 . 1 . . . . 214 K CB . 11078 1
590 . 1 1 67 67 LYS CD C 13 29.059 0.024 . 1 . . . . 214 K CD . 11078 1
591 . 1 1 67 67 LYS CE C 13 42.118 0.014 . 1 . . . . 214 K CE . 11078 1
592 . 1 1 67 67 LYS CG C 13 25.483 0.151 . 1 . . . . 214 K CG . 11078 1
593 . 1 1 67 67 LYS N N 15 113.119 0.061 . 1 . . . . 214 K N . 11078 1
594 . 1 1 68 68 ARG H H 1 7.948 0.013 . 1 . . . . 215 R HN . 11078 1
595 . 1 1 68 68 ARG HA H 1 4.629 0.006 . 1 . . . . 215 R HA . 11078 1
596 . 1 1 68 68 ARG HB2 H 1 2.231 0.009 . 2 . . . . 215 R HB2 . 11078 1
597 . 1 1 68 68 ARG HB3 H 1 1.827 0.007 . 2 . . . . 215 R HB3 . 11078 1
598 . 1 1 68 68 ARG HD2 H 1 3.219 0.012 . 2 . . . . 215 R QD . 11078 1
599 . 1 1 68 68 ARG HG2 H 1 1.881 0.006 . 2 . . . . 215 R HG2 . 11078 1
600 . 1 1 68 68 ARG HG3 H 1 1.735 0.012 . 2 . . . . 215 R HG3 . 11078 1
601 . 1 1 68 68 ARG CA C 13 56.560 0.135 . 1 . . . . 215 R CA . 11078 1
602 . 1 1 68 68 ARG CB C 13 31.953 0.132 . 1 . . . . 215 R CB . 11078 1
603 . 1 1 68 68 ARG CD C 13 42.961 0.042 . 1 . . . . 215 R CD . 11078 1
604 . 1 1 68 68 ARG CG C 13 27.934 0.134 . 1 . . . . 215 R CG . 11078 1
605 . 1 1 68 68 ARG N N 15 113.554 0.045 . 1 . . . . 215 R N . 11078 1
606 . 1 1 69 69 CYS H H 1 8.124 0.008 . 1 . . . . 216 C HN . 11078 1
607 . 1 1 69 69 CYS HA H 1 5.037 0.015 . 1 . . . . 216 C HA . 11078 1
608 . 1 1 69 69 CYS HB2 H 1 3.040 0.011 . 2 . . . . 216 C HB2 . 11078 1
609 . 1 1 69 69 CYS HB3 H 1 2.468 0.011 . 2 . . . . 216 C HB3 . 11078 1
610 . 1 1 69 69 CYS CA C 13 57.220 0.057 . 1 . . . . 216 C CA . 11078 1
611 . 1 1 69 69 CYS CB C 13 28.777 0.162 . 1 . . . . 216 C CB . 11078 1
612 . 1 1 69 69 CYS N N 15 116.532 0.085 . 1 . . . . 216 C N . 11078 1
613 . 1 1 70 70 ARG H H 1 8.370 0.011 . 1 . . . . 217 R HN . 11078 1
614 . 1 1 70 70 ARG HA H 1 4.114 0.008 . 1 . . . . 217 R HA . 11078 1
615 . 1 1 70 70 ARG HB2 H 1 2.192 0.013 . 2 . . . . 217 R HB2 . 11078 1
616 . 1 1 70 70 ARG HB3 H 1 2.040 0.018 . 2 . . . . 217 R HB3 . 11078 1
617 . 1 1 70 70 ARG HD2 H 1 3.467 0.013 . 2 . . . . 217 R HD2 . 11078 1
618 . 1 1 70 70 ARG HD3 H 1 3.364 0.013 . 2 . . . . 217 R HD3 . 11078 1
619 . 1 1 70 70 ARG HG2 H 1 2.352 0.021 . 2 . . . . 217 R QG . 11078 1
620 . 1 1 70 70 ARG CA C 13 60.914 0.149 . 1 . . . . 217 R CA . 11078 1
621 . 1 1 70 70 ARG CB C 13 29.807 0.260 . 1 . . . . 217 R CB . 11078 1
622 . 1 1 70 70 ARG CD C 13 43.436 0.062 . 1 . . . . 217 R CD . 11078 1
623 . 1 1 70 70 ARG N N 15 123.651 0.112 . 1 . . . . 217 R N . 11078 1
624 . 1 1 71 71 ARG H H 1 7.372 0.011 . 1 . . . . 218 R HN . 11078 1
625 . 1 1 71 71 ARG HA H 1 5.193 0.013 . 1 . . . . 218 R HA . 11078 1
626 . 1 1 71 71 ARG HG2 H 1 2.439 0.014 . 2 . . . . 218 R HG2 . 11078 1
627 . 1 1 71 71 ARG HG3 H 1 2.066 0.009 . 2 . . . . 218 R HG3 . 11078 1
628 . 1 1 71 71 ARG CA C 13 54.493 0.094 . 1 . . . . 218 R CA . 11078 1
629 . 1 1 71 71 ARG CB C 13 35.404 0.049 . 1 . . . . 218 R CB . 11078 1
630 . 1 1 71 71 ARG N N 15 113.485 0.079 . 1 . . . . 218 R N . 11078 1
631 . 1 1 72 72 MET H H 1 9.191 0.012 . 1 . . . . 219 M HN . 11078 1
632 . 1 1 72 72 MET HA H 1 5.205 0.010 . 1 . . . . 219 M HA . 11078 1
633 . 1 1 72 72 MET HB2 H 1 1.865 0.010 . 2 . . . . 219 M HB2 . 11078 1
634 . 1 1 72 72 MET HB3 H 1 1.546 0.011 . 2 . . . . 219 M HB3 . 11078 1
635 . 1 1 72 72 MET HE1 H 1 1.049 0.007 . 1 . . . . 219 M QE . 11078 1
636 . 1 1 72 72 MET HE2 H 1 1.049 0.007 . 1 . . . . 219 M QE . 11078 1
637 . 1 1 72 72 MET HE3 H 1 1.049 0.007 . 1 . . . . 219 M QE . 11078 1
638 . 1 1 72 72 MET HG2 H 1 2.444 0.000 . 2 . . . . 219 M QG . 11078 1
639 . 1 1 72 72 MET CA C 13 54.415 0.098 . 1 . . . . 219 M CA . 11078 1
640 . 1 1 72 72 MET CB C 13 36.133 0.200 . 1 . . . . 219 M CB . 11078 1
641 . 1 1 72 72 MET CE C 13 15.425 0.032 . 1 . . . . 219 M CE . 11078 1
642 . 1 1 72 72 MET CG C 13 31.445 0.000 . 1 . . . . 219 M CG . 11078 1
643 . 1 1 72 72 MET N N 15 119.856 0.069 . 1 . . . . 219 M N . 11078 1
644 . 1 1 73 73 VAL H H 1 9.291 0.014 . 1 . . . . 220 V HN . 11078 1
645 . 1 1 73 73 VAL HA H 1 4.630 0.006 . 1 . . . . 220 V HA . 11078 1
646 . 1 1 73 73 VAL HB H 1 1.863 0.009 . 1 . . . . 220 V HB . 11078 1
647 . 1 1 73 73 VAL HG11 H 1 0.911 0.007 . 1 . . . . 220 V QG1 . 11078 1
648 . 1 1 73 73 VAL HG12 H 1 0.911 0.007 . 1 . . . . 220 V QG1 . 11078 1
649 . 1 1 73 73 VAL HG13 H 1 0.911 0.007 . 1 . . . . 220 V QG1 . 11078 1
650 . 1 1 73 73 VAL HG21 H 1 0.814 0.004 . 1 . . . . 220 V QG2 . 11078 1
651 . 1 1 73 73 VAL HG22 H 1 0.814 0.004 . 1 . . . . 220 V QG2 . 11078 1
652 . 1 1 73 73 VAL HG23 H 1 0.814 0.004 . 1 . . . . 220 V QG2 . 11078 1
653 . 1 1 73 73 VAL CA C 13 61.057 0.113 . 1 . . . . 220 V CA . 11078 1
654 . 1 1 73 73 VAL CB C 13 33.126 0.166 . 1 . . . . 220 V CB . 11078 1
655 . 1 1 73 73 VAL CG1 C 13 21.555 0.054 . 2 . . . . 220 V CG1 . 11078 1
656 . 1 1 73 73 VAL CG2 C 13 22.625 0.181 . 2 . . . . 220 V CG2 . 11078 1
657 . 1 1 73 73 VAL N N 15 128.968 0.063 . 1 . . . . 220 V N . 11078 1
658 . 1 1 74 74 VAL H H 1 8.715 0.011 . 1 . . . . 221 V HN . 11078 1
659 . 1 1 74 74 VAL HA H 1 4.578 0.015 . 1 . . . . 221 V HA . 11078 1
660 . 1 1 74 74 VAL HB H 1 1.607 0.008 . 1 . . . . 221 V HB . 11078 1
661 . 1 1 74 74 VAL HG11 H 1 0.713 0.009 . 1 . . . . 221 V QG1 . 11078 1
662 . 1 1 74 74 VAL HG12 H 1 0.713 0.009 . 1 . . . . 221 V QG1 . 11078 1
663 . 1 1 74 74 VAL HG13 H 1 0.713 0.009 . 1 . . . . 221 V QG1 . 11078 1
664 . 1 1 74 74 VAL HG21 H 1 0.603 0.010 . 1 . . . . 221 V QG2 . 11078 1
665 . 1 1 74 74 VAL HG22 H 1 0.603 0.010 . 1 . . . . 221 V QG2 . 11078 1
666 . 1 1 74 74 VAL HG23 H 1 0.603 0.010 . 1 . . . . 221 V QG2 . 11078 1
667 . 1 1 74 74 VAL CA C 13 60.806 0.133 . 1 . . . . 221 V CA . 11078 1
668 . 1 1 74 74 VAL CB C 13 34.377 0.148 . 1 . . . . 221 V CB . 11078 1
669 . 1 1 74 74 VAL CG1 C 13 21.615 0.125 . 2 . . . . 221 V CG1 . 11078 1
670 . 1 1 74 74 VAL CG2 C 13 21.926 0.220 . 2 . . . . 221 V CG2 . 11078 1
671 . 1 1 74 74 VAL N N 15 128.293 0.045 . 1 . . . . 221 V N . 11078 1
672 . 1 1 75 75 VAL H H 1 8.092 0.013 . 1 . . . . 222 V HN . 11078 1
673 . 1 1 75 75 VAL HA H 1 4.077 0.007 . 1 . . . . 222 V HA . 11078 1
674 . 1 1 75 75 VAL HB H 1 2.228 0.012 . 1 . . . . 222 V HB . 11078 1
675 . 1 1 75 75 VAL HG11 H 1 0.875 0.007 . 1 . . . . 222 V QG1 . 11078 1
676 . 1 1 75 75 VAL HG12 H 1 0.875 0.007 . 1 . . . . 222 V QG1 . 11078 1
677 . 1 1 75 75 VAL HG13 H 1 0.875 0.007 . 1 . . . . 222 V QG1 . 11078 1
678 . 1 1 75 75 VAL HG21 H 1 0.807 0.003 . 1 . . . . 222 V QG2 . 11078 1
679 . 1 1 75 75 VAL HG22 H 1 0.807 0.003 . 1 . . . . 222 V QG2 . 11078 1
680 . 1 1 75 75 VAL HG23 H 1 0.807 0.003 . 1 . . . . 222 V QG2 . 11078 1
681 . 1 1 75 75 VAL CA C 13 62.937 0.193 . 1 . . . . 222 V CA . 11078 1
682 . 1 1 75 75 VAL CB C 13 30.276 0.141 . 1 . . . . 222 V CB . 11078 1
683 . 1 1 75 75 VAL CG1 C 13 21.778 0.085 . 2 . . . . 222 V CG1 . 11078 1
684 . 1 1 75 75 VAL CG2 C 13 21.415 0.057 . 2 . . . . 222 V CG2 . 11078 1
685 . 1 1 75 75 VAL N N 15 128.490 0.054 . 1 . . . . 222 V N . 11078 1
686 . 1 1 76 76 VAL H H 1 8.637 0.011 . 1 . . . . 223 V HN . 11078 1
687 . 1 1 76 76 VAL HA H 1 3.732 0.010 . 1 . . . . 223 V HA . 11078 1
688 . 1 1 76 76 VAL HB H 1 1.756 0.010 . 1 . . . . 223 V HB . 11078 1
689 . 1 1 76 76 VAL HG11 H 1 0.581 0.008 . 1 . . . . 223 V QG1 . 11078 1
690 . 1 1 76 76 VAL HG12 H 1 0.581 0.008 . 1 . . . . 223 V QG1 . 11078 1
691 . 1 1 76 76 VAL HG13 H 1 0.581 0.008 . 1 . . . . 223 V QG1 . 11078 1
692 . 1 1 76 76 VAL HG21 H 1 0.481 0.009 . 1 . . . . 223 V QG2 . 11078 1
693 . 1 1 76 76 VAL HG22 H 1 0.481 0.009 . 1 . . . . 223 V QG2 . 11078 1
694 . 1 1 76 76 VAL HG23 H 1 0.481 0.009 . 1 . . . . 223 V QG2 . 11078 1
695 . 1 1 76 76 VAL CA C 13 62.517 0.230 . 1 . . . . 223 V CA . 11078 1
696 . 1 1 76 76 VAL CB C 13 32.484 0.117 . 1 . . . . 223 V CB . 11078 1
697 . 1 1 76 76 VAL CG1 C 13 21.403 0.128 . 2 . . . . 223 V CG1 . 11078 1
698 . 1 1 76 76 VAL CG2 C 13 22.472 0.090 . 2 . . . . 223 V CG2 . 11078 1
699 . 1 1 76 76 VAL N N 15 125.312 0.055 . 1 . . . . 223 V N . 11078 1
700 . 1 1 77 77 SER H H 1 7.125 0.013 . 1 . . . . 224 S HN . 11078 1
701 . 1 1 77 77 SER HA H 1 4.414 0.013 . 1 . . . . 224 S HA . 11078 1
702 . 1 1 77 77 SER HB2 H 1 4.127 0.018 . 2 . . . . 224 S QB . 11078 1
703 . 1 1 77 77 SER CA C 13 57.150 0.131 . 1 . . . . 224 S CA . 11078 1
704 . 1 1 77 77 SER CB C 13 65.065 0.138 . 1 . . . . 224 S CB . 11078 1
705 . 1 1 77 77 SER N N 15 117.151 0.052 . 1 . . . . 224 S N . 11078 1
706 . 1 1 78 78 ASP H H 1 9.531 0.015 . 1 . . . . 225 D HN . 11078 1
707 . 1 1 78 78 ASP HA H 1 4.499 0.007 . 1 . . . . 225 D HA . 11078 1
708 . 1 1 78 78 ASP CA C 13 58.692 0.116 . 1 . . . . 225 D CA . 11078 1
709 . 1 1 78 78 ASP CB C 13 39.462 0.082 . 1 . . . . 225 D CB . 11078 1
710 . 1 1 78 78 ASP N N 15 122.945 0.085 . 1 . . . . 225 D N . 11078 1
711 . 1 1 79 79 ASP H H 1 8.455 0.014 . 1 . . . . 226 D HN . 11078 1
712 . 1 1 79 79 ASP HA H 1 4.335 0.011 . 1 . . . . 226 D HA . 11078 1
713 . 1 1 79 79 ASP HB2 H 1 2.625 0.021 . 2 . . . . 226 D HB2 . 11078 1
714 . 1 1 79 79 ASP HB3 H 1 2.453 0.015 . 2 . . . . 226 D HB3 . 11078 1
715 . 1 1 79 79 ASP CA C 13 57.181 0.094 . 1 . . . . 226 D CA . 11078 1
716 . 1 1 79 79 ASP CB C 13 40.607 0.123 . 1 . . . . 226 D CB . 11078 1
717 . 1 1 79 79 ASP N N 15 119.808 0.102 . 1 . . . . 226 D N . 11078 1
718 . 1 1 80 80 TYR H H 1 8.627 0.010 . 1 . . . . 227 Y HN . 11078 1
719 . 1 1 80 80 TYR HA H 1 4.343 0.008 . 1 . . . . 227 Y HA . 11078 1
720 . 1 1 80 80 TYR HB2 H 1 3.735 0.013 . 2 . . . . 227 Y HB2 . 11078 1
721 . 1 1 80 80 TYR HB3 H 1 3.131 0.017 . 2 . . . . 227 Y HB3 . 11078 1
722 . 1 1 80 80 TYR HD1 H 1 7.105 0.010 . 3 . . . . 227 Y QD . 11078 1
723 . 1 1 80 80 TYR HD2 H 1 7.105 0.010 . 3 . . . . 227 Y QD . 11078 1
724 . 1 1 80 80 TYR HE1 H 1 6.801 0.000 . 3 . . . . 227 Y QE . 11078 1
725 . 1 1 80 80 TYR HE2 H 1 6.801 0.000 . 3 . . . . 227 Y QE . 11078 1
726 . 1 1 80 80 TYR CA C 13 61.686 0.126 . 1 . . . . 227 Y CA . 11078 1
727 . 1 1 80 80 TYR CB C 13 38.865 0.129 . 1 . . . . 227 Y CB . 11078 1
728 . 1 1 80 80 TYR CD1 C 13 133.256 0.000 . 3 . . . . 227 Y CD1 . 11078 1
729 . 1 1 80 80 TYR CE1 C 13 117.762 0.000 . 3 . . . . 227 Y CE1 . 11078 1
730 . 1 1 80 80 TYR N N 15 123.460 0.053 . 1 . . . . 227 Y N . 11078 1
731 . 1 1 81 81 LEU H H 1 7.559 0.014 . 1 . . . . 228 L HN . 11078 1
732 . 1 1 81 81 LEU HA H 1 4.192 0.009 . 1 . . . . 228 L HA . 11078 1
733 . 1 1 81 81 LEU HB2 H 1 1.880 0.010 . 2 . . . . 228 L HB2 . 11078 1
734 . 1 1 81 81 LEU HB3 H 1 1.635 0.010 . 2 . . . . 228 L HB3 . 11078 1
735 . 1 1 81 81 LEU HD11 H 1 0.931 0.006 . 1 . . . . 228 L QD1 . 11078 1
736 . 1 1 81 81 LEU HD12 H 1 0.931 0.006 . 1 . . . . 228 L QD1 . 11078 1
737 . 1 1 81 81 LEU HD13 H 1 0.931 0.006 . 1 . . . . 228 L QD1 . 11078 1
738 . 1 1 81 81 LEU HD21 H 1 0.895 0.006 . 1 . . . . 228 L QD2 . 11078 1
739 . 1 1 81 81 LEU HD22 H 1 0.895 0.006 . 1 . . . . 228 L QD2 . 11078 1
740 . 1 1 81 81 LEU HD23 H 1 0.895 0.006 . 1 . . . . 228 L QD2 . 11078 1
741 . 1 1 81 81 LEU HG H 1 2.175 0.012 . 1 . . . . 228 L HG . 11078 1
742 . 1 1 81 81 LEU CA C 13 56.974 0.060 . 1 . . . . 228 L CA . 11078 1
743 . 1 1 81 81 LEU CB C 13 41.043 0.117 . 1 . . . . 228 L CB . 11078 1
744 . 1 1 81 81 LEU CD1 C 13 23.009 0.085 . 2 . . . . 228 L CD1 . 11078 1
745 . 1 1 81 81 LEU CD2 C 13 26.991 0.066 . 2 . . . . 228 L CD2 . 11078 1
746 . 1 1 81 81 LEU CG C 13 27.086 0.091 . 1 . . . . 228 L CG . 11078 1
747 . 1 1 81 81 LEU N N 15 117.119 0.060 . 1 . . . . 228 L N . 11078 1
748 . 1 1 82 82 GLN H H 1 7.134 0.014 . 1 . . . . 229 Q HN . 11078 1
749 . 1 1 82 82 GLN HA H 1 4.651 0.015 . 1 . . . . 229 Q HA . 11078 1
750 . 1 1 82 82 GLN HB2 H 1 2.205 0.006 . 2 . . . . 229 Q HB2 . 11078 1
751 . 1 1 82 82 GLN HB3 H 1 2.034 0.009 . 2 . . . . 229 Q HB3 . 11078 1
752 . 1 1 82 82 GLN HE21 H 1 6.903 0.000 . 2 . . . . 229 Q HE21 . 11078 1
753 . 1 1 82 82 GLN HE22 H 1 7.530 0.001 . 2 . . . . 229 Q HE22 . 11078 1
754 . 1 1 82 82 GLN HG2 H 1 2.355 0.008 . 2 . . . . 229 Q QG . 11078 1
755 . 1 1 82 82 GLN CA C 13 54.475 0.063 . 1 . . . . 229 Q CA . 11078 1
756 . 1 1 82 82 GLN CB C 13 29.748 0.107 . 1 . . . . 229 Q CB . 11078 1
757 . 1 1 82 82 GLN CG C 13 34.046 0.102 . 1 . . . . 229 Q CG . 11078 1
758 . 1 1 82 82 GLN N N 15 114.417 0.067 . 1 . . . . 229 Q N . 11078 1
759 . 1 1 82 82 GLN NE2 N 15 112.140 0.038 . 1 . . . . 229 Q NE2 . 11078 1
760 . 1 1 83 83 SER H H 1 7.762 0.014 . 1 . . . . 230 S HN . 11078 1
761 . 1 1 83 83 SER HA H 1 4.593 0.015 . 1 . . . . 230 S HA . 11078 1
762 . 1 1 83 83 SER HB2 H 1 4.018 0.012 . 2 . . . . 230 S QB . 11078 1
763 . 1 1 83 83 SER CA C 13 58.767 0.167 . 1 . . . . 230 S CA . 11078 1
764 . 1 1 83 83 SER CB C 13 66.992 0.163 . 1 . . . . 230 S CB . 11078 1
765 . 1 1 83 83 SER N N 15 117.045 0.053 . 1 . . . . 230 S N . 11078 1
766 . 1 1 84 84 LYS H H 1 9.134 0.015 . 1 . . . . 231 K HN . 11078 1
767 . 1 1 84 84 LYS HA H 1 4.182 0.011 . 1 . . . . 231 K HA . 11078 1
768 . 1 1 84 84 LYS HB2 H 1 1.853 0.010 . 2 . . . . 231 K HB2 . 11078 1
769 . 1 1 84 84 LYS HB3 H 1 1.802 0.003 . 2 . . . . 231 K HB3 . 11078 1
770 . 1 1 84 84 LYS HD2 H 1 1.671 0.008 . 2 . . . . 231 K QD . 11078 1
771 . 1 1 84 84 LYS HE2 H 1 2.960 0.021 . 2 . . . . 231 K QE . 11078 1
772 . 1 1 84 84 LYS HG2 H 1 1.525 0.010 . 2 . . . . 231 K HG2 . 11078 1
773 . 1 1 84 84 LYS HG3 H 1 1.421 0.008 . 2 . . . . 231 K HG3 . 11078 1
774 . 1 1 84 84 LYS CA C 13 58.367 0.142 . 1 . . . . 231 K CA . 11078 1
775 . 1 1 84 84 LYS CB C 13 31.638 0.116 . 1 . . . . 231 K CB . 11078 1
776 . 1 1 84 84 LYS CD C 13 29.053 0.009 . 1 . . . . 231 K CD . 11078 1
777 . 1 1 84 84 LYS CE C 13 42.082 0.022 . 1 . . . . 231 K CE . 11078 1
778 . 1 1 84 84 LYS CG C 13 24.732 0.118 . 1 . . . . 231 K CG . 11078 1
779 . 1 1 84 84 LYS N N 15 123.139 0.071 . 1 . . . . 231 K N . 11078 1
780 . 1 1 85 85 GLU H H 1 9.367 0.012 . 1 . . . . 232 E HN . 11078 1
781 . 1 1 85 85 GLU HA H 1 3.973 0.019 . 1 . . . . 232 E HA . 11078 1
782 . 1 1 85 85 GLU CA C 13 62.269 0.154 . 1 . . . . 232 E CA . 11078 1
783 . 1 1 85 85 GLU CB C 13 27.242 0.069 . 1 . . . . 232 E CB . 11078 1
784 . 1 1 85 85 GLU CG C 13 38.377 0.000 . 1 . . . . 232 E CG . 11078 1
785 . 1 1 85 85 GLU N N 15 124.392 0.080 . 1 . . . . 232 E N . 11078 1
786 . 1 1 86 86 CYS H H 1 7.512 0.011 . 1 . . . . 233 C HN . 11078 1
787 . 1 1 86 86 CYS HA H 1 4.167 0.011 . 1 . . . . 233 C HA . 11078 1
788 . 1 1 86 86 CYS HB2 H 1 2.533 0.018 . 2 . . . . 233 C QB . 11078 1
789 . 1 1 86 86 CYS CA C 13 60.807 0.116 . 1 . . . . 233 C CA . 11078 1
790 . 1 1 86 86 CYS CB C 13 25.961 0.135 . 1 . . . . 233 C CB . 11078 1
791 . 1 1 86 86 CYS N N 15 120.577 0.065 . 1 . . . . 233 C N . 11078 1
792 . 1 1 87 87 ASP H H 1 7.363 0.013 . 1 . . . . 234 D HN . 11078 1
793 . 1 1 87 87 ASP HA H 1 4.344 0.019 . 1 . . . . 234 D HA . 11078 1
794 . 1 1 87 87 ASP HB2 H 1 2.780 0.009 . 2 . . . . 234 D QB . 11078 1
795 . 1 1 87 87 ASP CA C 13 58.182 0.097 . 1 . . . . 234 D CA . 11078 1
796 . 1 1 87 87 ASP CB C 13 40.692 0.109 . 1 . . . . 234 D CB . 11078 1
797 . 1 1 87 87 ASP N N 15 123.072 0.067 . 1 . . . . 234 D N . 11078 1
798 . 1 1 88 88 PHE H H 1 7.852 0.010 . 1 . . . . 235 F HN . 11078 1
799 . 1 1 88 88 PHE HA H 1 4.189 0.008 . 1 . . . . 235 F HA . 11078 1
800 . 1 1 88 88 PHE HB2 H 1 3.397 0.011 . 2 . . . . 235 F HB2 . 11078 1
801 . 1 1 88 88 PHE HB3 H 1 3.174 0.008 . 2 . . . . 235 F HB3 . 11078 1
802 . 1 1 88 88 PHE CA C 13 61.140 0.082 . 1 . . . . 235 F CA . 11078 1
803 . 1 1 88 88 PHE CB C 13 38.207 0.084 . 1 . . . . 235 F CB . 11078 1
804 . 1 1 88 88 PHE N N 15 119.984 0.059 . 1 . . . . 235 F N . 11078 1
805 . 1 1 89 89 GLN H H 1 8.498 0.011 . 1 . . . . 236 Q HN . 11078 1
806 . 1 1 89 89 GLN HA H 1 4.221 0.018 . 1 . . . . 236 Q HA . 11078 1
807 . 1 1 89 89 GLN HB2 H 1 2.881 0.014 . 2 . . . . 236 Q HB2 . 11078 1
808 . 1 1 89 89 GLN HB3 H 1 2.373 0.003 . 2 . . . . 236 Q HB3 . 11078 1
809 . 1 1 89 89 GLN HE21 H 1 5.938 0.004 . 2 . . . . 236 Q HE21 . 11078 1
810 . 1 1 89 89 GLN HE22 H 1 6.341 0.005 . 2 . . . . 236 Q HE22 . 11078 1
811 . 1 1 89 89 GLN HG3 H 1 2.327 0.000 . 2 . . . . 236 Q HG3 . 11078 1
812 . 1 1 89 89 GLN CA C 13 59.477 0.228 . 1 . . . . 236 Q CA . 11078 1
813 . 1 1 89 89 GLN CB C 13 29.308 0.162 . 1 . . . . 236 Q CB . 11078 1
814 . 1 1 89 89 GLN CG C 13 33.673 0.000 . 1 . . . . 236 Q CG . 11078 1
815 . 1 1 89 89 GLN N N 15 121.890 0.096 . 1 . . . . 236 Q N . 11078 1
816 . 1 1 89 89 GLN NE2 N 15 106.678 0.087 . 1 . . . . 236 Q NE2 . 11078 1
817 . 1 1 90 90 THR H H 1 8.937 0.014 . 1 . . . . 237 T HN . 11078 1
818 . 1 1 90 90 THR HA H 1 3.637 0.007 . 1 . . . . 237 T HA . 11078 1
819 . 1 1 90 90 THR HB H 1 4.386 0.007 . 1 . . . . 237 T HB . 11078 1
820 . 1 1 90 90 THR HG21 H 1 1.170 0.008 . 1 . . . . 237 T QG2 . 11078 1
821 . 1 1 90 90 THR HG22 H 1 1.170 0.008 . 1 . . . . 237 T QG2 . 11078 1
822 . 1 1 90 90 THR HG23 H 1 1.170 0.008 . 1 . . . . 237 T QG2 . 11078 1
823 . 1 1 90 90 THR CA C 13 67.742 0.070 . 1 . . . . 237 T CA . 11078 1
824 . 1 1 90 90 THR CB C 13 68.758 0.244 . 1 . . . . 237 T CB . 11078 1
825 . 1 1 90 90 THR CG2 C 13 20.913 0.084 . 1 . . . . 237 T CG2 . 11078 1
826 . 1 1 90 90 THR N N 15 121.200 0.084 . 1 . . . . 237 T N . 11078 1
827 . 1 1 91 91 LYS H H 1 7.678 0.015 . 1 . . . . 238 K HN . 11078 1
828 . 1 1 91 91 LYS HA H 1 3.810 0.008 . 1 . . . . 238 K HA . 11078 1
829 . 1 1 91 91 LYS HB2 H 1 1.769 0.009 . 2 . . . . 238 K QB . 11078 1
830 . 1 1 91 91 LYS HE2 H 1 2.907 0.007 . 2 . . . . 238 K QE . 11078 1
831 . 1 1 91 91 LYS HG2 H 1 1.477 0.008 . 2 . . . . 238 K HG2 . 11078 1
832 . 1 1 91 91 LYS HG3 H 1 1.317 0.012 . 2 . . . . 238 K HG3 . 11078 1
833 . 1 1 91 91 LYS CA C 13 60.138 0.102 . 1 . . . . 238 K CA . 11078 1
834 . 1 1 91 91 LYS CB C 13 31.956 0.105 . 1 . . . . 238 K CB . 11078 1
835 . 1 1 91 91 LYS CD C 13 29.078 0.099 . 1 . . . . 238 K CD . 11078 1
836 . 1 1 91 91 LYS CE C 13 42.051 0.089 . 1 . . . . 238 K CE . 11078 1
837 . 1 1 91 91 LYS CG C 13 25.674 0.056 . 1 . . . . 238 K CG . 11078 1
838 . 1 1 91 91 LYS N N 15 121.818 0.056 . 1 . . . . 238 K N . 11078 1
839 . 1 1 92 92 PHE H H 1 8.257 0.014 . 1 . . . . 239 F HN . 11078 1
840 . 1 1 92 92 PHE HA H 1 3.884 0.010 . 1 . . . . 239 F HA . 11078 1
841 . 1 1 92 92 PHE HB2 H 1 2.901 0.010 . 2 . . . . 239 F HB2 . 11078 1
842 . 1 1 92 92 PHE HB3 H 1 2.462 0.009 . 2 . . . . 239 F HB3 . 11078 1
843 . 1 1 92 92 PHE HD1 H 1 6.997 0.002 . 3 . . . . 239 F QD . 11078 1
844 . 1 1 92 92 PHE HD2 H 1 6.997 0.002 . 3 . . . . 239 F QD . 11078 1
845 . 1 1 92 92 PHE CA C 13 60.566 0.082 . 1 . . . . 239 F CA . 11078 1
846 . 1 1 92 92 PHE CB C 13 38.684 0.086 . 1 . . . . 239 F CB . 11078 1
847 . 1 1 92 92 PHE N N 15 120.545 0.062 . 1 . . . . 239 F N . 11078 1
848 . 1 1 93 93 ALA H H 1 8.535 0.011 . 1 . . . . 240 A HN . 11078 1
849 . 1 1 93 93 ALA HA H 1 3.762 0.009 . 1 . . . . 240 A HA . 11078 1
850 . 1 1 93 93 ALA HB1 H 1 1.425 0.008 . 1 . . . . 240 A QB . 11078 1
851 . 1 1 93 93 ALA HB2 H 1 1.425 0.008 . 1 . . . . 240 A QB . 11078 1
852 . 1 1 93 93 ALA HB3 H 1 1.425 0.008 . 1 . . . . 240 A QB . 11078 1
853 . 1 1 93 93 ALA CA C 13 54.829 0.092 . 1 . . . . 240 A CA . 11078 1
854 . 1 1 93 93 ALA CB C 13 18.929 0.117 . 1 . . . . 240 A CB . 11078 1
855 . 1 1 93 93 ALA N N 15 121.575 0.058 . 1 . . . . 240 A N . 11078 1
856 . 1 1 94 94 LEU H H 1 8.209 0.012 . 1 . . . . 241 L HN . 11078 1
857 . 1 1 94 94 LEU HA H 1 4.149 0.008 . 1 . . . . 241 L HA . 11078 1
858 . 1 1 94 94 LEU HB2 H 1 1.775 0.006 . 2 . . . . 241 L HB2 . 11078 1
859 . 1 1 94 94 LEU HB3 H 1 1.492 0.011 . 2 . . . . 241 L HB3 . 11078 1
860 . 1 1 94 94 LEU HD11 H 1 0.834 0.014 . 1 . . . . 241 L QD1 . 11078 1
861 . 1 1 94 94 LEU HD12 H 1 0.834 0.014 . 1 . . . . 241 L QD1 . 11078 1
862 . 1 1 94 94 LEU HD13 H 1 0.834 0.014 . 1 . . . . 241 L QD1 . 11078 1
863 . 1 1 94 94 LEU HD21 H 1 0.801 0.007 . 1 . . . . 241 L QD2 . 11078 1
864 . 1 1 94 94 LEU HD22 H 1 0.801 0.007 . 1 . . . . 241 L QD2 . 11078 1
865 . 1 1 94 94 LEU HD23 H 1 0.801 0.007 . 1 . . . . 241 L QD2 . 11078 1
866 . 1 1 94 94 LEU HG H 1 1.766 0.007 . 1 . . . . 241 L HG . 11078 1
867 . 1 1 94 94 LEU CA C 13 56.929 0.106 . 1 . . . . 241 L CA . 11078 1
868 . 1 1 94 94 LEU CB C 13 41.945 0.048 . 1 . . . . 241 L CB . 11078 1
869 . 1 1 94 94 LEU CD1 C 13 22.809 0.045 . 2 . . . . 241 L CD1 . 11078 1
870 . 1 1 94 94 LEU CD2 C 13 25.419 0.080 . 2 . . . . 241 L CD2 . 11078 1
871 . 1 1 94 94 LEU CG C 13 26.824 0.146 . 1 . . . . 241 L CG . 11078 1
872 . 1 1 94 94 LEU N N 15 117.702 0.052 . 1 . . . . 241 L N . 11078 1
873 . 1 1 95 95 SER H H 1 7.436 0.015 . 1 . . . . 242 S HN . 11078 1
874 . 1 1 95 95 SER HA H 1 4.327 0.006 . 1 . . . . 242 S HA . 11078 1
875 . 1 1 95 95 SER CA C 13 59.172 0.073 . 1 . . . . 242 S CA . 11078 1
876 . 1 1 95 95 SER CB C 13 63.887 0.113 . 1 . . . . 242 S CB . 11078 1
877 . 1 1 95 95 SER N N 15 113.629 0.056 . 1 . . . . 242 S N . 11078 1
878 . 1 1 96 96 LEU H H 1 7.032 0.013 . 1 . . . . 243 L HN . 11078 1
879 . 1 1 96 96 LEU HA H 1 4.213 0.006 . 1 . . . . 243 L HA . 11078 1
880 . 1 1 96 96 LEU HB2 H 1 1.566 0.011 . 2 . . . . 243 L HB2 . 11078 1
881 . 1 1 96 96 LEU HB3 H 1 1.254 0.013 . 2 . . . . 243 L HB3 . 11078 1
882 . 1 1 96 96 LEU HD11 H 1 0.525 0.006 . 1 . . . . 243 L QD1 . 11078 1
883 . 1 1 96 96 LEU HD12 H 1 0.525 0.006 . 1 . . . . 243 L QD1 . 11078 1
884 . 1 1 96 96 LEU HD13 H 1 0.525 0.006 . 1 . . . . 243 L QD1 . 11078 1
885 . 1 1 96 96 LEU HD21 H 1 0.403 0.007 . 1 . . . . 243 L QD2 . 11078 1
886 . 1 1 96 96 LEU HD22 H 1 0.403 0.007 . 1 . . . . 243 L QD2 . 11078 1
887 . 1 1 96 96 LEU HD23 H 1 0.403 0.007 . 1 . . . . 243 L QD2 . 11078 1
888 . 1 1 96 96 LEU HG H 1 1.609 0.005 . 1 . . . . 243 L HG . 11078 1
889 . 1 1 96 96 LEU CA C 13 53.848 0.153 . 1 . . . . 243 L CA . 11078 1
890 . 1 1 96 96 LEU CB C 13 42.373 0.063 . 1 . . . . 243 L CB . 11078 1
891 . 1 1 96 96 LEU CD1 C 13 25.791 0.075 . 2 . . . . 243 L CD1 . 11078 1
892 . 1 1 96 96 LEU CD2 C 13 21.883 0.043 . 2 . . . . 243 L CD2 . 11078 1
893 . 1 1 96 96 LEU CG C 13 25.580 0.033 . 1 . . . . 243 L CG . 11078 1
894 . 1 1 96 96 LEU N N 15 121.432 0.050 . 1 . . . . 243 L N . 11078 1
895 . 1 1 97 97 SER H H 1 8.375 0.013 . 1 . . . . 244 S HN . 11078 1
896 . 1 1 97 97 SER HA H 1 4.546 0.007 . 1 . . . . 244 S HA . 11078 1
897 . 1 1 97 97 SER HB2 H 1 3.880 0.007 . 2 . . . . 244 S QB . 11078 1
898 . 1 1 97 97 SER CA C 13 57.304 0.097 . 1 . . . . 244 S CA . 11078 1
899 . 1 1 97 97 SER CB C 13 62.404 0.163 . 1 . . . . 244 S CB . 11078 1
900 . 1 1 97 97 SER N N 15 118.023 0.073 . 1 . . . . 244 S N . 11078 1
901 . 1 1 98 98 PRO HA H 1 4.160 0.008 . 1 . . . . 245 P HA . 11078 1
902 . 1 1 98 98 PRO HB2 H 1 2.266 0.016 . 2 . . . . 245 P HB2 . 11078 1
903 . 1 1 98 98 PRO HB3 H 1 1.854 0.009 . 2 . . . . 245 P HB3 . 11078 1
904 . 1 1 98 98 PRO HD2 H 1 3.844 0.013 . 2 . . . . 245 P HD2 . 11078 1
905 . 1 1 98 98 PRO HD3 H 1 3.603 0.014 . 2 . . . . 245 P HD3 . 11078 1
906 . 1 1 98 98 PRO HG2 H 1 1.983 0.016 . 2 . . . . 245 P QG . 11078 1
907 . 1 1 98 98 PRO CA C 13 65.231 0.095 . 1 . . . . 245 P CA . 11078 1
908 . 1 1 98 98 PRO CB C 13 31.926 0.132 . 1 . . . . 245 P CB . 11078 1
909 . 1 1 98 98 PRO CD C 13 50.370 0.073 . 1 . . . . 245 P CD . 11078 1
910 . 1 1 98 98 PRO CG C 13 27.504 0.040 . 1 . . . . 245 P CG . 11078 1
911 . 1 1 99 99 GLY H H 1 9.014 0.010 . 1 . . . . 246 G HN . 11078 1
912 . 1 1 99 99 GLY HA2 H 1 4.127 0.010 . 2 . . . . 246 G HA2 . 11078 1
913 . 1 1 99 99 GLY HA3 H 1 3.832 0.016 . 2 . . . . 246 G HA3 . 11078 1
914 . 1 1 99 99 GLY CA C 13 45.810 0.089 . 1 . . . . 246 G CA . 11078 1
915 . 1 1 99 99 GLY N N 15 111.102 0.101 . 1 . . . . 246 G N . 11078 1
916 . 1 1 100 100 ALA H H 1 8.261 0.014 . 1 . . . . 247 A HN . 11078 1
917 . 1 1 100 100 ALA HA H 1 4.321 0.008 . 1 . . . . 247 A HA . 11078 1
918 . 1 1 100 100 ALA HB1 H 1 1.453 0.007 . 1 . . . . 247 A QB . 11078 1
919 . 1 1 100 100 ALA HB2 H 1 1.453 0.007 . 1 . . . . 247 A QB . 11078 1
920 . 1 1 100 100 ALA HB3 H 1 1.453 0.007 . 1 . . . . 247 A QB . 11078 1
921 . 1 1 100 100 ALA CA C 13 53.741 0.080 . 1 . . . . 247 A CA . 11078 1
922 . 1 1 100 100 ALA CB C 13 19.961 0.158 . 1 . . . . 247 A CB . 11078 1
923 . 1 1 100 100 ALA N N 15 122.695 0.037 . 1 . . . . 247 A N . 11078 1
924 . 1 1 101 101 HIS H H 1 8.616 0.017 . 1 . . . . 248 H HN . 11078 1
925 . 1 1 101 101 HIS HA H 1 4.004 0.008 . 1 . . . . 248 H HA . 11078 1
926 . 1 1 101 101 HIS HB2 H 1 3.157 0.010 . 2 . . . . 248 H QB . 11078 1
927 . 1 1 101 101 HIS CA C 13 60.517 0.108 . 1 . . . . 248 H CA . 11078 1
928 . 1 1 101 101 HIS CB C 13 30.048 0.163 . 1 . . . . 248 H CB . 11078 1
929 . 1 1 101 101 HIS N N 15 118.682 0.085 . 1 . . . . 248 H N . 11078 1
930 . 1 1 102 102 GLN H H 1 8.091 0.010 . 1 . . . . 249 Q HN . 11078 1
931 . 1 1 102 102 GLN HA H 1 4.086 0.011 . 1 . . . . 249 Q HA . 11078 1
932 . 1 1 102 102 GLN HB2 H 1 2.117 0.007 . 2 . . . . 249 Q QB . 11078 1
933 . 1 1 102 102 GLN HE21 H 1 6.993 0.004 . 2 . . . . 249 Q HE21 . 11078 1
934 . 1 1 102 102 GLN HE22 H 1 7.574 0.000 . 2 . . . . 249 Q HE22 . 11078 1
935 . 1 1 102 102 GLN HG2 H 1 2.414 0.010 . 2 . . . . 249 Q HG2 . 11078 1
936 . 1 1 102 102 GLN HG3 H 1 2.322 0.011 . 2 . . . . 249 Q HG3 . 11078 1
937 . 1 1 102 102 GLN CA C 13 57.889 0.098 . 1 . . . . 249 Q CA . 11078 1
938 . 1 1 102 102 GLN CB C 13 28.413 0.095 . 1 . . . . 249 Q CB . 11078 1
939 . 1 1 102 102 GLN CG C 13 34.159 0.054 . 1 . . . . 249 Q CG . 11078 1
940 . 1 1 102 102 GLN N N 15 114.346 0.047 . 1 . . . . 249 Q N . 11078 1
941 . 1 1 102 102 GLN NE2 N 15 112.130 0.085 . 1 . . . . 249 Q NE2 . 11078 1
942 . 1 1 103 103 LYS H H 1 7.375 0.020 . 1 . . . . 250 K HN . 11078 1
943 . 1 1 103 103 LYS HA H 1 4.429 0.011 . 1 . . . . 250 K HA . 11078 1
944 . 1 1 103 103 LYS HB2 H 1 1.991 0.012 . 2 . . . . 250 K HB2 . 11078 1
945 . 1 1 103 103 LYS HB3 H 1 1.911 0.022 . 2 . . . . 250 K HB3 . 11078 1
946 . 1 1 103 103 LYS HD2 H 1 1.666 0.006 . 2 . . . . 250 K QD . 11078 1
947 . 1 1 103 103 LYS HE2 H 1 2.951 0.006 . 2 . . . . 250 K QE . 11078 1
948 . 1 1 103 103 LYS HG2 H 1 1.543 0.010 . 2 . . . . 250 K HG2 . 11078 1
949 . 1 1 103 103 LYS HG3 H 1 1.427 0.009 . 2 . . . . 250 K HG3 . 11078 1
950 . 1 1 103 103 LYS CA C 13 57.254 0.053 . 1 . . . . 250 K CA . 11078 1
951 . 1 1 103 103 LYS CB C 13 33.694 0.058 . 1 . . . . 250 K CB . 11078 1
952 . 1 1 103 103 LYS CD C 13 29.059 0.025 . 1 . . . . 250 K CD . 11078 1
953 . 1 1 103 103 LYS CE C 13 42.029 0.061 . 1 . . . . 250 K CE . 11078 1
954 . 1 1 103 103 LYS CG C 13 25.296 0.091 . 1 . . . . 250 K CG . 11078 1
955 . 1 1 103 103 LYS N N 15 116.054 0.043 . 1 . . . . 250 K N . 11078 1
956 . 1 1 104 104 ARG H H 1 7.924 0.012 . 1 . . . . 251 R HN . 11078 1
957 . 1 1 104 104 ARG HA H 1 4.676 0.009 . 1 . . . . 251 R HA . 11078 1
958 . 1 1 104 104 ARG HB2 H 1 2.368 0.008 . 2 . . . . 251 R QB . 11078 1
959 . 1 1 104 104 ARG HD2 H 1 3.065 0.014 . 2 . . . . 251 R QD . 11078 1
960 . 1 1 104 104 ARG HG2 H 1 2.094 0.012 . 2 . . . . 251 R HG2 . 11078 1
961 . 1 1 104 104 ARG HG3 H 1 1.647 0.006 . 2 . . . . 251 R HG3 . 11078 1
962 . 1 1 104 104 ARG CA C 13 56.927 0.063 . 1 . . . . 251 R CA . 11078 1
963 . 1 1 104 104 ARG CB C 13 32.221 0.057 . 1 . . . . 251 R CB . 11078 1
964 . 1 1 104 104 ARG CD C 13 43.412 0.002 . 1 . . . . 251 R CD . 11078 1
965 . 1 1 104 104 ARG N N 15 113.656 0.084 . 1 . . . . 251 R N . 11078 1
966 . 1 1 105 105 LEU H H 1 7.732 0.012 . 1 . . . . 252 L HN . 11078 1
967 . 1 1 105 105 LEU HA H 1 5.361 0.010 . 1 . . . . 252 L HA . 11078 1
968 . 1 1 105 105 LEU HB2 H 1 2.107 0.009 . 2 . . . . 252 L HB2 . 11078 1
969 . 1 1 105 105 LEU HB3 H 1 1.060 0.007 . 2 . . . . 252 L HB3 . 11078 1
970 . 1 1 105 105 LEU HD11 H 1 0.959 0.009 . 1 . . . . 252 L QD1 . 11078 1
971 . 1 1 105 105 LEU HD12 H 1 0.959 0.009 . 1 . . . . 252 L QD1 . 11078 1
972 . 1 1 105 105 LEU HD13 H 1 0.959 0.009 . 1 . . . . 252 L QD1 . 11078 1
973 . 1 1 105 105 LEU HD21 H 1 0.883 0.008 . 1 . . . . 252 L QD2 . 11078 1
974 . 1 1 105 105 LEU HD22 H 1 0.883 0.008 . 1 . . . . 252 L QD2 . 11078 1
975 . 1 1 105 105 LEU HD23 H 1 0.883 0.008 . 1 . . . . 252 L QD2 . 11078 1
976 . 1 1 105 105 LEU HG H 1 1.778 0.030 . 1 . . . . 252 L HG . 11078 1
977 . 1 1 105 105 LEU CA C 13 54.046 0.120 . 1 . . . . 252 L CA . 11078 1
978 . 1 1 105 105 LEU CB C 13 44.569 0.061 . 1 . . . . 252 L CB . 11078 1
979 . 1 1 105 105 LEU CD1 C 13 25.292 0.070 . 2 . . . . 252 L CD1 . 11078 1
980 . 1 1 105 105 LEU CD2 C 13 25.897 0.088 . 2 . . . . 252 L CD2 . 11078 1
981 . 1 1 105 105 LEU CG C 13 27.840 0.052 . 1 . . . . 252 L CG . 11078 1
982 . 1 1 105 105 LEU N N 15 118.532 0.085 . 1 . . . . 252 L N . 11078 1
983 . 1 1 106 106 ILE H H 1 8.690 0.011 . 1 . . . . 253 I HN . 11078 1
984 . 1 1 106 106 ILE HA H 1 4.642 0.009 . 1 . . . . 253 I HA . 11078 1
985 . 1 1 106 106 ILE HB H 1 1.820 0.002 . 1 . . . . 253 I HB . 11078 1
986 . 1 1 106 106 ILE HD11 H 1 0.652 0.009 . 1 . . . . 253 I QD1 . 11078 1
987 . 1 1 106 106 ILE HD12 H 1 0.652 0.009 . 1 . . . . 253 I QD1 . 11078 1
988 . 1 1 106 106 ILE HD13 H 1 0.652 0.009 . 1 . . . . 253 I QD1 . 11078 1
989 . 1 1 106 106 ILE HG12 H 1 1.237 0.009 . 2 . . . . 253 I HG12 . 11078 1
990 . 1 1 106 106 ILE HG13 H 1 1.063 0.008 . 2 . . . . 253 I HG13 . 11078 1
991 . 1 1 106 106 ILE HG21 H 1 0.785 0.013 . 1 . . . . 253 I QG2 . 11078 1
992 . 1 1 106 106 ILE HG22 H 1 0.785 0.013 . 1 . . . . 253 I QG2 . 11078 1
993 . 1 1 106 106 ILE HG23 H 1 0.785 0.013 . 1 . . . . 253 I QG2 . 11078 1
994 . 1 1 106 106 ILE CA C 13 57.879 0.109 . 1 . . . . 253 I CA . 11078 1
995 . 1 1 106 106 ILE CB C 13 44.567 0.000 . 1 . . . . 253 I CB . 11078 1
996 . 1 1 106 106 ILE CD1 C 13 12.944 0.045 . 1 . . . . 253 I CD1 . 11078 1
997 . 1 1 106 106 ILE CG1 C 13 26.672 0.053 . 1 . . . . 253 I CG1 . 11078 1
998 . 1 1 106 106 ILE CG2 C 13 17.171 0.075 . 1 . . . . 253 I CG2 . 11078 1
999 . 1 1 106 106 ILE N N 15 120.717 0.089 . 1 . . . . 253 I N . 11078 1
1000 . 1 1 107 107 PRO HA H 1 5.375 0.008 . 1 . . . . 254 P HA . 11078 1
1001 . 1 1 107 107 PRO HB2 H 1 1.987 0.014 . 2 . . . . 254 P QB . 11078 1
1002 . 1 1 107 107 PRO HD2 H 1 4.166 0.009 . 2 . . . . 254 P HD2 . 11078 1
1003 . 1 1 107 107 PRO HD3 H 1 3.698 0.013 . 2 . . . . 254 P HD3 . 11078 1
1004 . 1 1 107 107 PRO HG2 H 1 2.261 0.012 . 2 . . . . 254 P HG2 . 11078 1
1005 . 1 1 107 107 PRO HG3 H 1 1.675 0.016 . 2 . . . . 254 P HG3 . 11078 1
1006 . 1 1 107 107 PRO CA C 13 60.887 0.114 . 1 . . . . 254 P CA . 11078 1
1007 . 1 1 107 107 PRO CB C 13 32.316 0.090 . 1 . . . . 254 P CB . 11078 1
1008 . 1 1 107 107 PRO CD C 13 50.969 0.052 . 1 . . . . 254 P CD . 11078 1
1009 . 1 1 107 107 PRO CG C 13 27.867 0.118 . 1 . . . . 254 P CG . 11078 1
1010 . 1 1 108 108 ILE H H 1 9.429 0.010 . 1 . . . . 255 I HN . 11078 1
1011 . 1 1 108 108 ILE HA H 1 5.161 0.022 . 1 . . . . 255 I HA . 11078 1
1012 . 1 1 108 108 ILE HB H 1 1.784 0.010 . 1 . . . . 255 I HB . 11078 1
1013 . 1 1 108 108 ILE HD11 H 1 0.981 0.011 . 1 . . . . 255 I QD1 . 11078 1
1014 . 1 1 108 108 ILE HD12 H 1 0.981 0.011 . 1 . . . . 255 I QD1 . 11078 1
1015 . 1 1 108 108 ILE HD13 H 1 0.981 0.011 . 1 . . . . 255 I QD1 . 11078 1
1016 . 1 1 108 108 ILE HG12 H 1 1.726 0.009 . 2 . . . . 255 I HG12 . 11078 1
1017 . 1 1 108 108 ILE HG13 H 1 1.196 0.008 . 2 . . . . 255 I HG13 . 11078 1
1018 . 1 1 108 108 ILE HG21 H 1 1.026 0.008 . 1 . . . . 255 I QG2 . 11078 1
1019 . 1 1 108 108 ILE HG22 H 1 1.026 0.008 . 1 . . . . 255 I QG2 . 11078 1
1020 . 1 1 108 108 ILE HG23 H 1 1.026 0.008 . 1 . . . . 255 I QG2 . 11078 1
1021 . 1 1 108 108 ILE CA C 13 59.583 0.141 . 1 . . . . 255 I CA . 11078 1
1022 . 1 1 108 108 ILE CB C 13 41.757 0.145 . 1 . . . . 255 I CB . 11078 1
1023 . 1 1 108 108 ILE CD1 C 13 15.663 0.074 . 1 . . . . 255 I CD1 . 11078 1
1024 . 1 1 108 108 ILE CG1 C 13 27.635 0.078 . 1 . . . . 255 I CG1 . 11078 1
1025 . 1 1 108 108 ILE CG2 C 13 17.339 0.062 . 1 . . . . 255 I CG2 . 11078 1
1026 . 1 1 108 108 ILE N N 15 123.823 0.042 . 1 . . . . 255 I N . 11078 1
1027 . 1 1 109 109 LYS H H 1 8.178 0.015 . 1 . . . . 256 K HN . 11078 1
1028 . 1 1 109 109 LYS HA H 1 4.836 0.010 . 1 . . . . 256 K HA . 11078 1
1029 . 1 1 109 109 LYS HB2 H 1 1.654 0.020 . 2 . . . . 256 K QB . 11078 1
1030 . 1 1 109 109 LYS HD2 H 1 1.581 0.012 . 2 . . . . 256 K HD2 . 11078 1
1031 . 1 1 109 109 LYS HD3 H 1 1.454 0.002 . 2 . . . . 256 K HD3 . 11078 1
1032 . 1 1 109 109 LYS HG2 H 1 1.512 0.006 . 2 . . . . 256 K HG2 . 11078 1
1033 . 1 1 109 109 LYS HG3 H 1 1.117 0.008 . 2 . . . . 256 K HG3 . 11078 1
1034 . 1 1 109 109 LYS CA C 13 54.599 0.085 . 1 . . . . 256 K CA . 11078 1
1035 . 1 1 109 109 LYS CB C 13 37.107 0.160 . 1 . . . . 256 K CB . 11078 1
1036 . 1 1 109 109 LYS CD C 13 30.341 0.045 . 1 . . . . 256 K CD . 11078 1
1037 . 1 1 109 109 LYS CE C 13 42.063 0.021 . 1 . . . . 256 K CE . 11078 1
1038 . 1 1 109 109 LYS CG C 13 25.905 0.094 . 1 . . . . 256 K CG . 11078 1
1039 . 1 1 109 109 LYS N N 15 126.508 0.080 . 1 . . . . 256 K N . 11078 1
1040 . 1 1 110 110 TYR H H 1 8.742 0.011 . 1 . . . . 257 Y HN . 11078 1
1041 . 1 1 110 110 TYR HA H 1 4.825 0.032 . 1 . . . . 257 Y HA . 11078 1
1042 . 1 1 110 110 TYR HB2 H 1 2.441 0.010 . 2 . . . . 257 Y HB2 . 11078 1
1043 . 1 1 110 110 TYR HB3 H 1 1.332 0.011 . 2 . . . . 257 Y HB3 . 11078 1
1044 . 1 1 110 110 TYR HE1 H 1 6.480 0.013 . 3 . . . . 257 Y QE . 11078 1
1045 . 1 1 110 110 TYR HE2 H 1 6.480 0.013 . 3 . . . . 257 Y QE . 11078 1
1046 . 1 1 110 110 TYR CA C 13 56.416 0.102 . 1 . . . . 257 Y CA . 11078 1
1047 . 1 1 110 110 TYR CB C 13 40.879 0.179 . 1 . . . . 257 Y CB . 11078 1
1048 . 1 1 110 110 TYR CE1 C 13 117.309 0.000 . 3 . . . . 257 Y CE1 . 11078 1
1049 . 1 1 110 110 TYR N N 15 123.265 0.083 . 1 . . . . 257 Y N . 11078 1
1050 . 1 1 111 111 LYS H H 1 7.512 0.014 . 1 . . . . 258 K HN . 11078 1
1051 . 1 1 111 111 LYS HA H 1 4.218 0.008 . 1 . . . . 258 K HA . 11078 1
1052 . 1 1 111 111 LYS HB2 H 1 1.430 0.005 . 2 . . . . 258 K HB2 . 11078 1
1053 . 1 1 111 111 LYS HB3 H 1 1.293 0.009 . 2 . . . . 258 K HB3 . 11078 1
1054 . 1 1 111 111 LYS HD2 H 1 1.412 0.006 . 2 . . . . 258 K HD2 . 11078 1
1055 . 1 1 111 111 LYS HD3 H 1 1.293 0.006 . 2 . . . . 258 K HD3 . 11078 1
1056 . 1 1 111 111 LYS HE2 H 1 2.849 0.009 . 2 . . . . 258 K HE2 . 11078 1
1057 . 1 1 111 111 LYS HE3 H 1 2.674 0.023 . 2 . . . . 258 K HE3 . 11078 1
1058 . 1 1 111 111 LYS HG2 H 1 0.054 0.016 . 2 . . . . 258 K HG2 . 11078 1
1059 . 1 1 111 111 LYS HG3 H 1 0.674 0.024 . 2 . . . . 258 K HG3 . 11078 1
1060 . 1 1 111 111 LYS CA C 13 54.243 0.133 . 1 . . . . 258 K CA . 11078 1
1061 . 1 1 111 111 LYS CB C 13 34.928 0.138 . 1 . . . . 258 K CB . 11078 1
1062 . 1 1 111 111 LYS CD C 13 30.378 0.143 . 1 . . . . 258 K CD . 11078 1
1063 . 1 1 111 111 LYS CE C 13 38.945 0.064 . 1 . . . . 258 K CE . 11078 1
1064 . 1 1 111 111 LYS CG C 13 21.732 0.241 . 1 . . . . 258 K CG . 11078 1
1065 . 1 1 111 111 LYS N N 15 120.397 0.092 . 1 . . . . 258 K N . 11078 1
1066 . 1 1 112 112 ALA H H 1 8.055 0.013 . 1 . . . . 259 A HN . 11078 1
1067 . 1 1 112 112 ALA HA H 1 3.961 0.006 . 1 . . . . 259 A HA . 11078 1
1068 . 1 1 112 112 ALA HB1 H 1 1.242 0.008 . 1 . . . . 259 A QB . 11078 1
1069 . 1 1 112 112 ALA HB2 H 1 1.242 0.008 . 1 . . . . 259 A QB . 11078 1
1070 . 1 1 112 112 ALA HB3 H 1 1.242 0.008 . 1 . . . . 259 A QB . 11078 1
1071 . 1 1 112 112 ALA CA C 13 52.943 0.069 . 1 . . . . 259 A CA . 11078 1
1072 . 1 1 112 112 ALA CB C 13 18.801 0.113 . 1 . . . . 259 A CB . 11078 1
1073 . 1 1 112 112 ALA N N 15 120.108 0.057 . 1 . . . . 259 A N . 11078 1
1074 . 1 1 113 113 MET H H 1 8.426 0.013 . 1 . . . . 260 M HN . 11078 1
1075 . 1 1 113 113 MET HA H 1 4.465 0.015 . 1 . . . . 260 M HA . 11078 1
1076 . 1 1 113 113 MET HB2 H 1 1.516 0.007 . 2 . . . . 260 M QB . 11078 1
1077 . 1 1 113 113 MET HE1 H 1 1.819 0.006 . 1 . . . . 260 M QE . 11078 1
1078 . 1 1 113 113 MET HE2 H 1 1.819 0.006 . 1 . . . . 260 M QE . 11078 1
1079 . 1 1 113 113 MET HE3 H 1 1.819 0.006 . 1 . . . . 260 M QE . 11078 1
1080 . 1 1 113 113 MET HG2 H 1 2.730 0.006 . 2 . . . . 260 M HG2 . 11078 1
1081 . 1 1 113 113 MET HG3 H 1 2.380 0.003 . 2 . . . . 260 M HG3 . 11078 1
1082 . 1 1 113 113 MET CA C 13 55.070 0.169 . 1 . . . . 260 M CA . 11078 1
1083 . 1 1 113 113 MET CB C 13 38.354 0.095 . 1 . . . . 260 M CB . 11078 1
1084 . 1 1 113 113 MET CE C 13 15.568 0.037 . 1 . . . . 260 M CE . 11078 1
1085 . 1 1 113 113 MET N N 15 120.703 0.062 . 1 . . . . 260 M N . 11078 1
1086 . 1 1 114 114 LYS H H 1 11.487 0.012 . 1 . . . . 261 K HN . 11078 1
1087 . 1 1 114 114 LYS HA H 1 4.298 0.006 . 1 . . . . 261 K HA . 11078 1
1088 . 1 1 114 114 LYS HB2 H 1 1.807 0.007 . 2 . . . . 261 K HB2 . 11078 1
1089 . 1 1 114 114 LYS HB3 H 1 1.676 0.006 . 2 . . . . 261 K HB3 . 11078 1
1090 . 1 1 114 114 LYS HD2 H 1 1.603 0.006 . 2 . . . . 261 K QD . 11078 1
1091 . 1 1 114 114 LYS HE2 H 1 2.925 0.008 . 2 . . . . 261 K QE . 11078 1
1092 . 1 1 114 114 LYS CA C 13 56.677 0.089 . 1 . . . . 261 K CA . 11078 1
1093 . 1 1 114 114 LYS CB C 13 33.535 0.100 . 1 . . . . 261 K CB . 11078 1
1094 . 1 1 114 114 LYS CD C 13 29.003 0.171 . 1 . . . . 261 K CD . 11078 1
1095 . 1 1 114 114 LYS CE C 13 42.111 0.148 . 1 . . . . 261 K CE . 11078 1
1096 . 1 1 114 114 LYS CG C 13 25.151 0.067 . 1 . . . . 261 K CG . 11078 1
1097 . 1 1 114 114 LYS N N 15 125.661 0.087 . 1 . . . . 261 K N . 11078 1
1098 . 1 1 115 115 LYS H H 1 8.909 0.013 . 1 . . . . 262 K HN . 11078 1
1099 . 1 1 115 115 LYS HA H 1 4.286 0.012 . 1 . . . . 262 K HA . 11078 1
1100 . 1 1 115 115 LYS HB2 H 1 1.800 0.007 . 2 . . . . 262 K HB2 . 11078 1
1101 . 1 1 115 115 LYS HB3 H 1 1.745 0.003 . 2 . . . . 262 K HB3 . 11078 1
1102 . 1 1 115 115 LYS HD2 H 1 1.665 0.011 . 2 . . . . 262 K HD2 . 11078 1
1103 . 1 1 115 115 LYS HD3 H 1 1.610 0.009 . 2 . . . . 262 K HD3 . 11078 1
1104 . 1 1 115 115 LYS HG2 H 1 1.302 0.007 . 2 . . . . 262 K QG . 11078 1
1105 . 1 1 115 115 LYS CA C 13 55.373 0.030 . 1 . . . . 262 K CA . 11078 1
1106 . 1 1 115 115 LYS CB C 13 33.739 0.149 . 1 . . . . 262 K CB . 11078 1
1107 . 1 1 115 115 LYS CD C 13 29.105 0.126 . 1 . . . . 262 K CD . 11078 1
1108 . 1 1 115 115 LYS CE C 13 42.605 0.000 . 1 . . . . 262 K CE . 11078 1
1109 . 1 1 115 115 LYS CG C 13 25.670 0.041 . 1 . . . . 262 K CG . 11078 1
1110 . 1 1 115 115 LYS N N 15 122.133 0.085 . 1 . . . . 262 K N . 11078 1
1111 . 1 1 116 116 GLU H H 1 8.129 0.012 . 1 . . . . 263 E HN . 11078 1
1112 . 1 1 116 116 GLU HA H 1 4.134 0.009 . 1 . . . . 263 E HA . 11078 1
1113 . 1 1 116 116 GLU HB2 H 1 1.939 0.010 . 2 . . . . 263 E HB2 . 11078 1
1114 . 1 1 116 116 GLU HB3 H 1 1.788 0.008 . 2 . . . . 263 E HB3 . 11078 1
1115 . 1 1 116 116 GLU CA C 13 55.448 0.044 . 1 . . . . 263 E CA . 11078 1
1116 . 1 1 116 116 GLU CB C 13 30.701 0.105 . 1 . . . . 263 E CB . 11078 1
1117 . 1 1 116 116 GLU CG C 13 36.328 0.118 . 1 . . . . 263 E CG . 11078 1
1118 . 1 1 116 116 GLU N N 15 118.571 0.104 . 1 . . . . 263 E N . 11078 1
1119 . 1 1 117 117 PHE H H 1 8.806 0.010 . 1 . . . . 264 F HN . 11078 1
1120 . 1 1 117 117 PHE HA H 1 4.355 0.006 . 1 . . . . 264 F HA . 11078 1
1121 . 1 1 117 117 PHE HB2 H 1 3.032 0.013 . 2 . . . . 264 F HB2 . 11078 1
1122 . 1 1 117 117 PHE HB3 H 1 2.782 0.013 . 2 . . . . 264 F HB3 . 11078 1
1123 . 1 1 117 117 PHE HD1 H 1 7.145 0.000 . 3 . . . . 264 F QD . 11078 1
1124 . 1 1 117 117 PHE HD2 H 1 7.145 0.000 . 3 . . . . 264 F QD . 11078 1
1125 . 1 1 117 117 PHE CA C 13 56.511 0.046 . 1 . . . . 264 F CA . 11078 1
1126 . 1 1 117 117 PHE CB C 13 38.146 0.106 . 1 . . . . 264 F CB . 11078 1
1127 . 1 1 117 117 PHE N N 15 122.504 0.112 . 1 . . . . 264 F N . 11078 1
1128 . 1 1 118 118 PRO HA H 1 4.482 0.007 . 1 . . . . 265 P HA . 11078 1
1129 . 1 1 118 118 PRO HB2 H 1 2.354 0.008 . 2 . . . . 265 P HB2 . 11078 1
1130 . 1 1 118 118 PRO HB3 H 1 1.933 0.009 . 2 . . . . 265 P HB3 . 11078 1
1131 . 1 1 118 118 PRO HD2 H 1 3.653 0.011 . 2 . . . . 265 P HD2 . 11078 1
1132 . 1 1 118 118 PRO HD3 H 1 3.086 0.013 . 2 . . . . 265 P HD3 . 11078 1
1133 . 1 1 118 118 PRO HG2 H 1 2.016 0.009 . 2 . . . . 265 P HG2 . 11078 1
1134 . 1 1 118 118 PRO HG3 H 1 1.853 0.009 . 2 . . . . 265 P HG3 . 11078 1
1135 . 1 1 118 118 PRO CA C 13 62.509 0.046 . 1 . . . . 265 P CA . 11078 1
1136 . 1 1 118 118 PRO CB C 13 32.244 0.091 . 1 . . . . 265 P CB . 11078 1
1137 . 1 1 118 118 PRO CD C 13 50.244 0.100 . 1 . . . . 265 P CD . 11078 1
1138 . 1 1 118 118 PRO CG C 13 27.589 0.041 . 1 . . . . 265 P CG . 11078 1
1139 . 1 1 119 119 SER H H 1 8.860 0.012 . 1 . . . . 266 S HN . 11078 1
1140 . 1 1 119 119 SER HA H 1 3.887 0.007 . 1 . . . . 266 S HA . 11078 1
1141 . 1 1 119 119 SER HB2 H 1 4.757 0.007 . 2 . . . . 266 S QB . 11078 1
1142 . 1 1 119 119 SER CA C 13 62.479 0.174 . 1 . . . . 266 S CA . 11078 1
1143 . 1 1 119 119 SER CB C 13 58.842 0.000 . 1 . . . . 266 S CB . 11078 1
1144 . 1 1 119 119 SER N N 15 119.114 0.049 . 1 . . . . 266 S N . 11078 1
1145 . 1 1 120 120 ILE H H 1 8.249 0.013 . 1 . . . . 267 I HN . 11078 1
1146 . 1 1 120 120 ILE HA H 1 4.148 0.007 . 1 . . . . 267 I HA . 11078 1
1147 . 1 1 120 120 ILE HB H 1 1.873 0.007 . 1 . . . . 267 I HB . 11078 1
1148 . 1 1 120 120 ILE HD11 H 1 0.765 0.005 . 1 . . . . 267 I QD1 . 11078 1
1149 . 1 1 120 120 ILE HD12 H 1 0.765 0.005 . 1 . . . . 267 I QD1 . 11078 1
1150 . 1 1 120 120 ILE HD13 H 1 0.765 0.005 . 1 . . . . 267 I QD1 . 11078 1
1151 . 1 1 120 120 ILE HG12 H 1 1.419 0.009 . 2 . . . . 267 I HG12 . 11078 1
1152 . 1 1 120 120 ILE HG13 H 1 1.173 0.008 . 2 . . . . 267 I HG13 . 11078 1
1153 . 1 1 120 120 ILE HG21 H 1 0.790 0.006 . 1 . . . . 267 I QG2 . 11078 1
1154 . 1 1 120 120 ILE HG22 H 1 0.790 0.006 . 1 . . . . 267 I QG2 . 11078 1
1155 . 1 1 120 120 ILE HG23 H 1 0.790 0.006 . 1 . . . . 267 I QG2 . 11078 1
1156 . 1 1 120 120 ILE CA C 13 61.886 0.061 . 1 . . . . 267 I CA . 11078 1
1157 . 1 1 120 120 ILE CB C 13 38.142 0.036 . 1 . . . . 267 I CB . 11078 1
1158 . 1 1 120 120 ILE CD1 C 13 14.212 0.042 . 1 . . . . 267 I CD1 . 11078 1
1159 . 1 1 120 120 ILE CG1 C 13 29.443 0.061 . 1 . . . . 267 I CG1 . 11078 1
1160 . 1 1 120 120 ILE CG2 C 13 18.577 0.052 . 1 . . . . 267 I CG2 . 11078 1
1161 . 1 1 120 120 ILE N N 15 118.290 0.067 . 1 . . . . 267 I N . 11078 1
1162 . 1 1 121 121 LEU H H 1 7.429 0.013 . 1 . . . . 268 L HN . 11078 1
1163 . 1 1 121 121 LEU HA H 1 4.481 0.012 . 1 . . . . 268 L HA . 11078 1
1164 . 1 1 121 121 LEU HB2 H 1 1.617 0.012 . 2 . . . . 268 L QB . 11078 1
1165 . 1 1 121 121 LEU HD11 H 1 0.710 0.006 . 1 . . . . 268 L QD1 . 11078 1
1166 . 1 1 121 121 LEU HD12 H 1 0.710 0.006 . 1 . . . . 268 L QD1 . 11078 1
1167 . 1 1 121 121 LEU HD13 H 1 0.710 0.006 . 1 . . . . 268 L QD1 . 11078 1
1168 . 1 1 121 121 LEU HD21 H 1 0.724 0.005 . 1 . . . . 268 L QD2 . 11078 1
1169 . 1 1 121 121 LEU HD22 H 1 0.724 0.005 . 1 . . . . 268 L QD2 . 11078 1
1170 . 1 1 121 121 LEU HD23 H 1 0.724 0.005 . 1 . . . . 268 L QD2 . 11078 1
1171 . 1 1 121 121 LEU HG H 1 1.623 0.003 . 1 . . . . 268 L HG . 11078 1
1172 . 1 1 121 121 LEU CA C 13 53.934 0.144 . 1 . . . . 268 L CA . 11078 1
1173 . 1 1 121 121 LEU CB C 13 42.880 0.141 . 1 . . . . 268 L CB . 11078 1
1174 . 1 1 121 121 LEU CD1 C 13 25.794 0.059 . 2 . . . . 268 L CD1 . 11078 1
1175 . 1 1 121 121 LEU CD2 C 13 22.752 0.167 . 2 . . . . 268 L CD2 . 11078 1
1176 . 1 1 121 121 LEU CG C 13 26.719 0.000 . 1 . . . . 268 L CG . 11078 1
1177 . 1 1 121 121 LEU N N 15 116.276 0.039 . 1 . . . . 268 L N . 11078 1
1178 . 1 1 122 122 ARG H H 1 7.506 0.010 . 1 . . . . 269 R HN . 11078 1
1179 . 1 1 122 122 ARG HA H 1 3.878 0.008 . 1 . . . . 269 R HA . 11078 1
1180 . 1 1 122 122 ARG HB2 H 1 1.613 0.009 . 2 . . . . 269 R HB2 . 11078 1
1181 . 1 1 122 122 ARG HB3 H 1 1.302 0.006 . 2 . . . . 269 R HB3 . 11078 1
1182 . 1 1 122 122 ARG HG2 H 1 1.274 0.010 . 2 . . . . 269 R HG2 . 11078 1
1183 . 1 1 122 122 ARG HG3 H 1 1.162 0.019 . 2 . . . . 269 R HG3 . 11078 1
1184 . 1 1 122 122 ARG CA C 13 58.252 0.088 . 1 . . . . 269 R CA . 11078 1
1185 . 1 1 122 122 ARG CB C 13 30.295 0.126 . 1 . . . . 269 R CB . 11078 1
1186 . 1 1 122 122 ARG CD C 13 43.504 0.034 . 1 . . . . 269 R CD . 11078 1
1187 . 1 1 122 122 ARG CG C 13 26.987 0.034 . 1 . . . . 269 R CG . 11078 1
1188 . 1 1 122 122 ARG N N 15 118.196 0.058 . 1 . . . . 269 R N . 11078 1
1189 . 1 1 123 123 PHE H H 1 8.166 0.012 . 1 . . . . 270 F HN . 11078 1
1190 . 1 1 123 123 PHE HA H 1 4.594 0.009 . 1 . . . . 270 F HA . 11078 1
1191 . 1 1 123 123 PHE HB2 H 1 3.369 0.022 . 2 . . . . 270 F HB2 . 11078 1
1192 . 1 1 123 123 PHE HB3 H 1 2.991 0.011 . 2 . . . . 270 F HB3 . 11078 1
1193 . 1 1 123 123 PHE CA C 13 57.644 0.090 . 1 . . . . 270 F CA . 11078 1
1194 . 1 1 123 123 PHE CB C 13 37.712 0.093 . 1 . . . . 270 F CB . 11078 1
1195 . 1 1 123 123 PHE N N 15 115.346 0.036 . 1 . . . . 270 F N . 11078 1
1196 . 1 1 124 124 ILE H H 1 7.363 0.014 . 1 . . . . 271 I HN . 11078 1
1197 . 1 1 124 124 ILE HA H 1 4.335 0.009 . 1 . . . . 271 I HA . 11078 1
1198 . 1 1 124 124 ILE HB H 1 1.768 0.008 . 1 . . . . 271 I HB . 11078 1
1199 . 1 1 124 124 ILE HD11 H 1 0.845 0.009 . 1 . . . . 271 I QD1 . 11078 1
1200 . 1 1 124 124 ILE HD12 H 1 0.845 0.009 . 1 . . . . 271 I QD1 . 11078 1
1201 . 1 1 124 124 ILE HD13 H 1 0.845 0.009 . 1 . . . . 271 I QD1 . 11078 1
1202 . 1 1 124 124 ILE HG12 H 1 1.484 0.008 . 2 . . . . 271 I HG12 . 11078 1
1203 . 1 1 124 124 ILE HG13 H 1 0.970 0.014 . 2 . . . . 271 I HG13 . 11078 1
1204 . 1 1 124 124 ILE HG21 H 1 0.990 0.007 . 1 . . . . 271 I QG2 . 11078 1
1205 . 1 1 124 124 ILE HG22 H 1 0.990 0.007 . 1 . . . . 271 I QG2 . 11078 1
1206 . 1 1 124 124 ILE HG23 H 1 0.990 0.007 . 1 . . . . 271 I QG2 . 11078 1
1207 . 1 1 124 124 ILE CA C 13 60.496 0.104 . 1 . . . . 271 I CA . 11078 1
1208 . 1 1 124 124 ILE CB C 13 39.767 0.115 . 1 . . . . 271 I CB . 11078 1
1209 . 1 1 124 124 ILE CD1 C 13 14.731 0.064 . 1 . . . . 271 I CD1 . 11078 1
1210 . 1 1 124 124 ILE CG1 C 13 27.012 0.037 . 1 . . . . 271 I CG1 . 11078 1
1211 . 1 1 124 124 ILE CG2 C 13 18.304 0.062 . 1 . . . . 271 I CG2 . 11078 1
1212 . 1 1 124 124 ILE N N 15 119.380 0.065 . 1 . . . . 271 I N . 11078 1
1213 . 1 1 125 125 THR H H 1 8.608 0.010 . 1 . . . . 272 T HN . 11078 1
1214 . 1 1 125 125 THR HA H 1 3.989 0.012 . 1 . . . . 272 T HA . 11078 1
1215 . 1 1 125 125 THR HB H 1 4.044 0.010 . 1 . . . . 272 T HB . 11078 1
1216 . 1 1 125 125 THR HG21 H 1 1.160 0.007 . 1 . . . . 272 T QG2 . 11078 1
1217 . 1 1 125 125 THR HG22 H 1 1.160 0.007 . 1 . . . . 272 T QG2 . 11078 1
1218 . 1 1 125 125 THR HG23 H 1 1.160 0.007 . 1 . . . . 272 T QG2 . 11078 1
1219 . 1 1 125 125 THR CA C 13 64.481 0.176 . 1 . . . . 272 T CA . 11078 1
1220 . 1 1 125 125 THR CB C 13 69.201 0.082 . 1 . . . . 272 T CB . 11078 1
1221 . 1 1 125 125 THR CG2 C 13 21.992 0.152 . 1 . . . . 272 T CG2 . 11078 1
1222 . 1 1 125 125 THR N N 15 122.607 0.078 . 1 . . . . 272 T N . 11078 1
1223 . 1 1 126 126 VAL H H 1 8.427 0.012 . 1 . . . . 273 V HN . 11078 1
1224 . 1 1 126 126 VAL HA H 1 4.071 0.008 . 1 . . . . 273 V HA . 11078 1
1225 . 1 1 126 126 VAL HB H 1 1.940 0.012 . 1 . . . . 273 V HB . 11078 1
1226 . 1 1 126 126 VAL HG11 H 1 0.817 0.008 . 1 . . . . 273 V QG1 . 11078 1
1227 . 1 1 126 126 VAL HG12 H 1 0.817 0.008 . 1 . . . . 273 V QG1 . 11078 1
1228 . 1 1 126 126 VAL HG13 H 1 0.817 0.008 . 1 . . . . 273 V QG1 . 11078 1
1229 . 1 1 126 126 VAL HG21 H 1 0.725 0.010 . 1 . . . . 273 V QG2 . 11078 1
1230 . 1 1 126 126 VAL HG22 H 1 0.725 0.010 . 1 . . . . 273 V QG2 . 11078 1
1231 . 1 1 126 126 VAL HG23 H 1 0.725 0.010 . 1 . . . . 273 V QG2 . 11078 1
1232 . 1 1 126 126 VAL CA C 13 61.668 0.059 . 1 . . . . 273 V CA . 11078 1
1233 . 1 1 126 126 VAL CB C 13 33.629 0.083 . 1 . . . . 273 V CB . 11078 1
1234 . 1 1 126 126 VAL CG1 C 13 22.640 0.079 . 2 . . . . 273 V CG1 . 11078 1
1235 . 1 1 126 126 VAL CG2 C 13 21.403 0.100 . 2 . . . . 273 V CG2 . 11078 1
1236 . 1 1 126 126 VAL N N 15 127.032 0.056 . 1 . . . . 273 V N . 11078 1
1237 . 1 1 127 127 CYS H H 1 8.674 0.009 . 1 . . . . 274 C HN . 11078 1
1238 . 1 1 127 127 CYS HA H 1 4.499 0.011 . 1 . . . . 274 C HA . 11078 1
1239 . 1 1 127 127 CYS HB2 H 1 2.979 0.013 . 2 . . . . 274 C HB2 . 11078 1
1240 . 1 1 127 127 CYS HB3 H 1 2.747 0.010 . 2 . . . . 274 C HB3 . 11078 1
1241 . 1 1 127 127 CYS CA C 13 59.074 0.183 . 1 . . . . 274 C CA . 11078 1
1242 . 1 1 127 127 CYS CB C 13 26.638 0.125 . 1 . . . . 274 C CB . 11078 1
1243 . 1 1 127 127 CYS N N 15 127.367 0.073 . 1 . . . . 274 C N . 11078 1
1244 . 1 1 128 128 ASP H H 1 8.845 0.009 . 1 . . . . 275 D HN . 11078 1
1245 . 1 1 128 128 ASP HA H 1 5.058 0.011 . 1 . . . . 275 D HA . 11078 1
1246 . 1 1 128 128 ASP HB2 H 1 3.092 0.007 . 2 . . . . 275 D HB2 . 11078 1
1247 . 1 1 128 128 ASP HB3 H 1 2.271 0.011 . 2 . . . . 275 D HB3 . 11078 1
1248 . 1 1 128 128 ASP CA C 13 52.859 0.182 . 1 . . . . 275 D CA . 11078 1
1249 . 1 1 128 128 ASP CB C 13 41.310 0.125 . 1 . . . . 275 D CB . 11078 1
1250 . 1 1 128 128 ASP N N 15 126.081 0.067 . 1 . . . . 275 D N . 11078 1
1251 . 1 1 129 129 TYR H H 1 9.038 0.013 . 1 . . . . 276 Y HN . 11078 1
1252 . 1 1 129 129 TYR HA H 1 3.699 0.019 . 1 . . . . 276 Y HA . 11078 1
1253 . 1 1 129 129 TYR HB2 H 1 2.587 0.007 . 2 . . . . 276 Y HB2 . 11078 1
1254 . 1 1 129 129 TYR HB3 H 1 3.130 0.000 . 2 . . . . 276 Y HB3 . 11078 1
1255 . 1 1 129 129 TYR HD1 H 1 6.611 0.022 . 3 . . . . 276 Y QD . 11078 1
1256 . 1 1 129 129 TYR HD2 H 1 6.611 0.022 . 3 . . . . 276 Y QD . 11078 1
1257 . 1 1 129 129 TYR CA C 13 57.313 0.087 . 1 . . . . 276 Y CA . 11078 1
1258 . 1 1 129 129 TYR CB C 13 39.063 0.146 . 1 . . . . 276 Y CB . 11078 1
1259 . 1 1 129 129 TYR N N 15 128.416 0.062 . 1 . . . . 276 Y N . 11078 1
1260 . 1 1 130 130 THR H H 1 8.331 0.016 . 1 . . . . 277 T HN . 11078 1
1261 . 1 1 130 130 THR HA H 1 4.340 0.008 . 1 . . . . 277 T HA . 11078 1
1262 . 1 1 130 130 THR HG21 H 1 1.847 0.011 . 1 . . . . 277 T QG2 . 11078 1
1263 . 1 1 130 130 THR HG22 H 1 1.847 0.011 . 1 . . . . 277 T QG2 . 11078 1
1264 . 1 1 130 130 THR HG23 H 1 1.847 0.011 . 1 . . . . 277 T QG2 . 11078 1
1265 . 1 1 130 130 THR CA C 13 62.972 0.347 . 1 . . . . 277 T CA . 11078 1
1266 . 1 1 130 130 THR CB C 13 69.458 0.177 . 1 . . . . 277 T CB . 11078 1
1267 . 1 1 130 130 THR N N 15 107.465 0.067 . 1 . . . . 277 T N . 11078 1
1268 . 1 1 132 132 PRO HA H 1 4.044 0.022 . 1 . . . . 279 P HA . 11078 1
1269 . 1 1 132 132 PRO HB2 H 1 1.939 0.012 . 2 . . . . 279 P QB . 11078 1
1270 . 1 1 132 132 PRO HD2 H 1 3.659 0.000 . 2 . . . . 279 P QD . 11078 1
1271 . 1 1 132 132 PRO HG2 H 1 1.917 0.011 . 2 . . . . 279 P QG . 11078 1
1272 . 1 1 132 132 PRO CA C 13 64.652 0.065 . 1 . . . . 279 P CA . 11078 1
1273 . 1 1 132 132 PRO CB C 13 31.997 0.016 . 1 . . . . 279 P CB . 11078 1
1274 . 1 1 132 132 PRO CG C 13 26.710 0.005 . 1 . . . . 279 P CG . 11078 1
1275 . 1 1 133 133 CYS H H 1 8.217 0.010 . 1 . . . . 280 C HN . 11078 1
1276 . 1 1 133 133 CYS HA H 1 4.303 0.007 . 1 . . . . 280 C HA . 11078 1
1277 . 1 1 133 133 CYS HB2 H 1 3.059 0.007 . 2 . . . . 280 C HB2 . 11078 1
1278 . 1 1 133 133 CYS HB3 H 1 2.888 0.008 . 2 . . . . 280 C HB3 . 11078 1
1279 . 1 1 133 133 CYS CA C 13 60.475 0.083 . 1 . . . . 280 C CA . 11078 1
1280 . 1 1 133 133 CYS CB C 13 27.355 0.085 . 1 . . . . 280 C CB . 11078 1
1281 . 1 1 133 133 CYS N N 15 116.137 0.048 . 1 . . . . 280 C N . 11078 1
1282 . 1 1 134 134 THR H H 1 7.463 0.019 . 1 . . . . 281 T HN . 11078 1
1283 . 1 1 134 134 THR HA H 1 4.165 0.003 . 1 . . . . 281 T HA . 11078 1
1284 . 1 1 134 134 THR HB H 1 4.168 0.008 . 1 . . . . 281 T HB . 11078 1
1285 . 1 1 134 134 THR HG21 H 1 1.137 0.023 . 1 . . . . 281 T QG2 . 11078 1
1286 . 1 1 134 134 THR HG22 H 1 1.137 0.023 . 1 . . . . 281 T QG2 . 11078 1
1287 . 1 1 134 134 THR HG23 H 1 1.137 0.023 . 1 . . . . 281 T QG2 . 11078 1
1288 . 1 1 134 134 THR CA C 13 61.406 0.050 . 1 . . . . 281 T CA . 11078 1
1289 . 1 1 134 134 THR CB C 13 69.584 0.244 . 1 . . . . 281 T CB . 11078 1
1290 . 1 1 134 134 THR CG2 C 13 21.737 0.046 . 1 . . . . 281 T CG2 . 11078 1
1291 . 1 1 134 134 THR N N 15 108.808 0.091 . 1 . . . . 281 T N . 11078 1
1292 . 1 1 135 135 LYS H H 1 7.383 0.008 . 1 . . . . 282 K HN . 11078 1
1293 . 1 1 135 135 LYS HB2 H 1 1.652 0.003 . 2 . . . . 282 K QB . 11078 1
1294 . 1 1 135 135 LYS CA C 13 59.212 0.102 . 1 . . . . 282 K CA . 11078 1
1295 . 1 1 135 135 LYS CB C 13 32.613 0.058 . 1 . . . . 282 K CB . 11078 1
1296 . 1 1 135 135 LYS N N 15 123.123 0.097 . 1 . . . . 282 K N . 11078 1
1297 . 1 1 136 136 SER H H 1 8.437 0.017 . 1 . . . . 283 S HN . 11078 1
1298 . 1 1 136 136 SER HA H 1 4.378 0.015 . 1 . . . . 283 S HA . 11078 1
1299 . 1 1 136 136 SER HB2 H 1 3.873 0.012 . 2 . . . . 283 S QB . 11078 1
1300 . 1 1 136 136 SER CA C 13 61.215 0.227 . 1 . . . . 283 S CA . 11078 1
1301 . 1 1 136 136 SER CB C 13 62.852 0.454 . 1 . . . . 283 S CB . 11078 1
1302 . 1 1 136 136 SER N N 15 113.824 0.103 . 1 . . . . 283 S N . 11078 1
1303 . 1 1 137 137 TRP HA H 1 4.873 0.006 . 1 . . . . 284 W HA . 11078 1
1304 . 1 1 137 137 TRP HB2 H 1 3.412 0.008 . 2 . . . . 284 W HB2 . 11078 1
1305 . 1 1 137 137 TRP HB3 H 1 3.267 0.007 . 2 . . . . 284 W HB3 . 11078 1
1306 . 1 1 137 137 TRP HD1 H 1 7.214 0.014 . 1 . . . . 284 W HD1 . 11078 1
1307 . 1 1 137 137 TRP HE1 H 1 10.204 0.009 . 1 . . . . 284 W HE1 . 11078 1
1308 . 1 1 137 137 TRP HZ2 H 1 7.501 0.004 . 1 . . . . 284 W HZ2 . 11078 1
1309 . 1 1 137 137 TRP CA C 13 56.983 0.043 . 1 . . . . 284 W CA . 11078 1
1310 . 1 1 137 137 TRP CB C 13 28.869 0.168 . 1 . . . . 284 W CB . 11078 1
1311 . 1 1 137 137 TRP CD1 C 13 127.511 0.003 . 1 . . . . 284 W CD1 . 11078 1
1312 . 1 1 137 137 TRP CZ2 C 13 114.815 0.011 . 1 . . . . 284 W CZ2 . 11078 1
1313 . 1 1 137 137 TRP NE1 N 15 129.464 0.044 . 1 . . . . 284 W NE1 . 11078 1
1314 . 1 1 138 138 PHE H H 1 7.651 0.012 . 1 . . . . 285 F HN . 11078 1
1315 . 1 1 138 138 PHE HA H 1 3.721 0.006 . 1 . . . . 285 F HA . 11078 1
1316 . 1 1 138 138 PHE HB2 H 1 3.143 0.007 . 2 . . . . 285 F HB2 . 11078 1
1317 . 1 1 138 138 PHE HB3 H 1 2.226 0.004 . 2 . . . . 285 F HB3 . 11078 1
1318 . 1 1 138 138 PHE HD1 H 1 6.002 0.013 . 3 . . . . 285 F QD . 11078 1
1319 . 1 1 138 138 PHE HD2 H 1 6.002 0.013 . 3 . . . . 285 F QD . 11078 1
1320 . 1 1 138 138 PHE HE1 H 1 6.939 0.000 . 3 . . . . 285 F QE . 11078 1
1321 . 1 1 138 138 PHE HE2 H 1 6.939 0.000 . 3 . . . . 285 F QE . 11078 1
1322 . 1 1 138 138 PHE CA C 13 63.087 0.144 . 1 . . . . 285 F CA . 11078 1
1323 . 1 1 138 138 PHE CB C 13 40.578 0.052 . 1 . . . . 285 F CB . 11078 1
1324 . 1 1 138 138 PHE N N 15 120.963 0.060 . 1 . . . . 285 F N . 11078 1
1325 . 1 1 139 139 TRP H H 1 8.049 0.007 . 1 . . . . 286 W HN . 11078 1
1326 . 1 1 139 139 TRP HA H 1 4.574 0.009 . 1 . . . . 286 W HA . 11078 1
1327 . 1 1 139 139 TRP HB2 H 1 3.276 0.012 . 2 . . . . 286 W HB2 . 11078 1
1328 . 1 1 139 139 TRP HB3 H 1 3.088 0.005 . 2 . . . . 286 W HB3 . 11078 1
1329 . 1 1 139 139 TRP HD1 H 1 7.420 0.014 . 1 . . . . 286 W HD1 . 11078 1
1330 . 1 1 139 139 TRP HE1 H 1 10.284 0.009 . 1 . . . . 286 W HE1 . 11078 1
1331 . 1 1 139 139 TRP HZ2 H 1 6.990 0.005 . 1 . . . . 286 W HZ2 . 11078 1
1332 . 1 1 139 139 TRP CA C 13 58.635 0.121 . 1 . . . . 286 W CA . 11078 1
1333 . 1 1 139 139 TRP CB C 13 29.380 0.088 . 1 . . . . 286 W CB . 11078 1
1334 . 1 1 139 139 TRP CD1 C 13 129.150 0.005 . 1 . . . . 286 W CD1 . 11078 1
1335 . 1 1 139 139 TRP CZ2 C 13 115.130 0.028 . 1 . . . . 286 W CZ2 . 11078 1
1336 . 1 1 139 139 TRP N N 15 117.498 0.051 . 1 . . . . 286 W N . 11078 1
1337 . 1 1 139 139 TRP NE1 N 15 129.220 0.046 . 1 . . . . 286 W NE1 . 11078 1
1338 . 1 1 140 140 THR H H 1 8.125 0.010 . 1 . . . . 287 T HN . 11078 1
1339 . 1 1 140 140 THR HA H 1 4.023 0.009 . 1 . . . . 287 T HA . 11078 1
1340 . 1 1 140 140 THR HB H 1 4.341 0.007 . 1 . . . . 287 T HB . 11078 1
1341 . 1 1 140 140 THR HG21 H 1 1.459 0.007 . 1 . . . . 287 T QG2 . 11078 1
1342 . 1 1 140 140 THR HG22 H 1 1.459 0.007 . 1 . . . . 287 T QG2 . 11078 1
1343 . 1 1 140 140 THR HG23 H 1 1.459 0.007 . 1 . . . . 287 T QG2 . 11078 1
1344 . 1 1 140 140 THR CA C 13 66.669 0.079 . 1 . . . . 287 T CA . 11078 1
1345 . 1 1 140 140 THR CB C 13 68.599 0.055 . 1 . . . . 287 T CB . 11078 1
1346 . 1 1 140 140 THR CG2 C 13 22.662 0.104 . 1 . . . . 287 T CG2 . 11078 1
1347 . 1 1 140 140 THR N N 15 114.205 0.066 . 1 . . . . 287 T N . 11078 1
1348 . 1 1 141 141 ARG H H 1 8.198 0.012 . 1 . . . . 288 R HN . 11078 1
1349 . 1 1 141 141 ARG HA H 1 3.902 0.012 . 1 . . . . 288 R HA . 11078 1
1350 . 1 1 141 141 ARG HB2 H 1 1.674 0.018 . 2 . . . . 288 R QB . 11078 1
1351 . 1 1 141 141 ARG HD2 H 1 2.945 0.017 . 2 . . . . 288 R QD . 11078 1
1352 . 1 1 141 141 ARG HG2 H 1 1.782 0.009 . 2 . . . . 288 R HG2 . 11078 1
1353 . 1 1 141 141 ARG HG3 H 1 1.482 0.009 . 2 . . . . 288 R HG3 . 11078 1
1354 . 1 1 141 141 ARG CA C 13 59.810 0.171 . 1 . . . . 288 R CA . 11078 1
1355 . 1 1 141 141 ARG CB C 13 29.536 0.110 . 1 . . . . 288 R CB . 11078 1
1356 . 1 1 141 141 ARG CD C 13 43.442 0.000 . 1 . . . . 288 R CD . 11078 1
1357 . 1 1 141 141 ARG CG C 13 27.840 0.055 . 1 . . . . 288 R CG . 11078 1
1358 . 1 1 141 141 ARG N N 15 120.862 0.190 . 1 . . . . 288 R N . 11078 1
1359 . 1 1 142 142 LEU H H 1 7.774 0.013 . 1 . . . . 289 L HN . 11078 1
1360 . 1 1 142 142 LEU HA H 1 3.981 0.013 . 1 . . . . 289 L HA . 11078 1
1361 . 1 1 142 142 LEU HB2 H 1 1.773 0.009 . 2 . . . . 289 L HB2 . 11078 1
1362 . 1 1 142 142 LEU HB3 H 1 1.000 0.009 . 2 . . . . 289 L HB3 . 11078 1
1363 . 1 1 142 142 LEU HD11 H 1 0.993 0.012 . 1 . . . . 289 L QD1 . 11078 1
1364 . 1 1 142 142 LEU HD12 H 1 0.993 0.012 . 1 . . . . 289 L QD1 . 11078 1
1365 . 1 1 142 142 LEU HD13 H 1 0.993 0.012 . 1 . . . . 289 L QD1 . 11078 1
1366 . 1 1 142 142 LEU HD21 H 1 0.812 0.007 . 1 . . . . 289 L QD2 . 11078 1
1367 . 1 1 142 142 LEU HD22 H 1 0.812 0.007 . 1 . . . . 289 L QD2 . 11078 1
1368 . 1 1 142 142 LEU HD23 H 1 0.812 0.007 . 1 . . . . 289 L QD2 . 11078 1
1369 . 1 1 142 142 LEU HG H 1 1.417 0.010 . 1 . . . . 289 L HG . 11078 1
1370 . 1 1 142 142 LEU CA C 13 57.528 0.084 . 1 . . . . 289 L CA . 11078 1
1371 . 1 1 142 142 LEU CB C 13 41.272 0.315 . 1 . . . . 289 L CB . 11078 1
1372 . 1 1 142 142 LEU CD1 C 13 26.975 0.132 . 2 . . . . 289 L CD1 . 11078 1
1373 . 1 1 142 142 LEU CD2 C 13 22.670 0.042 . 2 . . . . 289 L CD2 . 11078 1
1374 . 1 1 142 142 LEU CG C 13 27.254 0.181 . 1 . . . . 289 L CG . 11078 1
1375 . 1 1 142 142 LEU N N 15 122.074 0.094 . 1 . . . . 289 L N . 11078 1
1376 . 1 1 143 143 ALA H H 1 8.401 0.014 . 1 . . . . 290 A HN . 11078 1
1377 . 1 1 143 143 ALA HA H 1 3.675 0.016 . 1 . . . . 290 A HA . 11078 1
1378 . 1 1 143 143 ALA HB1 H 1 1.435 0.007 . 1 . . . . 290 A QB . 11078 1
1379 . 1 1 143 143 ALA HB2 H 1 1.435 0.007 . 1 . . . . 290 A QB . 11078 1
1380 . 1 1 143 143 ALA HB3 H 1 1.435 0.007 . 1 . . . . 290 A QB . 11078 1
1381 . 1 1 143 143 ALA CA C 13 55.436 0.099 . 1 . . . . 290 A CA . 11078 1
1382 . 1 1 143 143 ALA CB C 13 19.446 0.191 . 1 . . . . 290 A CB . 11078 1
1383 . 1 1 143 143 ALA N N 15 120.468 0.091 . 1 . . . . 290 A N . 11078 1
1384 . 1 1 144 144 LYS H H 1 7.737 0.011 . 1 . . . . 291 K HN . 11078 1
1385 . 1 1 144 144 LYS HA H 1 3.143 0.017 . 1 . . . . 291 K HA . 11078 1
1386 . 1 1 144 144 LYS HB2 H 1 1.717 0.011 . 2 . . . . 291 K QB . 11078 1
1387 . 1 1 144 144 LYS HD2 H 1 1.622 0.007 . 2 . . . . 291 K QD . 11078 1
1388 . 1 1 144 144 LYS HE2 H 1 2.908 0.007 . 2 . . . . 291 K QE . 11078 1
1389 . 1 1 144 144 LYS HG2 H 1 1.264 0.006 . 2 . . . . 291 K QG . 11078 1
1390 . 1 1 144 144 LYS CA C 13 58.918 0.050 . 1 . . . . 291 K CA . 11078 1
1391 . 1 1 144 144 LYS CB C 13 31.897 0.137 . 1 . . . . 291 K CB . 11078 1
1392 . 1 1 144 144 LYS CD C 13 29.405 0.038 . 1 . . . . 291 K CD . 11078 1
1393 . 1 1 144 144 LYS CE C 13 42.266 0.050 . 1 . . . . 291 K CE . 11078 1
1394 . 1 1 144 144 LYS N N 15 116.072 0.054 . 1 . . . . 291 K N . 11078 1
1395 . 1 1 145 145 ALA H H 1 7.740 0.012 . 1 . . . . 292 A HN . 11078 1
1396 . 1 1 145 145 ALA HA H 1 3.922 0.012 . 1 . . . . 292 A HA . 11078 1
1397 . 1 1 145 145 ALA HB1 H 1 1.376 0.009 . 1 . . . . 292 A QB . 11078 1
1398 . 1 1 145 145 ALA HB2 H 1 1.376 0.009 . 1 . . . . 292 A QB . 11078 1
1399 . 1 1 145 145 ALA HB3 H 1 1.376 0.009 . 1 . . . . 292 A QB . 11078 1
1400 . 1 1 145 145 ALA CA C 13 55.223 0.091 . 1 . . . . 292 A CA . 11078 1
1401 . 1 1 145 145 ALA CB C 13 17.566 0.128 . 1 . . . . 292 A CB . 11078 1
1402 . 1 1 145 145 ALA N N 15 121.607 0.072 . 1 . . . . 292 A N . 11078 1
1403 . 1 1 146 146 LEU H H 1 8.023 0.013 . 1 . . . . 293 L HN . 11078 1
1404 . 1 1 146 146 LEU HA H 1 4.088 0.008 . 1 . . . . 293 L HA . 11078 1
1405 . 1 1 146 146 LEU HB2 H 1 1.913 0.013 . 2 . . . . 293 L HB2 . 11078 1
1406 . 1 1 146 146 LEU HB3 H 1 1.030 0.008 . 2 . . . . 293 L HB3 . 11078 1
1407 . 1 1 146 146 LEU CA C 13 55.431 0.049 . 1 . . . . 293 L CA . 11078 1
1408 . 1 1 146 146 LEU CB C 13 42.760 0.101 . 1 . . . . 293 L CB . 11078 1
1409 . 1 1 146 146 LEU CD1 C 13 25.864 0.055 . 2 . . . . 293 L CD1 . 11078 1
1410 . 1 1 146 146 LEU CD2 C 13 23.527 0.121 . 2 . . . . 293 L CD2 . 11078 1
1411 . 1 1 146 146 LEU N N 15 113.505 0.035 . 1 . . . . 293 L N . 11078 1
1412 . 1 1 147 147 SER H H 1 7.825 0.010 . 1 . . . . 294 S HN . 11078 1
1413 . 1 1 147 147 SER HA H 1 4.054 0.008 . 1 . . . . 294 S HA . 11078 1
1414 . 1 1 147 147 SER HB2 H 1 4.018 0.011 . 2 . . . . 294 S HB2 . 11078 1
1415 . 1 1 147 147 SER HB3 H 1 3.776 0.009 . 2 . . . . 294 S HB3 . 11078 1
1416 . 1 1 147 147 SER CA C 13 59.691 0.073 . 1 . . . . 294 S CA . 11078 1
1417 . 1 1 147 147 SER CB C 13 63.937 0.098 . 1 . . . . 294 S CB . 11078 1
1418 . 1 1 147 147 SER N N 15 114.925 0.065 . 1 . . . . 294 S N . 11078 1
1419 . 1 1 148 148 LEU H H 1 6.956 0.013 . 1 . . . . 295 L HN . 11078 1
1420 . 1 1 148 148 LEU HA H 1 4.449 0.008 . 1 . . . . 295 L HA . 11078 1
1421 . 1 1 148 148 LEU HB2 H 1 1.699 0.007 . 2 . . . . 295 L HB2 . 11078 1
1422 . 1 1 148 148 LEU HB3 H 1 1.578 0.011 . 2 . . . . 295 L HB3 . 11078 1
1423 . 1 1 148 148 LEU HD11 H 1 0.886 0.009 . 1 . . . . 295 L QD1 . 11078 1
1424 . 1 1 148 148 LEU HD12 H 1 0.886 0.009 . 1 . . . . 295 L QD1 . 11078 1
1425 . 1 1 148 148 LEU HD13 H 1 0.886 0.009 . 1 . . . . 295 L QD1 . 11078 1
1426 . 1 1 148 148 LEU HD21 H 1 0.863 0.007 . 1 . . . . 295 L QD2 . 11078 1
1427 . 1 1 148 148 LEU HD22 H 1 0.863 0.007 . 1 . . . . 295 L QD2 . 11078 1
1428 . 1 1 148 148 LEU HD23 H 1 0.863 0.007 . 1 . . . . 295 L QD2 . 11078 1
1429 . 1 1 148 148 LEU HG H 1 2.010 0.010 . 1 . . . . 295 L HG . 11078 1
1430 . 1 1 148 148 LEU CA C 13 53.711 0.070 . 1 . . . . 295 L CA . 11078 1
1431 . 1 1 148 148 LEU CB C 13 41.041 0.072 . 1 . . . . 295 L CB . 11078 1
1432 . 1 1 148 148 LEU CD1 C 13 25.726 0.106 . 2 . . . . 295 L CD1 . 11078 1
1433 . 1 1 148 148 LEU CD2 C 13 22.447 0.028 . 2 . . . . 295 L CD2 . 11078 1
1434 . 1 1 148 148 LEU CG C 13 26.080 0.054 . 1 . . . . 295 L CG . 11078 1
1435 . 1 1 148 148 LEU N N 15 123.944 0.049 . 1 . . . . 295 L N . 11078 1
1436 . 1 1 149 149 PRO HD2 H 1 3.828 0.005 . 2 . . . . 296 P HD2 . 11078 1
1437 . 1 1 149 149 PRO HD3 H 1 3.590 0.008 . 2 . . . . 296 P HD3 . 11078 1
1438 . 1 1 149 149 PRO CD C 13 50.399 0.039 . 1 . . . . 296 P CD . 11078 1
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