data_9CCZ
# 
_entry.id   9CCZ 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.402 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
_database_2.pdbx_database_accession 
_database_2.pdbx_DOI 
PDB   9CCZ         pdb_00009ccz 10.2210/pdb9ccz/pdb 
WWPDB D_1000285241 ?            ?                   
# 
_pdbx_audit_revision_history.ordinal             1 
_pdbx_audit_revision_history.data_content_type   'Structure model' 
_pdbx_audit_revision_history.major_revision      1 
_pdbx_audit_revision_history.minor_revision      0 
_pdbx_audit_revision_history.revision_date       2025-02-12 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9CCZ 
_pdbx_database_status.recvd_initial_deposition_date   2024-06-23 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    RCSB 
_pdbx_database_status.process_site                    RCSB 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           N 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              peizhou@biochem.duke.edu 
_pdbx_contact_author.name_first         Pei 
_pdbx_contact_author.name_last          Zhou 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0002-7823-3416 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Cochrane, C.S.' 1 ? 
'Zhou, P.'       2 ? 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   US 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'Jacs Au' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           2691-3704 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            4 
_citation.language                  ? 
_citation.page_first                4383 
_citation.page_last                 4393 
_citation.title                     
'Design and Evaluation of Pyridinyl Sulfonyl Piperazine LpxH Inhibitors with Potent Antibiotic Activity Against Enterobacterales.' 
_citation.year                      2024 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1021/jacsau.4c00731 
_citation.pdbx_database_id_PubMed   39610720 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Ennis, A.F.'    1  ?                   
primary 'Cochrane, C.S.' 2  ?                   
primary 'Dome, P.A.'     3  ?                   
primary 'Jeong, P.'      4  ?                   
primary 'Yu, J.'         5  0000-0001-8487-5565 
primary 'Lee, H.'        6  ?                   
primary 'Williams, C.S.' 7  ?                   
primary 'Ha, Y.'         8  0000-0001-5684-8420 
primary 'Yang, W.'       9  0000-0001-5576-2828 
primary 'Zhou, P.'       10 0000-0002-7823-3416 
primary 'Hong, J.'       11 0000-0002-5253-0949 
# 
loop_
_entity.id 
_entity.type 
_entity.src_method 
_entity.pdbx_description 
_entity.formula_weight 
_entity.pdbx_number_of_molecules 
_entity.pdbx_ec 
_entity.pdbx_mutation 
_entity.pdbx_fragment 
_entity.details 
1 polymer     man 'UDP-2,3-diacylglucosamine hydrolase'                                                                            
29627.680 1   3.6.1.54 ? ? ? 
2 non-polymer syn '1-(5-{4-[6-chloro-4-(trifluoromethyl)pyridin-2-yl]piperazine-1-sulfonyl}-2,3-dihydro-1H-indol-1-yl)ethan-1-one' 
488.911   1   ?        ? ? ? 
3 non-polymer syn 'DI(HYDROXYETHYL)ETHER'                                                                                          
106.120   2   ?        ? ? ? 
4 non-polymer syn 'MANGANESE (II) ION'                                                                                             
54.938    2   ?        ? ? ? 
5 water       nat water                                                                                                            
18.015    137 ?        ? ? ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        'UDP-2,3-diacylglucosamine diphosphatase' 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           'polypeptide(L)' 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   no 
_entity_poly.pdbx_seq_one_letter_code       
;MATLFIADLHLQTEEPAITAGFLRFLQGEARQADALYILGDLFEAWIGDDDPNPLHQQIASAIKAVVDAGVPCYFIHGNR
DFLVGQRFARQSGMILLAEEERLDLYGREVLIMHGDTLCTDDQGYLAFRAKVHTPWIQRLFLALPLFIRHRIAARMRADS
KAANSSKSMEIMDVNPQAVVDAMERHHVQWLIHGHTHRPAVHELQANGQPAWRVVLGAWHSEGSMVKVTPDDVELIHFPF
LEENLYFQSHHHHHHHHHH
;
_entity_poly.pdbx_seq_one_letter_code_can   
;MATLFIADLHLQTEEPAITAGFLRFLQGEARQADALYILGDLFEAWIGDDDPNPLHQQIASAIKAVVDAGVPCYFIHGNR
DFLVGQRFARQSGMILLAEEERLDLYGREVLIMHGDTLCTDDQGYLAFRAKVHTPWIQRLFLALPLFIRHRIAARMRADS
KAANSSKSMEIMDVNPQAVVDAMERHHVQWLIHGHTHRPAVHELQANGQPAWRVVLGAWHSEGSMVKVTPDDVELIHFPF
LEENLYFQSHHHHHHHHHH
;
_entity_poly.pdbx_strand_id                 A 
_entity_poly.pdbx_target_identifier         ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
2 '1-(5-{4-[6-chloro-4-(trifluoromethyl)pyridin-2-yl]piperazine-1-sulfonyl}-2,3-dihydro-1H-indol-1-yl)ethan-1-one' A1AV0 
3 'DI(HYDROXYETHYL)ETHER'                                                                                          PEG   
4 'MANGANESE (II) ION'                                                                                             MN    
5 water                                                                                                            HOH   
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   MET n 
1 2   ALA n 
1 3   THR n 
1 4   LEU n 
1 5   PHE n 
1 6   ILE n 
1 7   ALA n 
1 8   ASP n 
1 9   LEU n 
1 10  HIS n 
1 11  LEU n 
1 12  GLN n 
1 13  THR n 
1 14  GLU n 
1 15  GLU n 
1 16  PRO n 
1 17  ALA n 
1 18  ILE n 
1 19  THR n 
1 20  ALA n 
1 21  GLY n 
1 22  PHE n 
1 23  LEU n 
1 24  ARG n 
1 25  PHE n 
1 26  LEU n 
1 27  GLN n 
1 28  GLY n 
1 29  GLU n 
1 30  ALA n 
1 31  ARG n 
1 32  GLN n 
1 33  ALA n 
1 34  ASP n 
1 35  ALA n 
1 36  LEU n 
1 37  TYR n 
1 38  ILE n 
1 39  LEU n 
1 40  GLY n 
1 41  ASP n 
1 42  LEU n 
1 43  PHE n 
1 44  GLU n 
1 45  ALA n 
1 46  TRP n 
1 47  ILE n 
1 48  GLY n 
1 49  ASP n 
1 50  ASP n 
1 51  ASP n 
1 52  PRO n 
1 53  ASN n 
1 54  PRO n 
1 55  LEU n 
1 56  HIS n 
1 57  GLN n 
1 58  GLN n 
1 59  ILE n 
1 60  ALA n 
1 61  SER n 
1 62  ALA n 
1 63  ILE n 
1 64  LYS n 
1 65  ALA n 
1 66  VAL n 
1 67  VAL n 
1 68  ASP n 
1 69  ALA n 
1 70  GLY n 
1 71  VAL n 
1 72  PRO n 
1 73  CYS n 
1 74  TYR n 
1 75  PHE n 
1 76  ILE n 
1 77  HIS n 
1 78  GLY n 
1 79  ASN n 
1 80  ARG n 
1 81  ASP n 
1 82  PHE n 
1 83  LEU n 
1 84  VAL n 
1 85  GLY n 
1 86  GLN n 
1 87  ARG n 
1 88  PHE n 
1 89  ALA n 
1 90  ARG n 
1 91  GLN n 
1 92  SER n 
1 93  GLY n 
1 94  MET n 
1 95  ILE n 
1 96  LEU n 
1 97  LEU n 
1 98  ALA n 
1 99  GLU n 
1 100 GLU n 
1 101 GLU n 
1 102 ARG n 
1 103 LEU n 
1 104 ASP n 
1 105 LEU n 
1 106 TYR n 
1 107 GLY n 
1 108 ARG n 
1 109 GLU n 
1 110 VAL n 
1 111 LEU n 
1 112 ILE n 
1 113 MET n 
1 114 HIS n 
1 115 GLY n 
1 116 ASP n 
1 117 THR n 
1 118 LEU n 
1 119 CYS n 
1 120 THR n 
1 121 ASP n 
1 122 ASP n 
1 123 GLN n 
1 124 GLY n 
1 125 TYR n 
1 126 LEU n 
1 127 ALA n 
1 128 PHE n 
1 129 ARG n 
1 130 ALA n 
1 131 LYS n 
1 132 VAL n 
1 133 HIS n 
1 134 THR n 
1 135 PRO n 
1 136 TRP n 
1 137 ILE n 
1 138 GLN n 
1 139 ARG n 
1 140 LEU n 
1 141 PHE n 
1 142 LEU n 
1 143 ALA n 
1 144 LEU n 
1 145 PRO n 
1 146 LEU n 
1 147 PHE n 
1 148 ILE n 
1 149 ARG n 
1 150 HIS n 
1 151 ARG n 
1 152 ILE n 
1 153 ALA n 
1 154 ALA n 
1 155 ARG n 
1 156 MET n 
1 157 ARG n 
1 158 ALA n 
1 159 ASP n 
1 160 SER n 
1 161 LYS n 
1 162 ALA n 
1 163 ALA n 
1 164 ASN n 
1 165 SER n 
1 166 SER n 
1 167 LYS n 
1 168 SER n 
1 169 MET n 
1 170 GLU n 
1 171 ILE n 
1 172 MET n 
1 173 ASP n 
1 174 VAL n 
1 175 ASN n 
1 176 PRO n 
1 177 GLN n 
1 178 ALA n 
1 179 VAL n 
1 180 VAL n 
1 181 ASP n 
1 182 ALA n 
1 183 MET n 
1 184 GLU n 
1 185 ARG n 
1 186 HIS n 
1 187 HIS n 
1 188 VAL n 
1 189 GLN n 
1 190 TRP n 
1 191 LEU n 
1 192 ILE n 
1 193 HIS n 
1 194 GLY n 
1 195 HIS n 
1 196 THR n 
1 197 HIS n 
1 198 ARG n 
1 199 PRO n 
1 200 ALA n 
1 201 VAL n 
1 202 HIS n 
1 203 GLU n 
1 204 LEU n 
1 205 GLN n 
1 206 ALA n 
1 207 ASN n 
1 208 GLY n 
1 209 GLN n 
1 210 PRO n 
1 211 ALA n 
1 212 TRP n 
1 213 ARG n 
1 214 VAL n 
1 215 VAL n 
1 216 LEU n 
1 217 GLY n 
1 218 ALA n 
1 219 TRP n 
1 220 HIS n 
1 221 SER n 
1 222 GLU n 
1 223 GLY n 
1 224 SER n 
1 225 MET n 
1 226 VAL n 
1 227 LYS n 
1 228 VAL n 
1 229 THR n 
1 230 PRO n 
1 231 ASP n 
1 232 ASP n 
1 233 VAL n 
1 234 GLU n 
1 235 LEU n 
1 236 ILE n 
1 237 HIS n 
1 238 PHE n 
1 239 PRO n 
1 240 PHE n 
1 241 LEU n 
1 242 GLU n 
1 243 GLU n 
1 244 ASN n 
1 245 LEU n 
1 246 TYR n 
1 247 PHE n 
1 248 GLN n 
1 249 SER n 
1 250 HIS n 
1 251 HIS n 
1 252 HIS n 
1 253 HIS n 
1 254 HIS n 
1 255 HIS n 
1 256 HIS n 
1 257 HIS n 
1 258 HIS n 
1 259 HIS n 
# 
_entity_src_gen.entity_id                          1 
_entity_src_gen.pdbx_src_id                        1 
_entity_src_gen.pdbx_alt_source_flag               sample 
_entity_src_gen.pdbx_seq_type                      'Biological sequence' 
_entity_src_gen.pdbx_beg_seq_num                   1 
_entity_src_gen.pdbx_end_seq_num                   259 
_entity_src_gen.gene_src_common_name               ? 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 'lpxH_1, lpxH, C3483_19950, NCTC9128_00880, SAMEA104305404_03891' 
_entity_src_gen.gene_src_species                   ? 
_entity_src_gen.gene_src_strain                    ? 
_entity_src_gen.gene_src_tissue                    ? 
_entity_src_gen.gene_src_tissue_fraction           ? 
_entity_src_gen.gene_src_details                   ? 
_entity_src_gen.pdbx_gene_src_fragment             ? 
_entity_src_gen.pdbx_gene_src_scientific_name      'Klebsiella pneumoniae' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     573 
_entity_src_gen.pdbx_gene_src_variant              ? 
_entity_src_gen.pdbx_gene_src_cell_line            ? 
_entity_src_gen.pdbx_gene_src_atcc                 ? 
_entity_src_gen.pdbx_gene_src_organ                ? 
_entity_src_gen.pdbx_gene_src_organelle            ? 
_entity_src_gen.pdbx_gene_src_cell                 ? 
_entity_src_gen.pdbx_gene_src_cellular_location    ? 
_entity_src_gen.host_org_common_name               ? 
_entity_src_gen.pdbx_host_org_scientific_name      'Escherichia coli' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     562 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               ? 
_entity_src_gen.pdbx_host_org_variant              ? 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          ? 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       ? 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
A1AV0 non-polymer         . 
'1-(5-{4-[6-chloro-4-(trifluoromethyl)pyridin-2-yl]piperazine-1-sulfonyl}-2,3-dihydro-1H-indol-1-yl)ethan-1-one' ? 
'C20 H20 Cl F3 N4 O3 S' 488.911 
ALA   'L-peptide linking' y ALANINE ? 'C3 H7 N O2'            89.093  
ARG   'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1'        175.209 
ASN   'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3'           132.118 
ASP   'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4'            133.103 
CYS   'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S'          121.158 
GLN   'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3'          146.144 
GLU   'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4'            147.129 
GLY   'peptide linking'   y GLYCINE ? 'C2 H5 N O2'            75.067  
HIS   'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1'        156.162 
HOH   non-polymer         . WATER ? 'H2 O'                  18.015  
ILE   'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2'           131.173 
LEU   'L-peptide linking' y LEUCINE ? 'C6 H13 N O2'           131.173 
LYS   'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1'        147.195 
MET   'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S'         149.211 
MN    non-polymer         . 'MANGANESE (II) ION' ? 'Mn 2'                  54.938  
PEG   non-polymer         . 'DI(HYDROXYETHYL)ETHER' ? 'C4 H10 O3'             106.120 
PHE   'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2'           165.189 
PRO   'L-peptide linking' y PROLINE ? 'C5 H9 N O2'            115.130 
SER   'L-peptide linking' y SERINE ? 'C3 H7 N O3'            105.093 
THR   'L-peptide linking' y THREONINE ? 'C4 H9 N O3'            119.119 
TRP   'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2'         204.225 
TYR   'L-peptide linking' y TYROSINE ? 'C9 H11 N O3'           181.189 
VAL   'L-peptide linking' y VALINE ? 'C5 H11 N O2'           117.146 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   MET 1   1   ?   ?   ?   A . n 
A 1 2   ALA 2   2   2   ALA ALA A . n 
A 1 3   THR 3   3   3   THR THR A . n 
A 1 4   LEU 4   4   4   LEU LEU A . n 
A 1 5   PHE 5   5   5   PHE PHE A . n 
A 1 6   ILE 6   6   6   ILE ILE A . n 
A 1 7   ALA 7   7   7   ALA ALA A . n 
A 1 8   ASP 8   8   8   ASP ASP A . n 
A 1 9   LEU 9   9   9   LEU LEU A . n 
A 1 10  HIS 10  10  10  HIS HIS A . n 
A 1 11  LEU 11  11  11  LEU LEU A . n 
A 1 12  GLN 12  12  12  GLN GLN A . n 
A 1 13  THR 13  13  13  THR THR A . n 
A 1 14  GLU 14  14  14  GLU GLU A . n 
A 1 15  GLU 15  15  15  GLU GLU A . n 
A 1 16  PRO 16  16  16  PRO PRO A . n 
A 1 17  ALA 17  17  17  ALA ALA A . n 
A 1 18  ILE 18  18  18  ILE ILE A . n 
A 1 19  THR 19  19  19  THR THR A . n 
A 1 20  ALA 20  20  20  ALA ALA A . n 
A 1 21  GLY 21  21  21  GLY GLY A . n 
A 1 22  PHE 22  22  22  PHE PHE A . n 
A 1 23  LEU 23  23  23  LEU LEU A . n 
A 1 24  ARG 24  24  24  ARG ARG A . n 
A 1 25  PHE 25  25  25  PHE PHE A . n 
A 1 26  LEU 26  26  26  LEU LEU A . n 
A 1 27  GLN 27  27  27  GLN GLN A . n 
A 1 28  GLY 28  28  28  GLY GLY A . n 
A 1 29  GLU 29  29  29  GLU GLU A . n 
A 1 30  ALA 30  30  30  ALA ALA A . n 
A 1 31  ARG 31  31  31  ARG ARG A . n 
A 1 32  GLN 32  32  32  GLN GLN A . n 
A 1 33  ALA 33  33  33  ALA ALA A . n 
A 1 34  ASP 34  34  34  ASP ASP A . n 
A 1 35  ALA 35  35  35  ALA ALA A . n 
A 1 36  LEU 36  36  36  LEU LEU A . n 
A 1 37  TYR 37  37  37  TYR TYR A . n 
A 1 38  ILE 38  38  38  ILE ILE A . n 
A 1 39  LEU 39  39  39  LEU LEU A . n 
A 1 40  GLY 40  40  40  GLY GLY A . n 
A 1 41  ASP 41  41  41  ASP ASP A . n 
A 1 42  LEU 42  42  42  LEU LEU A . n 
A 1 43  PHE 43  43  43  PHE PHE A . n 
A 1 44  GLU 44  44  44  GLU GLU A . n 
A 1 45  ALA 45  45  45  ALA ALA A . n 
A 1 46  TRP 46  46  46  TRP TRP A . n 
A 1 47  ILE 47  47  47  ILE ILE A . n 
A 1 48  GLY 48  48  48  GLY GLY A . n 
A 1 49  ASP 49  49  49  ASP ASP A . n 
A 1 50  ASP 50  50  50  ASP ASP A . n 
A 1 51  ASP 51  51  51  ASP ASP A . n 
A 1 52  PRO 52  52  52  PRO PRO A . n 
A 1 53  ASN 53  53  53  ASN ASN A . n 
A 1 54  PRO 54  54  54  PRO PRO A . n 
A 1 55  LEU 55  55  55  LEU LEU A . n 
A 1 56  HIS 56  56  56  HIS HIS A . n 
A 1 57  GLN 57  57  57  GLN GLN A . n 
A 1 58  GLN 58  58  58  GLN GLN A . n 
A 1 59  ILE 59  59  59  ILE ILE A . n 
A 1 60  ALA 60  60  60  ALA ALA A . n 
A 1 61  SER 61  61  61  SER SER A . n 
A 1 62  ALA 62  62  62  ALA ALA A . n 
A 1 63  ILE 63  63  63  ILE ILE A . n 
A 1 64  LYS 64  64  64  LYS LYS A . n 
A 1 65  ALA 65  65  65  ALA ALA A . n 
A 1 66  VAL 66  66  66  VAL VAL A . n 
A 1 67  VAL 67  67  67  VAL VAL A . n 
A 1 68  ASP 68  68  68  ASP ASP A . n 
A 1 69  ALA 69  69  69  ALA ALA A . n 
A 1 70  GLY 70  70  70  GLY GLY A . n 
A 1 71  VAL 71  71  71  VAL VAL A . n 
A 1 72  PRO 72  72  72  PRO PRO A . n 
A 1 73  CYS 73  73  73  CYS CYS A . n 
A 1 74  TYR 74  74  74  TYR TYR A . n 
A 1 75  PHE 75  75  75  PHE PHE A . n 
A 1 76  ILE 76  76  76  ILE ILE A . n 
A 1 77  HIS 77  77  77  HIS HIS A . n 
A 1 78  GLY 78  78  78  GLY GLY A . n 
A 1 79  ASN 79  79  79  ASN ASN A . n 
A 1 80  ARG 80  80  80  ARG ARG A . n 
A 1 81  ASP 81  81  81  ASP ASP A . n 
A 1 82  PHE 82  82  82  PHE PHE A . n 
A 1 83  LEU 83  83  83  LEU LEU A . n 
A 1 84  VAL 84  84  84  VAL VAL A . n 
A 1 85  GLY 85  85  85  GLY GLY A . n 
A 1 86  GLN 86  86  86  GLN GLN A . n 
A 1 87  ARG 87  87  87  ARG ARG A . n 
A 1 88  PHE 88  88  88  PHE PHE A . n 
A 1 89  ALA 89  89  89  ALA ALA A . n 
A 1 90  ARG 90  90  90  ARG ARG A . n 
A 1 91  GLN 91  91  91  GLN GLN A . n 
A 1 92  SER 92  92  92  SER SER A . n 
A 1 93  GLY 93  93  93  GLY GLY A . n 
A 1 94  MET 94  94  94  MET MET A . n 
A 1 95  ILE 95  95  95  ILE ILE A . n 
A 1 96  LEU 96  96  96  LEU LEU A . n 
A 1 97  LEU 97  97  97  LEU LEU A . n 
A 1 98  ALA 98  98  98  ALA ALA A . n 
A 1 99  GLU 99  99  99  GLU GLU A . n 
A 1 100 GLU 100 100 100 GLU GLU A . n 
A 1 101 GLU 101 101 101 GLU GLU A . n 
A 1 102 ARG 102 102 102 ARG ARG A . n 
A 1 103 LEU 103 103 103 LEU LEU A . n 
A 1 104 ASP 104 104 104 ASP ASP A . n 
A 1 105 LEU 105 105 105 LEU LEU A . n 
A 1 106 TYR 106 106 106 TYR TYR A . n 
A 1 107 GLY 107 107 107 GLY GLY A . n 
A 1 108 ARG 108 108 108 ARG ARG A . n 
A 1 109 GLU 109 109 109 GLU GLU A . n 
A 1 110 VAL 110 110 110 VAL VAL A . n 
A 1 111 LEU 111 111 111 LEU LEU A . n 
A 1 112 ILE 112 112 112 ILE ILE A . n 
A 1 113 MET 113 113 113 MET MET A . n 
A 1 114 HIS 114 114 114 HIS HIS A . n 
A 1 115 GLY 115 115 115 GLY GLY A . n 
A 1 116 ASP 116 116 116 ASP ASP A . n 
A 1 117 THR 117 117 117 THR THR A . n 
A 1 118 LEU 118 118 118 LEU LEU A . n 
A 1 119 CYS 119 119 119 CYS CYS A . n 
A 1 120 THR 120 120 120 THR THR A . n 
A 1 121 ASP 121 121 121 ASP ASP A . n 
A 1 122 ASP 122 122 122 ASP ASP A . n 
A 1 123 GLN 123 123 123 GLN GLN A . n 
A 1 124 GLY 124 124 124 GLY GLY A . n 
A 1 125 TYR 125 125 125 TYR TYR A . n 
A 1 126 LEU 126 126 126 LEU LEU A . n 
A 1 127 ALA 127 127 127 ALA ALA A . n 
A 1 128 PHE 128 128 128 PHE PHE A . n 
A 1 129 ARG 129 129 129 ARG ARG A . n 
A 1 130 ALA 130 130 130 ALA ALA A . n 
A 1 131 LYS 131 131 131 LYS LYS A . n 
A 1 132 VAL 132 132 132 VAL VAL A . n 
A 1 133 HIS 133 133 133 HIS HIS A . n 
A 1 134 THR 134 134 134 THR THR A . n 
A 1 135 PRO 135 135 135 PRO PRO A . n 
A 1 136 TRP 136 136 136 TRP TRP A . n 
A 1 137 ILE 137 137 137 ILE ILE A . n 
A 1 138 GLN 138 138 138 GLN GLN A . n 
A 1 139 ARG 139 139 139 ARG ARG A . n 
A 1 140 LEU 140 140 140 LEU LEU A . n 
A 1 141 PHE 141 141 141 PHE PHE A . n 
A 1 142 LEU 142 142 142 LEU LEU A . n 
A 1 143 ALA 143 143 143 ALA ALA A . n 
A 1 144 LEU 144 144 144 LEU LEU A . n 
A 1 145 PRO 145 145 145 PRO PRO A . n 
A 1 146 LEU 146 146 146 LEU LEU A . n 
A 1 147 PHE 147 147 147 PHE PHE A . n 
A 1 148 ILE 148 148 148 ILE ILE A . n 
A 1 149 ARG 149 149 149 ARG ARG A . n 
A 1 150 HIS 150 150 150 HIS HIS A . n 
A 1 151 ARG 151 151 151 ARG ARG A . n 
A 1 152 ILE 152 152 152 ILE ILE A . n 
A 1 153 ALA 153 153 153 ALA ALA A . n 
A 1 154 ALA 154 154 154 ALA ALA A . n 
A 1 155 ARG 155 155 155 ARG ARG A . n 
A 1 156 MET 156 156 156 MET MET A . n 
A 1 157 ARG 157 157 157 ARG ARG A . n 
A 1 158 ALA 158 158 158 ALA ALA A . n 
A 1 159 ASP 159 159 159 ASP ASP A . n 
A 1 160 SER 160 160 160 SER SER A . n 
A 1 161 LYS 161 161 161 LYS LYS A . n 
A 1 162 ALA 162 162 162 ALA ALA A . n 
A 1 163 ALA 163 163 ?   ?   ?   A . n 
A 1 164 ASN 164 164 ?   ?   ?   A . n 
A 1 165 SER 165 165 ?   ?   ?   A . n 
A 1 166 SER 166 166 ?   ?   ?   A . n 
A 1 167 LYS 167 167 ?   ?   ?   A . n 
A 1 168 SER 168 168 ?   ?   ?   A . n 
A 1 169 MET 169 169 ?   ?   ?   A . n 
A 1 170 GLU 170 170 ?   ?   ?   A . n 
A 1 171 ILE 171 171 171 ILE ILE A . n 
A 1 172 MET 172 172 172 MET MET A . n 
A 1 173 ASP 173 173 173 ASP ASP A . n 
A 1 174 VAL 174 174 174 VAL VAL A . n 
A 1 175 ASN 175 175 175 ASN ASN A . n 
A 1 176 PRO 176 176 176 PRO PRO A . n 
A 1 177 GLN 177 177 177 GLN GLN A . n 
A 1 178 ALA 178 178 178 ALA ALA A . n 
A 1 179 VAL 179 179 179 VAL VAL A . n 
A 1 180 VAL 180 180 180 VAL VAL A . n 
A 1 181 ASP 181 181 181 ASP ASP A . n 
A 1 182 ALA 182 182 182 ALA ALA A . n 
A 1 183 MET 183 183 183 MET MET A . n 
A 1 184 GLU 184 184 184 GLU GLU A . n 
A 1 185 ARG 185 185 185 ARG ARG A . n 
A 1 186 HIS 186 186 186 HIS HIS A . n 
A 1 187 HIS 187 187 187 HIS HIS A . n 
A 1 188 VAL 188 188 188 VAL VAL A . n 
A 1 189 GLN 189 189 189 GLN GLN A . n 
A 1 190 TRP 190 190 190 TRP TRP A . n 
A 1 191 LEU 191 191 191 LEU LEU A . n 
A 1 192 ILE 192 192 192 ILE ILE A . n 
A 1 193 HIS 193 193 193 HIS HIS A . n 
A 1 194 GLY 194 194 194 GLY GLY A . n 
A 1 195 HIS 195 195 195 HIS HIS A . n 
A 1 196 THR 196 196 196 THR THR A . n 
A 1 197 HIS 197 197 197 HIS HIS A . n 
A 1 198 ARG 198 198 198 ARG ARG A . n 
A 1 199 PRO 199 199 199 PRO PRO A . n 
A 1 200 ALA 200 200 200 ALA ALA A . n 
A 1 201 VAL 201 201 201 VAL VAL A . n 
A 1 202 HIS 202 202 202 HIS HIS A . n 
A 1 203 GLU 203 203 203 GLU GLU A . n 
A 1 204 LEU 204 204 204 LEU LEU A . n 
A 1 205 GLN 205 205 205 GLN GLN A . n 
A 1 206 ALA 206 206 206 ALA ALA A . n 
A 1 207 ASN 207 207 207 ASN ASN A . n 
A 1 208 GLY 208 208 208 GLY GLY A . n 
A 1 209 GLN 209 209 209 GLN GLN A . n 
A 1 210 PRO 210 210 210 PRO PRO A . n 
A 1 211 ALA 211 211 211 ALA ALA A . n 
A 1 212 TRP 212 212 212 TRP TRP A . n 
A 1 213 ARG 213 213 213 ARG ARG A . n 
A 1 214 VAL 214 214 214 VAL VAL A . n 
A 1 215 VAL 215 215 215 VAL VAL A . n 
A 1 216 LEU 216 216 216 LEU LEU A . n 
A 1 217 GLY 217 217 217 GLY GLY A . n 
A 1 218 ALA 218 218 218 ALA ALA A . n 
A 1 219 TRP 219 219 219 TRP TRP A . n 
A 1 220 HIS 220 220 220 HIS HIS A . n 
A 1 221 SER 221 221 221 SER SER A . n 
A 1 222 GLU 222 222 222 GLU GLU A . n 
A 1 223 GLY 223 223 223 GLY GLY A . n 
A 1 224 SER 224 224 224 SER SER A . n 
A 1 225 MET 225 225 225 MET MET A . n 
A 1 226 VAL 226 226 226 VAL VAL A . n 
A 1 227 LYS 227 227 227 LYS LYS A . n 
A 1 228 VAL 228 228 228 VAL VAL A . n 
A 1 229 THR 229 229 229 THR THR A . n 
A 1 230 PRO 230 230 230 PRO PRO A . n 
A 1 231 ASP 231 231 231 ASP ASP A . n 
A 1 232 ASP 232 232 232 ASP ASP A . n 
A 1 233 VAL 233 233 233 VAL VAL A . n 
A 1 234 GLU 234 234 234 GLU GLU A . n 
A 1 235 LEU 235 235 235 LEU LEU A . n 
A 1 236 ILE 236 236 236 ILE ILE A . n 
A 1 237 HIS 237 237 237 HIS HIS A . n 
A 1 238 PHE 238 238 238 PHE PHE A . n 
A 1 239 PRO 239 239 239 PRO PRO A . n 
A 1 240 PHE 240 240 240 PHE PHE A . n 
A 1 241 LEU 241 241 241 LEU LEU A . n 
A 1 242 GLU 242 242 242 GLU GLU A . n 
A 1 243 GLU 243 243 243 GLU GLU A . n 
A 1 244 ASN 244 244 244 ASN ASN A . n 
A 1 245 LEU 245 245 245 LEU LEU A . n 
A 1 246 TYR 246 246 246 TYR TYR A . n 
A 1 247 PHE 247 247 247 PHE PHE A . n 
A 1 248 GLN 248 248 248 GLN GLN A . n 
A 1 249 SER 249 249 249 SER SER A . n 
A 1 250 HIS 250 250 250 HIS HIS A . n 
A 1 251 HIS 251 251 251 HIS HIS A . n 
A 1 252 HIS 252 252 252 HIS HIS A . n 
A 1 253 HIS 253 253 ?   ?   ?   A . n 
A 1 254 HIS 254 254 ?   ?   ?   A . n 
A 1 255 HIS 255 255 ?   ?   ?   A . n 
A 1 256 HIS 256 256 ?   ?   ?   A . n 
A 1 257 HIS 257 257 ?   ?   ?   A . n 
A 1 258 HIS 258 258 ?   ?   ?   A . n 
A 1 259 HIS 259 259 ?   ?   ?   A . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        A1AV0 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   A1AV0 
_pdbx_entity_instance_feature.auth_asym_id   ? 
_pdbx_entity_instance_feature.auth_seq_num   ? 
_pdbx_entity_instance_feature.feature_type   'SUBJECT OF INVESTIGATION' 
_pdbx_entity_instance_feature.details        ? 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
B 2 A1AV0 1   301 301 A1AV0 LIG A . 
C 3 PEG   1   302 302 PEG   PEG A . 
D 3 PEG   1   303 303 PEG   PEG A . 
E 4 MN    1   304 1   MN    MN  A . 
F 4 MN    1   305 2   MN    MN  A . 
G 5 HOH   1   401 10  HOH   HOH A . 
G 5 HOH   2   402 109 HOH   HOH A . 
G 5 HOH   3   403 33  HOH   HOH A . 
G 5 HOH   4   404 123 HOH   HOH A . 
G 5 HOH   5   405 59  HOH   HOH A . 
G 5 HOH   6   406 132 HOH   HOH A . 
G 5 HOH   7   407 39  HOH   HOH A . 
G 5 HOH   8   408 128 HOH   HOH A . 
G 5 HOH   9   409 35  HOH   HOH A . 
G 5 HOH   10  410 93  HOH   HOH A . 
G 5 HOH   11  411 3   HOH   HOH A . 
G 5 HOH   12  412 16  HOH   HOH A . 
G 5 HOH   13  413 135 HOH   HOH A . 
G 5 HOH   14  414 47  HOH   HOH A . 
G 5 HOH   15  415 21  HOH   HOH A . 
G 5 HOH   16  416 97  HOH   HOH A . 
G 5 HOH   17  417 103 HOH   HOH A . 
G 5 HOH   18  418 40  HOH   HOH A . 
G 5 HOH   19  419 62  HOH   HOH A . 
G 5 HOH   20  420 78  HOH   HOH A . 
G 5 HOH   21  421 25  HOH   HOH A . 
G 5 HOH   22  422 144 HOH   HOH A . 
G 5 HOH   23  423 1   HOH   HOH A . 
G 5 HOH   24  424 14  HOH   HOH A . 
G 5 HOH   25  425 19  HOH   HOH A . 
G 5 HOH   26  426 49  HOH   HOH A . 
G 5 HOH   27  427 11  HOH   HOH A . 
G 5 HOH   28  428 99  HOH   HOH A . 
G 5 HOH   29  429 9   HOH   HOH A . 
G 5 HOH   30  430 17  HOH   HOH A . 
G 5 HOH   31  431 64  HOH   HOH A . 
G 5 HOH   32  432 5   HOH   HOH A . 
G 5 HOH   33  433 38  HOH   HOH A . 
G 5 HOH   34  434 15  HOH   HOH A . 
G 5 HOH   35  435 52  HOH   HOH A . 
G 5 HOH   36  436 24  HOH   HOH A . 
G 5 HOH   37  437 31  HOH   HOH A . 
G 5 HOH   38  438 133 HOH   HOH A . 
G 5 HOH   39  439 60  HOH   HOH A . 
G 5 HOH   40  440 8   HOH   HOH A . 
G 5 HOH   41  441 61  HOH   HOH A . 
G 5 HOH   42  442 22  HOH   HOH A . 
G 5 HOH   43  443 12  HOH   HOH A . 
G 5 HOH   44  444 34  HOH   HOH A . 
G 5 HOH   45  445 79  HOH   HOH A . 
G 5 HOH   46  446 77  HOH   HOH A . 
G 5 HOH   47  447 26  HOH   HOH A . 
G 5 HOH   48  448 85  HOH   HOH A . 
G 5 HOH   49  449 117 HOH   HOH A . 
G 5 HOH   50  450 13  HOH   HOH A . 
G 5 HOH   51  451 37  HOH   HOH A . 
G 5 HOH   52  452 32  HOH   HOH A . 
G 5 HOH   53  453 65  HOH   HOH A . 
G 5 HOH   54  454 6   HOH   HOH A . 
G 5 HOH   55  455 56  HOH   HOH A . 
G 5 HOH   56  456 67  HOH   HOH A . 
G 5 HOH   57  457 68  HOH   HOH A . 
G 5 HOH   58  458 27  HOH   HOH A . 
G 5 HOH   59  459 28  HOH   HOH A . 
G 5 HOH   60  460 118 HOH   HOH A . 
G 5 HOH   61  461 41  HOH   HOH A . 
G 5 HOH   62  462 53  HOH   HOH A . 
G 5 HOH   63  463 58  HOH   HOH A . 
G 5 HOH   64  464 7   HOH   HOH A . 
G 5 HOH   65  465 63  HOH   HOH A . 
G 5 HOH   66  466 74  HOH   HOH A . 
G 5 HOH   67  467 4   HOH   HOH A . 
G 5 HOH   68  468 36  HOH   HOH A . 
G 5 HOH   69  469 20  HOH   HOH A . 
G 5 HOH   70  470 43  HOH   HOH A . 
G 5 HOH   71  471 98  HOH   HOH A . 
G 5 HOH   72  472 69  HOH   HOH A . 
G 5 HOH   73  473 136 HOH   HOH A . 
G 5 HOH   74  474 54  HOH   HOH A . 
G 5 HOH   75  475 145 HOH   HOH A . 
G 5 HOH   76  476 102 HOH   HOH A . 
G 5 HOH   77  477 44  HOH   HOH A . 
G 5 HOH   78  478 142 HOH   HOH A . 
G 5 HOH   79  479 101 HOH   HOH A . 
G 5 HOH   80  480 51  HOH   HOH A . 
G 5 HOH   81  481 124 HOH   HOH A . 
G 5 HOH   82  482 42  HOH   HOH A . 
G 5 HOH   83  483 143 HOH   HOH A . 
G 5 HOH   84  484 104 HOH   HOH A . 
G 5 HOH   85  485 81  HOH   HOH A . 
G 5 HOH   86  486 18  HOH   HOH A . 
G 5 HOH   87  487 50  HOH   HOH A . 
G 5 HOH   88  488 46  HOH   HOH A . 
G 5 HOH   89  489 83  HOH   HOH A . 
G 5 HOH   90  490 147 HOH   HOH A . 
G 5 HOH   91  491 100 HOH   HOH A . 
G 5 HOH   92  492 48  HOH   HOH A . 
G 5 HOH   93  493 96  HOH   HOH A . 
G 5 HOH   94  494 111 HOH   HOH A . 
G 5 HOH   95  495 86  HOH   HOH A . 
G 5 HOH   96  496 66  HOH   HOH A . 
G 5 HOH   97  497 92  HOH   HOH A . 
G 5 HOH   98  498 120 HOH   HOH A . 
G 5 HOH   99  499 30  HOH   HOH A . 
G 5 HOH   100 500 23  HOH   HOH A . 
G 5 HOH   101 501 146 HOH   HOH A . 
G 5 HOH   102 502 2   HOH   HOH A . 
G 5 HOH   103 503 95  HOH   HOH A . 
G 5 HOH   104 504 80  HOH   HOH A . 
G 5 HOH   105 505 115 HOH   HOH A . 
G 5 HOH   106 506 94  HOH   HOH A . 
G 5 HOH   107 507 106 HOH   HOH A . 
G 5 HOH   108 508 116 HOH   HOH A . 
G 5 HOH   109 509 72  HOH   HOH A . 
G 5 HOH   110 510 75  HOH   HOH A . 
G 5 HOH   111 511 126 HOH   HOH A . 
G 5 HOH   112 512 73  HOH   HOH A . 
G 5 HOH   113 513 127 HOH   HOH A . 
G 5 HOH   114 514 70  HOH   HOH A . 
G 5 HOH   115 515 82  HOH   HOH A . 
G 5 HOH   116 516 76  HOH   HOH A . 
G 5 HOH   117 517 29  HOH   HOH A . 
G 5 HOH   118 518 125 HOH   HOH A . 
G 5 HOH   119 519 134 HOH   HOH A . 
G 5 HOH   120 520 71  HOH   HOH A . 
G 5 HOH   121 521 91  HOH   HOH A . 
G 5 HOH   122 522 87  HOH   HOH A . 
G 5 HOH   123 523 55  HOH   HOH A . 
G 5 HOH   124 524 89  HOH   HOH A . 
G 5 HOH   125 525 114 HOH   HOH A . 
G 5 HOH   126 526 57  HOH   HOH A . 
G 5 HOH   127 527 88  HOH   HOH A . 
G 5 HOH   128 528 137 HOH   HOH A . 
G 5 HOH   129 529 45  HOH   HOH A . 
G 5 HOH   130 530 139 HOH   HOH A . 
G 5 HOH   131 531 130 HOH   HOH A . 
G 5 HOH   132 532 107 HOH   HOH A . 
G 5 HOH   133 533 90  HOH   HOH A . 
G 5 HOH   134 534 84  HOH   HOH A . 
G 5 HOH   135 535 129 HOH   HOH A . 
G 5 HOH   136 536 122 HOH   HOH A . 
G 5 HOH   137 537 148 HOH   HOH A . 
# 
loop_
_pdbx_unobs_or_zero_occ_atoms.id 
_pdbx_unobs_or_zero_occ_atoms.PDB_model_num 
_pdbx_unobs_or_zero_occ_atoms.polymer_flag 
_pdbx_unobs_or_zero_occ_atoms.occupancy_flag 
_pdbx_unobs_or_zero_occ_atoms.auth_asym_id 
_pdbx_unobs_or_zero_occ_atoms.auth_comp_id 
_pdbx_unobs_or_zero_occ_atoms.auth_seq_id 
_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code 
_pdbx_unobs_or_zero_occ_atoms.auth_atom_id 
_pdbx_unobs_or_zero_occ_atoms.label_alt_id 
_pdbx_unobs_or_zero_occ_atoms.label_asym_id 
_pdbx_unobs_or_zero_occ_atoms.label_comp_id 
_pdbx_unobs_or_zero_occ_atoms.label_seq_id 
_pdbx_unobs_or_zero_occ_atoms.label_atom_id 
1  1 Y 1 A GLU 109 ? CG  ? A GLU 109 CG  
2  1 Y 1 A GLU 109 ? CD  ? A GLU 109 CD  
3  1 Y 1 A GLU 109 ? OE1 ? A GLU 109 OE1 
4  1 Y 1 A GLU 109 ? OE2 ? A GLU 109 OE2 
5  1 Y 1 A GLN 123 ? CG  ? A GLN 123 CG  
6  1 Y 1 A GLN 123 ? CD  ? A GLN 123 CD  
7  1 Y 1 A GLN 123 ? OE1 ? A GLN 123 OE1 
8  1 Y 1 A GLN 123 ? NE2 ? A GLN 123 NE2 
9  1 Y 1 A LYS 131 ? CD  ? A LYS 131 CD  
10 1 Y 1 A LYS 131 ? CE  ? A LYS 131 CE  
11 1 Y 1 A LYS 131 ? NZ  ? A LYS 131 NZ  
12 1 Y 1 A LYS 161 ? CG  ? A LYS 161 CG  
13 1 Y 1 A LYS 161 ? CD  ? A LYS 161 CD  
14 1 Y 1 A LYS 161 ? CE  ? A LYS 161 CE  
15 1 Y 1 A LYS 161 ? NZ  ? A LYS 161 NZ  
16 1 Y 1 A ALA 162 ? CB  ? A ALA 162 CB  
17 1 Y 1 A GLU 222 ? CG  ? A GLU 222 CG  
18 1 Y 1 A GLU 222 ? CD  ? A GLU 222 CD  
19 1 Y 1 A GLU 222 ? OE1 ? A GLU 222 OE1 
20 1 Y 1 A GLU 222 ? OE2 ? A GLU 222 OE2 
21 1 Y 1 A GLU 242 ? CG  ? A GLU 242 CG  
22 1 Y 1 A GLU 242 ? CD  ? A GLU 242 CD  
23 1 Y 1 A GLU 242 ? OE1 ? A GLU 242 OE1 
24 1 Y 1 A GLU 242 ? OE2 ? A GLU 242 OE2 
25 1 Y 1 A LEU 245 ? CD1 ? A LEU 245 CD1 
26 1 Y 1 A LEU 245 ? CD2 ? A LEU 245 CD2 
27 1 Y 1 A GLN 248 ? CG  ? A GLN 248 CG  
28 1 Y 1 A GLN 248 ? CD  ? A GLN 248 CD  
29 1 Y 1 A GLN 248 ? OE1 ? A GLN 248 OE1 
30 1 Y 1 A GLN 248 ? NE2 ? A GLN 248 NE2 
31 1 Y 1 A SER 249 ? OG  ? A SER 249 OG  
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement       ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? 1.19.2_4158 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS    ? ? ? .           2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? XSCALE ? ? ? .           3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? .           4 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.000 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  120.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9CCZ 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     106.220 
_cell.length_a_esd                 ? 
_cell.length_b                     106.220 
_cell.length_b_esd                 ? 
_cell.length_c                     53.620 
_cell.length_c_esd                 ? 
_cell.volume                       523926.102 
_cell.volume_esd                   ? 
_cell.Z_PDB                        6 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
_cell.pdbx_esd_method              ? 
# 
_symmetry.entry_id                         9CCZ 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                154 
_symmetry.space_group_name_Hall            
;P 32 2"
;
_symmetry.space_group_name_H-M             'P 32 2 1' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   9CCZ 
_exptl.crystals_number            1 
_exptl.details                    ? 
_exptl.method                     'X-RAY DIFFRACTION' 
_exptl.method_details             ? 
# 
_exptl_crystal.colour                       ? 
_exptl_crystal.density_diffrn               ? 
_exptl_crystal.density_Matthews             2.95 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          58.27 
_exptl_crystal.description                  ? 
_exptl_crystal.F_000                        ? 
_exptl_crystal.id                           1 
_exptl_crystal.preparation                  ? 
_exptl_crystal.size_max                     ? 
_exptl_crystal.size_mid                     ? 
_exptl_crystal.size_min                     ? 
_exptl_crystal.size_rad                     ? 
_exptl_crystal.colour_lustre                ? 
_exptl_crystal.colour_modifier              ? 
_exptl_crystal.colour_primary               ? 
_exptl_crystal.density_meas                 ? 
_exptl_crystal.density_meas_esd             ? 
_exptl_crystal.density_meas_gt              ? 
_exptl_crystal.density_meas_lt              ? 
_exptl_crystal.density_meas_temp            ? 
_exptl_crystal.density_meas_temp_esd        ? 
_exptl_crystal.density_meas_temp_gt         ? 
_exptl_crystal.density_meas_temp_lt         ? 
_exptl_crystal.pdbx_crystal_image_url       ? 
_exptl_crystal.pdbx_crystal_image_format    ? 
_exptl_crystal.pdbx_mosaicity               ? 
_exptl_crystal.pdbx_mosaicity_esd           ? 
_exptl_crystal.pdbx_mosaic_method           ? 
_exptl_crystal.pdbx_mosaic_block_size       ? 
_exptl_crystal.pdbx_mosaic_block_size_esd   ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'VAPOR DIFFUSION, SITTING DROP' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              ? 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    
;1.25 mg/mL of LpxH, 
0.16 mM JH-LPH-92, 
10 mM MES (pH 6.0), 
100 mM NaCl, 
0.5 mM DTT, 
2.5% glycerol, 
0.8% DMSO, 
0.05 M Sodium Acetate pH 5.0, 
and 17 % w/v PEG 400
;
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            293 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS PILATUS 6M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2024-06-20 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   1.00003 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.current                     ? 
_diffrn_source.details                     ? 
_diffrn_source.diffrn_id                   1 
_diffrn_source.power                       ? 
_diffrn_source.size                        ? 
_diffrn_source.source                      SYNCHROTRON 
_diffrn_source.target                      ? 
_diffrn_source.type                        'ALS BEAMLINE 5.0.2' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        1.00003 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   5.0.2 
_diffrn_source.pdbx_synchrotron_site       ALS 
# 
_reflns.B_iso_Wilson_estimate                          28.62 
_reflns.entry_id                                       9CCZ 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              2.10 
_reflns.d_resolution_low                               45.99 
_reflns.details                                        ? 
_reflns.limit_h_max                                    ? 
_reflns.limit_h_min                                    ? 
_reflns.limit_k_max                                    ? 
_reflns.limit_k_min                                    ? 
_reflns.limit_l_max                                    ? 
_reflns.limit_l_min                                    ? 
_reflns.number_all                                     ? 
_reflns.number_obs                                     20620 
_reflns.observed_criterion                             ? 
_reflns.observed_criterion_F_max                       ? 
_reflns.observed_criterion_F_min                       ? 
_reflns.observed_criterion_I_max                       ? 
_reflns.observed_criterion_I_min                       ? 
_reflns.observed_criterion_sigma_F                     ? 
_reflns.observed_criterion_sigma_I                     ? 
_reflns.percent_possible_obs                           99.89 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                10.0 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          8.02 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                ? 
_reflns.pdbx_Rpim_I_all                                ? 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.991 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              ? 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
_reflns_shell.d_res_high                                    2.10 
_reflns_shell.d_res_low                                     2.175 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           ? 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             2036 
_reflns_shell.percent_possible_obs                          ? 
_reflns_shell.Rmerge_F_all                                  ? 
_reflns_shell.Rmerge_F_obs                                  ? 
_reflns_shell.meanI_over_sigI_gt                            ? 
_reflns_shell.meanI_over_uI_all                             ? 
_reflns_shell.meanI_over_uI_gt                              ? 
_reflns_shell.number_measured_gt                            ? 
_reflns_shell.number_unique_gt                              ? 
_reflns_shell.percent_possible_gt                           ? 
_reflns_shell.Rmerge_F_gt                                   ? 
_reflns_shell.Rmerge_I_gt                                   ? 
_reflns_shell.pdbx_redundancy                               ? 
_reflns_shell.pdbx_chi_squared                              ? 
_reflns_shell.pdbx_netI_over_sigmaI_all                     ? 
_reflns_shell.pdbx_netI_over_sigmaI_obs                     ? 
_reflns_shell.pdbx_Rrim_I_all                               ? 
_reflns_shell.pdbx_Rpim_I_all                               ? 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.856 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          ? 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  ? 
_reflns_shell.pdbx_Rsym_value                               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal             ? 
_reflns_shell.pdbx_percent_possible_spherical               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous   ? 
_reflns_shell.pdbx_percent_possible_spherical_anomalous     ? 
_reflns_shell.pdbx_redundancy_anomalous                     ? 
_reflns_shell.pdbx_CC_half_anomalous                        ? 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous             ? 
_reflns_shell.pdbx_percent_possible_anomalous               ? 
# 
_refine.aniso_B[1][1]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               37.97 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               ? 
_refine.correlation_coeff_Fo_to_Fc_free          ? 
_refine.details                                  ? 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 9CCZ 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.ls_abs_structure_details                 ? 
_refine.ls_abs_structure_Flack                   ? 
_refine.ls_abs_structure_Flack_esd               ? 
_refine.ls_abs_structure_Rogers                  ? 
_refine.ls_abs_structure_Rogers_esd              ? 
_refine.ls_d_res_high                            2.10 
_refine.ls_d_res_low                             45.99 
_refine.ls_extinction_coef                       ? 
_refine.ls_extinction_coef_esd                   ? 
_refine.ls_extinction_expression                 ? 
_refine.ls_extinction_method                     ? 
_refine.ls_goodness_of_fit_all                   ? 
_refine.ls_goodness_of_fit_all_esd               ? 
_refine.ls_goodness_of_fit_obs                   ? 
_refine.ls_goodness_of_fit_obs_esd               ? 
_refine.ls_hydrogen_treatment                    ? 
_refine.ls_matrix_type                           ? 
_refine.ls_number_constraints                    ? 
_refine.ls_number_parameters                     ? 
_refine.ls_number_reflns_all                     ? 
_refine.ls_number_reflns_obs                     20617 
_refine.ls_number_reflns_R_free                  1030 
_refine.ls_number_reflns_R_work                  19587 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.91 
_refine.ls_percent_reflns_R_free                 5.00 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1844 
_refine.ls_R_factor_R_free                       0.2122 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1829 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    'FLAT BULK SOLVENT MODEL' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          1.37 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       'GeoStd + Monomer Library + CDL v1.2' 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.pdbx_solvent_vdw_probe_radii             1.1100 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             0.9000 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 21.6962 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             ? 
_refine.overall_SU_ML                            0.1943 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       2.10 
_refine_hist.d_res_low                        45.99 
_refine_hist.number_atoms_solvent             137 
_refine_hist.number_atoms_total               2109 
_refine_hist.number_reflns_all                ? 
_refine_hist.number_reflns_obs                ? 
_refine_hist.number_reflns_R_free             ? 
_refine_hist.number_reflns_R_work             ? 
_refine_hist.R_factor_all                     ? 
_refine_hist.R_factor_obs                     ? 
_refine_hist.R_factor_R_free                  ? 
_refine_hist.R_factor_R_work                  ? 
_refine_hist.pdbx_number_residues_total       ? 
_refine_hist.pdbx_B_iso_mean_ligand           ? 
_refine_hist.pdbx_B_iso_mean_solvent          ? 
_refine_hist.pdbx_number_atoms_protein        1924 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         48 
_refine_hist.pdbx_number_atoms_lipid          ? 
_refine_hist.pdbx_number_atoms_carb           ? 
_refine_hist.pdbx_pseudo_atom_details         ? 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.criterion 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.number 
_refine_ls_restr.rejects 
_refine_ls_restr.type 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' ? 0.0024  ? 2039 ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 0.5297  ? 2778 ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 0.0428  ? 294  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.0037  ? 360  ? f_plane_restr      ? ? 
'X-RAY DIFFRACTION' ? 15.7146 ? 313  ? f_dihedral_angle_d ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_R_complete 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
_refine_ls_shell.R_factor_R_free 
'X-RAY DIFFRACTION' 2.10 2.21  . . 146 2777 99.97  . . . . 0.2243 . . . . . . . . . . . 0.2550 
'X-RAY DIFFRACTION' 2.21 2.35  . . 144 2747 99.66  . . . . 0.1994 . . . . . . . . . . . 0.2559 
'X-RAY DIFFRACTION' 2.35 2.53  . . 146 2785 99.93  . . . . 0.1932 . . . . . . . . . . . 0.2365 
'X-RAY DIFFRACTION' 2.53 2.78  . . 145 2762 99.86  . . . . 0.1823 . . . . . . . . . . . 0.2221 
'X-RAY DIFFRACTION' 2.79 3.19  . . 147 2789 100.00 . . . . 0.1905 . . . . . . . . . . . 0.2224 
'X-RAY DIFFRACTION' 3.19 4.02  . . 148 2816 100.00 . . . . 0.1663 . . . . . . . . . . . 0.2089 
'X-RAY DIFFRACTION' 4.02 45.99 . . 154 2911 99.97  . . . . 0.1777 . . . . . . . . . . . 0.1855 
# 
_struct.entry_id                     9CCZ 
_struct.title                        'Crystal Structure of the K. pneumoniae LpxH / JH-LPH-92 Complex' 
_struct.pdbx_model_details           ? 
_struct.pdbx_formula_weight          ? 
_struct.pdbx_formula_weight_method   ? 
_struct.pdbx_model_type_details      ? 
_struct.pdbx_CASP_flag               N 
# 
_struct_keywords.entry_id        9CCZ 
_struct_keywords.text            'antibiotic, LpxH, lipid A' 
_struct_keywords.pdbx_keywords   ANTIBIOTIC 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 2 ? 
C N N 3 ? 
D N N 3 ? 
E N N 4 ? 
F N N 4 ? 
G N N 5 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    A0A1S0WIC1_KLEPN 
_struct_ref.pdbx_db_accession          A0A1S0WIC1 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;MATLFIADLHLQTEEPAITAGFLRFLQGEARQADALYILGDLFEAWIGDDDPNPLHQQIASAIKAVVDAGVPCYFIHGNR
DFLVGQRFARQSGMILLAEEERLDLYGREVLIMHGDTLCTDDQGYLAFRAKVHTPWIQRLFLALPLFIRHRIAARMRADS
KAANSSKSMEIMDVNPQAVVDAMERHHVQWLIHGHTHRPAVHELQANGQPAWRVVLGAWHSEGSMVKVTPDDVELIHFPF

;
_struct_ref.pdbx_align_begin           1 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              9CCZ 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 1 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 240 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             A0A1S0WIC1 
_struct_ref_seq.db_align_beg                  1 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  240 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       1 
_struct_ref_seq.pdbx_auth_seq_align_end       240 
# 
loop_
_struct_ref_seq_dif.align_id 
_struct_ref_seq_dif.pdbx_pdb_id_code 
_struct_ref_seq_dif.mon_id 
_struct_ref_seq_dif.pdbx_pdb_strand_id 
_struct_ref_seq_dif.seq_num 
_struct_ref_seq_dif.pdbx_pdb_ins_code 
_struct_ref_seq_dif.pdbx_seq_db_name 
_struct_ref_seq_dif.pdbx_seq_db_accession_code 
_struct_ref_seq_dif.db_mon_id 
_struct_ref_seq_dif.pdbx_seq_db_seq_num 
_struct_ref_seq_dif.details 
_struct_ref_seq_dif.pdbx_auth_seq_num 
_struct_ref_seq_dif.pdbx_ordinal 
1 9CCZ LEU A 241 ? UNP A0A1S0WIC1 ? ? 'expression tag' 241 1  
1 9CCZ GLU A 242 ? UNP A0A1S0WIC1 ? ? 'expression tag' 242 2  
1 9CCZ GLU A 243 ? UNP A0A1S0WIC1 ? ? 'expression tag' 243 3  
1 9CCZ ASN A 244 ? UNP A0A1S0WIC1 ? ? 'expression tag' 244 4  
1 9CCZ LEU A 245 ? UNP A0A1S0WIC1 ? ? 'expression tag' 245 5  
1 9CCZ TYR A 246 ? UNP A0A1S0WIC1 ? ? 'expression tag' 246 6  
1 9CCZ PHE A 247 ? UNP A0A1S0WIC1 ? ? 'expression tag' 247 7  
1 9CCZ GLN A 248 ? UNP A0A1S0WIC1 ? ? 'expression tag' 248 8  
1 9CCZ SER A 249 ? UNP A0A1S0WIC1 ? ? 'expression tag' 249 9  
1 9CCZ HIS A 250 ? UNP A0A1S0WIC1 ? ? 'expression tag' 250 10 
1 9CCZ HIS A 251 ? UNP A0A1S0WIC1 ? ? 'expression tag' 251 11 
1 9CCZ HIS A 252 ? UNP A0A1S0WIC1 ? ? 'expression tag' 252 12 
1 9CCZ HIS A 253 ? UNP A0A1S0WIC1 ? ? 'expression tag' 253 13 
1 9CCZ HIS A 254 ? UNP A0A1S0WIC1 ? ? 'expression tag' 254 14 
1 9CCZ HIS A 255 ? UNP A0A1S0WIC1 ? ? 'expression tag' 255 15 
1 9CCZ HIS A 256 ? UNP A0A1S0WIC1 ? ? 'expression tag' 256 16 
1 9CCZ HIS A 257 ? UNP A0A1S0WIC1 ? ? 'expression tag' 257 17 
1 9CCZ HIS A 258 ? UNP A0A1S0WIC1 ? ? 'expression tag' 258 18 
1 9CCZ HIS A 259 ? UNP A0A1S0WIC1 ? ? 'expression tag' 259 19 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D,E,F,G 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1 AA1 GLU A 15  ? GLY A 28  ? GLU A 15  GLY A 28  1 ? 14 
HELX_P HELX_P2 AA2 GLU A 29  ? ALA A 33  ? GLU A 29  ALA A 33  5 ? 5  
HELX_P HELX_P3 AA3 ASN A 53  ? ALA A 69  ? ASN A 53  ALA A 69  1 ? 17 
HELX_P HELX_P4 AA4 GLY A 85  ? GLY A 93  ? GLY A 85  GLY A 93  1 ? 9  
HELX_P HELX_P5 AA5 GLY A 115 ? CYS A 119 ? GLY A 115 CYS A 119 5 ? 5  
HELX_P HELX_P6 AA6 ASP A 122 ? HIS A 133 ? ASP A 122 HIS A 133 1 ? 12 
HELX_P HELX_P7 AA7 THR A 134 ? LEU A 144 ? THR A 134 LEU A 144 1 ? 11 
HELX_P HELX_P8 AA8 PRO A 145 ? ALA A 162 ? PRO A 145 ALA A 162 1 ? 18 
HELX_P HELX_P9 AA9 ASN A 175 ? HIS A 186 ? ASN A 175 HIS A 186 1 ? 12 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
metalc1  metalc ? ? A ASP 8   OD1 ? ? ? 1_555 E MN  . MN ? ? A ASP 8   A MN  304 1_555 ? ? ? ? ? ? ? 1.930 ? ? 
metalc2  metalc ? ? A HIS 10  NE2 ? ? ? 1_555 E MN  . MN ? ? A HIS 10  A MN  304 1_555 ? ? ? ? ? ? ? 2.254 ? ? 
metalc3  metalc ? ? A ASP 41  OD2 ? ? ? 1_555 E MN  . MN ? ? A ASP 41  A MN  304 1_555 ? ? ? ? ? ? ? 2.409 ? ? 
metalc4  metalc ? ? A ASP 41  OD2 ? ? ? 1_555 F MN  . MN ? ? A ASP 41  A MN  305 1_555 ? ? ? ? ? ? ? 2.173 ? ? 
metalc5  metalc ? ? A ASN 79  OD1 ? ? ? 1_555 F MN  . MN ? ? A ASN 79  A MN  305 1_555 ? ? ? ? ? ? ? 1.894 ? ? 
metalc6  metalc ? ? A HIS 114 NE2 ? ? ? 1_555 F MN  . MN ? ? A HIS 114 A MN  305 1_555 ? ? ? ? ? ? ? 2.130 ? ? 
metalc7  metalc ? ? A HIS 195 ND1 ? ? ? 1_555 F MN  . MN ? ? A HIS 195 A MN  305 1_555 ? ? ? ? ? ? ? 2.256 ? ? 
metalc8  metalc ? ? A HIS 197 NE2 ? ? ? 1_555 E MN  . MN ? ? A HIS 197 A MN  304 1_555 ? ? ? ? ? ? ? 2.257 ? ? 
metalc9  metalc ? ? E MN  .   MN  ? ? ? 1_555 G HOH . O  ? ? A MN  304 A HOH 404 1_555 ? ? ? ? ? ? ? 1.807 ? ? 
metalc10 metalc ? ? F MN  .   MN  ? ? ? 1_555 G HOH . O  ? ? A MN  305 A HOH 404 1_555 ? ? ? ? ? ? ? 1.947 ? ? 
# 
_struct_conn_type.id          metalc 
_struct_conn_type.criteria    ? 
_struct_conn_type.reference   ? 
# 
loop_
_pdbx_struct_conn_angle.id 
_pdbx_struct_conn_angle.ptnr1_label_atom_id 
_pdbx_struct_conn_angle.ptnr1_label_alt_id 
_pdbx_struct_conn_angle.ptnr1_label_asym_id 
_pdbx_struct_conn_angle.ptnr1_label_comp_id 
_pdbx_struct_conn_angle.ptnr1_label_seq_id 
_pdbx_struct_conn_angle.ptnr1_auth_atom_id 
_pdbx_struct_conn_angle.ptnr1_auth_asym_id 
_pdbx_struct_conn_angle.ptnr1_auth_comp_id 
_pdbx_struct_conn_angle.ptnr1_auth_seq_id 
_pdbx_struct_conn_angle.ptnr1_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr1_symmetry 
_pdbx_struct_conn_angle.ptnr2_label_atom_id 
_pdbx_struct_conn_angle.ptnr2_label_alt_id 
_pdbx_struct_conn_angle.ptnr2_label_asym_id 
_pdbx_struct_conn_angle.ptnr2_label_comp_id 
_pdbx_struct_conn_angle.ptnr2_label_seq_id 
_pdbx_struct_conn_angle.ptnr2_auth_atom_id 
_pdbx_struct_conn_angle.ptnr2_auth_asym_id 
_pdbx_struct_conn_angle.ptnr2_auth_comp_id 
_pdbx_struct_conn_angle.ptnr2_auth_seq_id 
_pdbx_struct_conn_angle.ptnr2_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr2_symmetry 
_pdbx_struct_conn_angle.ptnr3_label_atom_id 
_pdbx_struct_conn_angle.ptnr3_label_alt_id 
_pdbx_struct_conn_angle.ptnr3_label_asym_id 
_pdbx_struct_conn_angle.ptnr3_label_comp_id 
_pdbx_struct_conn_angle.ptnr3_label_seq_id 
_pdbx_struct_conn_angle.ptnr3_auth_atom_id 
_pdbx_struct_conn_angle.ptnr3_auth_asym_id 
_pdbx_struct_conn_angle.ptnr3_auth_comp_id 
_pdbx_struct_conn_angle.ptnr3_auth_seq_id 
_pdbx_struct_conn_angle.ptnr3_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr3_symmetry 
_pdbx_struct_conn_angle.value 
_pdbx_struct_conn_angle.value_esd 
1  OD1 ? A ASP 8   ? A ASP 8   ? 1_555 MN ? E MN . ? A MN 304 ? 1_555 NE2 ? A HIS 10  ? A HIS 10  ? 1_555 116.1 ? 
2  OD1 ? A ASP 8   ? A ASP 8   ? 1_555 MN ? E MN . ? A MN 304 ? 1_555 OD2 ? A ASP 41  ? A ASP 41  ? 1_555 82.8  ? 
3  NE2 ? A HIS 10  ? A HIS 10  ? 1_555 MN ? E MN . ? A MN 304 ? 1_555 OD2 ? A ASP 41  ? A ASP 41  ? 1_555 101.1 ? 
4  OD1 ? A ASP 8   ? A ASP 8   ? 1_555 MN ? E MN . ? A MN 304 ? 1_555 NE2 ? A HIS 197 ? A HIS 197 ? 1_555 100.3 ? 
5  NE2 ? A HIS 10  ? A HIS 10  ? 1_555 MN ? E MN . ? A MN 304 ? 1_555 NE2 ? A HIS 197 ? A HIS 197 ? 1_555 85.3  ? 
6  OD2 ? A ASP 41  ? A ASP 41  ? 1_555 MN ? E MN . ? A MN 304 ? 1_555 NE2 ? A HIS 197 ? A HIS 197 ? 1_555 170.9 ? 
7  OD1 ? A ASP 8   ? A ASP 8   ? 1_555 MN ? E MN . ? A MN 304 ? 1_555 O   ? G HOH .   ? A HOH 404 ? 1_555 102.6 ? 
8  NE2 ? A HIS 10  ? A HIS 10  ? 1_555 MN ? E MN . ? A MN 304 ? 1_555 O   ? G HOH .   ? A HOH 404 ? 1_555 137.9 ? 
9  OD2 ? A ASP 41  ? A ASP 41  ? 1_555 MN ? E MN . ? A MN 304 ? 1_555 O   ? G HOH .   ? A HOH 404 ? 1_555 66.9  ? 
10 NE2 ? A HIS 197 ? A HIS 197 ? 1_555 MN ? E MN . ? A MN 304 ? 1_555 O   ? G HOH .   ? A HOH 404 ? 1_555 104.0 ? 
11 OD2 ? A ASP 41  ? A ASP 41  ? 1_555 MN ? F MN . ? A MN 305 ? 1_555 OD1 ? A ASN 79  ? A ASN 79  ? 1_555 96.5  ? 
12 OD2 ? A ASP 41  ? A ASP 41  ? 1_555 MN ? F MN . ? A MN 305 ? 1_555 NE2 ? A HIS 114 ? A HIS 114 ? 1_555 96.8  ? 
13 OD1 ? A ASN 79  ? A ASN 79  ? 1_555 MN ? F MN . ? A MN 305 ? 1_555 NE2 ? A HIS 114 ? A HIS 114 ? 1_555 92.1  ? 
14 OD2 ? A ASP 41  ? A ASP 41  ? 1_555 MN ? F MN . ? A MN 305 ? 1_555 ND1 ? A HIS 195 ? A HIS 195 ? 1_555 168.9 ? 
15 OD1 ? A ASN 79  ? A ASN 79  ? 1_555 MN ? F MN . ? A MN 305 ? 1_555 ND1 ? A HIS 195 ? A HIS 195 ? 1_555 89.8  ? 
16 NE2 ? A HIS 114 ? A HIS 114 ? 1_555 MN ? F MN . ? A MN 305 ? 1_555 ND1 ? A HIS 195 ? A HIS 195 ? 1_555 92.0  ? 
17 OD2 ? A ASP 41  ? A ASP 41  ? 1_555 MN ? F MN . ? A MN 305 ? 1_555 O   ? G HOH .   ? A HOH 404 ? 1_555 70.2  ? 
18 OD1 ? A ASN 79  ? A ASN 79  ? 1_555 MN ? F MN . ? A MN 305 ? 1_555 O   ? G HOH .   ? A HOH 404 ? 1_555 129.6 ? 
19 NE2 ? A HIS 114 ? A HIS 114 ? 1_555 MN ? F MN . ? A MN 305 ? 1_555 O   ? G HOH .   ? A HOH 404 ? 1_555 136.6 ? 
20 ND1 ? A HIS 195 ? A HIS 195 ? 1_555 MN ? F MN . ? A MN 305 ? 1_555 O   ? G HOH .   ? A HOH 404 ? 1_555 98.8  ? 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 6 ? 
AA2 ? 5 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? parallel      
AA1 2 3 ? parallel      
AA1 3 4 ? parallel      
AA1 4 5 ? anti-parallel 
AA1 5 6 ? anti-parallel 
AA2 1 2 ? anti-parallel 
AA2 2 3 ? parallel      
AA2 3 4 ? parallel      
AA2 4 5 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
AA1 1 ILE A 95  ? LEU A 96  ? ILE A 95  LEU A 96  
AA1 2 CYS A 73  ? PHE A 75  ? CYS A 73  PHE A 75  
AA1 3 ALA A 35  ? ILE A 38  ? ALA A 35  ILE A 38  
AA1 4 THR A 3   ? ILE A 6   ? THR A 3   ILE A 6   
AA1 5 GLY A 223 ? VAL A 228 ? GLY A 223 VAL A 228 
AA1 6 VAL A 233 ? PHE A 238 ? VAL A 233 PHE A 238 
AA2 1 GLU A 101 ? LEU A 105 ? GLU A 101 LEU A 105 
AA2 2 ARG A 108 ? ILE A 112 ? ARG A 108 ILE A 112 
AA2 3 TRP A 190 ? HIS A 193 ? TRP A 190 HIS A 193 
AA2 4 GLN A 209 ? VAL A 215 ? GLN A 209 VAL A 215 
AA2 5 ALA A 200 ? ALA A 206 ? ALA A 200 ALA A 206 
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
AA1 1 2 O ILE A 95  ? O ILE A 95  N CYS A 73  ? N CYS A 73  
AA1 2 3 O TYR A 74  ? O TYR A 74  N LEU A 36  ? N LEU A 36  
AA1 3 4 O TYR A 37  ? O TYR A 37  N LEU A 4   ? N LEU A 4   
AA1 4 5 N THR A 3   ? N THR A 3   O VAL A 228 ? O VAL A 228 
AA1 5 6 N MET A 225 ? N MET A 225 O ILE A 236 ? O ILE A 236 
AA2 1 2 N LEU A 103 ? N LEU A 103 O VAL A 110 ? O VAL A 110 
AA2 2 3 N LEU A 111 ? N LEU A 111 O ILE A 192 ? O ILE A 192 
AA2 3 4 N LEU A 191 ? N LEU A 191 O VAL A 214 ? O VAL A 214 
AA2 4 5 O ARG A 213 ? O ARG A 213 N HIS A 202 ? N HIS A 202 
# 
_pdbx_entry_details.entry_id                   9CCZ 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.has_protein_modification   N 
# 
loop_
_pdbx_validate_torsion.id 
_pdbx_validate_torsion.PDB_model_num 
_pdbx_validate_torsion.auth_comp_id 
_pdbx_validate_torsion.auth_asym_id 
_pdbx_validate_torsion.auth_seq_id 
_pdbx_validate_torsion.PDB_ins_code 
_pdbx_validate_torsion.label_alt_id 
_pdbx_validate_torsion.phi 
_pdbx_validate_torsion.psi 
1 1 LEU A 39  ? ? -93.22 46.75  
2 1 HIS A 195 ? ? 69.00  -48.65 
3 1 HIS A 220 ? ? -93.40 -60.76 
4 1 HIS A 220 ? ? -93.40 -61.20 
# 
_pdbx_struct_special_symmetry.id              1 
_pdbx_struct_special_symmetry.PDB_model_num   1 
_pdbx_struct_special_symmetry.auth_asym_id    A 
_pdbx_struct_special_symmetry.auth_comp_id    HOH 
_pdbx_struct_special_symmetry.auth_seq_id     406 
_pdbx_struct_special_symmetry.PDB_ins_code    ? 
_pdbx_struct_special_symmetry.label_asym_id   G 
_pdbx_struct_special_symmetry.label_comp_id   HOH 
_pdbx_struct_special_symmetry.label_seq_id    . 
# 
loop_
_space_group_symop.id 
_space_group_symop.operation_xyz 
1 x,y,z          
2 -y,x-y,z+2/3   
3 -x+y,-x,z+1/3  
4 x-y,-y,-z+1/3  
5 -x,-x+y,-z+2/3 
6 y,x,-z         
# 
loop_
_pdbx_refine_tls.id 
_pdbx_refine_tls.pdbx_refine_id 
_pdbx_refine_tls.details 
_pdbx_refine_tls.method 
_pdbx_refine_tls.origin_x 
_pdbx_refine_tls.origin_y 
_pdbx_refine_tls.origin_z 
_pdbx_refine_tls.T[1][1] 
_pdbx_refine_tls.T[1][1]_esd 
_pdbx_refine_tls.T[1][2] 
_pdbx_refine_tls.T[1][2]_esd 
_pdbx_refine_tls.T[1][3] 
_pdbx_refine_tls.T[1][3]_esd 
_pdbx_refine_tls.T[2][2] 
_pdbx_refine_tls.T[2][2]_esd 
_pdbx_refine_tls.T[2][3] 
_pdbx_refine_tls.T[2][3]_esd 
_pdbx_refine_tls.T[3][3] 
_pdbx_refine_tls.T[3][3]_esd 
_pdbx_refine_tls.L[1][1] 
_pdbx_refine_tls.L[1][1]_esd 
_pdbx_refine_tls.L[1][2] 
_pdbx_refine_tls.L[1][2]_esd 
_pdbx_refine_tls.L[1][3] 
_pdbx_refine_tls.L[1][3]_esd 
_pdbx_refine_tls.L[2][2] 
_pdbx_refine_tls.L[2][2]_esd 
_pdbx_refine_tls.L[2][3] 
_pdbx_refine_tls.L[2][3]_esd 
_pdbx_refine_tls.L[3][3] 
_pdbx_refine_tls.L[3][3]_esd 
_pdbx_refine_tls.S[1][1] 
_pdbx_refine_tls.S[1][1]_esd 
_pdbx_refine_tls.S[1][2] 
_pdbx_refine_tls.S[1][2]_esd 
_pdbx_refine_tls.S[1][3] 
_pdbx_refine_tls.S[1][3]_esd 
_pdbx_refine_tls.S[2][1] 
_pdbx_refine_tls.S[2][1]_esd 
_pdbx_refine_tls.S[2][2] 
_pdbx_refine_tls.S[2][2]_esd 
_pdbx_refine_tls.S[2][3] 
_pdbx_refine_tls.S[2][3]_esd 
_pdbx_refine_tls.S[3][1] 
_pdbx_refine_tls.S[3][1]_esd 
_pdbx_refine_tls.S[3][2] 
_pdbx_refine_tls.S[3][2]_esd 
_pdbx_refine_tls.S[3][3] 
_pdbx_refine_tls.S[3][3]_esd 
1 'X-RAY DIFFRACTION' ? refined -36.7511526119 -31.1772761337 -1.04985371804 0.237114409125 ? 0.0261894408617  ? -0.0112916612038 
? 0.191256401618 ? -0.0130493699636  ? 0.212049846961 ? 0.793505615551 ? -0.405178963709  ? -0.21290729691   ? 0.198607477002 ? 
0.0123491583962  ? 0.457033849137 ? 0.10824398296    ? 0.0813998425198  ? -0.1416362385    ? -0.231734312001  ? -0.165727485919 ? 
-0.162265373716  ? 0.180488717161   ? 0.128539366607   ? 2.22244261069e-05  ? 
2 'X-RAY DIFFRACTION' ? refined -38.2377161801 -18.4870774863 7.36131386393  0.197618565729 ? 0.00955240086571 ? -0.0247217383293 
? 0.18459872979  ? -0.0251294356475  ? 0.2191400413   ? 0.911146657458 ? -0.947670775403  ? -0.0422927739841 ? 1.4413078244   ? 
-0.0327452640259 ? 0.655471529269 ? -0.0739727034879 ? -0.190750555862  ? 0.150716642979   ? 0.044374555418   ? 0.0439029957364 ? 
-0.190551004461  ? -0.0948712636846 ? -0.0200995712947 ? -0.000114999801268 ? 
3 'X-RAY DIFFRACTION' ? refined -17.9299470744 -19.364637669  12.8149935286  0.324704217064 ? -0.0640028928421 ? -0.0437403754876 
? 0.383396184529 ? -0.0853097768839  ? 0.57950044143  ? 0.338880074912 ? -0.218342240547  ? -0.579645872416  ? 0.38138117684  ? 
0.0187045548761  ? 0.995138898179 ? -0.267596623206  ? -0.473929003179  ? 0.466746635907   ? 0.399348677244   ? 0.323261476641  ? 
-0.818601025773  ? -0.031965431822  ? 0.763903650387   ? 0.141838909585     ? 
4 'X-RAY DIFFRACTION' ? refined -21.0501694506 -28.8701712486 6.9693627887   0.180715327184 ? 0.0237623649901  ? -0.0353350330983 
? 0.269534657095 ? -0.00629081291532 ? 0.395969356335 ? 0.634947394761 ? -0.533520938433  ? -0.459470033537  ? 0.727998600345 ? 
0.575703579032   ? 0.484648392686 ? -0.0553164459015 ? -0.0365985219757 ? 0.364057668503   ? -0.131864597195  ? 0.113942902838  ? 
-0.494390441311  ? -0.0549944324674 ? 0.10435222074    ? -0.00311465006502  ? 
5 'X-RAY DIFFRACTION' ? refined -26.5792838807 -39.7868170003 -11.9227399305 0.275455642506 ? 0.100910714844   ? 0.00240897577055 
? 0.32512943251  ? -0.0270223974531  ? 0.292652166169 ? 0.224039546587 ? -0.0269909860659 ? -0.0218411940292 ? 0.117759960622 ? 
0.158624808625   ? 0.232263206153 ? 0.0127664920883  ? 0.19079743144    ? -0.0175257437831 ? -0.0387591442703 ? -0.193469864465 ? 
-0.0233565992029 ? 0.0468826904669  ? 0.195977815104   ? -0.0166814291726   ? 
# 
loop_
_pdbx_refine_tls_group.id 
_pdbx_refine_tls_group.pdbx_refine_id 
_pdbx_refine_tls_group.refine_tls_id 
_pdbx_refine_tls_group.beg_label_asym_id 
_pdbx_refine_tls_group.beg_label_seq_id 
_pdbx_refine_tls_group.beg_auth_asym_id 
_pdbx_refine_tls_group.beg_auth_seq_id 
_pdbx_refine_tls_group.beg_PDB_ins_code 
_pdbx_refine_tls_group.end_label_asym_id 
_pdbx_refine_tls_group.end_label_seq_id 
_pdbx_refine_tls_group.end_auth_asym_id 
_pdbx_refine_tls_group.end_auth_seq_id 
_pdbx_refine_tls_group.end_PDB_ins_code 
_pdbx_refine_tls_group.selection 
_pdbx_refine_tls_group.selection_details 
1 'X-RAY DIFFRACTION' 1 A 1   A 2   ? A 37  A 38  ? ? 
;chain 'A' and (resid 2 through 38 )
;
2 'X-RAY DIFFRACTION' 2 A 38  A 39  ? A 160 A 161 ? ? 
;chain 'A' and (resid 39 through 161 )
;
3 'X-RAY DIFFRACTION' 3 A 161 A 162 ? A 176 A 185 ? ? 
;chain 'A' and (resid 162 through 185 )
;
4 'X-RAY DIFFRACTION' 4 A 177 A 186 ? A 219 A 228 ? ? 
;chain 'A' and (resid 186 through 228 )
;
5 'X-RAY DIFFRACTION' 5 A 220 A 229 ? A 243 A 252 ? ? 
;chain 'A' and (resid 229 through 252 )
;
# 
loop_
_pdbx_distant_solvent_atoms.id 
_pdbx_distant_solvent_atoms.PDB_model_num 
_pdbx_distant_solvent_atoms.auth_atom_id 
_pdbx_distant_solvent_atoms.label_alt_id 
_pdbx_distant_solvent_atoms.auth_asym_id 
_pdbx_distant_solvent_atoms.auth_comp_id 
_pdbx_distant_solvent_atoms.auth_seq_id 
_pdbx_distant_solvent_atoms.PDB_ins_code 
_pdbx_distant_solvent_atoms.neighbor_macromolecule_distance 
_pdbx_distant_solvent_atoms.neighbor_ligand_distance 
1 1 O ? A HOH 536 ? 5.86 . 
2 1 O ? A HOH 537 ? 7.80 . 
# 
loop_
_pdbx_unobs_or_zero_occ_residues.id 
_pdbx_unobs_or_zero_occ_residues.PDB_model_num 
_pdbx_unobs_or_zero_occ_residues.polymer_flag 
_pdbx_unobs_or_zero_occ_residues.occupancy_flag 
_pdbx_unobs_or_zero_occ_residues.auth_asym_id 
_pdbx_unobs_or_zero_occ_residues.auth_comp_id 
_pdbx_unobs_or_zero_occ_residues.auth_seq_id 
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code 
_pdbx_unobs_or_zero_occ_residues.label_asym_id 
_pdbx_unobs_or_zero_occ_residues.label_comp_id 
_pdbx_unobs_or_zero_occ_residues.label_seq_id 
1  1 Y 1 A MET 1   ? A MET 1   
2  1 Y 1 A ALA 163 ? A ALA 163 
3  1 Y 1 A ASN 164 ? A ASN 164 
4  1 Y 1 A SER 165 ? A SER 165 
5  1 Y 1 A SER 166 ? A SER 166 
6  1 Y 1 A LYS 167 ? A LYS 167 
7  1 Y 1 A SER 168 ? A SER 168 
8  1 Y 1 A MET 169 ? A MET 169 
9  1 Y 1 A GLU 170 ? A GLU 170 
10 1 Y 1 A HIS 253 ? A HIS 253 
11 1 Y 1 A HIS 254 ? A HIS 254 
12 1 Y 1 A HIS 255 ? A HIS 255 
13 1 Y 1 A HIS 256 ? A HIS 256 
14 1 Y 1 A HIS 257 ? A HIS 257 
15 1 Y 1 A HIS 258 ? A HIS 258 
16 1 Y 1 A HIS 259 ? A HIS 259 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
A1AV0 N12  N  N N 1   
A1AV0 C13  C  N N 2   
A1AV0 C17  C  N N 3   
A1AV0 C21  C  Y N 4   
A1AV0 C22  C  Y N 5   
A1AV0 C24  C  Y N 6   
A1AV0 C26  C  Y N 7   
A1AV0 C28  C  N N 8   
A1AV0 C02  C  Y N 9   
A1AV0 C04  C  Y N 10  
A1AV0 C05  C  Y N 11  
A1AV0 C06  C  Y N 12  
A1AV0 C07  C  Y N 13  
A1AV0 C08  C  N N 14  
A1AV0 C14  C  N N 15  
A1AV0 C16  C  N N 16  
A1AV0 C23  C  Y N 17  
A1AV0 C25  C  Y N 18  
A1AV0 C30  C  N N 19  
A1AV0 C31  C  N N 20  
A1AV0 C32  C  N N 21  
A1AV0 F09  F  N N 22  
A1AV0 F10  F  N N 23  
A1AV0 F11  F  N N 24  
A1AV0 N03  N  Y N 25  
A1AV0 N15  N  N N 26  
A1AV0 N27  N  N N 27  
A1AV0 O19  O  N N 28  
A1AV0 O20  O  N N 29  
A1AV0 O29  O  N N 30  
A1AV0 S18  S  N N 31  
A1AV0 CL01 CL N N 32  
A1AV0 H131 H  N N 33  
A1AV0 H132 H  N N 34  
A1AV0 H171 H  N N 35  
A1AV0 H172 H  N N 36  
A1AV0 H221 H  N N 37  
A1AV0 H261 H  N N 38  
A1AV0 H051 H  N N 39  
A1AV0 H071 H  N N 40  
A1AV0 H141 H  N N 41  
A1AV0 H142 H  N N 42  
A1AV0 H162 H  N N 43  
A1AV0 H161 H  N N 44  
A1AV0 H251 H  N N 45  
A1AV0 H303 H  N N 46  
A1AV0 H302 H  N N 47  
A1AV0 H301 H  N N 48  
A1AV0 H311 H  N N 49  
A1AV0 H312 H  N N 50  
A1AV0 H321 H  N N 51  
A1AV0 H322 H  N N 52  
ALA   N    N  N N 53  
ALA   CA   C  N S 54  
ALA   C    C  N N 55  
ALA   O    O  N N 56  
ALA   CB   C  N N 57  
ALA   OXT  O  N N 58  
ALA   H    H  N N 59  
ALA   H2   H  N N 60  
ALA   HA   H  N N 61  
ALA   HB1  H  N N 62  
ALA   HB2  H  N N 63  
ALA   HB3  H  N N 64  
ALA   HXT  H  N N 65  
ARG   N    N  N N 66  
ARG   CA   C  N S 67  
ARG   C    C  N N 68  
ARG   O    O  N N 69  
ARG   CB   C  N N 70  
ARG   CG   C  N N 71  
ARG   CD   C  N N 72  
ARG   NE   N  N N 73  
ARG   CZ   C  N N 74  
ARG   NH1  N  N N 75  
ARG   NH2  N  N N 76  
ARG   OXT  O  N N 77  
ARG   H    H  N N 78  
ARG   H2   H  N N 79  
ARG   HA   H  N N 80  
ARG   HB2  H  N N 81  
ARG   HB3  H  N N 82  
ARG   HG2  H  N N 83  
ARG   HG3  H  N N 84  
ARG   HD2  H  N N 85  
ARG   HD3  H  N N 86  
ARG   HE   H  N N 87  
ARG   HH11 H  N N 88  
ARG   HH12 H  N N 89  
ARG   HH21 H  N N 90  
ARG   HH22 H  N N 91  
ARG   HXT  H  N N 92  
ASN   N    N  N N 93  
ASN   CA   C  N S 94  
ASN   C    C  N N 95  
ASN   O    O  N N 96  
ASN   CB   C  N N 97  
ASN   CG   C  N N 98  
ASN   OD1  O  N N 99  
ASN   ND2  N  N N 100 
ASN   OXT  O  N N 101 
ASN   H    H  N N 102 
ASN   H2   H  N N 103 
ASN   HA   H  N N 104 
ASN   HB2  H  N N 105 
ASN   HB3  H  N N 106 
ASN   HD21 H  N N 107 
ASN   HD22 H  N N 108 
ASN   HXT  H  N N 109 
ASP   N    N  N N 110 
ASP   CA   C  N S 111 
ASP   C    C  N N 112 
ASP   O    O  N N 113 
ASP   CB   C  N N 114 
ASP   CG   C  N N 115 
ASP   OD1  O  N N 116 
ASP   OD2  O  N N 117 
ASP   OXT  O  N N 118 
ASP   H    H  N N 119 
ASP   H2   H  N N 120 
ASP   HA   H  N N 121 
ASP   HB2  H  N N 122 
ASP   HB3  H  N N 123 
ASP   HD2  H  N N 124 
ASP   HXT  H  N N 125 
CYS   N    N  N N 126 
CYS   CA   C  N R 127 
CYS   C    C  N N 128 
CYS   O    O  N N 129 
CYS   CB   C  N N 130 
CYS   SG   S  N N 131 
CYS   OXT  O  N N 132 
CYS   H    H  N N 133 
CYS   H2   H  N N 134 
CYS   HA   H  N N 135 
CYS   HB2  H  N N 136 
CYS   HB3  H  N N 137 
CYS   HG   H  N N 138 
CYS   HXT  H  N N 139 
GLN   N    N  N N 140 
GLN   CA   C  N S 141 
GLN   C    C  N N 142 
GLN   O    O  N N 143 
GLN   CB   C  N N 144 
GLN   CG   C  N N 145 
GLN   CD   C  N N 146 
GLN   OE1  O  N N 147 
GLN   NE2  N  N N 148 
GLN   OXT  O  N N 149 
GLN   H    H  N N 150 
GLN   H2   H  N N 151 
GLN   HA   H  N N 152 
GLN   HB2  H  N N 153 
GLN   HB3  H  N N 154 
GLN   HG2  H  N N 155 
GLN   HG3  H  N N 156 
GLN   HE21 H  N N 157 
GLN   HE22 H  N N 158 
GLN   HXT  H  N N 159 
GLU   N    N  N N 160 
GLU   CA   C  N S 161 
GLU   C    C  N N 162 
GLU   O    O  N N 163 
GLU   CB   C  N N 164 
GLU   CG   C  N N 165 
GLU   CD   C  N N 166 
GLU   OE1  O  N N 167 
GLU   OE2  O  N N 168 
GLU   OXT  O  N N 169 
GLU   H    H  N N 170 
GLU   H2   H  N N 171 
GLU   HA   H  N N 172 
GLU   HB2  H  N N 173 
GLU   HB3  H  N N 174 
GLU   HG2  H  N N 175 
GLU   HG3  H  N N 176 
GLU   HE2  H  N N 177 
GLU   HXT  H  N N 178 
GLY   N    N  N N 179 
GLY   CA   C  N N 180 
GLY   C    C  N N 181 
GLY   O    O  N N 182 
GLY   OXT  O  N N 183 
GLY   H    H  N N 184 
GLY   H2   H  N N 185 
GLY   HA2  H  N N 186 
GLY   HA3  H  N N 187 
GLY   HXT  H  N N 188 
HIS   N    N  N N 189 
HIS   CA   C  N S 190 
HIS   C    C  N N 191 
HIS   O    O  N N 192 
HIS   CB   C  N N 193 
HIS   CG   C  Y N 194 
HIS   ND1  N  Y N 195 
HIS   CD2  C  Y N 196 
HIS   CE1  C  Y N 197 
HIS   NE2  N  Y N 198 
HIS   OXT  O  N N 199 
HIS   H    H  N N 200 
HIS   H2   H  N N 201 
HIS   HA   H  N N 202 
HIS   HB2  H  N N 203 
HIS   HB3  H  N N 204 
HIS   HD1  H  N N 205 
HIS   HD2  H  N N 206 
HIS   HE1  H  N N 207 
HIS   HE2  H  N N 208 
HIS   HXT  H  N N 209 
HOH   O    O  N N 210 
HOH   H1   H  N N 211 
HOH   H2   H  N N 212 
ILE   N    N  N N 213 
ILE   CA   C  N S 214 
ILE   C    C  N N 215 
ILE   O    O  N N 216 
ILE   CB   C  N S 217 
ILE   CG1  C  N N 218 
ILE   CG2  C  N N 219 
ILE   CD1  C  N N 220 
ILE   OXT  O  N N 221 
ILE   H    H  N N 222 
ILE   H2   H  N N 223 
ILE   HA   H  N N 224 
ILE   HB   H  N N 225 
ILE   HG12 H  N N 226 
ILE   HG13 H  N N 227 
ILE   HG21 H  N N 228 
ILE   HG22 H  N N 229 
ILE   HG23 H  N N 230 
ILE   HD11 H  N N 231 
ILE   HD12 H  N N 232 
ILE   HD13 H  N N 233 
ILE   HXT  H  N N 234 
LEU   N    N  N N 235 
LEU   CA   C  N S 236 
LEU   C    C  N N 237 
LEU   O    O  N N 238 
LEU   CB   C  N N 239 
LEU   CG   C  N N 240 
LEU   CD1  C  N N 241 
LEU   CD2  C  N N 242 
LEU   OXT  O  N N 243 
LEU   H    H  N N 244 
LEU   H2   H  N N 245 
LEU   HA   H  N N 246 
LEU   HB2  H  N N 247 
LEU   HB3  H  N N 248 
LEU   HG   H  N N 249 
LEU   HD11 H  N N 250 
LEU   HD12 H  N N 251 
LEU   HD13 H  N N 252 
LEU   HD21 H  N N 253 
LEU   HD22 H  N N 254 
LEU   HD23 H  N N 255 
LEU   HXT  H  N N 256 
LYS   N    N  N N 257 
LYS   CA   C  N S 258 
LYS   C    C  N N 259 
LYS   O    O  N N 260 
LYS   CB   C  N N 261 
LYS   CG   C  N N 262 
LYS   CD   C  N N 263 
LYS   CE   C  N N 264 
LYS   NZ   N  N N 265 
LYS   OXT  O  N N 266 
LYS   H    H  N N 267 
LYS   H2   H  N N 268 
LYS   HA   H  N N 269 
LYS   HB2  H  N N 270 
LYS   HB3  H  N N 271 
LYS   HG2  H  N N 272 
LYS   HG3  H  N N 273 
LYS   HD2  H  N N 274 
LYS   HD3  H  N N 275 
LYS   HE2  H  N N 276 
LYS   HE3  H  N N 277 
LYS   HZ1  H  N N 278 
LYS   HZ2  H  N N 279 
LYS   HZ3  H  N N 280 
LYS   HXT  H  N N 281 
MET   N    N  N N 282 
MET   CA   C  N S 283 
MET   C    C  N N 284 
MET   O    O  N N 285 
MET   CB   C  N N 286 
MET   CG   C  N N 287 
MET   SD   S  N N 288 
MET   CE   C  N N 289 
MET   OXT  O  N N 290 
MET   H    H  N N 291 
MET   H2   H  N N 292 
MET   HA   H  N N 293 
MET   HB2  H  N N 294 
MET   HB3  H  N N 295 
MET   HG2  H  N N 296 
MET   HG3  H  N N 297 
MET   HE1  H  N N 298 
MET   HE2  H  N N 299 
MET   HE3  H  N N 300 
MET   HXT  H  N N 301 
MN    MN   MN N N 302 
PEG   C1   C  N N 303 
PEG   O1   O  N N 304 
PEG   C2   C  N N 305 
PEG   O2   O  N N 306 
PEG   C3   C  N N 307 
PEG   C4   C  N N 308 
PEG   O4   O  N N 309 
PEG   H11  H  N N 310 
PEG   H12  H  N N 311 
PEG   HO1  H  N N 312 
PEG   H21  H  N N 313 
PEG   H22  H  N N 314 
PEG   H31  H  N N 315 
PEG   H32  H  N N 316 
PEG   H41  H  N N 317 
PEG   H42  H  N N 318 
PEG   HO4  H  N N 319 
PHE   N    N  N N 320 
PHE   CA   C  N S 321 
PHE   C    C  N N 322 
PHE   O    O  N N 323 
PHE   CB   C  N N 324 
PHE   CG   C  Y N 325 
PHE   CD1  C  Y N 326 
PHE   CD2  C  Y N 327 
PHE   CE1  C  Y N 328 
PHE   CE2  C  Y N 329 
PHE   CZ   C  Y N 330 
PHE   OXT  O  N N 331 
PHE   H    H  N N 332 
PHE   H2   H  N N 333 
PHE   HA   H  N N 334 
PHE   HB2  H  N N 335 
PHE   HB3  H  N N 336 
PHE   HD1  H  N N 337 
PHE   HD2  H  N N 338 
PHE   HE1  H  N N 339 
PHE   HE2  H  N N 340 
PHE   HZ   H  N N 341 
PHE   HXT  H  N N 342 
PRO   N    N  N N 343 
PRO   CA   C  N S 344 
PRO   C    C  N N 345 
PRO   O    O  N N 346 
PRO   CB   C  N N 347 
PRO   CG   C  N N 348 
PRO   CD   C  N N 349 
PRO   OXT  O  N N 350 
PRO   H    H  N N 351 
PRO   HA   H  N N 352 
PRO   HB2  H  N N 353 
PRO   HB3  H  N N 354 
PRO   HG2  H  N N 355 
PRO   HG3  H  N N 356 
PRO   HD2  H  N N 357 
PRO   HD3  H  N N 358 
PRO   HXT  H  N N 359 
SER   N    N  N N 360 
SER   CA   C  N S 361 
SER   C    C  N N 362 
SER   O    O  N N 363 
SER   CB   C  N N 364 
SER   OG   O  N N 365 
SER   OXT  O  N N 366 
SER   H    H  N N 367 
SER   H2   H  N N 368 
SER   HA   H  N N 369 
SER   HB2  H  N N 370 
SER   HB3  H  N N 371 
SER   HG   H  N N 372 
SER   HXT  H  N N 373 
THR   N    N  N N 374 
THR   CA   C  N S 375 
THR   C    C  N N 376 
THR   O    O  N N 377 
THR   CB   C  N R 378 
THR   OG1  O  N N 379 
THR   CG2  C  N N 380 
THR   OXT  O  N N 381 
THR   H    H  N N 382 
THR   H2   H  N N 383 
THR   HA   H  N N 384 
THR   HB   H  N N 385 
THR   HG1  H  N N 386 
THR   HG21 H  N N 387 
THR   HG22 H  N N 388 
THR   HG23 H  N N 389 
THR   HXT  H  N N 390 
TRP   N    N  N N 391 
TRP   CA   C  N S 392 
TRP   C    C  N N 393 
TRP   O    O  N N 394 
TRP   CB   C  N N 395 
TRP   CG   C  Y N 396 
TRP   CD1  C  Y N 397 
TRP   CD2  C  Y N 398 
TRP   NE1  N  Y N 399 
TRP   CE2  C  Y N 400 
TRP   CE3  C  Y N 401 
TRP   CZ2  C  Y N 402 
TRP   CZ3  C  Y N 403 
TRP   CH2  C  Y N 404 
TRP   OXT  O  N N 405 
TRP   H    H  N N 406 
TRP   H2   H  N N 407 
TRP   HA   H  N N 408 
TRP   HB2  H  N N 409 
TRP   HB3  H  N N 410 
TRP   HD1  H  N N 411 
TRP   HE1  H  N N 412 
TRP   HE3  H  N N 413 
TRP   HZ2  H  N N 414 
TRP   HZ3  H  N N 415 
TRP   HH2  H  N N 416 
TRP   HXT  H  N N 417 
TYR   N    N  N N 418 
TYR   CA   C  N S 419 
TYR   C    C  N N 420 
TYR   O    O  N N 421 
TYR   CB   C  N N 422 
TYR   CG   C  Y N 423 
TYR   CD1  C  Y N 424 
TYR   CD2  C  Y N 425 
TYR   CE1  C  Y N 426 
TYR   CE2  C  Y N 427 
TYR   CZ   C  Y N 428 
TYR   OH   O  N N 429 
TYR   OXT  O  N N 430 
TYR   H    H  N N 431 
TYR   H2   H  N N 432 
TYR   HA   H  N N 433 
TYR   HB2  H  N N 434 
TYR   HB3  H  N N 435 
TYR   HD1  H  N N 436 
TYR   HD2  H  N N 437 
TYR   HE1  H  N N 438 
TYR   HE2  H  N N 439 
TYR   HH   H  N N 440 
TYR   HXT  H  N N 441 
VAL   N    N  N N 442 
VAL   CA   C  N S 443 
VAL   C    C  N N 444 
VAL   O    O  N N 445 
VAL   CB   C  N N 446 
VAL   CG1  C  N N 447 
VAL   CG2  C  N N 448 
VAL   OXT  O  N N 449 
VAL   H    H  N N 450 
VAL   H2   H  N N 451 
VAL   HA   H  N N 452 
VAL   HB   H  N N 453 
VAL   HG11 H  N N 454 
VAL   HG12 H  N N 455 
VAL   HG13 H  N N 456 
VAL   HG21 H  N N 457 
VAL   HG22 H  N N 458 
VAL   HG23 H  N N 459 
VAL   HXT  H  N N 460 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
A1AV0 C02 CL01 sing N N 1   
A1AV0 N03 C02  doub Y N 2   
A1AV0 C04 N03  sing Y N 3   
A1AV0 C06 C05  sing Y N 4   
A1AV0 C07 C06  doub Y N 5   
A1AV0 C08 C06  sing N N 6   
A1AV0 F09 C08  sing N N 7   
A1AV0 F10 C08  sing N N 8   
A1AV0 F11 C08  sing N N 9   
A1AV0 C05 C04  doub Y N 10  
A1AV0 N12 C04  sing N N 11  
A1AV0 C13 N12  sing N N 12  
A1AV0 C14 C13  sing N N 13  
A1AV0 N15 C14  sing N N 14  
A1AV0 C17 C16  sing N N 15  
A1AV0 C16 N15  sing N N 16  
A1AV0 S18 N15  sing N N 17  
A1AV0 O19 S18  doub N N 18  
A1AV0 O20 S18  doub N N 19  
A1AV0 C21 S18  sing N N 20  
A1AV0 C22 C21  doub Y N 21  
A1AV0 C23 C22  sing Y N 22  
A1AV0 C24 C23  doub Y N 23  
A1AV0 C26 C25  doub Y N 24  
A1AV0 C25 C24  sing Y N 25  
A1AV0 N27 C24  sing N N 26  
A1AV0 O29 C28  doub N N 27  
A1AV0 C30 C28  sing N N 28  
A1AV0 C28 N27  sing N N 29  
A1AV0 C31 N27  sing N N 30  
A1AV0 C32 C31  sing N N 31  
A1AV0 C02 C07  sing Y N 32  
A1AV0 N12 C17  sing N N 33  
A1AV0 C21 C26  sing Y N 34  
A1AV0 C23 C32  sing N N 35  
A1AV0 C13 H131 sing N N 36  
A1AV0 C13 H132 sing N N 37  
A1AV0 C17 H171 sing N N 38  
A1AV0 C17 H172 sing N N 39  
A1AV0 C22 H221 sing N N 40  
A1AV0 C26 H261 sing N N 41  
A1AV0 C05 H051 sing N N 42  
A1AV0 C07 H071 sing N N 43  
A1AV0 C14 H141 sing N N 44  
A1AV0 C14 H142 sing N N 45  
A1AV0 C16 H162 sing N N 46  
A1AV0 C16 H161 sing N N 47  
A1AV0 C25 H251 sing N N 48  
A1AV0 C30 H303 sing N N 49  
A1AV0 C30 H302 sing N N 50  
A1AV0 C30 H301 sing N N 51  
A1AV0 C31 H311 sing N N 52  
A1AV0 C31 H312 sing N N 53  
A1AV0 C32 H321 sing N N 54  
A1AV0 C32 H322 sing N N 55  
ALA   N   CA   sing N N 56  
ALA   N   H    sing N N 57  
ALA   N   H2   sing N N 58  
ALA   CA  C    sing N N 59  
ALA   CA  CB   sing N N 60  
ALA   CA  HA   sing N N 61  
ALA   C   O    doub N N 62  
ALA   C   OXT  sing N N 63  
ALA   CB  HB1  sing N N 64  
ALA   CB  HB2  sing N N 65  
ALA   CB  HB3  sing N N 66  
ALA   OXT HXT  sing N N 67  
ARG   N   CA   sing N N 68  
ARG   N   H    sing N N 69  
ARG   N   H2   sing N N 70  
ARG   CA  C    sing N N 71  
ARG   CA  CB   sing N N 72  
ARG   CA  HA   sing N N 73  
ARG   C   O    doub N N 74  
ARG   C   OXT  sing N N 75  
ARG   CB  CG   sing N N 76  
ARG   CB  HB2  sing N N 77  
ARG   CB  HB3  sing N N 78  
ARG   CG  CD   sing N N 79  
ARG   CG  HG2  sing N N 80  
ARG   CG  HG3  sing N N 81  
ARG   CD  NE   sing N N 82  
ARG   CD  HD2  sing N N 83  
ARG   CD  HD3  sing N N 84  
ARG   NE  CZ   sing N N 85  
ARG   NE  HE   sing N N 86  
ARG   CZ  NH1  sing N N 87  
ARG   CZ  NH2  doub N N 88  
ARG   NH1 HH11 sing N N 89  
ARG   NH1 HH12 sing N N 90  
ARG   NH2 HH21 sing N N 91  
ARG   NH2 HH22 sing N N 92  
ARG   OXT HXT  sing N N 93  
ASN   N   CA   sing N N 94  
ASN   N   H    sing N N 95  
ASN   N   H2   sing N N 96  
ASN   CA  C    sing N N 97  
ASN   CA  CB   sing N N 98  
ASN   CA  HA   sing N N 99  
ASN   C   O    doub N N 100 
ASN   C   OXT  sing N N 101 
ASN   CB  CG   sing N N 102 
ASN   CB  HB2  sing N N 103 
ASN   CB  HB3  sing N N 104 
ASN   CG  OD1  doub N N 105 
ASN   CG  ND2  sing N N 106 
ASN   ND2 HD21 sing N N 107 
ASN   ND2 HD22 sing N N 108 
ASN   OXT HXT  sing N N 109 
ASP   N   CA   sing N N 110 
ASP   N   H    sing N N 111 
ASP   N   H2   sing N N 112 
ASP   CA  C    sing N N 113 
ASP   CA  CB   sing N N 114 
ASP   CA  HA   sing N N 115 
ASP   C   O    doub N N 116 
ASP   C   OXT  sing N N 117 
ASP   CB  CG   sing N N 118 
ASP   CB  HB2  sing N N 119 
ASP   CB  HB3  sing N N 120 
ASP   CG  OD1  doub N N 121 
ASP   CG  OD2  sing N N 122 
ASP   OD2 HD2  sing N N 123 
ASP   OXT HXT  sing N N 124 
CYS   N   CA   sing N N 125 
CYS   N   H    sing N N 126 
CYS   N   H2   sing N N 127 
CYS   CA  C    sing N N 128 
CYS   CA  CB   sing N N 129 
CYS   CA  HA   sing N N 130 
CYS   C   O    doub N N 131 
CYS   C   OXT  sing N N 132 
CYS   CB  SG   sing N N 133 
CYS   CB  HB2  sing N N 134 
CYS   CB  HB3  sing N N 135 
CYS   SG  HG   sing N N 136 
CYS   OXT HXT  sing N N 137 
GLN   N   CA   sing N N 138 
GLN   N   H    sing N N 139 
GLN   N   H2   sing N N 140 
GLN   CA  C    sing N N 141 
GLN   CA  CB   sing N N 142 
GLN   CA  HA   sing N N 143 
GLN   C   O    doub N N 144 
GLN   C   OXT  sing N N 145 
GLN   CB  CG   sing N N 146 
GLN   CB  HB2  sing N N 147 
GLN   CB  HB3  sing N N 148 
GLN   CG  CD   sing N N 149 
GLN   CG  HG2  sing N N 150 
GLN   CG  HG3  sing N N 151 
GLN   CD  OE1  doub N N 152 
GLN   CD  NE2  sing N N 153 
GLN   NE2 HE21 sing N N 154 
GLN   NE2 HE22 sing N N 155 
GLN   OXT HXT  sing N N 156 
GLU   N   CA   sing N N 157 
GLU   N   H    sing N N 158 
GLU   N   H2   sing N N 159 
GLU   CA  C    sing N N 160 
GLU   CA  CB   sing N N 161 
GLU   CA  HA   sing N N 162 
GLU   C   O    doub N N 163 
GLU   C   OXT  sing N N 164 
GLU   CB  CG   sing N N 165 
GLU   CB  HB2  sing N N 166 
GLU   CB  HB3  sing N N 167 
GLU   CG  CD   sing N N 168 
GLU   CG  HG2  sing N N 169 
GLU   CG  HG3  sing N N 170 
GLU   CD  OE1  doub N N 171 
GLU   CD  OE2  sing N N 172 
GLU   OE2 HE2  sing N N 173 
GLU   OXT HXT  sing N N 174 
GLY   N   CA   sing N N 175 
GLY   N   H    sing N N 176 
GLY   N   H2   sing N N 177 
GLY   CA  C    sing N N 178 
GLY   CA  HA2  sing N N 179 
GLY   CA  HA3  sing N N 180 
GLY   C   O    doub N N 181 
GLY   C   OXT  sing N N 182 
GLY   OXT HXT  sing N N 183 
HIS   N   CA   sing N N 184 
HIS   N   H    sing N N 185 
HIS   N   H2   sing N N 186 
HIS   CA  C    sing N N 187 
HIS   CA  CB   sing N N 188 
HIS   CA  HA   sing N N 189 
HIS   C   O    doub N N 190 
HIS   C   OXT  sing N N 191 
HIS   CB  CG   sing N N 192 
HIS   CB  HB2  sing N N 193 
HIS   CB  HB3  sing N N 194 
HIS   CG  ND1  sing Y N 195 
HIS   CG  CD2  doub Y N 196 
HIS   ND1 CE1  doub Y N 197 
HIS   ND1 HD1  sing N N 198 
HIS   CD2 NE2  sing Y N 199 
HIS   CD2 HD2  sing N N 200 
HIS   CE1 NE2  sing Y N 201 
HIS   CE1 HE1  sing N N 202 
HIS   NE2 HE2  sing N N 203 
HIS   OXT HXT  sing N N 204 
HOH   O   H1   sing N N 205 
HOH   O   H2   sing N N 206 
ILE   N   CA   sing N N 207 
ILE   N   H    sing N N 208 
ILE   N   H2   sing N N 209 
ILE   CA  C    sing N N 210 
ILE   CA  CB   sing N N 211 
ILE   CA  HA   sing N N 212 
ILE   C   O    doub N N 213 
ILE   C   OXT  sing N N 214 
ILE   CB  CG1  sing N N 215 
ILE   CB  CG2  sing N N 216 
ILE   CB  HB   sing N N 217 
ILE   CG1 CD1  sing N N 218 
ILE   CG1 HG12 sing N N 219 
ILE   CG1 HG13 sing N N 220 
ILE   CG2 HG21 sing N N 221 
ILE   CG2 HG22 sing N N 222 
ILE   CG2 HG23 sing N N 223 
ILE   CD1 HD11 sing N N 224 
ILE   CD1 HD12 sing N N 225 
ILE   CD1 HD13 sing N N 226 
ILE   OXT HXT  sing N N 227 
LEU   N   CA   sing N N 228 
LEU   N   H    sing N N 229 
LEU   N   H2   sing N N 230 
LEU   CA  C    sing N N 231 
LEU   CA  CB   sing N N 232 
LEU   CA  HA   sing N N 233 
LEU   C   O    doub N N 234 
LEU   C   OXT  sing N N 235 
LEU   CB  CG   sing N N 236 
LEU   CB  HB2  sing N N 237 
LEU   CB  HB3  sing N N 238 
LEU   CG  CD1  sing N N 239 
LEU   CG  CD2  sing N N 240 
LEU   CG  HG   sing N N 241 
LEU   CD1 HD11 sing N N 242 
LEU   CD1 HD12 sing N N 243 
LEU   CD1 HD13 sing N N 244 
LEU   CD2 HD21 sing N N 245 
LEU   CD2 HD22 sing N N 246 
LEU   CD2 HD23 sing N N 247 
LEU   OXT HXT  sing N N 248 
LYS   N   CA   sing N N 249 
LYS   N   H    sing N N 250 
LYS   N   H2   sing N N 251 
LYS   CA  C    sing N N 252 
LYS   CA  CB   sing N N 253 
LYS   CA  HA   sing N N 254 
LYS   C   O    doub N N 255 
LYS   C   OXT  sing N N 256 
LYS   CB  CG   sing N N 257 
LYS   CB  HB2  sing N N 258 
LYS   CB  HB3  sing N N 259 
LYS   CG  CD   sing N N 260 
LYS   CG  HG2  sing N N 261 
LYS   CG  HG3  sing N N 262 
LYS   CD  CE   sing N N 263 
LYS   CD  HD2  sing N N 264 
LYS   CD  HD3  sing N N 265 
LYS   CE  NZ   sing N N 266 
LYS   CE  HE2  sing N N 267 
LYS   CE  HE3  sing N N 268 
LYS   NZ  HZ1  sing N N 269 
LYS   NZ  HZ2  sing N N 270 
LYS   NZ  HZ3  sing N N 271 
LYS   OXT HXT  sing N N 272 
MET   N   CA   sing N N 273 
MET   N   H    sing N N 274 
MET   N   H2   sing N N 275 
MET   CA  C    sing N N 276 
MET   CA  CB   sing N N 277 
MET   CA  HA   sing N N 278 
MET   C   O    doub N N 279 
MET   C   OXT  sing N N 280 
MET   CB  CG   sing N N 281 
MET   CB  HB2  sing N N 282 
MET   CB  HB3  sing N N 283 
MET   CG  SD   sing N N 284 
MET   CG  HG2  sing N N 285 
MET   CG  HG3  sing N N 286 
MET   SD  CE   sing N N 287 
MET   CE  HE1  sing N N 288 
MET   CE  HE2  sing N N 289 
MET   CE  HE3  sing N N 290 
MET   OXT HXT  sing N N 291 
PEG   C1  O1   sing N N 292 
PEG   C1  C2   sing N N 293 
PEG   C1  H11  sing N N 294 
PEG   C1  H12  sing N N 295 
PEG   O1  HO1  sing N N 296 
PEG   C2  O2   sing N N 297 
PEG   C2  H21  sing N N 298 
PEG   C2  H22  sing N N 299 
PEG   O2  C3   sing N N 300 
PEG   C3  C4   sing N N 301 
PEG   C3  H31  sing N N 302 
PEG   C3  H32  sing N N 303 
PEG   C4  O4   sing N N 304 
PEG   C4  H41  sing N N 305 
PEG   C4  H42  sing N N 306 
PEG   O4  HO4  sing N N 307 
PHE   N   CA   sing N N 308 
PHE   N   H    sing N N 309 
PHE   N   H2   sing N N 310 
PHE   CA  C    sing N N 311 
PHE   CA  CB   sing N N 312 
PHE   CA  HA   sing N N 313 
PHE   C   O    doub N N 314 
PHE   C   OXT  sing N N 315 
PHE   CB  CG   sing N N 316 
PHE   CB  HB2  sing N N 317 
PHE   CB  HB3  sing N N 318 
PHE   CG  CD1  doub Y N 319 
PHE   CG  CD2  sing Y N 320 
PHE   CD1 CE1  sing Y N 321 
PHE   CD1 HD1  sing N N 322 
PHE   CD2 CE2  doub Y N 323 
PHE   CD2 HD2  sing N N 324 
PHE   CE1 CZ   doub Y N 325 
PHE   CE1 HE1  sing N N 326 
PHE   CE2 CZ   sing Y N 327 
PHE   CE2 HE2  sing N N 328 
PHE   CZ  HZ   sing N N 329 
PHE   OXT HXT  sing N N 330 
PRO   N   CA   sing N N 331 
PRO   N   CD   sing N N 332 
PRO   N   H    sing N N 333 
PRO   CA  C    sing N N 334 
PRO   CA  CB   sing N N 335 
PRO   CA  HA   sing N N 336 
PRO   C   O    doub N N 337 
PRO   C   OXT  sing N N 338 
PRO   CB  CG   sing N N 339 
PRO   CB  HB2  sing N N 340 
PRO   CB  HB3  sing N N 341 
PRO   CG  CD   sing N N 342 
PRO   CG  HG2  sing N N 343 
PRO   CG  HG3  sing N N 344 
PRO   CD  HD2  sing N N 345 
PRO   CD  HD3  sing N N 346 
PRO   OXT HXT  sing N N 347 
SER   N   CA   sing N N 348 
SER   N   H    sing N N 349 
SER   N   H2   sing N N 350 
SER   CA  C    sing N N 351 
SER   CA  CB   sing N N 352 
SER   CA  HA   sing N N 353 
SER   C   O    doub N N 354 
SER   C   OXT  sing N N 355 
SER   CB  OG   sing N N 356 
SER   CB  HB2  sing N N 357 
SER   CB  HB3  sing N N 358 
SER   OG  HG   sing N N 359 
SER   OXT HXT  sing N N 360 
THR   N   CA   sing N N 361 
THR   N   H    sing N N 362 
THR   N   H2   sing N N 363 
THR   CA  C    sing N N 364 
THR   CA  CB   sing N N 365 
THR   CA  HA   sing N N 366 
THR   C   O    doub N N 367 
THR   C   OXT  sing N N 368 
THR   CB  OG1  sing N N 369 
THR   CB  CG2  sing N N 370 
THR   CB  HB   sing N N 371 
THR   OG1 HG1  sing N N 372 
THR   CG2 HG21 sing N N 373 
THR   CG2 HG22 sing N N 374 
THR   CG2 HG23 sing N N 375 
THR   OXT HXT  sing N N 376 
TRP   N   CA   sing N N 377 
TRP   N   H    sing N N 378 
TRP   N   H2   sing N N 379 
TRP   CA  C    sing N N 380 
TRP   CA  CB   sing N N 381 
TRP   CA  HA   sing N N 382 
TRP   C   O    doub N N 383 
TRP   C   OXT  sing N N 384 
TRP   CB  CG   sing N N 385 
TRP   CB  HB2  sing N N 386 
TRP   CB  HB3  sing N N 387 
TRP   CG  CD1  doub Y N 388 
TRP   CG  CD2  sing Y N 389 
TRP   CD1 NE1  sing Y N 390 
TRP   CD1 HD1  sing N N 391 
TRP   CD2 CE2  doub Y N 392 
TRP   CD2 CE3  sing Y N 393 
TRP   NE1 CE2  sing Y N 394 
TRP   NE1 HE1  sing N N 395 
TRP   CE2 CZ2  sing Y N 396 
TRP   CE3 CZ3  doub Y N 397 
TRP   CE3 HE3  sing N N 398 
TRP   CZ2 CH2  doub Y N 399 
TRP   CZ2 HZ2  sing N N 400 
TRP   CZ3 CH2  sing Y N 401 
TRP   CZ3 HZ3  sing N N 402 
TRP   CH2 HH2  sing N N 403 
TRP   OXT HXT  sing N N 404 
TYR   N   CA   sing N N 405 
TYR   N   H    sing N N 406 
TYR   N   H2   sing N N 407 
TYR   CA  C    sing N N 408 
TYR   CA  CB   sing N N 409 
TYR   CA  HA   sing N N 410 
TYR   C   O    doub N N 411 
TYR   C   OXT  sing N N 412 
TYR   CB  CG   sing N N 413 
TYR   CB  HB2  sing N N 414 
TYR   CB  HB3  sing N N 415 
TYR   CG  CD1  doub Y N 416 
TYR   CG  CD2  sing Y N 417 
TYR   CD1 CE1  sing Y N 418 
TYR   CD1 HD1  sing N N 419 
TYR   CD2 CE2  doub Y N 420 
TYR   CD2 HD2  sing N N 421 
TYR   CE1 CZ   doub Y N 422 
TYR   CE1 HE1  sing N N 423 
TYR   CE2 CZ   sing Y N 424 
TYR   CE2 HE2  sing N N 425 
TYR   CZ  OH   sing N N 426 
TYR   OH  HH   sing N N 427 
TYR   OXT HXT  sing N N 428 
VAL   N   CA   sing N N 429 
VAL   N   H    sing N N 430 
VAL   N   H2   sing N N 431 
VAL   CA  C    sing N N 432 
VAL   CA  CB   sing N N 433 
VAL   CA  HA   sing N N 434 
VAL   C   O    doub N N 435 
VAL   C   OXT  sing N N 436 
VAL   CB  CG1  sing N N 437 
VAL   CB  CG2  sing N N 438 
VAL   CB  HB   sing N N 439 
VAL   CG1 HG11 sing N N 440 
VAL   CG1 HG12 sing N N 441 
VAL   CG1 HG13 sing N N 442 
VAL   CG2 HG21 sing N N 443 
VAL   CG2 HG22 sing N N 444 
VAL   CG2 HG23 sing N N 445 
VAL   OXT HXT  sing N N 446 
# 
_pdbx_audit_support.funding_organization   
'National Institutes of Health/National Institute Of Allergy and Infectious Diseases (NIH/NIAID)' 
_pdbx_audit_support.country                'United States' 
_pdbx_audit_support.grant_number           ? 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   6PJ3 
_pdbx_initial_refinement_model.details          ? 
# 
_space_group.name_H-M_alt     'P 32 2 1' 
_space_group.name_Hall        
;P 32 2"
;
_space_group.IT_number        154 
_space_group.crystal_system   trigonal 
_space_group.id               1 
# 
_atom_sites.entry_id                    9CCZ 
_atom_sites.Cartn_transf_matrix[1][1]   ? 
_atom_sites.Cartn_transf_matrix[1][2]   ? 
_atom_sites.Cartn_transf_matrix[1][3]   ? 
_atom_sites.Cartn_transf_matrix[2][1]   ? 
_atom_sites.Cartn_transf_matrix[2][2]   ? 
_atom_sites.Cartn_transf_matrix[2][3]   ? 
_atom_sites.Cartn_transf_matrix[3][1]   ? 
_atom_sites.Cartn_transf_matrix[3][2]   ? 
_atom_sites.Cartn_transf_matrix[3][3]   ? 
_atom_sites.Cartn_transf_vector[1]      ? 
_atom_sites.Cartn_transf_vector[2]      ? 
_atom_sites.Cartn_transf_vector[3]      ? 
_atom_sites.Cartn_transform_axes        ? 
_atom_sites.fract_transf_matrix[1][1]   0.009414 
_atom_sites.fract_transf_matrix[1][2]   0.005435 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.010871 
_atom_sites.fract_transf_matrix[2][3]   0.000000 
_atom_sites.fract_transf_matrix[3][1]   0.000000 
_atom_sites.fract_transf_matrix[3][2]   0.000000 
_atom_sites.fract_transf_matrix[3][3]   0.018650 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
_atom_type.scat_dispersion_real 
_atom_type.scat_dispersion_imag 
_atom_type.scat_Cromer_Mann_a1 
_atom_type.scat_Cromer_Mann_a2 
_atom_type.scat_Cromer_Mann_a3 
_atom_type.scat_Cromer_Mann_a4 
_atom_type.scat_Cromer_Mann_b1 
_atom_type.scat_Cromer_Mann_b2 
_atom_type.scat_Cromer_Mann_b3 
_atom_type.scat_Cromer_Mann_b4 
_atom_type.scat_Cromer_Mann_c 
_atom_type.scat_source 
_atom_type.scat_dispersion_source 
C  ? ? 3.54356  2.42580 ? ? 25.62398 1.50364  ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
CL ? ? 9.50761  7.44341 ? ? 1.04373  23.83732 ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
F  ? ? 4.90428  4.07044 ? ? 12.99538 1.63651  ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
MN ? ? 20.23591 4.67902 ? ? 2.76514  44.01191 ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
N  ? ? 4.01032  2.96436 ? ? 19.97189 1.75589  ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
O  ? ? 4.49882  3.47563 ? ? 15.80542 1.70748  ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
S  ? ? 9.55732  6.39887 ? ? 1.23737  29.19336 ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
ATOM   1    N  N    . ALA   A 1 2   ? -31.48823 -43.46125 8.00890   1.000 28.33664  ? 2   ALA   A N    1 
ATOM   2    C  CA   . ALA   A 1 2   ? -30.70811 -42.28150 7.64980   1.000 30.48728  ? 2   ALA   A CA   1 
ATOM   3    C  C    . ALA   A 1 2   ? -31.51725 -41.00707 7.87158   1.000 27.30718  ? 2   ALA   A C    1 
ATOM   4    O  O    . ALA   A 1 2   ? -32.73661 -41.00011 7.70555   1.000 25.13474  ? 2   ALA   A O    1 
ATOM   5    C  CB   . ALA   A 1 2   ? -30.24604 -42.37255 6.20517   1.000 27.46318  ? 2   ALA   A CB   1 
ATOM   6    N  N    . THR   A 1 3   ? -30.83415 -39.93119 8.25230   1.000 24.40902  ? 3   THR   A N    1 
ATOM   7    C  CA   . THR   A 1 3   ? -31.45746 -38.63151 8.46489   1.000 23.05193  ? 3   THR   A CA   1 
ATOM   8    C  C    . THR   A 1 3   ? -30.98066 -37.67326 7.38299   1.000 27.46414  ? 3   THR   A C    1 
ATOM   9    O  O    . THR   A 1 3   ? -29.78245 -37.61867 7.08264   1.000 22.16531  ? 3   THR   A O    1 
ATOM   10   C  CB   . THR   A 1 3   ? -31.12252 -38.08287 9.85391   1.000 23.96986  ? 3   THR   A CB   1 
ATOM   11   O  OG1  . THR   A 1 3   ? -31.60293 -38.99246 10.85285  1.000 27.19689  ? 3   THR   A OG1  1 
ATOM   12   C  CG2  . THR   A 1 3   ? -31.76668 -36.71400 10.06482  1.000 18.16981  ? 3   THR   A CG2  1 
ATOM   13   N  N    . LEU   A 1 4   ? -31.91388 -36.92444 6.79966   1.000 22.21755  ? 4   LEU   A N    1 
ATOM   14   C  CA   . LEU   A 1 4   ? -31.62219 -36.06399 5.66379   1.000 18.61490  ? 4   LEU   A CA   1 
ATOM   15   C  C    . LEU   A 1 4   ? -31.63366 -34.59878 6.07310   1.000 26.06475  ? 4   LEU   A C    1 
ATOM   16   O  O    . LEU   A 1 4   ? -32.41370 -34.17590 6.93252   1.000 25.19329  ? 4   LEU   A O    1 
ATOM   17   C  CB   . LEU   A 1 4   ? -32.62293 -36.28116 4.52481   1.000 18.50938  ? 4   LEU   A CB   1 
ATOM   18   C  CG   . LEU   A 1 4   ? -32.78080 -37.72153 4.03571   1.000 28.50699  ? 4   LEU   A CG   1 
ATOM   19   C  CD1  . LEU   A 1 4   ? -33.70971 -37.78196 2.83381   1.000 23.10652  ? 4   LEU   A CD1  1 
ATOM   20   C  CD2  . LEU   A 1 4   ? -31.42238 -38.32543 3.70211   1.000 29.74283  ? 4   LEU   A CD2  1 
ATOM   21   N  N    . PHE   A 1 5   ? -30.75416 -33.82836 5.43841   1.000 20.13693  ? 5   PHE   A N    1 
ATOM   22   C  CA   . PHE   A 1 5   ? -30.68331 -32.38804 5.62680   1.000 19.50530  ? 5   PHE   A CA   1 
ATOM   23   C  C    . PHE   A 1 5   ? -30.61688 -31.72974 4.25885   1.000 22.34839  ? 5   PHE   A C    1 
ATOM   24   O  O    . PHE   A 1 5   ? -29.83899 -32.15598 3.39779   1.000 20.89820  ? 5   PHE   A O    1 
ATOM   25   C  CB   . PHE   A 1 5   ? -29.46584 -31.99139 6.47324   1.000 21.71950  ? 5   PHE   A CB   1 
ATOM   26   C  CG   . PHE   A 1 5   ? -29.45195 -32.61787 7.83975   1.000 26.26910  ? 5   PHE   A CG   1 
ATOM   27   C  CD1  . PHE   A 1 5   ? -28.97817 -33.91055 8.02005   1.000 20.06003  ? 5   PHE   A CD1  1 
ATOM   28   C  CD2  . PHE   A 1 5   ? -29.92717 -31.92542 8.93972   1.000 24.83708  ? 5   PHE   A CD2  1 
ATOM   29   C  CE1  . PHE   A 1 5   ? -28.97502 -34.49714 9.27463   1.000 21.21629  ? 5   PHE   A CE1  1 
ATOM   30   C  CE2  . PHE   A 1 5   ? -29.92516 -32.50875 10.19997  1.000 21.47731  ? 5   PHE   A CE2  1 
ATOM   31   C  CZ   . PHE   A 1 5   ? -29.44764 -33.79444 10.36445  1.000 25.15311  ? 5   PHE   A CZ   1 
ATOM   32   N  N    . ILE   A 1 6   ? -31.44935 -30.70915 4.05749   1.000 18.76752  ? 6   ILE   A N    1 
ATOM   33   C  CA   . ILE   A 1 6   ? -31.42809 -29.87881 2.86232   1.000 24.45204  ? 6   ILE   A CA   1 
ATOM   34   C  C    . ILE   A 1 6   ? -31.53387 -28.42889 3.31447   1.000 21.78941  ? 6   ILE   A C    1 
ATOM   35   O  O    . ILE   A 1 6   ? -31.85247 -28.13973 4.46998   1.000 21.50653  ? 6   ILE   A O    1 
ATOM   36   C  CB   . ILE   A 1 6   ? -32.56510 -30.22584 1.87478   1.000 18.78950  ? 6   ILE   A CB   1 
ATOM   37   C  CG1  . ILE   A 1 6   ? -33.92651 -29.96856 2.52413   1.000 19.29940  ? 6   ILE   A CG1  1 
ATOM   38   C  CG2  . ILE   A 1 6   ? -32.45666 -31.67977 1.40965   1.000 20.65163  ? 6   ILE   A CG2  1 
ATOM   39   C  CD1  . ILE   A 1 6   ? -35.11127 -30.32164 1.64148   1.000 17.93123  ? 6   ILE   A CD1  1 
ATOM   40   N  N    . ALA   A 1 7   ? -31.25551 -27.51527 2.38778   1.000 18.22422  ? 7   ALA   A N    1 
ATOM   41   C  CA   . ALA   A 1 7   ? -31.31063 -26.08457 2.66868   1.000 17.33348  ? 7   ALA   A CA   1 
ATOM   42   C  C    . ALA   A 1 7   ? -31.13843 -25.32402 1.36261   1.000 27.60877  ? 7   ALA   A C    1 
ATOM   43   O  O    . ALA   A 1 7   ? -30.72806 -25.88441 0.34224   1.000 18.93663  ? 7   ALA   A O    1 
ATOM   44   C  CB   . ALA   A 1 7   ? -30.24266 -25.65306 3.67801   1.000 20.06622  ? 7   ALA   A CB   1 
ATOM   45   N  N    . ASP   A 1 8   ? -31.46894 -24.03112 1.41355   1.000 21.02236  ? 8   ASP   A N    1 
ATOM   46   C  CA   . ASP   A 1 8   ? -31.17091 -23.09245 0.33402   1.000 21.03282  ? 8   ASP   A CA   1 
ATOM   47   C  C    . ASP   A 1 8   ? -31.76992 -23.54701 -0.99227  1.000 22.86750  ? 8   ASP   A C    1 
ATOM   48   O  O    . ASP   A 1 8   ? -31.12364 -23.50130 -2.04064  1.000 25.43627  ? 8   ASP   A O    1 
ATOM   49   C  CB   . ASP   A 1 8   ? -29.66469 -22.87226 0.21957   1.000 25.65557  ? 8   ASP   A CB   1 
ATOM   50   C  CG   . ASP   A 1 8   ? -29.08369 -22.27792 1.48171   1.000 27.40026  ? 8   ASP   A CG   1 
ATOM   51   O  OD1  . ASP   A 1 8   ? -29.41121 -21.11085 1.78187   1.000 33.63579  ? 8   ASP   A OD1  1 
ATOM   52   O  OD2  . ASP   A 1 8   ? -28.33893 -22.98407 2.19368   1.000 29.99337  ? 8   ASP   A OD2  1 
ATOM   53   N  N    . LEU   A 1 9   ? -33.02289 -23.99606 -0.94048  1.000 21.95152  ? 9   LEU   A N    1 
ATOM   54   C  CA   . LEU   A 1 9   ? -33.75501 -24.27645 -2.16789  1.000 23.26360  ? 9   LEU   A CA   1 
ATOM   55   C  C    . LEU   A 1 9   ? -34.19653 -22.99084 -2.85726  1.000 20.78212  ? 9   LEU   A C    1 
ATOM   56   O  O    . LEU   A 1 9   ? -34.28239 -22.95090 -4.08998  1.000 24.58161  ? 9   LEU   A O    1 
ATOM   57   C  CB   . LEU   A 1 9   ? -34.96230 -25.16514 -1.86425  1.000 23.20072  ? 9   LEU   A CB   1 
ATOM   58   C  CG   . LEU   A 1 9   ? -34.65594 -26.63737 -1.56496  1.000 27.11956  ? 9   LEU   A CG   1 
ATOM   59   C  CD1  . LEU   A 1 9   ? -34.27333 -26.84640 -0.10075  1.000 21.30374  ? 9   LEU   A CD1  1 
ATOM   60   C  CD2  . LEU   A 1 9   ? -35.85121 -27.49657 -1.93477  1.000 26.04404  ? 9   LEU   A CD2  1 
ATOM   61   N  N    . HIS   A 1 10  ? -34.46124 -21.93585 -2.08576  1.000 18.62893  ? 10  HIS   A N    1 
ATOM   62   C  CA   . HIS   A 1 10  ? -34.90351 -20.64735 -2.62409  1.000 26.46731  ? 10  HIS   A CA   1 
ATOM   63   C  C    . HIS   A 1 10  ? -36.05511 -20.82668 -3.61318  1.000 20.89954  ? 10  HIS   A C    1 
ATOM   64   O  O    . HIS   A 1 10  ? -36.03740 -20.29953 -4.72802  1.000 23.46601  ? 10  HIS   A O    1 
ATOM   65   C  CB   . HIS   A 1 10  ? -33.73905 -19.90184 -3.28219  1.000 28.79079  ? 10  HIS   A CB   1 
ATOM   66   C  CG   . HIS   A 1 10  ? -32.61237 -19.58022 -2.34949  1.000 30.59601  ? 10  HIS   A CG   1 
ATOM   67   N  ND1  . HIS   A 1 10  ? -32.49777 -18.36422 -1.70989  1.000 33.45586  ? 10  HIS   A ND1  1 
ATOM   68   C  CD2  . HIS   A 1 10  ? -31.55338 -20.31988 -1.94314  1.000 32.89069  ? 10  HIS   A CD2  1 
ATOM   69   C  CE1  . HIS   A 1 10  ? -31.41285 -18.36588 -0.95574  1.000 32.61122  ? 10  HIS   A CE1  1 
ATOM   70   N  NE2  . HIS   A 1 10  ? -30.82276 -19.54161 -1.07782  1.000 34.53172  ? 10  HIS   A NE2  1 
ATOM   71   N  N    . LEU   A 1 11  ? -37.05768 -21.60394 -3.20536  1.000 25.39993  ? 11  LEU   A N    1 
ATOM   72   C  CA   . LEU   A 1 11  ? -38.19976 -21.85782 -4.07721  1.000 26.91591  ? 11  LEU   A CA   1 
ATOM   73   C  C    . LEU   A 1 11  ? -38.90788 -20.55499 -4.43400  1.000 26.57211  ? 11  LEU   A C    1 
ATOM   74   O  O    . LEU   A 1 11  ? -39.02809 -19.64687 -3.60788  1.000 24.59272  ? 11  LEU   A O    1 
ATOM   75   C  CB   . LEU   A 1 11  ? -39.18553 -22.81959 -3.41063  1.000 20.50226  ? 11  LEU   A CB   1 
ATOM   76   C  CG   . LEU   A 1 11  ? -38.69447 -24.22696 -3.06545  1.000 29.26733  ? 11  LEU   A CG   1 
ATOM   77   C  CD1  . LEU   A 1 11  ? -39.72290 -24.95289 -2.21278  1.000 24.01798  ? 11  LEU   A CD1  1 
ATOM   78   C  CD2  . LEU   A 1 11  ? -38.38936 -25.01947 -4.32791  1.000 27.84445  ? 11  LEU   A CD2  1 
ATOM   79   N  N    . GLN   A 1 12  ? -39.37295 -20.47133 -5.67986  1.000 22.49997  ? 12  GLN   A N    1 
ATOM   80   C  CA   . GLN   A 1 12  ? -40.07657 -19.30305 -6.18943  1.000 29.70570  ? 12  GLN   A CA   1 
ATOM   81   C  C    . GLN   A 1 12  ? -40.79813 -19.70178 -7.46898  1.000 31.32957  ? 12  GLN   A C    1 
ATOM   82   O  O    . GLN   A 1 12  ? -40.32161 -20.55757 -8.22157  1.000 26.62470  ? 12  GLN   A O    1 
ATOM   83   C  CB   . GLN   A 1 12  ? -39.11803 -18.13607 -6.45567  1.000 25.27991  ? 12  GLN   A CB   1 
ATOM   84   C  CG   . GLN   A 1 12  ? -37.98230 -18.47834 -7.40872  1.000 28.38253  ? 12  GLN   A CG   1 
ATOM   85   C  CD   . GLN   A 1 12  ? -36.97680 -17.34981 -7.55324  1.000 47.65530  ? 12  GLN   A CD   1 
ATOM   86   O  OE1  . GLN   A 1 12  ? -35.78208 -17.53116 -7.31628  1.000 45.19735  ? 12  GLN   A OE1  1 
ATOM   87   N  NE2  . GLN   A 1 12  ? -37.45794 -16.17719 -7.94208  1.000 38.10486  ? 12  GLN   A NE2  1 
ATOM   88   N  N    . THR   A 1 13  ? -41.94963 -19.06564 -7.71088  1.000 25.98287  ? 13  THR   A N    1 
ATOM   89   C  CA   . THR   A 1 13  ? -42.76768 -19.42062 -8.86707  1.000 25.94281  ? 13  THR   A CA   1 
ATOM   90   C  C    . THR   A 1 13  ? -42.04178 -19.19164 -10.18694 1.000 27.64674  ? 13  THR   A C    1 
ATOM   91   O  O    . THR   A 1 13  ? -42.37517 -19.84023 -11.18469 1.000 31.49062  ? 13  THR   A O    1 
ATOM   92   C  CB   . THR   A 1 13  ? -44.08502 -18.63458 -8.85623  1.000 31.63208  ? 13  THR   A CB   1 
ATOM   93   O  OG1  . THR   A 1 13  ? -43.84157 -17.28345 -8.45437  1.000 31.68751  ? 13  THR   A OG1  1 
ATOM   94   C  CG2  . THR   A 1 13  ? -45.07988 -19.26409 -7.88640  1.000 38.01359  ? 13  THR   A CG2  1 
ATOM   95   N  N    . GLU   A 1 14  ? -41.05575 -18.29570 -10.21776 1.000 26.85397  ? 14  GLU   A N    1 
ATOM   96   C  CA   . GLU   A 1 14  ? -40.26999 -18.07529 -11.42570 1.000 32.88817  ? 14  GLU   A CA   1 
ATOM   97   C  C    . GLU   A 1 14  ? -39.24160 -19.17149 -11.68087 1.000 36.66670  ? 14  GLU   A C    1 
ATOM   98   O  O    . GLU   A 1 14  ? -38.58080 -19.14459 -12.72556 1.000 35.25866  ? 14  GLU   A O    1 
ATOM   99   C  CB   . GLU   A 1 14  ? -39.55843 -16.72005 -11.35544 1.000 32.09452  ? 14  GLU   A CB   1 
ATOM   100  C  CG   . GLU   A 1 14  ? -40.49476 -15.52010 -11.37089 1.000 46.12250  ? 14  GLU   A CG   1 
ATOM   101  C  CD   . GLU   A 1 14  ? -40.96297 -15.13054 -9.98308  1.000 59.89710  ? 14  GLU   A CD   1 
ATOM   102  O  OE1  . GLU   A 1 14  ? -40.51615 -15.76858 -9.00552  1.000 43.47564  ? 14  GLU   A OE1  1 
ATOM   103  O  OE2  . GLU   A 1 14  ? -41.77411 -14.18586 -9.87019  1.000 67.67491  ? 14  GLU   A OE2  1 
ATOM   104  N  N    . GLU   A 1 15  ? -39.08615 -20.12644 -10.76576 1.000 28.75400  ? 15  GLU   A N    1 
ATOM   105  C  CA   . GLU   A 1 15  ? -38.14633 -21.23761 -10.92400 1.000 35.94805  ? 15  GLU   A CA   1 
ATOM   106  C  C    . GLU   A 1 15  ? -38.89224 -22.55434 -10.74331 1.000 33.47330  ? 15  GLU   A C    1 
ATOM   107  O  O    . GLU   A 1 15  ? -38.69296 -23.26597 -9.75103  1.000 31.47454  ? 15  GLU   A O    1 
ATOM   108  C  CB   . GLU   A 1 15  ? -36.98996 -21.12773 -9.92797  1.000 25.73469  ? 15  GLU   A CB   1 
ATOM   109  C  CG   . GLU   A 1 15  ? -36.05128 -19.95877 -10.17199 1.000 38.64283  ? 15  GLU   A CG   1 
ATOM   110  C  CD   . GLU   A 1 15  ? -35.31634 -20.06657 -11.49162 1.000 46.15554  ? 15  GLU   A CD   1 
ATOM   111  O  OE1  . GLU   A 1 15  ? -35.10187 -21.20254 -11.96859 1.000 51.87139  ? 15  GLU   A OE1  1 
ATOM   112  O  OE2  . GLU   A 1 15  ? -34.94731 -19.01316 -12.05063 1.000 57.13861  ? 15  GLU   A OE2  1 
ATOM   113  N  N    . PRO   A 1 16  ? -39.76123 -22.91538 -11.69340 1.000 37.37458  ? 16  PRO   A N    1 
ATOM   114  C  CA   . PRO   A 1 16  ? -40.56577 -24.13442 -11.51456 1.000 31.80905  ? 16  PRO   A CA   1 
ATOM   115  C  C    . PRO   A 1 16  ? -39.75628 -25.41982 -11.57644 1.000 28.44181  ? 16  PRO   A C    1 
ATOM   116  O  O    . PRO   A 1 16  ? -40.21745 -26.43894 -11.04910 1.000 33.25105  ? 16  PRO   A O    1 
ATOM   117  C  CB   . PRO   A 1 16  ? -41.58294 -24.05598 -12.66033 1.000 28.79003  ? 16  PRO   A CB   1 
ATOM   118  C  CG   . PRO   A 1 16  ? -40.89066 -23.25426 -13.71119 1.000 40.11040  ? 16  PRO   A CG   1 
ATOM   119  C  CD   . PRO   A 1 16  ? -40.04356 -22.24905 -12.97792 1.000 31.57523  ? 16  PRO   A CD   1 
ATOM   120  N  N    . ALA   A 1 17  ? -38.57076 -25.41161 -12.19362 1.000 33.15494  ? 17  ALA   A N    1 
ATOM   121  C  CA   . ALA   A 1 17  ? -37.75748 -26.62509 -12.23471 1.000 33.47207  ? 17  ALA   A CA   1 
ATOM   122  C  C    . ALA   A 1 17  ? -37.29052 -27.02563 -10.84041 1.000 27.73912  ? 17  ALA   A C    1 
ATOM   123  O  O    . ALA   A 1 17  ? -37.30387 -28.21248 -10.49324 1.000 30.48865  ? 17  ALA   A O    1 
ATOM   124  C  CB   . ALA   A 1 17  ? -36.56028 -26.43275 -13.16628 1.000 28.89166  ? 17  ALA   A CB   1 
ATOM   125  N  N    . ILE   A 1 18  ? -36.87483 -26.05104 -10.02716 1.000 30.99459  ? 18  ILE   A N    1 
ATOM   126  C  CA   . ILE   A 1 18  ? -36.48122 -26.34963 -8.65162  1.000 35.87267  ? 18  ILE   A CA   1 
ATOM   127  C  C    . ILE   A 1 18  ? -37.66243 -26.91117 -7.87194  1.000 29.48876  ? 18  ILE   A C    1 
ATOM   128  O  O    . ILE   A 1 18  ? -37.52300 -27.87978 -7.11432  1.000 25.33130  ? 18  ILE   A O    1 
ATOM   129  C  CB   . ILE   A 1 18  ? -35.90506 -25.09406 -7.97203  1.000 31.70388  ? 18  ILE   A CB   1 
ATOM   130  C  CG1  . ILE   A 1 18  ? -34.81441 -24.46746 -8.84036  1.000 34.69947  ? 18  ILE   A CG1  1 
ATOM   131  C  CG2  . ILE   A 1 18  ? -35.35842 -25.43725 -6.59391  1.000 26.92873  ? 18  ILE   A CG2  1 
ATOM   132  C  CD1  . ILE   A 1 18  ? -34.30782 -23.13827 -8.31126  1.000 37.36776  ? 18  ILE   A CD1  1 
ATOM   133  N  N    . THR   A 1 19  ? -38.84122 -26.30635 -8.03852  1.000 26.94384  ? 19  THR   A N    1 
ATOM   134  C  CA   . THR   A 1 19  ? -40.03928 -26.82277 -7.38609  1.000 28.76788  ? 19  THR   A CA   1 
ATOM   135  C  C    . THR   A 1 19  ? -40.31646 -28.26010 -7.80563  1.000 29.55276  ? 19  THR   A C    1 
ATOM   136  O  O    . THR   A 1 19  ? -40.62245 -29.11074 -6.96287  1.000 22.51678  ? 19  THR   A O    1 
ATOM   137  C  CB   . THR   A 1 19  ? -41.24108 -25.93225 -7.70711  1.000 26.22637  ? 19  THR   A CB   1 
ATOM   138  O  OG1  . THR   A 1 19  ? -41.02161 -24.61807 -7.17751  1.000 29.54765  ? 19  THR   A OG1  1 
ATOM   139  C  CG2  . THR   A 1 19  ? -42.51477 -26.51484 -7.11003  1.000 22.33186  ? 19  THR   A CG2  1 
ATOM   140  N  N    . ALA   A 1 20  ? -40.21148 -28.54985 -9.10653  1.000 26.12837  ? 20  ALA   A N    1 
ATOM   141  C  CA   . ALA   A 1 20  ? -40.42687 -29.91363 -9.58093  1.000 30.37063  ? 20  ALA   A CA   1 
ATOM   142  C  C    . ALA   A 1 20  ? -39.40174 -30.87311 -8.98988  1.000 26.86391  ? 20  ALA   A C    1 
ATOM   143  O  O    . ALA   A 1 20  ? -39.73823 -32.00616 -8.62541  1.000 29.35770  ? 20  ALA   A O    1 
ATOM   144  C  CB   . ALA   A 1 20  ? -40.38334 -29.95399 -11.10901 1.000 28.31966  ? 20  ALA   A CB   1 
ATOM   145  N  N    . GLY   A 1 21  ? -38.14567 -30.43814 -8.88183  1.000 27.24521  ? 21  GLY   A N    1 
ATOM   146  C  CA   . GLY   A 1 21  ? -37.13468 -31.28649 -8.27724  1.000 27.28850  ? 21  GLY   A CA   1 
ATOM   147  C  C    . GLY   A 1 21  ? -37.37845 -31.53791 -6.80375  1.000 24.39185  ? 21  GLY   A C    1 
ATOM   148  O  O    . GLY   A 1 21  ? -37.10857 -32.63421 -6.30637  1.000 24.82941  ? 21  GLY   A O    1 
ATOM   149  N  N    . PHE   A 1 22  ? -37.89870 -30.53796 -6.08876  1.000 21.98996  ? 22  PHE   A N    1 
ATOM   150  C  CA   . PHE   A 1 22  ? -38.19515 -30.72194 -4.67243  1.000 25.36035  ? 22  PHE   A CA   1 
ATOM   151  C  C    . PHE   A 1 22  ? -39.37318 -31.66904 -4.48064  1.000 30.39368  ? 22  PHE   A C    1 
ATOM   152  O  O    . PHE   A 1 22  ? -39.34159 -32.53411 -3.59736  1.000 23.06728  ? 22  PHE   A O    1 
ATOM   153  C  CB   . PHE   A 1 22  ? -38.47229 -29.36688 -4.01980  1.000 22.44240  ? 22  PHE   A CB   1 
ATOM   154  C  CG   . PHE   A 1 22  ? -38.69028 -29.43526 -2.53062  1.000 19.58715  ? 22  PHE   A CG   1 
ATOM   155  C  CD1  . PHE   A 1 22  ? -37.89272 -30.24511 -1.73153  1.000 20.56088  ? 22  PHE   A CD1  1 
ATOM   156  C  CD2  . PHE   A 1 22  ? -39.68394 -28.67845 -1.92921  1.000 19.37285  ? 22  PHE   A CD2  1 
ATOM   157  C  CE1  . PHE   A 1 22  ? -38.08644 -30.30084 -0.35998  1.000 21.45351  ? 22  PHE   A CE1  1 
ATOM   158  C  CE2  . PHE   A 1 22  ? -39.88597 -28.72969 -0.55857  1.000 21.56203  ? 22  PHE   A CE2  1 
ATOM   159  C  CZ   . PHE   A 1 22  ? -39.08700 -29.54311 0.22746   1.000 21.86965  ? 22  PHE   A CZ   1 
ATOM   160  N  N    . LEU   A 1 23  ? -40.41743 -31.52949 -5.30607  1.000 21.73965  ? 23  LEU   A N    1 
ATOM   161  C  CA   . LEU   A 1 23  ? -41.55962 -32.43566 -5.20960  1.000 23.38010  ? 23  LEU   A CA   1 
ATOM   162  C  C    . LEU   A 1 23  ? -41.14784 -33.87900 -5.47938  1.000 24.54651  ? 23  LEU   A C    1 
ATOM   163  O  O    . LEU   A 1 23  ? -41.60359 -34.79925 -4.79088  1.000 29.89038  ? 23  LEU   A O    1 
ATOM   164  C  CB   . LEU   A 1 23  ? -42.66596 -32.00285 -6.17255  1.000 25.05862  ? 23  LEU   A CB   1 
ATOM   165  C  CG   . LEU   A 1 23  ? -43.25670 -30.61188 -5.93385  1.000 30.72873  ? 23  LEU   A CG   1 
ATOM   166  C  CD1  . LEU   A 1 23  ? -44.32359 -30.27941 -6.96940  1.000 30.12680  ? 23  LEU   A CD1  1 
ATOM   167  C  CD2  . LEU   A 1 23  ? -43.81322 -30.50715 -4.52829  1.000 22.49088  ? 23  LEU   A CD2  1 
ATOM   168  N  N    . ARG   A 1 24  ? -40.28084 -34.09932 -6.47226  1.000 32.18980  ? 24  ARG   A N    1 
ATOM   169  C  CA   . ARG   A 1 24  ? -39.79597 -35.45317 -6.72888  1.000 31.43067  ? 24  ARG   A CA   1 
ATOM   170  C  C    . ARG   A 1 24  ? -38.97260 -35.97325 -5.55715  1.000 34.92231  ? 24  ARG   A C    1 
ATOM   171  O  O    . ARG   A 1 24  ? -39.07710 -37.15008 -5.19119  1.000 29.64556  ? 24  ARG   A O    1 
ATOM   172  C  CB   . ARG   A 1 24  ? -38.97702 -35.48977 -8.01908  1.000 36.39947  ? 24  ARG   A CB   1 
ATOM   173  C  CG   . ARG   A 1 24  ? -38.40152 -36.86527 -8.34805  1.000 37.54875  ? 24  ARG   A CG   1 
ATOM   174  C  CD   . ARG   A 1 24  ? -37.62290 -36.84780 -9.65760  1.000 55.56777  ? 24  ARG   A CD   1 
ATOM   175  N  NE   . ARG   A 1 24  ? -36.19690 -36.61913 -9.45137  1.000 56.56623  ? 24  ARG   A NE   1 
ATOM   176  C  CZ   . ARG   A 1 24  ? -35.31640 -37.56849 -9.16334  1.000 60.92786  ? 24  ARG   A CZ   1 
ATOM   177  N  NH1  . ARG   A 1 24  ? -35.67770 -38.83675 -9.05254  1.000 62.63166  ? 24  ARG   A NH1  1 
ATOM   178  N  NH2  . ARG   A 1 24  ? -34.04002 -37.23746 -8.98500  1.000 54.48306  ? 24  ARG   A NH2  1 
ATOM   179  N  N    . PHE   A 1 25  ? -38.14458 -35.10969 -4.96334  1.000 24.62320  ? 25  PHE   A N    1 
ATOM   180  C  CA   . PHE   A 1 25  ? -37.39922 -35.48380 -3.76563  1.000 28.68196  ? 25  PHE   A CA   1 
ATOM   181  C  C    . PHE   A 1 25  ? -38.34159 -35.89463 -2.64061  1.000 27.33387  ? 25  PHE   A C    1 
ATOM   182  O  O    . PHE   A 1 25  ? -38.13132 -36.92290 -1.98545  1.000 24.05369  ? 25  PHE   A O    1 
ATOM   183  C  CB   . PHE   A 1 25  ? -36.51114 -34.31270 -3.33631  1.000 24.81137  ? 25  PHE   A CB   1 
ATOM   184  C  CG   . PHE   A 1 25  ? -35.87168 -34.48010 -1.98261  1.000 25.61226  ? 25  PHE   A CG   1 
ATOM   185  C  CD1  . PHE   A 1 25  ? -34.67068 -35.16571 -1.84894  1.000 24.87278  ? 25  PHE   A CD1  1 
ATOM   186  C  CD2  . PHE   A 1 25  ? -36.44854 -33.92152 -0.85270  1.000 21.81217  ? 25  PHE   A CD2  1 
ATOM   187  C  CE1  . PHE   A 1 25  ? -34.06812 -35.31213 -0.60743  1.000 24.17229  ? 25  PHE   A CE1  1 
ATOM   188  C  CE2  . PHE   A 1 25  ? -35.85480 -34.06391 0.39323   1.000 28.84873  ? 25  PHE   A CE2  1 
ATOM   189  C  CZ   . PHE   A 1 25  ? -34.65957 -34.75934 0.51619   1.000 23.57158  ? 25  PHE   A CZ   1 
ATOM   190  N  N    . LEU   A 1 26  ? -39.39561 -35.10602 -2.41430  1.000 22.05672  ? 26  LEU   A N    1 
ATOM   191  C  CA   . LEU   A 1 26  ? -40.34163 -35.39850 -1.34172  1.000 27.35391  ? 26  LEU   A CA   1 
ATOM   192  C  C    . LEU   A 1 26  ? -41.11487 -36.68328 -1.61474  1.000 33.00441  ? 26  LEU   A C    1 
ATOM   193  O  O    . LEU   A 1 26  ? -41.44497 -37.42495 -0.68223  1.000 29.22128  ? 26  LEU   A O    1 
ATOM   194  C  CB   . LEU   A 1 26  ? -41.30962 -34.22747 -1.16724  1.000 20.59733  ? 26  LEU   A CB   1 
ATOM   195  C  CG   . LEU   A 1 26  ? -40.75876 -32.92677 -0.57845  1.000 21.06470  ? 26  LEU   A CG   1 
ATOM   196  C  CD1  . LEU   A 1 26  ? -41.86117 -31.88029 -0.48846  1.000 20.39705  ? 26  LEU   A CD1  1 
ATOM   197  C  CD2  . LEU   A 1 26  ? -40.13367 -33.16576 0.78886   1.000 16.96360  ? 26  LEU   A CD2  1 
ATOM   198  N  N    . GLN   A 1 27  ? -41.42120 -36.95669 -2.88481  1.000 27.96196  ? 27  GLN   A N    1 
ATOM   199  C  CA   . GLN   A 1 27  ? -42.17810 -38.14747 -3.24497  1.000 34.71336  ? 27  GLN   A CA   1 
ATOM   200  C  C    . GLN   A 1 27  ? -41.33100 -39.41045 -3.23120  1.000 35.41204  ? 27  GLN   A C    1 
ATOM   201  O  O    . GLN   A 1 27  ? -41.88891 -40.50994 -3.16437  1.000 39.00925  ? 27  GLN   A O    1 
ATOM   202  C  CB   . GLN   A 1 27  ? -42.80446 -37.97619 -4.63064  1.000 40.61950  ? 27  GLN   A CB   1 
ATOM   203  C  CG   . GLN   A 1 27  ? -44.22385 -37.44302 -4.61248  1.000 50.95969  ? 27  GLN   A CG   1 
ATOM   204  C  CD   . GLN   A 1 27  ? -44.53678 -36.59117 -5.82676  1.000 64.98263  ? 27  GLN   A CD   1 
ATOM   205  O  OE1  . GLN   A 1 27  ? -44.39770 -37.03915 -6.96515  1.000 75.74158  ? 27  GLN   A OE1  1 
ATOM   206  N  NE2  . GLN   A 1 27  ? -44.96276 -35.35497 -5.59012  1.000 58.32280  ? 27  GLN   A NE2  1 
ATOM   207  N  N    . GLY   A 1 28  ? -40.00725 -39.28276 -3.29020  1.000 28.92359  ? 28  GLY   A N    1 
ATOM   208  C  CA   . GLY   A 1 28  ? -39.15125 -40.44838 -3.35378  1.000 33.62703  ? 28  GLY   A CA   1 
ATOM   209  C  C    . GLY   A 1 28  ? -38.21461 -40.59751 -2.17425  1.000 37.69766  ? 28  GLY   A C    1 
ATOM   210  O  O    . GLY   A 1 28  ? -38.52837 -41.29904 -1.20733  1.000 38.27026  ? 28  GLY   A O    1 
ATOM   211  N  N    . GLU   A 1 29  ? -37.06492 -39.92248 -2.24926  1.000 36.51006  ? 29  GLU   A N    1 
ATOM   212  C  CA   . GLU   A 1 29  ? -36.01021 -40.09102 -1.25318  1.000 36.25529  ? 29  GLU   A CA   1 
ATOM   213  C  C    . GLU   A 1 29  ? -36.52220 -39.84957 0.16365   1.000 30.36851  ? 29  GLU   A C    1 
ATOM   214  O  O    . GLU   A 1 29  ? -36.25870 -40.64333 1.07411   1.000 31.31248  ? 29  GLU   A O    1 
ATOM   215  C  CB   . GLU   A 1 29  ? -34.85118 -39.14481 -1.57341  1.000 34.59722  ? 29  GLU   A CB   1 
ATOM   216  C  CG   . GLU   A 1 29  ? -33.66091 -39.27277 -0.63917  1.000 47.70971  ? 29  GLU   A CG   1 
ATOM   217  C  CD   . GLU   A 1 29  ? -32.77747 -40.45551 -0.98663  1.000 48.37269  ? 29  GLU   A CD   1 
ATOM   218  O  OE1  . GLU   A 1 29  ? -32.59675 -40.73106 -2.19207  1.000 57.14895  ? 29  GLU   A OE1  1 
ATOM   219  O  OE2  . GLU   A 1 29  ? -32.25437 -41.10378 -0.05595  1.000 43.28074  ? 29  GLU   A OE2  1 
ATOM   220  N  N    . ALA   A 1 30  ? -37.26423 -38.75767 0.36675   1.000 32.50460  ? 30  ALA   A N    1 
ATOM   221  C  CA   . ALA   A 1 30  ? -37.64590 -38.35464 1.71746   1.000 26.79966  ? 30  ALA   A CA   1 
ATOM   222  C  C    . ALA   A 1 30  ? -38.55848 -39.37279 2.39397   1.000 29.33622  ? 30  ALA   A C    1 
ATOM   223  O  O    . ALA   A 1 30  ? -38.58183 -39.45310 3.62792   1.000 25.81352  ? 30  ALA   A O    1 
ATOM   224  C  CB   . ALA   A 1 30  ? -38.32320 -36.98566 1.68007   1.000 26.00384  ? 30  ALA   A CB   1 
ATOM   225  N  N    . ARG   A 1 31  ? -39.31556 -40.15288 1.61760   1.000 27.26248  ? 31  ARG   A N    1 
ATOM   226  C  CA   . ARG   A 1 31  ? -40.23166 -41.11983 2.21543   1.000 34.07374  ? 31  ARG   A CA   1 
ATOM   227  C  C    . ARG   A 1 31  ? -39.50383 -42.23798 2.95231   1.000 35.37760  ? 31  ARG   A C    1 
ATOM   228  O  O    . ARG   A 1 31  ? -40.10720 -42.89060 3.81024   1.000 33.13318  ? 31  ARG   A O    1 
ATOM   229  C  CB   . ARG   A 1 31  ? -41.14424 -41.72369 1.14524   1.000 31.51926  ? 31  ARG   A CB   1 
ATOM   230  C  CG   . ARG   A 1 31  ? -41.91906 -40.70728 0.32551   1.000 32.08550  ? 31  ARG   A CG   1 
ATOM   231  C  CD   . ARG   A 1 31  ? -42.81546 -39.84282 1.19585   1.000 34.43516  ? 31  ARG   A CD   1 
ATOM   232  N  NE   . ARG   A 1 31  ? -43.58109 -38.89515 0.39431   1.000 35.01953  ? 31  ARG   A NE   1 
ATOM   233  C  CZ   . ARG   A 1 31  ? -44.83640 -39.08705 0.01283   1.000 40.09699  ? 31  ARG   A CZ   1 
ATOM   234  N  NH1  . ARG   A 1 31  ? -45.50236 -40.17820 0.35597   1.000 34.77047  ? 31  ARG   A NH1  1 
ATOM   235  N  NH2  . ARG   A 1 31  ? -45.43540 -38.16615 -0.73806  1.000 31.06841  ? 31  ARG   A NH2  1 
ATOM   236  N  N    . GLN   A 1 32  ? -38.22986 -42.47330 2.64366   1.000 35.07412  ? 32  GLN   A N    1 
ATOM   237  C  CA   . GLN   A 1 32  ? -37.46117 -43.54189 3.26741   1.000 38.97861  ? 32  GLN   A CA   1 
ATOM   238  C  C    . GLN   A 1 32  ? -36.62887 -43.07057 4.45212   1.000 37.96805  ? 32  GLN   A C    1 
ATOM   239  O  O    . GLN   A 1 32  ? -35.96767 -43.89420 5.09093   1.000 29.59424  ? 32  GLN   A O    1 
ATOM   240  C  CB   . GLN   A 1 32  ? -36.54446 -44.20300 2.23365   1.000 35.43603  ? 32  GLN   A CB   1 
ATOM   241  C  CG   . GLN   A 1 32  ? -37.16035 -44.32489 0.85193   1.000 38.94135  ? 32  GLN   A CG   1 
ATOM   242  C  CD   . GLN   A 1 32  ? -38.17347 -45.44741 0.76725   1.000 56.80651  ? 32  GLN   A CD   1 
ATOM   243  O  OE1  . GLN   A 1 32  ? -39.34986 -45.21599 0.48607   1.000 68.11760  ? 32  GLN   A OE1  1 
ATOM   244  N  NE2  . GLN   A 1 32  ? -37.72287 -46.67239 1.01090   1.000 73.91260  ? 32  GLN   A NE2  1 
ATOM   245  N  N    . ALA   A 1 33  ? -36.65062 -41.77992 4.76849   1.000 27.09578  ? 33  ALA   A N    1 
ATOM   246  C  CA   . ALA   A 1 33  ? -35.77366 -41.24811 5.79867   1.000 31.03787  ? 33  ALA   A CA   1 
ATOM   247  C  C    . ALA   A 1 33  ? -36.37949 -41.43061 7.18752   1.000 29.59343  ? 33  ALA   A C    1 
ATOM   248  O  O    . ALA   A 1 33  ? -37.59228 -41.58564 7.35125   1.000 28.45659  ? 33  ALA   A O    1 
ATOM   249  C  CB   . ALA   A 1 33  ? -35.49112 -39.76612 5.54822   1.000 22.05934  ? 33  ALA   A CB   1 
ATOM   250  N  N    . ASP   A 1 34  ? -35.50340 -41.41559 8.19955   1.000 24.86790  ? 34  ASP   A N    1 
ATOM   251  C  CA   . ASP   A 1 34  ? -35.96777 -41.36452 9.58364   1.000 25.48031  ? 34  ASP   A CA   1 
ATOM   252  C  C    . ASP   A 1 34  ? -36.49797 -39.98189 9.94188   1.000 33.03238  ? 34  ASP   A C    1 
ATOM   253  O  O    . ASP   A 1 34  ? -37.39035 -39.86129 10.79018  1.000 25.81314  ? 34  ASP   A O    1 
ATOM   254  C  CB   . ASP   A 1 34  ? -34.84215 -41.74401 10.54723  1.000 28.32510  ? 34  ASP   A CB   1 
ATOM   255  C  CG   . ASP   A 1 34  ? -34.31185 -43.14492 10.30914  1.000 31.38602  ? 34  ASP   A CG   1 
ATOM   256  O  OD1  . ASP   A 1 34  ? -33.08793 -43.35457 10.45214  1.000 30.33176  ? 34  ASP   A OD1  1 
ATOM   257  O  OD2  . ASP   A 1 34  ? -35.11890 -44.03549 9.97701   1.000 30.74024  ? 34  ASP   A OD2  1 
ATOM   258  N  N    . ALA   A 1 35  ? -35.94655 -38.93653 9.32769   1.000 25.52373  ? 35  ALA   A N    1 
ATOM   259  C  CA   . ALA   A 1 35  ? -36.37515 -37.56347 9.55491   1.000 25.00051  ? 35  ALA   A CA   1 
ATOM   260  C  C    . ALA   A 1 35  ? -35.79729 -36.68874 8.45243   1.000 24.83272  ? 35  ALA   A C    1 
ATOM   261  O  O    . ALA   A 1 35  ? -34.79095 -37.03094 7.82409   1.000 23.88691  ? 35  ALA   A O    1 
ATOM   262  C  CB   . ALA   A 1 35  ? -35.93634 -37.04891 10.93196  1.000 20.70032  ? 35  ALA   A CB   1 
ATOM   263  N  N    . LEU   A 1 36  ? -36.44772 -35.54943 8.23122   1.000 18.28642  ? 36  LEU   A N    1 
ATOM   264  C  CA   . LEU   A 1 36  ? -36.01956 -34.57073 7.23869   1.000 23.60544  ? 36  LEU   A CA   1 
ATOM   265  C  C    . LEU   A 1 36  ? -35.89079 -33.21149 7.90959   1.000 26.29412  ? 36  LEU   A C    1 
ATOM   266  O  O    . LEU   A 1 36  ? -36.86437 -32.69729 8.47076   1.000 25.27433  ? 36  LEU   A O    1 
ATOM   267  C  CB   . LEU   A 1 36  ? -37.00756 -34.49495 6.07039   1.000 25.81436  ? 36  LEU   A CB   1 
ATOM   268  C  CG   . LEU   A 1 36  ? -36.79797 -33.33586 5.08952   1.000 25.58896  ? 36  LEU   A CG   1 
ATOM   269  C  CD1  . LEU   A 1 36  ? -35.45880 -33.45687 4.36770   1.000 22.26572  ? 36  LEU   A CD1  1 
ATOM   270  C  CD2  . LEU   A 1 36  ? -37.94514 -33.26047 4.09121   1.000 20.62773  ? 36  LEU   A CD2  1 
ATOM   271  N  N    . TYR   A 1 37  ? -34.69916 -32.63058 7.84784   1.000 23.14944  ? 37  TYR   A N    1 
ATOM   272  C  CA   . TYR   A 1 37  ? -34.44442 -31.30295 8.38439   1.000 19.75722  ? 37  TYR   A CA   1 
ATOM   273  C  C    . TYR   A 1 37  ? -34.20843 -30.34264 7.23197   1.000 21.42459  ? 37  TYR   A C    1 
ATOM   274  O  O    . TYR   A 1 37  ? -33.39480 -30.61849 6.34444   1.000 18.27107  ? 37  TYR   A O    1 
ATOM   275  C  CB   . TYR   A 1 37  ? -33.23362 -31.30150 9.31600   1.000 18.86918  ? 37  TYR   A CB   1 
ATOM   276  C  CG   . TYR   A 1 37  ? -33.44929 -32.01661 10.62985  1.000 24.45088  ? 37  TYR   A CG   1 
ATOM   277  C  CD1  . TYR   A 1 37  ? -33.44073 -33.40587 10.69466  1.000 20.31842  ? 37  TYR   A CD1  1 
ATOM   278  C  CD2  . TYR   A 1 37  ? -33.62996 -31.30367 11.80965  1.000 19.46225  ? 37  TYR   A CD2  1 
ATOM   279  C  CE1  . TYR   A 1 37  ? -33.62942 -34.06703 11.89560  1.000 21.12833  ? 37  TYR   A CE1  1 
ATOM   280  C  CE2  . TYR   A 1 37  ? -33.81547 -31.95307 13.01318  1.000 24.68369  ? 37  TYR   A CE2  1 
ATOM   281  C  CZ   . TYR   A 1 37  ? -33.81314 -33.33443 13.05037  1.000 26.17031  ? 37  TYR   A CZ   1 
ATOM   282  O  OH   . TYR   A 1 37  ? -33.99766 -33.98294 14.24692  1.000 24.42110  ? 37  TYR   A OH   1 
ATOM   283  N  N    . ILE   A 1 38  ? -34.91593 -29.22184 7.25285   1.000 18.97694  ? 38  ILE   A N    1 
ATOM   284  C  CA   . ILE   A 1 38  ? -34.75489 -28.15996 6.27195   1.000 23.28241  ? 38  ILE   A CA   1 
ATOM   285  C  C    . ILE   A 1 38  ? -34.13842 -26.98072 7.00868   1.000 26.31082  ? 38  ILE   A C    1 
ATOM   286  O  O    . ILE   A 1 38  ? -34.79904 -26.33863 7.83567   1.000 21.90161  ? 38  ILE   A O    1 
ATOM   287  C  CB   . ILE   A 1 38  ? -36.09018 -27.79205 5.61312   1.000 22.74632  ? 38  ILE   A CB   1 
ATOM   288  C  CG1  . ILE   A 1 38  ? -36.74659 -29.05388 5.04262   1.000 24.45655  ? 38  ILE   A CG1  1 
ATOM   289  C  CG2  . ILE   A 1 38  ? -35.88654 -26.73925 4.53042   1.000 22.94120  ? 38  ILE   A CG2  1 
ATOM   290  C  CD1  . ILE   A 1 38  ? -38.08299 -28.81690 4.36283   1.000 20.15232  ? 38  ILE   A CD1  1 
ATOM   291  N  N    . LEU   A 1 39  ? -32.86930 -26.70396 6.71937   1.000 19.37205  ? 39  LEU   A N    1 
ATOM   292  C  CA   . LEU   A 1 39  ? -32.08309 -25.72374 7.46889   1.000 17.56478  ? 39  LEU   A CA   1 
ATOM   293  C  C    . LEU   A 1 39  ? -32.13044 -24.33322 6.83686   1.000 17.66425  ? 39  LEU   A C    1 
ATOM   294  O  O    . LEU   A 1 39  ? -31.10112 -23.67724 6.66779   1.000 20.68224  ? 39  LEU   A O    1 
ATOM   295  C  CB   . LEU   A 1 39  ? -30.64382 -26.21232 7.59767   1.000 19.33194  ? 39  LEU   A CB   1 
ATOM   296  C  CG   . LEU   A 1 39  ? -30.44206 -27.60360 8.20867   1.000 28.00709  ? 39  LEU   A CG   1 
ATOM   297  C  CD1  . LEU   A 1 39  ? -28.96293 -27.87571 8.46030   1.000 29.69948  ? 39  LEU   A CD1  1 
ATOM   298  C  CD2  . LEU   A 1 39  ? -31.24278 -27.75924 9.49419   1.000 17.92217  ? 39  LEU   A CD2  1 
ATOM   299  N  N    . GLY   A 1 40  ? -33.32096 -23.86985 6.47288   1.000 18.54078  ? 40  GLY   A N    1 
ATOM   300  C  CA   . GLY   A 1 40  ? -33.49788 -22.47453 6.12879   1.000 17.53401  ? 40  GLY   A CA   1 
ATOM   301  C  C    . GLY   A 1 40  ? -33.36592 -22.20427 4.63841   1.000 25.11569  ? 40  GLY   A C    1 
ATOM   302  O  O    . GLY   A 1 40  ? -32.76687 -22.97155 3.87869   1.000 22.16287  ? 40  GLY   A O    1 
ATOM   303  N  N    . ASP   A 1 41  ? -33.92808 -21.06340 4.22993   1.000 20.16783  ? 41  ASP   A N    1 
ATOM   304  C  CA   . ASP   A 1 41  ? -33.98806 -20.65129 2.82687   1.000 19.41012  ? 41  ASP   A CA   1 
ATOM   305  C  C    . ASP   A 1 41  ? -34.70326 -21.69683 1.97520   1.000 20.34991  ? 41  ASP   A C    1 
ATOM   306  O  O    . ASP   A 1 41  ? -34.30900 -21.98433 0.84080   1.000 22.04392  ? 41  ASP   A O    1 
ATOM   307  C  CB   . ASP   A 1 41  ? -32.59728 -20.34595 2.26620   1.000 22.93368  ? 41  ASP   A CB   1 
ATOM   308  C  CG   . ASP   A 1 41  ? -32.02248 -19.04526 2.80092   1.000 28.62352  ? 41  ASP   A CG   1 
ATOM   309  O  OD1  . ASP   A 1 41  ? -32.70611 -18.36483 3.59771   1.000 26.61266  ? 41  ASP   A OD1  1 
ATOM   310  O  OD2  . ASP   A 1 41  ? -30.88231 -18.70406 2.42333   1.000 27.38965  ? 41  ASP   A OD2  1 
ATOM   311  N  N    . LEU   A 1 42  ? -35.76374 -22.28337 2.53186   1.000 17.55723  ? 42  LEU   A N    1 
ATOM   312  C  CA   . LEU   A 1 42  ? -36.64979 -23.09737 1.70848   1.000 19.21628  ? 42  LEU   A CA   1 
ATOM   313  C  C    . LEU   A 1 42  ? -37.26528 -22.25316 0.59963   1.000 23.27967  ? 42  LEU   A C    1 
ATOM   314  O  O    . LEU   A 1 42  ? -37.30876 -22.67354 -0.56242  1.000 21.36767  ? 42  LEU   A O    1 
ATOM   315  C  CB   . LEU   A 1 42  ? -37.73336 -23.74022 2.57890   1.000 21.00173  ? 42  LEU   A CB   1 
ATOM   316  C  CG   . LEU   A 1 42  ? -38.82787 -24.56754 1.89860   1.000 22.02258  ? 42  LEU   A CG   1 
ATOM   317  C  CD1  . LEU   A 1 42  ? -38.22028 -25.69896 1.07658   1.000 22.29511  ? 42  LEU   A CD1  1 
ATOM   318  C  CD2  . LEU   A 1 42  ? -39.79904 -25.11992 2.93511   1.000 19.64668  ? 42  LEU   A CD2  1 
ATOM   319  N  N    . PHE   A 1 43  ? -37.70009 -21.03865 0.93150   1.000 19.57735  ? 43  PHE   A N    1 
ATOM   320  C  CA   . PHE   A 1 43  ? -38.28667 -20.11608 -0.02645  1.000 18.37308  ? 43  PHE   A CA   1 
ATOM   321  C  C    . PHE   A 1 43  ? -37.36595 -18.92217 -0.24928  1.000 21.84979  ? 43  PHE   A C    1 
ATOM   322  O  O    . PHE   A 1 43  ? -36.63497 -18.49852 0.65181   1.000 21.43122  ? 43  PHE   A O    1 
ATOM   323  C  CB   . PHE   A 1 43  ? -39.66265 -19.63339 0.45264   1.000 25.91459  ? 43  PHE   A CB   1 
ATOM   324  C  CG   . PHE   A 1 43  ? -40.68020 -20.73377 0.57321   1.000 22.88124  ? 43  PHE   A CG   1 
ATOM   325  C  CD1  . PHE   A 1 43  ? -41.41559 -21.14440 -0.53144  1.000 21.01439  ? 43  PHE   A CD1  1 
ATOM   326  C  CD2  . PHE   A 1 43  ? -40.88856 -21.36976 1.78614   1.000 17.38033  ? 43  PHE   A CD2  1 
ATOM   327  C  CE1  . PHE   A 1 43  ? -42.35068 -22.16633 -0.42255  1.000 22.03780  ? 43  PHE   A CE1  1 
ATOM   328  C  CE2  . PHE   A 1 43  ? -41.82137 -22.39178 1.90313   1.000 19.68616  ? 43  PHE   A CE2  1 
ATOM   329  C  CZ   . PHE   A 1 43  ? -42.55151 -22.79117 0.79804   1.000 16.78266  ? 43  PHE   A CZ   1 
ATOM   330  N  N    . GLU   A 1 44  ? -37.40864 -18.38401 -1.47123  1.000 21.76170  ? 44  GLU   A N    1 
ATOM   331  C  CA   . GLU   A 1 44  ? -36.63220 -17.18942 -1.78989  1.000 23.03512  ? 44  GLU   A CA   1 
ATOM   332  C  C    . GLU   A 1 44  ? -37.11447 -15.97674 -1.00233  1.000 31.46554  ? 44  GLU   A C    1 
ATOM   333  O  O    . GLU   A 1 44  ? -36.33043 -15.05639 -0.73500  1.000 25.49015  ? 44  GLU   A O    1 
ATOM   334  C  CB   . GLU   A 1 44  ? -36.70024 -16.90810 -3.29491  1.000 27.01388  ? 44  GLU   A CB   1 
ATOM   335  C  CG   . GLU   A 1 44  ? -36.08082 -15.57926 -3.73876  1.000 31.66739  ? 44  GLU   A CG   1 
ATOM   336  C  CD   . GLU   A 1 44  ? -34.57310 -15.50753 -3.52315  1.000 43.20874  ? 44  GLU   A CD   1 
ATOM   337  O  OE1  . GLU   A 1 44  ? -33.94813 -16.54402 -3.21288  1.000 43.97492  ? 44  GLU   A OE1  1 
ATOM   338  O  OE2  . GLU   A 1 44  ? -34.01026 -14.39956 -3.64473  1.000 43.29147  ? 44  GLU   A OE2  1 
ATOM   339  N  N    . ALA   A 1 45  ? -38.38967 -15.95694 -0.61910  1.000 27.11120  ? 45  ALA   A N    1 
ATOM   340  C  CA   . ALA   A 1 45  ? -38.94903 -14.83254 0.11298   1.000 23.89187  ? 45  ALA   A CA   1 
ATOM   341  C  C    . ALA   A 1 45  ? -40.13379 -15.31252 0.93851   1.000 25.89707  ? 45  ALA   A C    1 
ATOM   342  O  O    . ALA   A 1 45  ? -40.75356 -16.33470 0.63442   1.000 25.51815  ? 45  ALA   A O    1 
ATOM   343  C  CB   . ALA   A 1 45  ? -39.37583 -13.70441 -0.83650  1.000 24.87095  ? 45  ALA   A CB   1 
ATOM   344  N  N    . TRP   A 1 46  ? -40.43960 -14.55983 1.99483   1.000 25.87756  ? 46  TRP   A N    1 
ATOM   345  C  CA   . TRP   A 1 46  ? -41.61849 -14.81877 2.81340   1.000 30.19933  ? 46  TRP   A CA   1 
ATOM   346  C  C    . TRP   A 1 46  ? -42.04068 -13.51873 3.47677   1.000 25.94971  ? 46  TRP   A C    1 
ATOM   347  O  O    . TRP   A 1 46  ? -41.20803 -12.82914 4.07162   1.000 24.50694  ? 46  TRP   A O    1 
ATOM   348  C  CB   . TRP   A 1 46  ? -41.34688 -15.89180 3.87472   1.000 23.20378  ? 46  TRP   A CB   1 
ATOM   349  C  CG   . TRP   A 1 46  ? -42.58808 -16.56567 4.39112   1.000 26.96568  ? 46  TRP   A CG   1 
ATOM   350  C  CD1  . TRP   A 1 46  ? -43.32559 -16.20250 5.48200   1.000 19.52558  ? 46  TRP   A CD1  1 
ATOM   351  C  CD2  . TRP   A 1 46  ? -43.22277 -17.73458 3.85010   1.000 20.53846  ? 46  TRP   A CD2  1 
ATOM   352  N  NE1  . TRP   A 1 46  ? -44.38585 -17.06472 5.64541   1.000 22.03005  ? 46  TRP   A NE1  1 
ATOM   353  C  CE2  . TRP   A 1 46  ? -44.34372 -18.01354 4.65812   1.000 20.51790  ? 46  TRP   A CE2  1 
ATOM   354  C  CE3  . TRP   A 1 46  ? -42.95263 -18.56882 2.75946   1.000 19.91043  ? 46  TRP   A CE3  1 
ATOM   355  C  CZ2  . TRP   A 1 46  ? -45.19508 -19.09264 4.41117   1.000 23.30687  ? 46  TRP   A CZ2  1 
ATOM   356  C  CZ3  . TRP   A 1 46  ? -43.80035 -19.64126 2.51613   1.000 20.95773  ? 46  TRP   A CZ3  1 
ATOM   357  C  CH2  . TRP   A 1 46  ? -44.90650 -19.89149 3.33823   1.000 21.74019  ? 46  TRP   A CH2  1 
ATOM   358  N  N    . ILE   A 1 47  ? -43.32872 -13.18762 3.37181   1.000 21.06485  ? 47  ILE   A N    1 
ATOM   359  C  CA   . ILE   A 1 47  ? -43.87807 -11.97224 3.95646   1.000 27.12355  ? 47  ILE   A CA   1 
ATOM   360  C  C    . ILE   A 1 47  ? -44.98171 -12.26733 4.96360   1.000 26.99451  ? 47  ILE   A C    1 
ATOM   361  O  O    . ILE   A 1 47  ? -45.69468 -11.35331 5.37742   1.000 26.83915  ? 47  ILE   A O    1 
ATOM   362  C  CB   . ILE   A 1 47  ? -44.38571 -11.00608 2.86774   1.000 23.77774  ? 47  ILE   A CB   1 
ATOM   363  C  CG1  . ILE   A 1 47  ? -45.48402 -11.67403 2.03656   1.000 29.31126  ? 47  ILE   A CG1  1 
ATOM   364  C  CG2  . ILE   A 1 47  ? -43.23077 -10.52906 1.99346   1.000 23.40165  ? 47  ILE   A CG2  1 
ATOM   365  C  CD1  . ILE   A 1 47  ? -46.25108 -10.71621 1.15004   1.000 35.06559  ? 47  ILE   A CD1  1 
ATOM   366  N  N    . GLY   A 1 48  ? -45.14123 -13.52488 5.36407   1.000 25.28190  ? 48  GLY   A N    1 
ATOM   367  C  CA   . GLY   A 1 48  ? -46.17993 -13.90730 6.30748   1.000 26.12603  ? 48  GLY   A CA   1 
ATOM   368  C  C    . GLY   A 1 48  ? -46.97592 -15.10767 5.83156   1.000 25.41302  ? 48  GLY   A C    1 
ATOM   369  O  O    . GLY   A 1 48  ? -47.11586 -15.35664 4.63246   1.000 24.46388  ? 48  GLY   A O    1 
ATOM   370  N  N    . ASP   A 1 49  ? -47.51551 -15.86188 6.79366   1.000 20.81848  ? 49  ASP   A N    1 
ATOM   371  C  CA   . ASP   A 1 49  ? -48.24019 -17.09461 6.49522   1.000 24.60633  ? 49  ASP   A CA   1 
ATOM   372  C  C    . ASP   A 1 49  ? -49.61449 -16.85806 5.88233   1.000 32.30413  ? 49  ASP   A C    1 
ATOM   373  O  O    . ASP   A 1 49  ? -50.22611 -17.81827 5.40090   1.000 23.47144  ? 49  ASP   A O    1 
ATOM   374  C  CB   . ASP   A 1 49  ? -48.41270 -17.93128 7.76346   1.000 23.49550  ? 49  ASP   A CB   1 
ATOM   375  C  CG   . ASP   A 1 49  ? -47.10368 -18.45637 8.30607   1.000 24.02058  ? 49  ASP   A CG   1 
ATOM   376  O  OD1  . ASP   A 1 49  ? -46.06265 -18.31215 7.62969   1.000 25.32481  ? 49  ASP   A OD1  1 
ATOM   377  O  OD2  . ASP   A 1 49  ? -47.12256 -19.01609 9.42011   1.000 24.09061  ? 49  ASP   A OD2  1 
ATOM   378  N  N    . ASP   A 1 50  ? -50.12940 -15.62989 5.91277   1.000 23.08034  ? 50  ASP   A N    1 
ATOM   379  C  CA   . ASP   A 1 50  ? -51.40791 -15.33865 5.27566   1.000 21.70034  ? 50  ASP   A CA   1 
ATOM   380  C  C    . ASP   A 1 50  ? -51.27184 -15.07906 3.78111   1.000 24.77204  ? 50  ASP   A C    1 
ATOM   381  O  O    . ASP   A 1 50  ? -52.27442 -14.77524 3.12658   1.000 25.87688  ? 50  ASP   A O    1 
ATOM   382  C  CB   . ASP   A 1 50  ? -52.07846 -14.14351 5.95940   1.000 20.51402  ? 50  ASP   A CB   1 
ATOM   383  C  CG   . ASP   A 1 50  ? -51.19488 -12.90869 5.97679   1.000 27.53384  ? 50  ASP   A CG   1 
ATOM   384  O  OD1  . ASP   A 1 50  ? -49.96744 -13.04401 5.79009   1.000 28.19441  ? 50  ASP   A OD1  1 
ATOM   385  O  OD2  . ASP   A 1 50  ? -51.72685 -11.79905 6.17761   1.000 30.34175  ? 50  ASP   A OD2  1 
ATOM   386  N  N    . ASP   A 1 51  ? -50.06798 -15.19748 3.23620   1.000 24.18354  ? 51  ASP   A N    1 
ATOM   387  C  CA   . ASP   A 1 51  ? -49.83132 -15.00329 1.80968   1.000 23.13091  ? 51  ASP   A CA   1 
ATOM   388  C  C    . ASP   A 1 51  ? -50.54321 -16.08802 1.00888   1.000 28.05215  ? 51  ASP   A C    1 
ATOM   389  O  O    . ASP   A 1 51  ? -50.27320 -17.27747 1.21780   1.000 26.52637  ? 51  ASP   A O    1 
ATOM   390  C  CB   . ASP   A 1 51  ? -48.32441 -15.02054 1.55123   1.000 21.52603  ? 51  ASP   A CB   1 
ATOM   391  C  CG   . ASP   A 1 51  ? -47.95364 -14.67874 0.11642   1.000 25.52526  ? 51  ASP   A CG   1 
ATOM   392  O  OD1  . ASP   A 1 51  ? -48.83545 -14.65496 -0.76665  1.000 20.67978  ? 51  ASP   A OD1  1 
ATOM   393  O  OD2  . ASP   A 1 51  ? -46.75316 -14.42869 -0.12520  1.000 28.38832  ? 51  ASP   A OD2  1 
ATOM   394  N  N    . PRO   A 1 52  ? -51.44987 -15.73638 0.09456   1.000 27.36557  ? 52  PRO   A N    1 
ATOM   395  C  CA   . PRO   A 1 52  ? -52.14227 -16.75038 -0.70840  1.000 27.67182  ? 52  PRO   A CA   1 
ATOM   396  C  C    . PRO   A 1 52  ? -51.33829 -17.30341 -1.87541  1.000 30.15785  ? 52  PRO   A C    1 
ATOM   397  O  O    . PRO   A 1 52  ? -51.91628 -18.01534 -2.70111  1.000 22.91621  ? 52  PRO   A O    1 
ATOM   398  C  CB   . PRO   A 1 52  ? -53.37984 -15.98959 -1.21482  1.000 23.30924  ? 52  PRO   A CB   1 
ATOM   399  C  CG   . PRO   A 1 52  ? -52.92692 -14.57375 -1.30283  1.000 30.04390  ? 52  PRO   A CG   1 
ATOM   400  C  CD   . PRO   A 1 52  ? -51.96141 -14.37618 -0.16006  1.000 25.39665  ? 52  PRO   A CD   1 
ATOM   401  N  N    . ASN   A 1 53  ? -50.04102 -16.99873 -1.96687  1.000 22.21947  ? 53  ASN   A N    1 
ATOM   402  C  CA   . ASN   A 1 53  ? -49.17809 -17.52184 -3.01845  1.000 22.62850  ? 53  ASN   A CA   1 
ATOM   403  C  C    . ASN   A 1 53  ? -49.42078 -19.02220 -3.17899  1.000 21.70148  ? 53  ASN   A C    1 
ATOM   404  O  O    . ASN   A 1 53  ? -49.23457 -19.77920 -2.21524  1.000 21.77351  ? 53  ASN   A O    1 
ATOM   405  C  CB   . ASN   A 1 53  ? -47.70875 -17.24093 -2.68363  1.000 24.24864  ? 53  ASN   A CB   1 
ATOM   406  C  CG   . ASN   A 1 53  ? -46.74513 -17.63384 -3.80699  1.000 31.51198  ? 53  ASN   A CG   1 
ATOM   407  O  OD1  . ASN   A 1 53  ? -47.07476 -18.42162 -4.69380  1.000 28.23142  ? 53  ASN   A OD1  1 
ATOM   408  N  ND2  . ASN   A 1 53  ? -45.54452 -17.06568 -3.77066  1.000 23.38031  ? 53  ASN   A ND2  1 
ATOM   409  N  N    . PRO   A 1 54  ? -49.88013 -19.47849 -4.34734  1.000 25.31775  ? 54  PRO   A N    1 
ATOM   410  C  CA   . PRO   A 1 54  ? -50.23920 -20.89706 -4.48427  1.000 26.30553  ? 54  PRO   A CA   1 
ATOM   411  C  C    . PRO   A 1 54  ? -49.06612 -21.82997 -4.27770  1.000 27.78085  ? 54  PRO   A C    1 
ATOM   412  O  O    . PRO   A 1 54  ? -49.26571 -22.96606 -3.83009  1.000 19.37007  ? 54  PRO   A O    1 
ATOM   413  C  CB   . PRO   A 1 54  ? -50.78700 -20.98393 -5.91647  1.000 27.67490  ? 54  PRO   A CB   1 
ATOM   414  C  CG   . PRO   A 1 54  ? -51.19692 -19.57592 -6.25363  1.000 28.97365  ? 54  PRO   A CG   1 
ATOM   415  C  CD   . PRO   A 1 54  ? -50.19008 -18.71056 -5.56443  1.000 24.04704  ? 54  PRO   A CD   1 
ATOM   416  N  N    . LEU   A 1 55  ? -47.84590 -21.37809 -4.57939  1.000 23.44035  ? 55  LEU   A N    1 
ATOM   417  C  CA   . LEU   A 1 55  ? -46.67206 -22.20937 -4.34188  1.000 26.54424  ? 55  LEU   A CA   1 
ATOM   418  C  C    . LEU   A 1 55  ? -46.58864 -22.62527 -2.87946  1.000 24.94569  ? 55  LEU   A C    1 
ATOM   419  O  O    . LEU   A 1 55  ? -46.22740 -23.76612 -2.57116  1.000 24.15278  ? 55  LEU   A O    1 
ATOM   420  C  CB   . LEU   A 1 55  ? -45.40742 -21.46188 -4.76835  1.000 25.44792  ? 55  LEU   A CB   1 
ATOM   421  C  CG   . LEU   A 1 55  ? -44.06462 -22.14824 -4.50675  1.000 28.33594  ? 55  LEU   A CG   1 
ATOM   422  C  CD1  . LEU   A 1 55  ? -43.94042 -23.40337 -5.35180  1.000 23.54615  ? 55  LEU   A CD1  1 
ATOM   423  C  CD2  . LEU   A 1 55  ? -42.91064 -21.19468 -4.78578  1.000 28.68406  ? 55  LEU   A CD2  1 
ATOM   424  N  N    . HIS   A 1 56  ? -46.95636 -21.72270 -1.96561  1.000 21.58736  ? 56  HIS   A N    1 
ATOM   425  C  CA   . HIS   A 1 56  ? -46.87170 -22.03563 -0.54233  1.000 22.98465  ? 56  HIS   A CA   1 
ATOM   426  C  C    . HIS   A 1 56  ? -47.76682 -23.21409 -0.17693  1.000 20.68817  ? 56  HIS   A C    1 
ATOM   427  O  O    . HIS   A 1 56  ? -47.36969 -24.07881 0.61047   1.000 22.82253  ? 56  HIS   A O    1 
ATOM   428  C  CB   . HIS   A 1 56  ? -47.23639 -20.80965 0.29703   1.000 19.11250  ? 56  HIS   A CB   1 
ATOM   429  C  CG   . HIS   A 1 56  ? -46.29521 -19.65443 0.12828   1.000 19.50511  ? 56  HIS   A CG   1 
ATOM   430  N  ND1  . HIS   A 1 56  ? -46.43038 -18.47636 0.83108   1.000 23.45071  ? 56  HIS   A ND1  1 
ATOM   431  C  CD2  . HIS   A 1 56  ? -45.21327 -19.49279 -0.67046  1.000 20.76216  ? 56  HIS   A CD2  1 
ATOM   432  C  CE1  . HIS   A 1 56  ? -45.46855 -17.64156 0.47839   1.000 24.41966  ? 56  HIS   A CE1  1 
ATOM   433  N  NE2  . HIS   A 1 56  ? -44.71702 -18.23362 -0.43286  1.000 22.79032  ? 56  HIS   A NE2  1 
ATOM   434  N  N    . GLN   A 1 57  ? -48.98046 -23.26725 -0.73360  1.000 19.41912  ? 57  GLN   A N    1 
ATOM   435  C  CA   . GLN   A 1 57  ? -49.87798 -24.37146 -0.40959  1.000 24.88433  ? 57  GLN   A CA   1 
ATOM   436  C  C    . GLN   A 1 57  ? -49.45407 -25.66173 -1.09590  1.000 21.43696  ? 57  GLN   A C    1 
ATOM   437  O  O    . GLN   A 1 57  ? -49.63580 -26.74822 -0.53623  1.000 24.09895  ? 57  GLN   A O    1 
ATOM   438  C  CB   . GLN   A 1 57  ? -51.31726 -24.01504 -0.78594  1.000 22.66726  ? 57  GLN   A CB   1 
ATOM   439  C  CG   . GLN   A 1 57  ? -51.88383 -22.82969 -0.01050  1.000 43.58733  ? 57  GLN   A CG   1 
ATOM   440  C  CD   . GLN   A 1 57  ? -51.41167 -22.78346 1.43765   1.000 62.75923  ? 57  GLN   A CD   1 
ATOM   441  O  OE1  . GLN   A 1 57  ? -50.86148 -21.77693 1.88929   1.000 49.86808  ? 57  GLN   A OE1  1 
ATOM   442  N  NE2  . GLN   A 1 57  ? -51.64396 -23.86797 2.17759   1.000 56.91330  ? 57  GLN   A NE2  1 
ATOM   443  N  N    . GLN   A 1 58  ? -48.90219 -25.56211 -2.30466  1.000 23.02064  ? 58  GLN   A N    1 
ATOM   444  C  CA   . GLN   A 1 58  ? -48.39873 -26.74336 -2.99365  1.000 26.05429  ? 58  GLN   A CA   1 
ATOM   445  C  C    . GLN   A 1 58  ? -47.24309 -27.36653 -2.22763  1.000 22.47392  ? 58  GLN   A C    1 
ATOM   446  O  O    . GLN   A 1 58  ? -47.17748 -28.59119 -2.07183  1.000 23.13170  ? 58  GLN   A O    1 
ATOM   447  C  CB   . GLN   A 1 58  ? -47.96441 -26.36200 -4.40578  1.000 30.90508  ? 58  GLN   A CB   1 
ATOM   448  C  CG   . GLN   A 1 58  ? -49.13080 -25.97689 -5.28787  1.000 50.07976  ? 58  GLN   A CG   1 
ATOM   449  C  CD   . GLN   A 1 58  ? -48.69794 -25.43742 -6.63028  1.000 54.92846  ? 58  GLN   A CD   1 
ATOM   450  O  OE1  . GLN   A 1 58  ? -49.52403 -24.97570 -7.41786  1.000 47.67807  ? 58  GLN   A OE1  1 
ATOM   451  N  NE2  . GLN   A 1 58  ? -47.39839 -25.49136 -6.90204  1.000 60.85475  ? 58  GLN   A NE2  1 
ATOM   452  N  N    . ILE   A 1 59  ? -46.32054 -26.53487 -1.74215  1.000 22.79373  ? 59  ILE   A N    1 
ATOM   453  C  CA   . ILE   A 1 59  ? -45.21189 -27.03811 -0.94014  1.000 26.27904  ? 59  ILE   A CA   1 
ATOM   454  C  C    . ILE   A 1 59  ? -45.71944 -27.58336 0.38990   1.000 21.62334  ? 59  ILE   A C    1 
ATOM   455  O  O    . ILE   A 1 59  ? -45.30038 -28.65866 0.83486   1.000 21.42001  ? 59  ILE   A O    1 
ATOM   456  C  CB   . ILE   A 1 59  ? -44.15959 -25.93103 -0.74146  1.000 23.36260  ? 59  ILE   A CB   1 
ATOM   457  C  CG1  . ILE   A 1 59  ? -43.51228 -25.56756 -2.08142  1.000 22.04196  ? 59  ILE   A CG1  1 
ATOM   458  C  CG2  . ILE   A 1 59  ? -43.09774 -26.38120 0.24382   1.000 22.50014  ? 59  ILE   A CG2  1 
ATOM   459  C  CD1  . ILE   A 1 59  ? -42.98144 -26.77104 -2.85175  1.000 22.15317  ? 59  ILE   A CD1  1 
ATOM   460  N  N    . ALA   A 1 60  ? -46.63556 -26.85820 1.04162   1.000 23.09645  ? 60  ALA   A N    1 
ATOM   461  C  CA   . ALA   A 1 60  ? -47.18706 -27.32886 2.31007   1.000 23.38947  ? 60  ALA   A CA   1 
ATOM   462  C  C    . ALA   A 1 60  ? -47.81786 -28.70958 2.16419   1.000 24.95402  ? 60  ALA   A C    1 
ATOM   463  O  O    . ALA   A 1 60  ? -47.57993 -29.59693 2.99165   1.000 21.84359  ? 60  ALA   A O    1 
ATOM   464  C  CB   . ALA   A 1 60  ? -48.21011 -26.32798 2.84745   1.000 22.34396  ? 60  ALA   A CB   1 
ATOM   465  N  N    . SER   A 1 61  ? -48.60997 -28.91762 1.10772   1.000 20.80812  ? 61  SER   A N    1 
ATOM   466  C  CA   . SER   A 1 61  ? -49.27427 -30.20682 0.92917   1.000 20.95308  ? 61  SER   A CA   1 
ATOM   467  C  C    . SER   A 1 61  ? -48.26948 -31.32127 0.67194   1.000 25.09118  ? 61  SER   A C    1 
ATOM   468  O  O    . SER   A 1 61  ? -48.45641 -32.45085 1.13881   1.000 26.81038  ? 61  SER   A O    1 
ATOM   469  C  CB   . SER   A 1 61  ? -50.28414 -30.13614 -0.21690  1.000 23.42833  ? 61  SER   A CB   1 
ATOM   470  O  OG   . SER   A 1 61  ? -51.20666 -29.07911 -0.02912  1.000 45.72883  ? 61  SER   A OG   1 
ATOM   471  N  N    . ALA   A 1 62  ? -47.20330 -31.02764 -0.07519  1.000 28.18177  ? 62  ALA   A N    1 
ATOM   472  C  CA   . ALA   A 1 62  ? -46.21904 -32.05897 -0.38814  1.000 26.35014  ? 62  ALA   A CA   1 
ATOM   473  C  C    . ALA   A 1 62  ? -45.41538 -32.44752 0.84392   1.000 23.46470  ? 62  ALA   A C    1 
ATOM   474  O  O    . ALA   A 1 62  ? -45.13498 -33.63294 1.06194   1.000 24.51621  ? 62  ALA   A O    1 
ATOM   475  C  CB   . ALA   A 1 62  ? -45.29332 -31.58067 -1.50210  1.000 22.18243  ? 62  ALA   A CB   1 
ATOM   476  N  N    . ILE   A 1 63  ? -45.03176 -31.46487 1.65992   1.000 20.30816  ? 63  ILE   A N    1 
ATOM   477  C  CA   . ILE   A 1 63  ? -44.33270 -31.77806 2.90030   1.000 22.96406  ? 63  ILE   A CA   1 
ATOM   478  C  C    . ILE   A 1 63  ? -45.25630 -32.52478 3.85415   1.000 23.18781  ? 63  ILE   A C    1 
ATOM   479  O  O    . ILE   A 1 63  ? -44.83903 -33.47710 4.52514   1.000 21.93017  ? 63  ILE   A O    1 
ATOM   480  C  CB   . ILE   A 1 63  ? -43.76774 -30.49471 3.53547   1.000 22.54393  ? 63  ILE   A CB   1 
ATOM   481  C  CG1  . ILE   A 1 63  ? -42.70103 -29.87872 2.62684   1.000 17.75357  ? 63  ILE   A CG1  1 
ATOM   482  C  CG2  . ILE   A 1 63  ? -43.17491 -30.79692 4.90174   1.000 24.42676  ? 63  ILE   A CG2  1 
ATOM   483  C  CD1  . ILE   A 1 63  ? -42.11721 -28.58838 3.15811   1.000 16.81276  ? 63  ILE   A CD1  1 
ATOM   484  N  N    . LYS   A 1 64  ? -46.52954 -32.12112 3.91471   1.000 22.95734  ? 64  LYS   A N    1 
ATOM   485  C  CA   . LYS   A 1 64  ? -47.48015 -32.79732 4.79236   1.000 23.17701  ? 64  LYS   A CA   1 
ATOM   486  C  C    . LYS   A 1 64  ? -47.65738 -34.26113 4.40809   1.000 24.15763  ? 64  LYS   A C    1 
ATOM   487  O  O    . LYS   A 1 64  ? -47.87680 -35.10886 5.28079   1.000 22.37652  ? 64  LYS   A O    1 
ATOM   488  C  CB   . LYS   A 1 64  ? -48.82849 -32.07015 4.76968   1.000 25.33301  ? 64  LYS   A CB   1 
ATOM   489  C  CG   . LYS   A 1 64  ? -49.86464 -32.63393 5.74478   1.000 31.32374  ? 64  LYS   A CG   1 
ATOM   490  C  CD   . LYS   A 1 64  ? -49.54667 -32.23510 7.18183   1.000 38.66101  ? 64  LYS   A CD   1 
ATOM   491  C  CE   . LYS   A 1 64  ? -50.31592 -33.07597 8.19573   1.000 44.05808  ? 64  LYS   A CE   1 
ATOM   492  N  NZ   . LYS   A 1 64  ? -51.67677 -33.45590 7.72442   1.000 50.15858  ? 64  LYS   A NZ   1 
ATOM   493  N  N    . ALA   A 1 65  ? -47.57026 -34.57838 3.11392   1.000 20.20793  ? 65  ALA   A N    1 
ATOM   494  C  CA   . ALA   A 1 65  ? -47.65388 -35.97277 2.69303   1.000 24.13952  ? 65  ALA   A CA   1 
ATOM   495  C  C    . ALA   A 1 65  ? -46.45365 -36.77712 3.17770   1.000 24.83010  ? 65  ALA   A C    1 
ATOM   496  O  O    . ALA   A 1 65  ? -46.57693 -37.98131 3.43616   1.000 26.19971  ? 65  ALA   A O    1 
ATOM   497  C  CB   . ALA   A 1 65  ? -47.77390 -36.05612 1.17118   1.000 24.55224  ? 65  ALA   A CB   1 
ATOM   498  N  N    . VAL   A 1 66  ? -45.29044 -36.13641 3.30470   1.000 22.18432  ? 66  VAL   A N    1 
ATOM   499  C  CA   . VAL   A 1 66  ? -44.12799 -36.81763 3.86638   1.000 22.07346  ? 66  VAL   A CA   1 
ATOM   500  C  C    . VAL   A 1 66  ? -44.33231 -37.05348 5.35699   1.000 28.07910  ? 66  VAL   A C    1 
ATOM   501  O  O    . VAL   A 1 66  ? -44.04166 -38.13855 5.87819   1.000 26.36282  ? 66  VAL   A O    1 
ATOM   502  C  CB   . VAL   A 1 66  ? -42.84935 -36.00191 3.58931   1.000 25.65570  ? 66  VAL   A CB   1 
ATOM   503  C  CG1  . VAL   A 1 66  ? -41.65952 -36.58447 4.33984   1.000 26.19403  ? 66  VAL   A CG1  1 
ATOM   504  C  CG2  . VAL   A 1 66  ? -42.57175 -35.92249 2.09274   1.000 19.72915  ? 66  VAL   A CG2  1 
ATOM   505  N  N    . VAL   A 1 67  ? -44.84901 -36.04285 6.06039   1.000 21.93172  ? 67  VAL   A N    1 
ATOM   506  C  CA   . VAL   A 1 67  ? -45.12446 -36.16880 7.48842   1.000 23.07080  ? 67  VAL   A CA   1 
ATOM   507  C  C    . VAL   A 1 67  ? -46.16365 -37.25645 7.73531   1.000 30.48912  ? 67  VAL   A C    1 
ATOM   508  O  O    . VAL   A 1 67  ? -46.02369 -38.07301 8.65497   1.000 28.12978  ? 67  VAL   A O    1 
ATOM   509  C  CB   . VAL   A 1 67  ? -45.57911 -34.80874 8.05463   1.000 24.17995  ? 67  VAL   A CB   1 
ATOM   510  C  CG1  . VAL   A 1 67  ? -46.05071 -34.94345 9.49993   1.000 24.45639  ? 67  VAL   A CG1  1 
ATOM   511  C  CG2  . VAL   A 1 67  ? -44.47007 -33.76642 7.92334   1.000 18.18583  ? 67  VAL   A CG2  1 
ATOM   512  N  N    . ASP   A 1 68  ? -47.22049 -37.28846 6.91375   1.000 24.12879  ? 68  ASP   A N    1 
ATOM   513  C  CA   . ASP   A 1 68  ? -48.25641 -38.30629 7.06649   1.000 23.64645  ? 68  ASP   A CA   1 
ATOM   514  C  C    . ASP   A 1 68  ? -47.71891 -39.70031 6.77817   1.000 30.10987  ? 68  ASP   A C    1 
ATOM   515  O  O    . ASP   A 1 68  ? -48.26241 -40.68800 7.28437   1.000 25.94392  ? 68  ASP   A O    1 
ATOM   516  C  CB   . ASP   A 1 68  ? -49.43961 -38.01658 6.14101   1.000 28.34367  ? 68  ASP   A CB   1 
ATOM   517  C  CG   . ASP   A 1 68  ? -50.22142 -36.78529 6.55213   1.000 34.12990  ? 68  ASP   A CG   1 
ATOM   518  O  OD1  . ASP   A 1 68  ? -50.18121 -36.40928 7.74216   1.000 32.03685  ? 68  ASP   A OD1  1 
ATOM   519  O  OD2  . ASP   A 1 68  ? -50.88851 -36.19462 5.67892   1.000 28.99179  ? 68  ASP   A OD2  1 
ATOM   520  N  N    . ALA   A 1 69  ? -46.66950 -39.80180 5.96217   1.000 30.25564  ? 69  ALA   A N    1 
ATOM   521  C  CA   . ALA   A 1 69  ? -46.04029 -41.07751 5.65259   1.000 29.65246  ? 69  ALA   A CA   1 
ATOM   522  C  C    . ALA   A 1 69  ? -45.09316 -41.55027 6.74779   1.000 35.45679  ? 69  ALA   A C    1 
ATOM   523  O  O    . ALA   A 1 69  ? -44.38318 -42.54092 6.54488   1.000 38.68713  ? 69  ALA   A O    1 
ATOM   524  C  CB   . ALA   A 1 69  ? -45.29304 -40.98588 4.32057   1.000 30.28711  ? 69  ALA   A CB   1 
ATOM   525  N  N    . GLY   A 1 70  ? -45.06408 -40.87035 7.89060   1.000 27.78548  ? 70  GLY   A N    1 
ATOM   526  C  CA   . GLY   A 1 70  ? -44.26869 -41.29528 9.02196   1.000 26.92733  ? 70  GLY   A CA   1 
ATOM   527  C  C    . GLY   A 1 70  ? -42.90524 -40.65522 9.15701   1.000 27.57278  ? 70  GLY   A C    1 
ATOM   528  O  O    . GLY   A 1 70  ? -42.12736 -41.08427 10.01539  1.000 30.48494  ? 70  GLY   A O    1 
ATOM   529  N  N    . VAL   A 1 71  ? -42.59238 -39.64384 8.35404   1.000 26.07548  ? 71  VAL   A N    1 
ATOM   530  C  CA   . VAL   A 1 71  ? -41.27667 -39.00784 8.39511   1.000 23.55179  ? 71  VAL   A CA   1 
ATOM   531  C  C    . VAL   A 1 71  ? -41.39714 -37.62139 9.01698   1.000 26.18756  ? 71  VAL   A C    1 
ATOM   532  O  O    . VAL   A 1 71  ? -41.85912 -36.68134 8.35342   1.000 19.84189  ? 71  VAL   A O    1 
ATOM   533  C  CB   . VAL   A 1 71  ? -40.65534 -38.92381 6.99362   1.000 20.70986  ? 71  VAL   A CB   1 
ATOM   534  C  CG1  . VAL   A 1 71  ? -39.28142 -38.26367 7.05684   1.000 20.52590  ? 71  VAL   A CG1  1 
ATOM   535  C  CG2  . VAL   A 1 71  ? -40.56713 -40.31366 6.36658   1.000 21.91558  ? 71  VAL   A CG2  1 
ATOM   536  N  N    . PRO   A 1 72  ? -41.00357 -37.44526 10.27627  1.000 19.81369  ? 72  PRO   A N    1 
ATOM   537  C  CA   . PRO   A 1 72  ? -41.06343 -36.10941 10.87953  1.000 22.45677  ? 72  PRO   A CA   1 
ATOM   538  C  C    . PRO   A 1 72  ? -40.16274 -35.12899 10.14168  1.000 24.94401  ? 72  PRO   A C    1 
ATOM   539  O  O    . PRO   A 1 72  ? -39.03342 -35.45259 9.76550   1.000 19.32484  ? 72  PRO   A O    1 
ATOM   540  C  CB   . PRO   A 1 72  ? -40.59063 -36.34100 12.31935  1.000 27.75733  ? 72  PRO   A CB   1 
ATOM   541  C  CG   . PRO   A 1 72  ? -39.84799 -37.64645 12.28500  1.000 31.74352  ? 72  PRO   A CG   1 
ATOM   542  C  CD   . PRO   A 1 72  ? -40.48405 -38.46331 11.20494  1.000 21.80633  ? 72  PRO   A CD   1 
ATOM   543  N  N    . CYS   A 1 73  ? -40.68449 -33.92176 9.92795   1.000 16.38106  ? 73  CYS   A N    1 
ATOM   544  C  CA   . CYS   A 1 73  ? -40.00199 -32.87767 9.17718   1.000 19.28313  ? 73  CYS   A CA   1 
ATOM   545  C  C    . CYS   A 1 73  ? -39.79360 -31.65673 10.06434  1.000 23.87162  ? 73  CYS   A C    1 
ATOM   546  O  O    . CYS   A 1 73  ? -40.70655 -31.23824 10.78360  1.000 22.84002  ? 73  CYS   A O    1 
ATOM   547  C  CB   . CYS   A 1 73  ? -40.80246 -32.49255 7.92789   1.000 24.99265  ? 73  CYS   A CB   1 
ATOM   548  S  SG   . CYS   A 1 73  ? -40.85775 -33.77586 6.64930   1.000 24.50362  ? 73  CYS   A SG   1 
ATOM   549  N  N    . TYR   A 1 74  ? -38.59412 -31.07932 10.00382  1.000 20.85842  ? 74  TYR   A N    1 
ATOM   550  C  CA   . TYR   A 1 74  ? -38.22585 -29.96314 10.86239  1.000 19.73072  ? 74  TYR   A CA   1 
ATOM   551  C  C    . TYR   A 1 74  ? -37.72513 -28.80096 10.01632  1.000 27.51536  ? 74  TYR   A C    1 
ATOM   552  O  O    . TYR   A 1 74  ? -37.23052 -28.98230 8.90029   1.000 25.90042  ? 74  TYR   A O    1 
ATOM   553  C  CB   . TYR   A 1 74  ? -37.14633 -30.36473 11.88102  1.000 23.66380  ? 74  TYR   A CB   1 
ATOM   554  C  CG   . TYR   A 1 74  ? -37.51668 -31.55828 12.73265  1.000 23.64668  ? 74  TYR   A CG   1 
ATOM   555  C  CD1  . TYR   A 1 74  ? -37.23228 -32.84986 12.30873  1.000 22.16497  ? 74  TYR   A CD1  1 
ATOM   556  C  CD2  . TYR   A 1 74  ? -38.14617 -31.39405 13.96167  1.000 23.24802  ? 74  TYR   A CD2  1 
ATOM   557  C  CE1  . TYR   A 1 74  ? -37.56837 -33.94599 13.07741  1.000 21.80219  ? 74  TYR   A CE1  1 
ATOM   558  C  CE2  . TYR   A 1 74  ? -38.48540 -32.48572 14.74029  1.000 20.98118  ? 74  TYR   A CE2  1 
ATOM   559  C  CZ   . TYR   A 1 74  ? -38.19371 -33.75904 14.29272  1.000 27.47277  ? 74  TYR   A CZ   1 
ATOM   560  O  OH   . TYR   A 1 74  ? -38.52865 -34.85182 15.05923  1.000 24.99362  ? 74  TYR   A OH   1 
ATOM   561  N  N    . PHE   A 1 75  ? -37.83499 -27.59616 10.57413  1.000 21.31777  ? 75  PHE   A N    1 
ATOM   562  C  CA   . PHE   A 1 75  ? -37.46931 -26.38019 9.85587   1.000 22.43372  ? 75  PHE   A CA   1 
ATOM   563  C  C    . PHE   A 1 75  ? -36.73962 -25.43298 10.79524  1.000 19.82573  ? 75  PHE   A C    1 
ATOM   564  O  O    . PHE   A 1 75  ? -37.24264 -25.10903 11.87539  1.000 24.74077  ? 75  PHE   A O    1 
ATOM   565  C  CB   . PHE   A 1 75  ? -38.70849 -25.69860 9.26024   1.000 20.62780  ? 75  PHE   A CB   1 
ATOM   566  C  CG   . PHE   A 1 75  ? -38.40339 -24.45819 8.45633   1.000 25.03680  ? 75  PHE   A CG   1 
ATOM   567  C  CD1  . PHE   A 1 75  ? -37.84768 -24.55547 7.18766   1.000 19.60025  ? 75  PHE   A CD1  1 
ATOM   568  C  CD2  . PHE   A 1 75  ? -38.69361 -23.19832 8.95892   1.000 25.41048  ? 75  PHE   A CD2  1 
ATOM   569  C  CE1  . PHE   A 1 75  ? -37.57428 -23.41924 6.44005   1.000 23.34174  ? 75  PHE   A CE1  1 
ATOM   570  C  CE2  . PHE   A 1 75  ? -38.42574 -22.05641 8.21516   1.000 22.91720  ? 75  PHE   A CE2  1 
ATOM   571  C  CZ   . PHE   A 1 75  ? -37.86526 -22.16710 6.95469   1.000 18.24382  ? 75  PHE   A CZ   1 
ATOM   572  N  N    . ILE   A 1 76  ? -35.54721 -25.01352 10.38818  1.000 19.98753  ? 76  ILE   A N    1 
ATOM   573  C  CA   . ILE   A 1 76  ? -34.84356 -23.88551 10.98287  1.000 21.66561  ? 76  ILE   A CA   1 
ATOM   574  C  C    . ILE   A 1 76  ? -34.91462 -22.74465 9.98085   1.000 25.24827  ? 76  ILE   A C    1 
ATOM   575  O  O    . ILE   A 1 76  ? -34.74245 -22.96349 8.77780   1.000 24.34860  ? 76  ILE   A O    1 
ATOM   576  C  CB   . ILE   A 1 76  ? -33.38133 -24.23945 11.32460  1.000 24.66401  ? 76  ILE   A CB   1 
ATOM   577  C  CG1  . ILE   A 1 76  ? -33.32643 -25.20370 12.51479  1.000 24.85069  ? 76  ILE   A CG1  1 
ATOM   578  C  CG2  . ILE   A 1 76  ? -32.56038 -22.97696 11.59912  1.000 19.71897  ? 76  ILE   A CG2  1 
ATOM   579  C  CD1  . ILE   A 1 76  ? -31.91665 -25.53663 12.96758  1.000 26.23648  ? 76  ILE   A CD1  1 
ATOM   580  N  N    . HIS   A 1 77  ? -35.18703 -21.53678 10.46691  1.000 21.69526  ? 77  HIS   A N    1 
ATOM   581  C  CA   . HIS   A 1 77  ? -35.35199 -20.39685 9.57423   1.000 25.84865  ? 77  HIS   A CA   1 
ATOM   582  C  C    . HIS   A 1 77  ? -34.03643 -20.01886 8.90211   1.000 28.20139  ? 77  HIS   A C    1 
ATOM   583  O  O    . HIS   A 1 77  ? -32.95406 -20.14396 9.48058   1.000 25.37905  ? 77  HIS   A O    1 
ATOM   584  C  CB   . HIS   A 1 77  ? -35.89351 -19.18670 10.33778  1.000 22.39307  ? 77  HIS   A CB   1 
ATOM   585  C  CG   . HIS   A 1 77  ? -37.29572 -19.35948 10.82909  1.000 26.38263  ? 77  HIS   A CG   1 
ATOM   586  N  ND1  . HIS   A 1 77  ? -37.59218 -19.94531 12.04087  1.000 25.29438  ? 77  HIS   A ND1  1 
ATOM   587  C  CD2  . HIS   A 1 77  ? -38.48368 -19.02908 10.26938  1.000 26.34947  ? 77  HIS   A CD2  1 
ATOM   588  C  CE1  . HIS   A 1 77  ? -38.90304 -19.96585 12.20775  1.000 29.88540  ? 77  HIS   A CE1  1 
ATOM   589  N  NE2  . HIS   A 1 77  ? -39.46712 -19.41621 11.14748  1.000 26.70748  ? 77  HIS   A NE2  1 
ATOM   590  N  N    . GLY   A 1 78  ? -34.14403 -19.54569 7.65998   1.000 22.00264  ? 78  GLY   A N    1 
ATOM   591  C  CA   . GLY   A 1 78  ? -33.03549 -18.93349 6.96417   1.000 22.88199  ? 78  GLY   A CA   1 
ATOM   592  C  C    . GLY   A 1 78  ? -33.14671 -17.41850 6.97771   1.000 26.98501  ? 78  GLY   A C    1 
ATOM   593  O  O    . GLY   A 1 78  ? -34.03643 -16.83502 7.59667   1.000 25.03916  ? 78  GLY   A O    1 
ATOM   594  N  N    . ASN   A 1 79  ? -32.21922 -16.77139 6.27211   1.000 31.27567  ? 79  ASN   A N    1 
ATOM   595  C  CA   . ASN   A 1 79  ? -32.26513 -15.31590 6.18083   1.000 32.97650  ? 79  ASN   A CA   1 
ATOM   596  C  C    . ASN   A 1 79  ? -33.33619 -14.82720 5.21429   1.000 27.09483  ? 79  ASN   A C    1 
ATOM   597  O  O    . ASN   A 1 79  ? -33.78097 -13.68020 5.33067   1.000 30.29298  ? 79  ASN   A O    1 
ATOM   598  C  CB   . ASN   A 1 79  ? -30.89191 -14.75742 5.78160   1.000 29.01406  ? 79  ASN   A CB   1 
ATOM   599  C  CG   . ASN   A 1 79  ? -30.37853 -15.32407 4.47206   1.000 34.87348  ? 79  ASN   A CG   1 
ATOM   600  O  OD1  . ASN   A 1 79  ? -30.07821 -16.51280 4.37169   1.000 31.59280  ? 79  ASN   A OD1  1 
ATOM   601  N  ND2  . ASN   A 1 79  ? -30.24712 -14.46518 3.46702   1.000 30.53959  ? 79  ASN   A ND2  1 
ATOM   602  N  N    . ARG   A 1 80  ? -33.77787 -15.67080 4.28378   1.000 27.18114  ? 80  ARG   A N    1 
ATOM   603  C  CA   . ARG   A 1 80  ? -34.82214 -15.27418 3.34905   1.000 33.16714  ? 80  ARG   A CA   1 
ATOM   604  C  C    . ARG   A 1 80  ? -36.22219 -15.50776 3.90708   1.000 27.30456  ? 80  ARG   A C    1 
ATOM   605  O  O    . ARG   A 1 80  ? -37.11654 -14.68610 3.68444   1.000 27.51128  ? 80  ARG   A O    1 
ATOM   606  C  CB   . ARG   A 1 80  ? -34.66314 -16.02851 2.02527   1.000 28.07942  ? 80  ARG   A CB   1 
ATOM   607  C  CG   . ARG   A 1 80  ? -33.28186 -15.92243 1.40009   1.000 31.33415  ? 80  ARG   A CG   1 
ATOM   608  C  CD   . ARG   A 1 80  ? -32.92682 -14.48541 1.05558   1.000 36.41229  ? 80  ARG   A CD   1 
ATOM   609  N  NE   . ARG   A 1 80  ? -33.85532 -13.91353 0.08867   1.000 37.38874  ? 80  ARG   A NE   1 
ATOM   610  C  CZ   . ARG   A 1 80  ? -33.66684 -12.76325 -0.54420  1.000 35.34421  ? 80  ARG   A CZ   1 
ATOM   611  N  NH1  . ARG   A 1 80  ? -32.58010 -12.03531 -0.34710  1.000 29.33695  ? 80  ARG   A NH1  1 
ATOM   612  N  NH2  . ARG   A 1 80  ? -34.59202 -12.33337 -1.39776  1.000 38.47787  ? 80  ARG   A NH2  1 
ATOM   613  N  N    . ASP   A 1 81  ? -36.43641 -16.60268 4.63649   1.000 28.55291  ? 81  ASP   A N    1 
ATOM   614  C  CA   . ASP   A 1 81  ? -37.77357 -17.00799 5.05818   1.000 24.74764  ? 81  ASP   A CA   1 
ATOM   615  C  C    . ASP   A 1 81  ? -37.91320 -17.01224 6.57802   1.000 24.91069  ? 81  ASP   A C    1 
ATOM   616  O  O    . ASP   A 1 81  ? -38.52486 -17.91107 7.16046   1.000 25.15928  ? 81  ASP   A O    1 
ATOM   617  C  CB   . ASP   A 1 81  ? -38.13817 -18.37645 4.47845   1.000 20.22713  ? 81  ASP   A CB   1 
ATOM   618  C  CG   . ASP   A 1 81  ? -37.01230 -19.40333 4.60703   1.000 23.92061  ? 81  ASP   A CG   1 
ATOM   619  O  OD1  . ASP   A 1 81  ? -36.02483 -19.15367 5.33303   1.000 23.27469  ? 81  ASP   A OD1  1 
ATOM   620  O  OD2  . ASP   A 1 81  ? -37.12435 -20.47534 3.97405   1.000 22.97144  ? 81  ASP   A OD2  1 
ATOM   621  N  N    . PHE   A 1 82  ? -37.36730 -15.98815 7.23950   1.000 23.92981  ? 82  PHE   A N    1 
ATOM   622  C  CA   . PHE   A 1 82  ? -37.46092 -15.88873 8.69291   1.000 19.14240  ? 82  PHE   A CA   1 
ATOM   623  C  C    . PHE   A 1 82  ? -38.87736 -15.60807 9.18455   1.000 23.01507  ? 82  PHE   A C    1 
ATOM   624  O  O    . PHE   A 1 82  ? -39.12986 -15.73245 10.38807  1.000 24.52329  ? 82  PHE   A O    1 
ATOM   625  C  CB   . PHE   A 1 82  ? -36.51527 -14.79965 9.21080   1.000 24.58822  ? 82  PHE   A CB   1 
ATOM   626  C  CG   . PHE   A 1 82  ? -36.77031 -13.44073 8.61657   1.000 25.17924  ? 82  PHE   A CG   1 
ATOM   627  C  CD1  . PHE   A 1 82  ? -36.16782 -13.06571 7.42765   1.000 30.23889  ? 82  PHE   A CD1  1 
ATOM   628  C  CD2  . PHE   A 1 82  ? -37.61216 -12.53945 9.25010   1.000 28.93824  ? 82  PHE   A CD2  1 
ATOM   629  C  CE1  . PHE   A 1 82  ? -36.40043 -11.82267 6.87859   1.000 29.18082  ? 82  PHE   A CE1  1 
ATOM   630  C  CE2  . PHE   A 1 82  ? -37.85067 -11.29240 8.70437   1.000 27.43423  ? 82  PHE   A CE2  1 
ATOM   631  C  CZ   . PHE   A 1 82  ? -37.24551 -10.93534 7.51590   1.000 35.81636  ? 82  PHE   A CZ   1 
ATOM   632  N  N    . LEU   A 1 83  ? -39.80128 -15.22927 8.30518   1.000 20.57086  ? 83  LEU   A N    1 
ATOM   633  C  CA   . LEU   A 1 83  ? -41.17540 -14.98179 8.72253   1.000 22.74525  ? 83  LEU   A CA   1 
ATOM   634  C  C    . LEU   A 1 83  ? -42.06533 -16.21507 8.62935   1.000 23.40663  ? 83  LEU   A C    1 
ATOM   635  O  O    . LEU   A 1 83  ? -43.26707 -16.10591 8.88588   1.000 22.23075  ? 83  LEU   A O    1 
ATOM   636  C  CB   . LEU   A 1 83  ? -41.79413 -13.84563 7.90079   1.000 19.48004  ? 83  LEU   A CB   1 
ATOM   637  C  CG   . LEU   A 1 83  ? -41.21524 -12.45331 8.16404   1.000 24.66923  ? 83  LEU   A CG   1 
ATOM   638  C  CD1  . LEU   A 1 83  ? -41.85230 -11.42604 7.24725   1.000 27.59516  ? 83  LEU   A CD1  1 
ATOM   639  C  CD2  . LEU   A 1 83  ? -41.39530 -12.06123 9.62557   1.000 24.94206  ? 83  LEU   A CD2  1 
ATOM   640  N  N    . VAL   A 1 84  ? -41.52143 -17.37804 8.26763   1.000 20.58655  ? 84  VAL   A N    1 
ATOM   641  C  CA   . VAL   A 1 84  ? -42.33125 -18.59211 8.28594   1.000 19.03310  ? 84  VAL   A CA   1 
ATOM   642  C  C    . VAL   A 1 84  ? -42.77652 -18.85057 9.71778   1.000 24.00370  ? 84  VAL   A C    1 
ATOM   643  O  O    . VAL   A 1 84  ? -41.95320 -18.90944 10.64056  1.000 25.19960  ? 84  VAL   A O    1 
ATOM   644  C  CB   . VAL   A 1 84  ? -41.55319 -19.77847 7.70970   1.000 20.77012  ? 84  VAL   A CB   1 
ATOM   645  C  CG1  . VAL   A 1 84  ? -42.29171 -21.08353 7.99389   1.000 21.81663  ? 84  VAL   A CG1  1 
ATOM   646  C  CG2  . VAL   A 1 84  ? -41.34891 -19.60102 6.21223   1.000 17.70441  ? 84  VAL   A CG2  1 
ATOM   647  N  N    . GLY   A 1 85  ? -44.08445 -18.99120 9.91393   1.000 18.17775  ? 85  GLY   A N    1 
ATOM   648  C  CA   . GLY   A 1 85  ? -44.62537 -19.08885 11.25518  1.000 26.27020  ? 85  GLY   A CA   1 
ATOM   649  C  C    . GLY   A 1 85  ? -45.40730 -20.35600 11.53259  1.000 31.70051  ? 85  GLY   A C    1 
ATOM   650  O  O    . GLY   A 1 85  ? -45.33652 -21.32498 10.76873  1.000 23.22380  ? 85  GLY   A O    1 
ATOM   651  N  N    . GLN   A 1 86  ? -46.17011 -20.34948 12.62851  1.000 26.59117  ? 86  GLN   A N    1 
ATOM   652  C  CA   . GLN   A 1 86  ? -46.84093 -21.55409 13.09719  1.000 29.85188  ? 86  GLN   A CA   1 
ATOM   653  C  C    . GLN   A 1 86  ? -48.02594 -21.94742 12.22970  1.000 32.35276  ? 86  GLN   A C    1 
ATOM   654  O  O    . GLN   A 1 86  ? -48.38999 -23.12783 12.20407  1.000 30.96373  ? 86  GLN   A O    1 
ATOM   655  C  CB   . GLN   A 1 86  ? -47.30054 -21.36908 14.54453  1.000 35.95080  ? 86  GLN   A CB   1 
ATOM   656  C  CG   . GLN   A 1 86  ? -46.36056 -21.99242 15.55767  1.000 52.41958  ? 86  GLN   A CG   1 
ATOM   657  C  CD   . GLN   A 1 86  ? -46.15523 -23.47863 15.32396  1.000 51.52172  ? 86  GLN   A CD   1 
ATOM   658  O  OE1  . GLN   A 1 86  ? -45.03204 -23.97134 15.37527  1.000 42.37601  ? 86  GLN   A OE1  1 
ATOM   659  N  NE2  . GLN   A 1 86  ? -47.24586 -24.20205 15.07572  1.000 57.13448  ? 86  GLN   A NE2  1 
ATOM   660  N  N    . ARG   A 1 87  ? -48.63754 -20.99085 11.53039  1.000 26.27827  ? 87  ARG   A N    1 
ATOM   661  C  CA   . ARG   A 1 87  ? -49.70769 -21.32807 10.59936  1.000 31.67969  ? 87  ARG   A CA   1 
ATOM   662  C  C    . ARG   A 1 87  ? -49.18537 -22.20274 9.46625   1.000 27.16580  ? 87  ARG   A C    1 
ATOM   663  O  O    . ARG   A 1 87  ? -49.77114 -23.24535 9.15137   1.000 23.12162  ? 87  ARG   A O    1 
ATOM   664  C  CB   . ARG   A 1 87  ? -50.35101 -20.05346 10.05001  1.000 27.03612  ? 87  ARG   A CB   1 
ATOM   665  C  CG   . ARG   A 1 87  ? -51.39274 -20.30880 8.97808   1.000 28.18716  ? 87  ARG   A CG   1 
ATOM   666  C  CD   . ARG   A 1 87  ? -52.33917 -19.12618 8.81786   1.000 32.46223  ? 87  ARG   A CD   1 
ATOM   667  N  NE   . ARG   A 1 87  ? -53.29625 -19.35238 7.74195   1.000 36.91244  ? 87  ARG   A NE   1 
ATOM   668  C  CZ   . ARG   A 1 87  ? -53.95469 -18.39470 7.10375   1.000 51.02036  ? 87  ARG   A CZ   1 
ATOM   669  N  NH1  . ARG   A 1 87  ? -53.79344 -17.11825 7.41442   1.000 32.51783  ? 87  ARG   A NH1  1 
ATOM   670  N  NH2  . ARG   A 1 87  ? -54.80227 -18.72711 6.13410   1.000 46.79248  ? 87  ARG   A NH2  1 
ATOM   671  N  N    . PHE   A 1 88  ? -48.07407 -21.79830 8.84220   1.000 21.69202  ? 88  PHE   A N    1 
ATOM   672  C  CA   . PHE   A 1 88  ? -47.49869 -22.63148 7.79198   1.000 24.61199  ? 88  PHE   A CA   1 
ATOM   673  C  C    . PHE   A 1 88  ? -46.96440 -23.94286 8.35333   1.000 24.33068  ? 88  PHE   A C    1 
ATOM   674  O  O    . PHE   A 1 88  ? -47.00195 -24.96982 7.66589   1.000 20.87879  ? 88  PHE   A O    1 
ATOM   675  C  CB   . PHE   A 1 88  ? -46.38764 -21.88453 7.05064   1.000 25.81600  ? 88  PHE   A CB   1 
ATOM   676  C  CG   . PHE   A 1 88  ? -45.79997 -22.66631 5.90691   1.000 23.44745  ? 88  PHE   A CG   1 
ATOM   677  C  CD1  . PHE   A 1 88  ? -46.46897 -22.75299 4.69623   1.000 23.17960  ? 88  PHE   A CD1  1 
ATOM   678  C  CD2  . PHE   A 1 88  ? -44.58725 -23.32839 6.04764   1.000 24.88255  ? 88  PHE   A CD2  1 
ATOM   679  C  CE1  . PHE   A 1 88  ? -45.93596 -23.48392 3.64075   1.000 25.49617  ? 88  PHE   A CE1  1 
ATOM   680  C  CE2  . PHE   A 1 88  ? -44.04815 -24.05916 4.99659   1.000 23.39821  ? 88  PHE   A CE2  1 
ATOM   681  C  CZ   . PHE   A 1 88  ? -44.72405 -24.13627 3.79339   1.000 23.19855  ? 88  PHE   A CZ   1 
ATOM   682  N  N    . ALA   A 1 89  ? -46.46773 -23.93069 9.59331   1.000 20.18199  ? 89  ALA   A N    1 
ATOM   683  C  CA   . ALA   A 1 89  ? -46.02304 -25.17218 10.21788  1.000 24.53681  ? 89  ALA   A CA   1 
ATOM   684  C  C    . ALA   A 1 89  ? -47.17530 -26.15863 10.34874  1.000 20.30080  ? 89  ALA   A C    1 
ATOM   685  O  O    . ALA   A 1 89  ? -47.01931 -27.35126 10.06122  1.000 24.28720  ? 89  ALA   A O    1 
ATOM   686  C  CB   . ALA   A 1 89  ? -45.40424 -24.88322 11.58541  1.000 19.76569  ? 89  ALA   A CB   1 
ATOM   687  N  N    . ARG   A 1 90  ? -48.34349 -25.67386 10.77477  1.000 25.04161  ? 90  ARG   A N    1 
ATOM   688  C  CA   . ARG   A 1 90  ? -49.51840 -26.53263 10.87931  1.000 28.16443  ? 90  ARG   A CA   1 
ATOM   689  C  C    . ARG   A 1 90  ? -49.96468 -27.02939 9.50909   1.000 27.42503  ? 90  ARG   A C    1 
ATOM   690  O  O    . ARG   A 1 90  ? -50.30457 -28.20765 9.35028   1.000 28.95511  ? 90  ARG   A O    1 
ATOM   691  C  CB   . ARG   A 1 90  ? -50.65449 -25.77590 11.56956  1.000 32.76056  ? 90  ARG   A CB   1 
ATOM   692  C  CG   . ARG   A 1 90  ? -50.55310 -25.74784 13.08716  1.000 41.85977  ? 90  ARG   A CG   1 
ATOM   693  C  CD   . ARG   A 1 90  ? -51.78829 -25.11753 13.71776  1.000 57.09648  ? 90  ARG   A CD   1 
ATOM   694  N  NE   . ARG   A 1 90  ? -51.63432 -23.67867 13.90228  1.000 64.03881  ? 90  ARG   A NE   1 
ATOM   695  C  CZ   . ARG   A 1 90  ? -52.27813 -22.75724 13.19806  1.000 57.35481  ? 90  ARG   A CZ   1 
ATOM   696  N  NH1  . ARG   A 1 90  ? -53.13572 -23.08799 12.24586  1.000 63.08422  ? 90  ARG   A NH1  1 
ATOM   697  N  NH2  . ARG   A 1 90  ? -52.05391 -21.47135 13.45393  1.000 56.63473  ? 90  ARG   A NH2  1 
ATOM   698  N  N    . GLN   A 1 91  ? -49.97216 -26.14524 8.50763   1.000 27.00554  ? 91  GLN   A N    1 
ATOM   699  C  CA   . GLN   A 1 91  ? -50.37153 -26.55259 7.16292   1.000 26.66065  ? 91  GLN   A CA   1 
ATOM   700  C  C    . GLN   A 1 91  ? -49.43879 -27.62199 6.60490   1.000 23.55470  ? 91  GLN   A C    1 
ATOM   701  O  O    . GLN   A 1 91  ? -49.88734 -28.55731 5.93183   1.000 24.33449  ? 91  GLN   A O    1 
ATOM   702  C  CB   . GLN   A 1 91  ? -50.40189 -25.33822 6.23431   1.000 26.69860  ? 91  GLN   A CB   1 
ATOM   703  C  CG   . GLN   A 1 91  ? -51.59294 -24.41700 6.43883   1.000 41.53149  ? 91  GLN   A CG   1 
ATOM   704  C  CD   . GLN   A 1 91  ? -51.57061 -23.21908 5.50330   1.000 57.70749  ? 91  GLN   A CD   1 
ATOM   705  O  OE1  . GLN   A 1 91  ? -50.58126 -22.97630 4.81040   1.000 45.26405  ? 91  GLN   A OE1  1 
ATOM   706  N  NE2  . GLN   A 1 91  ? -52.66450 -22.46264 5.48092   1.000 54.52463  ? 91  GLN   A NE2  1 
ATOM   707  N  N    . SER   A 1 92  ? -48.13659 -27.50253 6.87096   1.000 22.81398  ? 92  SER   A N    1 
ATOM   708  C  CA   . SER   A 1 92  ? -47.15460 -28.42338 6.31280   1.000 21.12530  ? 92  SER   A CA   1 
ATOM   709  C  C    . SER   A 1 92  ? -46.86591 -29.61785 7.21157   1.000 22.60029  ? 92  SER   A C    1 
ATOM   710  O  O    . SER   A 1 92  ? -46.24184 -30.58041 6.75315   1.000 25.69950  ? 92  SER   A O    1 
ATOM   711  C  CB   . SER   A 1 92  ? -45.83986 -27.68907 6.03529   1.000 18.82687  ? 92  SER   A CB   1 
ATOM   712  O  OG   . SER   A 1 92  ? -45.32564 -27.12822 7.22820   1.000 22.70447  ? 92  SER   A OG   1 
ATOM   713  N  N    . GLY   A 1 93  ? -47.28089 -29.57969 8.47487   1.000 25.06767  ? 93  GLY   A N    1 
ATOM   714  C  CA   . GLY   A 1 93  ? -46.86355 -30.61016 9.40232   1.000 21.85295  ? 93  GLY   A CA   1 
ATOM   715  C  C    . GLY   A 1 93  ? -45.42904 -30.50458 9.87156   1.000 22.43130  ? 93  GLY   A C    1 
ATOM   716  O  O    . GLY   A 1 93  ? -44.95284 -31.40883 10.56431  1.000 25.76572  ? 93  GLY   A O    1 
ATOM   717  N  N    . MET   A 1 94  ? -44.72419 -29.43012 9.52308   1.000 19.11314  ? 94  MET   A N    1 
ATOM   718  C  CA   . MET   A 1 94  ? -43.35260 -29.24761 9.97013   1.000 22.75788  ? 94  MET   A CA   1 
ATOM   719  C  C    . MET   A 1 94  ? -43.31304 -28.72903 11.40162  1.000 29.08745  ? 94  MET   A C    1 
ATOM   720  O  O    . MET   A 1 94  ? -44.21381 -28.01636 11.85537  1.000 30.81360  ? 94  MET   A O    1 
ATOM   721  C  CB   . MET   A 1 94  ? -42.60683 -28.26861 9.06409   1.000 26.81584  ? 94  MET   A CB   1 
ATOM   722  C  CG   . MET   A 1 94  ? -42.23150 -28.81156 7.70687   1.000 32.66224  ? 94  MET   A CG   1 
ATOM   723  S  SD   . MET   A 1 94  ? -40.86978 -27.88081 6.98047   1.000 28.83382  ? 94  MET   A SD   1 
ATOM   724  C  CE   . MET   A 1 94  ? -41.60665 -26.25634 6.87028   1.000 24.31662  ? 94  MET   A CE   1 
ATOM   725  N  N    . ILE   A 1 95  ? -42.24377 -29.08440 12.10590  1.000 21.43096  ? 95  ILE   A N    1 
ATOM   726  C  CA   . ILE   A 1 95  ? -41.97114 -28.58346 13.44678  1.000 24.18071  ? 95  ILE   A CA   1 
ATOM   727  C  C    . ILE   A 1 95  ? -40.90720 -27.50078 13.32697  1.000 27.06162  ? 95  ILE   A C    1 
ATOM   728  O  O    . ILE   A 1 95  ? -39.83618 -27.73249 12.75337  1.000 24.50438  ? 95  ILE   A O    1 
ATOM   729  C  CB   . ILE   A 1 95  ? -41.52156 -29.71481 14.38504  1.000 23.49957  ? 95  ILE   A CB   1 
ATOM   730  C  CG1  . ILE   A 1 95  ? -42.68540 -30.68054 14.63935  1.000 25.11073  ? 95  ILE   A CG1  1 
ATOM   731  C  CG2  . ILE   A 1 95  ? -40.99529 -29.15144 15.69745  1.000 22.26104  ? 95  ILE   A CG2  1 
ATOM   732  C  CD1  . ILE   A 1 95  ? -42.26493 -32.03555 15.16923  1.000 31.43328  ? 95  ILE   A CD1  1 
ATOM   733  N  N    . LEU   A 1 96  ? -41.20287 -26.31361 13.84926  1.000 23.51150  ? 96  LEU   A N    1 
ATOM   734  C  CA   . LEU   A 1 96  ? -40.25402 -25.21053 13.80025  1.000 18.79415  ? 96  LEU   A CA   1 
ATOM   735  C  C    . LEU   A 1 96  ? -39.23644 -25.34754 14.92542  1.000 27.32844  ? 96  LEU   A C    1 
ATOM   736  O  O    . LEU   A 1 96  ? -39.60345 -25.55912 16.08548  1.000 25.45699  ? 96  LEU   A O    1 
ATOM   737  C  CB   . LEU   A 1 96  ? -40.98743 -23.87347 13.90666  1.000 20.87331  ? 96  LEU   A CB   1 
ATOM   738  C  CG   . LEU   A 1 96  ? -42.12873 -23.60950 12.92029  1.000 25.16505  ? 96  LEU   A CG   1 
ATOM   739  C  CD1  . LEU   A 1 96  ? -42.76094 -22.25040 13.19295  1.000 29.59360  ? 96  LEU   A CD1  1 
ATOM   740  C  CD2  . LEU   A 1 96  ? -41.63813 -23.69305 11.48204  1.000 23.72313  ? 96  LEU   A CD2  1 
ATOM   741  N  N    . LEU   A 1 97  ? -37.95985 -25.22235 14.58298  1.000 23.61120  ? 97  LEU   A N    1 
ATOM   742  C  CA   . LEU   A 1 97  ? -36.87271 -25.32111 15.54405  1.000 22.84778  ? 97  LEU   A CA   1 
ATOM   743  C  C    . LEU   A 1 97  ? -36.21985 -23.95847 15.73739  1.000 24.48694  ? 97  LEU   A C    1 
ATOM   744  O  O    . LEU   A 1 97  ? -36.47716 -23.00550 14.99721  1.000 32.07474  ? 97  LEU   A O    1 
ATOM   745  C  CB   . LEU   A 1 97  ? -35.83539 -26.35446 15.08527  1.000 17.88906  ? 97  LEU   A CB   1 
ATOM   746  C  CG   . LEU   A 1 97  ? -36.34266 -27.78344 14.89226  1.000 22.78782  ? 97  LEU   A CG   1 
ATOM   747  C  CD1  . LEU   A 1 97  ? -35.20784 -28.69288 14.44983  1.000 25.22045  ? 97  LEU   A CD1  1 
ATOM   748  C  CD2  . LEU   A 1 97  ? -36.98659 -28.30504 16.16723  1.000 24.70105  ? 97  LEU   A CD2  1 
ATOM   749  N  N    . ALA   A 1 98  ? -35.36325 -23.87634 16.75303  1.000 30.99984  ? 98  ALA   A N    1 
ATOM   750  C  CA   . ALA   A 1 98  ? -34.63569 -22.65009 17.04063  1.000 26.74637  ? 98  ALA   A CA   1 
ATOM   751  C  C    . ALA   A 1 98  ? -33.49293 -22.46134 16.04299  1.000 38.95940  ? 98  ALA   A C    1 
ATOM   752  O  O    . ALA   A 1 98  ? -33.19500 -23.33587 15.22520  1.000 29.68905  ? 98  ALA   A O    1 
ATOM   753  C  CB   . ALA   A 1 98  ? -34.10204 -22.66957 18.47215  1.000 29.28308  ? 98  ALA   A CB   1 
ATOM   754  N  N    . GLU   A 1 99  ? -32.83760 -21.29795 16.11810  1.000 32.39761  ? 99  GLU   A N    1 
ATOM   755  C  CA   . GLU   A 1 99  ? -31.77060 -21.01002 15.16623  1.000 28.68499  ? 99  GLU   A CA   1 
ATOM   756  C  C    . GLU   A 1 99  ? -30.57270 -21.92975 15.35001  1.000 23.10467  ? 99  GLU   A C    1 
ATOM   757  O  O    . GLU   A 1 99  ? -29.82298 -22.14008 14.39305  1.000 30.33662  ? 99  GLU   A O    1 
ATOM   758  C  CB   . GLU   A 1 99  ? -31.33413 -19.54528 15.26256  1.000 35.11134  ? 99  GLU   A CB   1 
ATOM   759  C  CG   . GLU   A 1 99  ? -30.72782 -19.13281 16.58640  1.000 34.84724  ? 99  GLU   A CG   1 
ATOM   760  C  CD   . GLU   A 1 99  ? -30.14805 -17.72886 16.53482  1.000 52.92305  ? 99  GLU   A CD   1 
ATOM   761  O  OE1  . GLU   A 1 99  ? -30.92060 -16.77477 16.30523  1.000 45.18693  ? 99  GLU   A OE1  1 
ATOM   762  O  OE2  . GLU   A 1 99  ? -28.92210 -17.57697 16.72398  1.000 45.80634  ? 99  GLU   A OE2  1 
ATOM   763  N  N    . GLU   A 1 100 ? -30.38300 -22.48401 16.54696  1.000 28.81975  ? 100 GLU   A N    1 
ATOM   764  C  CA   . GLU   A 1 100 ? -29.38401 -23.51201 16.80220  1.000 28.13030  ? 100 GLU   A CA   1 
ATOM   765  C  C    . GLU   A 1 100 ? -30.05575 -24.69045 17.49014  1.000 35.21033  ? 100 GLU   A C    1 
ATOM   766  O  O    . GLU   A 1 100 ? -30.88034 -24.50360 18.39057  1.000 34.56095  ? 100 GLU   A O    1 
ATOM   767  C  CB   . GLU   A 1 100 ? -28.23778 -22.99400 17.68308  1.000 32.35942  ? 100 GLU   A CB   1 
ATOM   768  C  CG   . GLU   A 1 100 ? -27.39323 -21.90410 17.05337  1.000 39.25034  ? 100 GLU   A CG   1 
ATOM   769  C  CD   . GLU   A 1 100 ? -26.26341 -21.44790 17.96087  1.000 51.57532  ? 100 GLU   A CD   1 
ATOM   770  O  OE1  . GLU   A 1 100 ? -26.12324 -22.00604 19.07050  1.000 40.32335  ? 100 GLU   A OE1  1 
ATOM   771  O  OE2  . GLU   A 1 100 ? -25.51904 -20.52607 17.56683  1.000 51.91879  ? 100 GLU   A OE2  1 
ATOM   772  N  N    . GLU   A 1 101 ? -29.70697 -25.90279 17.06148  1.000 29.85206  ? 101 GLU   A N    1 
ATOM   773  C  CA   . GLU   A 1 101 ? -30.18666 -27.11607 17.70605  1.000 29.35433  ? 101 GLU   A CA   1 
ATOM   774  C  C    . GLU   A 1 101 ? -29.06297 -28.13816 17.75141  1.000 31.38472  ? 101 GLU   A C    1 
ATOM   775  O  O    . GLU   A 1 101 ? -28.25668 -28.23095 16.82121  1.000 33.54579  ? 101 GLU   A O    1 
ATOM   776  C  CB   . GLU   A 1 101 ? -31.39877 -27.72415 16.97978  1.000 32.33509  ? 101 GLU   A CB   1 
ATOM   777  C  CG   . GLU   A 1 101 ? -32.65180 -26.85590 16.96694  1.000 36.21998  ? 101 GLU   A CG   1 
ATOM   778  C  CD   . GLU   A 1 101 ? -33.38122 -26.82124 18.30232  1.000 35.42813  ? 101 GLU   A CD   1 
ATOM   779  O  OE1  . GLU   A 1 101 ? -32.92382 -27.47321 19.26558  1.000 39.13291  ? 101 GLU   A OE1  1 
ATOM   780  O  OE2  . GLU   A 1 101 ? -34.42337 -26.13747 18.38555  1.000 39.85801  ? 101 GLU   A OE2  1 
ATOM   781  N  N    . ARG   A 1 102 ? -29.02094 -28.90296 18.83670  1.000 30.55259  ? 102 ARG   A N    1 
ATOM   782  C  CA   . ARG   A 1 102 ? -28.08068 -30.00263 19.00600  1.000 34.76063  ? 102 ARG   A CA   1 
ATOM   783  C  C    . ARG   A 1 102 ? -28.84706 -31.30955 18.86468  1.000 28.83139  ? 102 ARG   A C    1 
ATOM   784  O  O    . ARG   A 1 102 ? -29.77342 -31.57416 19.63854  1.000 42.53294  ? 102 ARG   A O    1 
ATOM   785  C  CB   . ARG   A 1 102 ? -27.39096 -29.92358 20.36745  1.000 39.74295  ? 102 ARG   A CB   1 
ATOM   786  C  CG   . ARG   A 1 102 ? -26.28499 -30.94299 20.57689  1.000 46.64659  ? 102 ARG   A CG   1 
ATOM   787  C  CD   . ARG   A 1 102 ? -25.31063 -30.49560 21.66079  1.000 50.05585  ? 102 ARG   A CD   1 
ATOM   788  N  NE   . ARG   A 1 102 ? -25.93151 -30.40400 22.97827  1.000 67.42619  ? 102 ARG   A NE   1 
ATOM   789  C  CZ   . ARG   A 1 102 ? -26.40826 -29.28782 23.51465  1.000 73.15159  ? 102 ARG   A CZ   1 
ATOM   790  N  NH1  . ARG   A 1 102 ? -26.35439 -28.13279 22.87183  1.000 55.89252  ? 102 ARG   A NH1  1 
ATOM   791  N  NH2  . ARG   A 1 102 ? -26.95223 -29.33222 24.72772  1.000 81.59202  ? 102 ARG   A NH2  1 
ATOM   792  N  N    . LEU   A 1 103 ? -28.47091 -32.11625 17.87810  1.000 33.35791  ? 103 LEU   A N    1 
ATOM   793  C  CA   . LEU   A 1 103 ? -29.13557 -33.38099 17.61033  1.000 29.44347  ? 103 LEU   A CA   1 
ATOM   794  C  C    . LEU   A 1 103 ? -28.23723 -34.55174 17.98306  1.000 40.90914  ? 103 LEU   A C    1 
ATOM   795  O  O    . LEU   A 1 103 ? -27.00721 -34.46268 17.92074  1.000 34.18154  ? 103 LEU   A O    1 
ATOM   796  C  CB   . LEU   A 1 103 ? -29.53128 -33.50589 16.13531  1.000 31.40682  ? 103 LEU   A CB   1 
ATOM   797  C  CG   . LEU   A 1 103 ? -30.31188 -32.36502 15.48476  1.000 27.83388  ? 103 LEU   A CG   1 
ATOM   798  C  CD1  . LEU   A 1 103 ? -30.43842 -32.62004 13.99256  1.000 27.87409  ? 103 LEU   A CD1  1 
ATOM   799  C  CD2  . LEU   A 1 103 ? -31.68123 -32.21499 16.12765  1.000 30.98231  ? 103 LEU   A CD2  1 
ATOM   800  N  N    . ASP   A 1 104 ? -28.87069 -35.65297 18.37483  1.000 29.79174  ? 104 ASP   A N    1 
ATOM   801  C  CA   . ASP   A 1 104 ? -28.20238 -36.93795 18.54228  1.000 33.50055  ? 104 ASP   A CA   1 
ATOM   802  C  C    . ASP   A 1 104 ? -28.59732 -37.79353 17.34742  1.000 31.26789  ? 104 ASP   A C    1 
ATOM   803  O  O    . ASP   A 1 104 ? -29.75309 -38.21553 17.23570  1.000 35.45078  ? 104 ASP   A O    1 
ATOM   804  C  CB   . ASP   A 1 104 ? -28.59226 -37.60602 19.85976  1.000 38.11562  ? 104 ASP   A CB   1 
ATOM   805  C  CG   . ASP   A 1 104 ? -27.85466 -38.91697 20.09321  1.000 50.87964  ? 104 ASP   A CG   1 
ATOM   806  O  OD1  . ASP   A 1 104 ? -26.62948 -38.88198 20.34321  1.000 55.49165  ? 104 ASP   A OD1  1 
ATOM   807  O  OD2  . ASP   A 1 104 ? -28.50098 -39.98328 20.02556  1.000 53.26345  ? 104 ASP   A OD2  1 
ATOM   808  N  N    . LEU   A 1 105 ? -27.65072 -38.02501 16.44509  1.000 34.97012  ? 105 LEU   A N    1 
ATOM   809  C  CA   . LEU   A 1 105 ? -27.89175 -38.80006 15.23183  1.000 28.47695  ? 105 LEU   A CA   1 
ATOM   810  C  C    . LEU   A 1 105 ? -27.08732 -40.09153 15.33919  1.000 31.45743  ? 105 LEU   A C    1 
ATOM   811  O  O    . LEU   A 1 105 ? -25.88308 -40.10800 15.06840  1.000 28.37426  ? 105 LEU   A O    1 
ATOM   812  C  CB   . LEU   A 1 105 ? -27.51976 -37.99942 13.98704  1.000 26.81072  ? 105 LEU   A CB   1 
ATOM   813  C  CG   . LEU   A 1 105 ? -28.23268 -36.65333 13.81296  1.000 31.19983  ? 105 LEU   A CG   1 
ATOM   814  C  CD1  . LEU   A 1 105 ? -27.61795 -35.86156 12.66935  1.000 27.44531  ? 105 LEU   A CD1  1 
ATOM   815  C  CD2  . LEU   A 1 105 ? -29.72464 -36.85138 13.59119  1.000 28.26607  ? 105 LEU   A CD2  1 
ATOM   816  N  N    . TYR   A 1 106 ? -27.76298 -41.16529 15.75318  1.000 33.27094  ? 106 TYR   A N    1 
ATOM   817  C  CA   . TYR   A 1 106 ? -27.16522 -42.49654 15.86000  1.000 31.95069  ? 106 TYR   A CA   1 
ATOM   818  C  C    . TYR   A 1 106 ? -25.90018 -42.47361 16.71367  1.000 34.45079  ? 106 TYR   A C    1 
ATOM   819  O  O    . TYR   A 1 106 ? -24.92591 -43.17816 16.44322  1.000 38.35759  ? 106 TYR   A O    1 
ATOM   820  C  CB   . TYR   A 1 106 ? -26.89167 -43.08058 14.47424  1.000 33.40944  ? 106 TYR   A CB   1 
ATOM   821  C  CG   . TYR   A 1 106 ? -27.98582 -42.75485 13.48786  1.000 30.39578  ? 106 TYR   A CG   1 
ATOM   822  C  CD1  . TYR   A 1 106 ? -29.18873 -43.45229 13.49862  1.000 34.26857  ? 106 TYR   A CD1  1 
ATOM   823  C  CD2  . TYR   A 1 106 ? -27.82796 -41.73231 12.56121  1.000 34.27870  ? 106 TYR   A CD2  1 
ATOM   824  C  CE1  . TYR   A 1 106 ? -30.19713 -43.14677 12.60513  1.000 33.76305  ? 106 TYR   A CE1  1 
ATOM   825  C  CE2  . TYR   A 1 106 ? -28.83065 -41.41903 11.66480  1.000 27.51963  ? 106 TYR   A CE2  1 
ATOM   826  C  CZ   . TYR   A 1 106 ? -30.01120 -42.12781 11.69067  1.000 28.33649  ? 106 TYR   A CZ   1 
ATOM   827  O  OH   . TYR   A 1 106 ? -31.00685 -41.81493 10.79681  1.000 28.51527  ? 106 TYR   A OH   1 
ATOM   828  N  N    . GLY   A 1 107 ? -25.91543 -41.64362 17.76003  1.000 36.49226  ? 107 GLY   A N    1 
ATOM   829  C  CA   . GLY   A 1 107 ? -24.85765 -41.58691 18.74453  1.000 43.01910  ? 107 GLY   A CA   1 
ATOM   830  C  C    . GLY   A 1 107 ? -24.00788 -40.33251 18.67988  1.000 52.95829  ? 107 GLY   A C    1 
ATOM   831  O  O    . GLY   A 1 107 ? -23.47819 -39.90366 19.71254  1.000 55.64224  ? 107 GLY   A O    1 
ATOM   832  N  N    . ARG   A 1 108 ? -23.85854 -39.73898 17.49833  1.000 40.51191  ? 108 ARG   A N    1 
ATOM   833  C  CA   . ARG   A 1 108 ? -22.99125 -38.57977 17.34222  1.000 45.61051  ? 108 ARG   A CA   1 
ATOM   834  C  C    . ARG   A 1 108 ? -23.78874 -37.29633 17.54999  1.000 38.73670  ? 108 ARG   A C    1 
ATOM   835  O  O    . ARG   A 1 108 ? -24.90571 -37.15489 17.03998  1.000 37.25249  ? 108 ARG   A O    1 
ATOM   836  C  CB   . ARG   A 1 108 ? -22.30585 -38.59223 15.97205  1.000 47.52037  ? 108 ARG   A CB   1 
ATOM   837  C  CG   . ARG   A 1 108 ? -23.18987 -38.24217 14.79218  1.000 55.90371  ? 108 ARG   A CG   1 
ATOM   838  C  CD   . ARG   A 1 108 ? -22.36986 -38.04376 13.52662  1.000 47.43770  ? 108 ARG   A CD   1 
ATOM   839  N  NE   . ARG   A 1 108 ? -22.51786 -39.16530 12.60690  1.000 55.70122  ? 108 ARG   A NE   1 
ATOM   840  C  CZ   . ARG   A 1 108 ? -21.51524 -39.74954 11.96523  1.000 56.61315  ? 108 ARG   A CZ   1 
ATOM   841  N  NH1  . ARG   A 1 108 ? -20.26667 -39.33393 12.10708  1.000 64.16678  ? 108 ARG   A NH1  1 
ATOM   842  N  NH2  . ARG   A 1 108 ? -21.77214 -40.77397 11.15649  1.000 49.22222  ? 108 ARG   A NH2  1 
ATOM   843  N  N    . GLU   A 1 109 ? -23.22178 -36.37874 18.32861  1.000 36.63175  ? 109 GLU   A N    1 
ATOM   844  C  CA   . GLU   A 1 109 ? -23.86088 -35.09809 18.59365  1.000 45.20810  ? 109 GLU   A CA   1 
ATOM   845  C  C    . GLU   A 1 109 ? -23.57965 -34.13822 17.44497  1.000 43.92569  ? 109 GLU   A C    1 
ATOM   846  O  O    . GLU   A 1 109 ? -22.41961 -33.89931 17.09497  1.000 41.06934  ? 109 GLU   A O    1 
ATOM   847  C  CB   . GLU   A 1 109 ? -23.35602 -34.51599 19.91370  1.000 43.22756  ? 109 GLU   A CB   1 
ATOM   848  N  N    . VAL   A 1 110 ? -24.64077 -33.59109 16.85604  1.000 33.39469  ? 110 VAL   A N    1 
ATOM   849  C  CA   . VAL   A 1 110 ? -24.53325 -32.74322 15.67583  1.000 32.45043  ? 110 VAL   A CA   1 
ATOM   850  C  C    . VAL   A 1 110 ? -25.25605 -31.43194 15.94177  1.000 43.34538  ? 110 VAL   A C    1 
ATOM   851  O  O    . VAL   A 1 110 ? -26.40850 -31.42872 16.38990  1.000 32.19553  ? 110 VAL   A O    1 
ATOM   852  C  CB   . VAL   A 1 110 ? -25.10953 -33.42869 14.42203  1.000 32.25759  ? 110 VAL   A CB   1 
ATOM   853  C  CG1  . VAL   A 1 110 ? -24.89009 -32.55778 13.19630  1.000 27.32636  ? 110 VAL   A CG1  1 
ATOM   854  C  CG2  . VAL   A 1 110 ? -24.47658 -34.79643 14.22529  1.000 32.76348  ? 110 VAL   A CG2  1 
ATOM   855  N  N    . LEU   A 1 111 ? -24.57995 -30.32409 15.66218  1.000 32.09136  ? 111 LEU   A N    1 
ATOM   856  C  CA   . LEU   A 1 111 ? -25.17084 -28.99787 15.73717  1.000 33.14267  ? 111 LEU   A CA   1 
ATOM   857  C  C    . LEU   A 1 111 ? -25.67093 -28.60543 14.35301  1.000 39.86533  ? 111 LEU   A C    1 
ATOM   858  O  O    . LEU   A 1 111 ? -24.97236 -28.81663 13.35507  1.000 33.95416  ? 111 LEU   A O    1 
ATOM   859  C  CB   . LEU   A 1 111 ? -24.14551 -27.98623 16.25074  1.000 37.06172  ? 111 LEU   A CB   1 
ATOM   860  C  CG   . LEU   A 1 111 ? -24.46720 -26.49519 16.17810  1.000 34.96698  ? 111 LEU   A CG   1 
ATOM   861  C  CD1  . LEU   A 1 111 ? -25.65666 -26.16294 17.05991  1.000 30.69350  ? 111 LEU   A CD1  1 
ATOM   862  C  CD2  . LEU   A 1 111 ? -23.24740 -25.69865 16.60526  1.000 38.51918  ? 111 LEU   A CD2  1 
ATOM   863  N  N    . ILE   A 1 112 ? -26.88203 -28.05345 14.29003  1.000 29.15755  ? 112 ILE   A N    1 
ATOM   864  C  CA   . ILE   A 1 112 ? -27.46956 -27.61085 13.03134  1.000 24.83314  ? 112 ILE   A CA   1 
ATOM   865  C  C    . ILE   A 1 112 ? -27.90757 -26.15745 13.15906  1.000 27.25065  ? 112 ILE   A C    1 
ATOM   866  O  O    . ILE   A 1 112 ? -28.34425 -25.71472 14.22788  1.000 25.14707  ? 112 ILE   A O    1 
ATOM   867  C  CB   . ILE   A 1 112 ? -28.65313 -28.50506 12.59446  1.000 24.67903  ? 112 ILE   A CB   1 
ATOM   868  C  CG1  . ILE   A 1 112 ? -29.75161 -28.52977 13.65769  1.000 24.29746  ? 112 ILE   A CG1  1 
ATOM   869  C  CG2  . ILE   A 1 112 ? -28.17576 -29.92185 12.27417  1.000 23.01420  ? 112 ILE   A CG2  1 
ATOM   870  C  CD1  . ILE   A 1 112 ? -31.05700 -29.12062 13.16347  1.000 21.99746  ? 112 ILE   A CD1  1 
ATOM   871  N  N    . MET   A 1 113 ? -27.77130 -25.41822 12.06179  1.000 24.57948  ? 113 MET   A N    1 
ATOM   872  C  CA   . MET   A 1 113 ? -28.21302 -24.03454 11.94317  1.000 24.83787  ? 113 MET   A CA   1 
ATOM   873  C  C    . MET   A 1 113 ? -28.25839 -23.68978 10.46211  1.000 29.85095  ? 113 MET   A C    1 
ATOM   874  O  O    . MET   A 1 113 ? -27.79492 -24.45563 9.61364   1.000 28.64428  ? 113 MET   A O    1 
ATOM   875  C  CB   . MET   A 1 113 ? -27.28921 -23.06207 12.68487  1.000 26.11707  ? 113 MET   A CB   1 
ATOM   876  C  CG   . MET   A 1 113 ? -25.82795 -23.16875 12.27923  1.000 33.58033  ? 113 MET   A CG   1 
ATOM   877  S  SD   . MET   A 1 113 ? -24.76936 -22.04571 13.22526  1.000 44.29594  ? 113 MET   A SD   1 
ATOM   878  C  CE   . MET   A 1 113 ? -24.50612 -22.96794 14.72818  1.000 30.40296  ? 113 MET   A CE   1 
ATOM   879  N  N    . HIS   A 1 114 ? -28.82450 -22.52114 10.15485  1.000 23.85651  ? 114 HIS   A N    1 
ATOM   880  C  CA   . HIS   A 1 114 ? -28.81107 -22.07200 8.76802   1.000 25.54411  ? 114 HIS   A CA   1 
ATOM   881  C  C    . HIS   A 1 114 ? -27.40403 -21.66838 8.34279   1.000 24.81948  ? 114 HIS   A C    1 
ATOM   882  O  O    . HIS   A 1 114 ? -26.98781 -21.94068 7.21067   1.000 25.28209  ? 114 HIS   A O    1 
ATOM   883  C  CB   . HIS   A 1 114 ? -29.78172 -20.90953 8.56635   1.000 24.41567  ? 114 HIS   A CB   1 
ATOM   884  C  CG   . HIS   A 1 114 ? -29.77414 -20.36895 7.17130   1.000 23.55406  ? 114 HIS   A CG   1 
ATOM   885  N  ND1  . HIS   A 1 114 ? -30.13505 -21.13120 6.08100   1.000 22.40070  ? 114 HIS   A ND1  1 
ATOM   886  C  CD2  . HIS   A 1 114 ? -29.40804 -19.16036 6.68152   1.000 29.62552  ? 114 HIS   A CD2  1 
ATOM   887  C  CE1  . HIS   A 1 114 ? -30.01375 -20.40831 4.98209   1.000 23.82761  ? 114 HIS   A CE1  1 
ATOM   888  N  NE2  . HIS   A 1 114 ? -29.57366 -19.20846 5.31859   1.000 27.67180  ? 114 HIS   A NE2  1 
ATOM   889  N  N    . GLY   A 1 115 ? -26.65873 -21.02102 9.23585   1.000 23.04926  ? 115 GLY   A N    1 
ATOM   890  C  CA   . GLY   A 1 115 ? -25.28397 -20.64076 8.98153   1.000 24.85418  ? 115 GLY   A CA   1 
ATOM   891  C  C    . GLY   A 1 115 ? -25.04556 -19.15215 8.86673   1.000 29.99825  ? 115 GLY   A C    1 
ATOM   892  O  O    . GLY   A 1 115 ? -23.88219 -18.72968 8.89028   1.000 32.94457  ? 115 GLY   A O    1 
ATOM   893  N  N    . ASP   A 1 116 ? -26.09825 -18.33785 8.74946   1.000 30.45224  ? 116 ASP   A N    1 
ATOM   894  C  CA   . ASP   A 1 116 ? -25.88575 -16.90916 8.54282   1.000 28.02779  ? 116 ASP   A CA   1 
ATOM   895  C  C    . ASP   A 1 116 ? -25.33559 -16.22891 9.79041   1.000 33.74680  ? 116 ASP   A C    1 
ATOM   896  O  O    . ASP   A 1 116 ? -24.65744 -15.20162 9.68054   1.000 39.82203  ? 116 ASP   A O    1 
ATOM   897  C  CB   . ASP   A 1 116 ? -27.18051 -16.22559 8.09395   1.000 37.17337  ? 116 ASP   A CB   1 
ATOM   898  C  CG   . ASP   A 1 116 ? -28.29251 -16.33595 9.11980   1.000 38.96880  ? 116 ASP   A CG   1 
ATOM   899  O  OD1  . ASP   A 1 116 ? -28.56481 -17.45986 9.59154   1.000 34.33921  ? 116 ASP   A OD1  1 
ATOM   900  O  OD2  . ASP   A 1 116 ? -28.88182 -15.29028 9.46782   1.000 36.47865  ? 116 ASP   A OD2  1 
ATOM   901  N  N    . THR   A 1 117 ? -25.60527 -16.77714 10.97813  1.000 33.10029  ? 117 THR   A N    1 
ATOM   902  C  CA   . THR   A 1 117 ? -25.06808 -16.18582 12.20030  1.000 37.16048  ? 117 THR   A CA   1 
ATOM   903  C  C    . THR   A 1 117 ? -23.57120 -16.41767 12.35318  1.000 46.45361  ? 117 THR   A C    1 
ATOM   904  O  O    . THR   A 1 117 ? -22.97090 -15.87667 13.28875  1.000 42.33792  ? 117 THR   A O    1 
ATOM   905  C  CB   . THR   A 1 117 ? -25.78938 -16.73830 13.43212  1.000 38.61747  ? 117 THR   A CB   1 
ATOM   906  O  OG1  . THR   A 1 117 ? -25.66675 -18.16562 13.46067  1.000 35.50505  ? 117 THR   A OG1  1 
ATOM   907  C  CG2  . THR   A 1 117 ? -27.26487 -16.36423 13.39314  1.000 44.70888  ? 117 THR   A CG2  1 
ATOM   908  N  N    . LEU   A 1 118 ? -22.96319 -17.21470 11.47421  1.000 38.71511  ? 118 LEU   A N    1 
ATOM   909  C  CA   . LEU   A 1 118 ? -21.52271 -17.42197 11.47307  1.000 41.53629  ? 118 LEU   A CA   1 
ATOM   910  C  C    . LEU   A 1 118 ? -20.77687 -16.38725 10.64021  1.000 42.72642  ? 118 LEU   A C    1 
ATOM   911  O  O    . LEU   A 1 118 ? -19.54691 -16.31084 10.73505  1.000 40.69595  ? 118 LEU   A O    1 
ATOM   912  C  CB   . LEU   A 1 118 ? -21.18780 -18.82597 10.95132  1.000 41.60249  ? 118 LEU   A CB   1 
ATOM   913  C  CG   . LEU   A 1 118 ? -21.89126 -20.02886 11.58905  1.000 40.62241  ? 118 LEU   A CG   1 
ATOM   914  C  CD1  . LEU   A 1 118 ? -21.58317 -21.30074 10.80999  1.000 30.22822  ? 118 LEU   A CD1  1 
ATOM   915  C  CD2  . LEU   A 1 118 ? -21.48831 -20.18859 13.04766  1.000 40.45879  ? 118 LEU   A CD2  1 
ATOM   916  N  N    . CYS   A 1 119 ? -21.48301 -15.59761 9.83046   1.000 41.28293  ? 119 CYS   A N    1 
ATOM   917  C  CA   . CYS   A 1 119 ? -20.85113 -14.59336 8.97200   1.000 53.46085  ? 119 CYS   A CA   1 
ATOM   918  C  C    . CYS   A 1 119 ? -20.72323 -13.25879 9.70934   1.000 61.95662  ? 119 CYS   A C    1 
ATOM   919  O  O    . CYS   A 1 119 ? -21.28311 -12.23331 9.32152   1.000 58.90578  ? 119 CYS   A O    1 
ATOM   920  C  CB   . CYS   A 1 119 ? -21.63276 -14.43834 7.67164   1.000 53.57292  ? 119 CYS   A CB   1 
ATOM   921  S  SG   . CYS   A 1 119 ? -22.05857 -15.99524 6.85162   1.000 59.29047  ? 119 CYS   A SG   1 
ATOM   922  N  N    . THR   A 1 120 ? -19.94621 -13.29239 10.79225  1.000 51.24225  ? 120 THR   A N    1 
ATOM   923  C  CA   . THR   A 1 120 ? -19.78134 -12.14004 11.67104  1.000 70.36216  ? 120 THR   A CA   1 
ATOM   924  C  C    . THR   A 1 120 ? -18.90605 -11.04265 11.07406  1.000 68.20134  ? 120 THR   A C    1 
ATOM   925  O  O    . THR   A 1 120 ? -18.72600 -10.00544 11.72233  1.000 56.31269  ? 120 THR   A O    1 
ATOM   926  C  CB   . THR   A 1 120 ? -19.19856 -12.59116 13.01170  1.000 68.31449  ? 120 THR   A CB   1 
ATOM   927  O  OG1  . THR   A 1 120 ? -17.88341 -13.12208 12.80720  1.000 52.11532  ? 120 THR   A OG1  1 
ATOM   928  C  CG2  . THR   A 1 120 ? -20.08080 -13.66612 13.63591  1.000 51.90580  ? 120 THR   A CG2  1 
ATOM   929  N  N    . ASP   A 1 121 ? -18.35973 -11.23277 9.87436   1.000 69.30520  ? 121 ASP   A N    1 
ATOM   930  C  CA   . ASP   A 1 121 ? -17.57350 -10.19665 9.21793   1.000 67.79867  ? 121 ASP   A CA   1 
ATOM   931  C  C    . ASP   A 1 121 ? -18.40514 -9.30403  8.30604   1.000 73.71073  ? 121 ASP   A C    1 
ATOM   932  O  O    . ASP   A 1 121 ? -17.92709 -8.23597  7.90730   1.000 72.59487  ? 121 ASP   A O    1 
ATOM   933  C  CB   . ASP   A 1 121 ? -16.42992 -10.82860 8.41610   1.000 65.92464  ? 121 ASP   A CB   1 
ATOM   934  C  CG   . ASP   A 1 121 ? -15.42173 -11.53787 9.30112   1.000 79.93432  ? 121 ASP   A CG   1 
ATOM   935  O  OD1  . ASP   A 1 121 ? -14.88049 -12.58175 8.87652   1.000 70.95064  ? 121 ASP   A OD1  1 
ATOM   936  O  OD2  . ASP   A 1 121 ? -15.16529 -11.04433 10.42004  1.000 65.63727  ? 121 ASP   A OD2  1 
ATOM   937  N  N    . ASP   A 1 122 ? -19.63097 -9.71005  7.97017   1.000 70.10864  ? 122 ASP   A N    1 
ATOM   938  C  CA   . ASP   A 1 122 ? -20.52447 -8.90010  7.14166   1.000 65.14453  ? 122 ASP   A CA   1 
ATOM   939  C  C    . ASP   A 1 122 ? -21.38083 -8.03922  8.06721   1.000 67.39943  ? 122 ASP   A C    1 
ATOM   940  O  O    . ASP   A 1 122 ? -22.51795 -8.36976  8.41175   1.000 60.90552  ? 122 ASP   A O    1 
ATOM   941  C  CB   . ASP   A 1 122 ? -21.37111 -9.79085  6.23935   1.000 74.89089  ? 122 ASP   A CB   1 
ATOM   942  C  CG   . ASP   A 1 122 ? -22.02186 -9.02626  5.09870   1.000 71.31979  ? 122 ASP   A CG   1 
ATOM   943  O  OD1  . ASP   A 1 122 ? -22.18921 -7.79445  5.21517   1.000 74.23665  ? 122 ASP   A OD1  1 
ATOM   944  O  OD2  . ASP   A 1 122 ? -22.36938 -9.66231  4.08122   1.000 76.40481  ? 122 ASP   A OD2  1 
ATOM   945  N  N    . GLN   A 1 123 ? -20.80826 -6.90264  8.47535   1.000 68.59268  ? 123 GLN   A N    1 
ATOM   946  C  CA   . GLN   A 1 123 ? -21.50725 -6.01112  9.39574   1.000 62.23323  ? 123 GLN   A CA   1 
ATOM   947  C  C    . GLN   A 1 123 ? -22.76585 -5.42724  8.76829   1.000 60.73312  ? 123 GLN   A C    1 
ATOM   948  O  O    . GLN   A 1 123 ? -23.73226 -5.12991  9.47972   1.000 53.11995  ? 123 GLN   A O    1 
ATOM   949  C  CB   . GLN   A 1 123 ? -20.57352 -4.89068  9.85502   1.000 58.02220  ? 123 GLN   A CB   1 
ATOM   950  N  N    . GLY   A 1 124 ? -22.77516 -5.25428  7.44576   1.000 59.84812  ? 124 GLY   A N    1 
ATOM   951  C  CA   . GLY   A 1 124 ? -23.97113 -4.75333  6.78673   1.000 45.67318  ? 124 GLY   A CA   1 
ATOM   952  C  C    . GLY   A 1 124 ? -25.12849 -5.73147  6.87056   1.000 62.94171  ? 124 GLY   A C    1 
ATOM   953  O  O    . GLY   A 1 124 ? -26.26555 -5.34616  7.15925   1.000 47.73398  ? 124 GLY   A O    1 
ATOM   954  N  N    . TYR   A 1 125 ? -24.85598 -7.01414  6.62086   1.000 52.75553  ? 125 TYR   A N    1 
ATOM   955  C  CA   . TYR   A 1 125 ? -25.91051 -8.01290  6.74855   1.000 56.79164  ? 125 TYR   A CA   1 
ATOM   956  C  C    . TYR   A 1 125 ? -26.36393 -8.15581  8.19509   1.000 50.96905  ? 125 TYR   A C    1 
ATOM   957  O  O    . TYR   A 1 125 ? -27.56564 -8.26160  8.46635   1.000 52.48931  ? 125 TYR   A O    1 
ATOM   958  C  CB   . TYR   A 1 125 ? -25.44884 -9.36839  6.21674   1.000 47.50495  ? 125 TYR   A CB   1 
ATOM   959  C  CG   . TYR   A 1 125 ? -26.37033 -10.47465 6.67279   1.000 50.61116  ? 125 TYR   A CG   1 
ATOM   960  C  CD1  . TYR   A 1 125 ? -27.66491 -10.56164 6.18175   1.000 45.96897  ? 125 TYR   A CD1  1 
ATOM   961  C  CD2  . TYR   A 1 125 ? -25.96441 -11.40463 7.62061   1.000 37.91952  ? 125 TYR   A CD2  1 
ATOM   962  C  CE1  . TYR   A 1 125 ? -28.52640 -11.55489 6.60381   1.000 50.81645  ? 125 TYR   A CE1  1 
ATOM   963  C  CE2  . TYR   A 1 125 ? -26.81916 -12.40320 8.04947   1.000 46.33981  ? 125 TYR   A CE2  1 
ATOM   964  C  CZ   . TYR   A 1 125 ? -28.09894 -12.47256 7.53597   1.000 40.88939  ? 125 TYR   A CZ   1 
ATOM   965  O  OH   . TYR   A 1 125 ? -28.95610 -13.46145 7.95689   1.000 45.68428  ? 125 TYR   A OH   1 
ATOM   966  N  N    . LEU   A 1 126 ? -25.41584 -8.17184  9.13561   1.000 53.19200  ? 126 LEU   A N    1 
ATOM   967  C  CA   . LEU   A 1 126 ? -25.76758 -8.36845  10.53758  1.000 57.90773  ? 126 LEU   A CA   1 
ATOM   968  C  C    . LEU   A 1 126 ? -26.65986 -7.24716  11.05337  1.000 58.63165  ? 126 LEU   A C    1 
ATOM   969  O  O    . LEU   A 1 126 ? -27.51029 -7.48084  11.91994  1.000 53.48582  ? 126 LEU   A O    1 
ATOM   970  C  CB   . LEU   A 1 126 ? -24.49837 -8.48206  11.38262  1.000 65.14239  ? 126 LEU   A CB   1 
ATOM   971  C  CG   . LEU   A 1 126 ? -24.41431 -9.70318  12.30170  1.000 72.73584  ? 126 LEU   A CG   1 
ATOM   972  C  CD1  . LEU   A 1 126 ? -24.65683 -10.98330 11.51426  1.000 76.52860  ? 126 LEU   A CD1  1 
ATOM   973  C  CD2  . LEU   A 1 126 ? -23.06899 -9.75691  13.01003  1.000 76.01843  ? 126 LEU   A CD2  1 
ATOM   974  N  N    . ALA   A 1 127 ? -26.48865 -6.02964  10.53171  1.000 49.37861  ? 127 ALA   A N    1 
ATOM   975  C  CA   . ALA   A 1 127 ? -27.39376 -4.94205  10.88702  1.000 50.04301  ? 127 ALA   A CA   1 
ATOM   976  C  C    . ALA   A 1 127 ? -28.79142 -5.19361  10.33687  1.000 50.94140  ? 127 ALA   A C    1 
ATOM   977  O  O    . ALA   A 1 127 ? -29.78959 -4.95834  11.02789  1.000 44.38159  ? 127 ALA   A O    1 
ATOM   978  C  CB   . ALA   A 1 127 ? -26.84473 -3.61166  10.37421  1.000 46.10275  ? 127 ALA   A CB   1 
ATOM   979  N  N    . PHE   A 1 128 ? -28.88122 -5.67337  9.09390   1.000 55.92564  ? 128 PHE   A N    1 
ATOM   980  C  CA   . PHE   A 1 128 ? -30.17853 -6.03184  8.53041   1.000 50.14262  ? 128 PHE   A CA   1 
ATOM   981  C  C    . PHE   A 1 128 ? -30.82546 -7.16350  9.31910   1.000 43.32785  ? 128 PHE   A C    1 
ATOM   982  O  O    . PHE   A 1 128 ? -32.03010 -7.12832  9.59383   1.000 44.13774  ? 128 PHE   A O    1 
ATOM   983  C  CB   . PHE   A 1 128 ? -30.01943 -6.42285  7.06034   1.000 52.07808  ? 128 PHE   A CB   1 
ATOM   984  C  CG   . PHE   A 1 128 ? -31.27895 -6.94583  6.42947   1.000 50.58823  ? 128 PHE   A CG   1 
ATOM   985  C  CD1  . PHE   A 1 128 ? -32.30744 -6.08326  6.08507   1.000 62.05711  ? 128 PHE   A CD1  1 
ATOM   986  C  CD2  . PHE   A 1 128 ? -31.43509 -8.29948  6.18081   1.000 47.74028  ? 128 PHE   A CD2  1 
ATOM   987  C  CE1  . PHE   A 1 128 ? -33.46742 -6.56119  5.50233   1.000 46.85464  ? 128 PHE   A CE1  1 
ATOM   988  C  CE2  . PHE   A 1 128 ? -32.59311 -8.78315  5.60064   1.000 45.97287  ? 128 PHE   A CE2  1 
ATOM   989  C  CZ   . PHE   A 1 128 ? -33.60977 -7.91264  5.26044   1.000 54.55631  ? 128 PHE   A CZ   1 
ATOM   990  N  N    . ARG   A 1 129 ? -30.03761 -8.17283  9.70093   1.000 36.51807  ? 129 ARG   A N    1 
ATOM   991  C  CA   . ARG   A 1 129 ? -30.59057 -9.30339  10.44050  1.000 40.85485  ? 129 ARG   A CA   1 
ATOM   992  C  C    . ARG   A 1 129 ? -31.11621 -8.87301  11.80337  1.000 40.03277  ? 129 ARG   A C    1 
ATOM   993  O  O    . ARG   A 1 129 ? -32.21105 -9.27892  12.20930  1.000 40.92560  ? 129 ARG   A O    1 
ATOM   994  C  CB   . ARG   A 1 129 ? -29.53965 -10.40083 10.60241  1.000 41.47394  ? 129 ARG   A CB   1 
ATOM   995  C  CG   . ARG   A 1 129 ? -30.08961 -11.65969 11.25394  1.000 50.44914  ? 129 ARG   A CG   1 
ATOM   996  C  CD   . ARG   A 1 129 ? -28.99227 -12.62525 11.66948  1.000 37.70826  ? 129 ARG   A CD   1 
ATOM   997  N  NE   . ARG   A 1 129 ? -29.53442 -13.94870 11.95577  1.000 40.83363  ? 129 ARG   A NE   1 
ATOM   998  C  CZ   . ARG   A 1 129 ? -30.18575 -14.27308 13.06526  1.000 47.32028  ? 129 ARG   A CZ   1 
ATOM   999  N  NH1  . ARG   A 1 129 ? -30.37959 -13.39537 14.03631  1.000 47.42217  ? 129 ARG   A NH1  1 
ATOM   1000 N  NH2  . ARG   A 1 129 ? -30.65158 -15.51183 13.20612  1.000 46.01233  ? 129 ARG   A NH2  1 
ATOM   1001 N  N    . ALA   A 1 130 ? -30.34756 -8.05691  12.52894  1.000 41.91670  ? 130 ALA   A N    1 
ATOM   1002 C  CA   . ALA   A 1 130 ? -30.82317 -7.54893  13.81105  1.000 45.87616  ? 130 ALA   A CA   1 
ATOM   1003 C  C    . ALA   A 1 130 ? -32.09740 -6.73287  13.64700  1.000 45.64832  ? 130 ALA   A C    1 
ATOM   1004 O  O    . ALA   A 1 130 ? -32.95156 -6.72876  14.54067  1.000 44.11001  ? 130 ALA   A O    1 
ATOM   1005 C  CB   . ALA   A 1 130 ? -29.73592 -6.70913  14.48189  1.000 47.62692  ? 130 ALA   A CB   1 
ATOM   1006 N  N    . LYS   A 1 131 ? -32.24640 -6.04605  12.51305  1.000 42.73862  ? 131 LYS   A N    1 
ATOM   1007 C  CA   . LYS   A 1 131 ? -33.44198 -5.24505  12.27660  1.000 42.70302  ? 131 LYS   A CA   1 
ATOM   1008 C  C    . LYS   A 1 131 ? -34.66899 -6.13188  12.10332  1.000 46.48920  ? 131 LYS   A C    1 
ATOM   1009 O  O    . LYS   A 1 131 ? -35.63697 -6.03150  12.86599  1.000 40.06046  ? 131 LYS   A O    1 
ATOM   1010 C  CB   . LYS   A 1 131 ? -33.24032 -4.35341  11.04953  1.000 45.92963  ? 131 LYS   A CB   1 
ATOM   1011 C  CG   . LYS   A 1 131 ? -34.41252 -3.43012  10.75802  1.000 54.51591  ? 131 LYS   A CG   1 
ATOM   1012 N  N    . VAL   A 1 132 ? -34.63991 -7.02496  11.10869  1.000 39.81614  ? 132 VAL   A N    1 
ATOM   1013 C  CA   . VAL   A 1 132 ? -35.82208 -7.82299  10.78725  1.000 34.09482  ? 132 VAL   A CA   1 
ATOM   1014 C  C    . VAL   A 1 132 ? -36.08576 -8.93548  11.78787  1.000 34.44534  ? 132 VAL   A C    1 
ATOM   1015 O  O    . VAL   A 1 132 ? -37.11471 -9.61274  11.68335  1.000 35.84690  ? 132 VAL   A O    1 
ATOM   1016 C  CB   . VAL   A 1 132 ? -35.71608 -8.42947  9.37514   1.000 36.67103  ? 132 VAL   A CB   1 
ATOM   1017 C  CG1  . VAL   A 1 132 ? -35.67717 -7.32773  8.32558   1.000 26.65065  ? 132 VAL   A CG1  1 
ATOM   1018 C  CG2  . VAL   A 1 132 ? -34.49573 -9.33744  9.26282   1.000 33.47048  ? 132 VAL   A CG2  1 
ATOM   1019 N  N    . HIS   A 1 133 ? -35.19501 -9.15089  12.75218  1.000 42.16135  ? 133 HIS   A N    1 
ATOM   1020 C  CA   . HIS   A 1 133 ? -35.43267 -10.11603 13.81697  1.000 42.29481  ? 133 HIS   A CA   1 
ATOM   1021 C  C    . HIS   A 1 133 ? -35.92627 -9.46322  15.10020  1.000 50.84320  ? 133 HIS   A C    1 
ATOM   1022 O  O    . HIS   A 1 133 ? -36.23113 -10.17141 16.06561  1.000 44.74880  ? 133 HIS   A O    1 
ATOM   1023 C  CB   . HIS   A 1 133 ? -34.16242 -10.92576 14.09246  1.000 41.42762  ? 133 HIS   A CB   1 
ATOM   1024 C  CG   . HIS   A 1 133 ? -33.96110 -12.06005 13.13770  1.000 41.03023  ? 133 HIS   A CG   1 
ATOM   1025 N  ND1  . HIS   A 1 133 ? -33.39539 -11.89275 11.89204  1.000 45.41473  ? 133 HIS   A ND1  1 
ATOM   1026 C  CD2  . HIS   A 1 133 ? -34.26786 -13.37484 13.23820  1.000 36.95549  ? 133 HIS   A CD2  1 
ATOM   1027 C  CE1  . HIS   A 1 133 ? -33.35555 -13.05688 11.26882  1.000 35.73937  ? 133 HIS   A CE1  1 
ATOM   1028 N  NE2  . HIS   A 1 133 ? -33.87793 -13.97299 12.06425  1.000 42.16036  ? 133 HIS   A NE2  1 
ATOM   1029 N  N    . THR   A 1 134 ? -36.01444 -8.14202  15.13136  1.000 42.25220  ? 134 THR   A N    1 
ATOM   1030 C  CA   . THR   A 1 134 ? -36.58396 -7.44832  16.27656  1.000 40.30403  ? 134 THR   A CA   1 
ATOM   1031 C  C    . THR   A 1 134 ? -38.07607 -7.74691  16.34632  1.000 34.40383  ? 134 THR   A C    1 
ATOM   1032 O  O    . THR   A 1 134 ? -38.78961 -7.50930  15.36329  1.000 40.22051  ? 134 THR   A O    1 
ATOM   1033 C  CB   . THR   A 1 134 ? -36.33895 -5.94994  16.15723  1.000 43.14029  ? 134 THR   A CB   1 
ATOM   1034 O  OG1  . THR   A 1 134 ? -34.94333 -5.71469  15.93368  1.000 46.42273  ? 134 THR   A OG1  1 
ATOM   1035 C  CG2  . THR   A 1 134 ? -36.76489 -5.24342  17.42816  1.000 45.27682  ? 134 THR   A CG2  1 
ATOM   1036 N  N    . PRO   A 1 135 ? -38.58712 -8.26895  17.46589  1.000 41.96643  ? 135 PRO   A N    1 
ATOM   1037 C  CA   . PRO   A 1 135 ? -39.99265 -8.71626  17.48847  1.000 41.34700  ? 135 PRO   A CA   1 
ATOM   1038 C  C    . PRO   A 1 135 ? -41.00734 -7.62528  17.17833  1.000 41.52326  ? 135 PRO   A C    1 
ATOM   1039 O  O    . PRO   A 1 135 ? -41.98058 -7.89331  16.46353  1.000 39.31068  ? 135 PRO   A O    1 
ATOM   1040 C  CB   . PRO   A 1 135 ? -40.15678 -9.25957  18.91497  1.000 38.79780  ? 135 PRO   A CB   1 
ATOM   1041 C  CG   . PRO   A 1 135 ? -38.77467 -9.65009  19.32542  1.000 42.97266  ? 135 PRO   A CG   1 
ATOM   1042 C  CD   . PRO   A 1 135 ? -37.86880 -8.63264  18.69884  1.000 40.44767  ? 135 PRO   A CD   1 
ATOM   1043 N  N    . TRP   A 1 136 ? -40.82416 -6.40335  17.68771  1.000 45.18326  ? 136 TRP   A N    1 
ATOM   1044 C  CA   . TRP   A 1 136 ? -41.81438 -5.36815  17.40194  1.000 41.19906  ? 136 TRP   A CA   1 
ATOM   1045 C  C    . TRP   A 1 136 ? -41.77645 -4.94875  15.93822  1.000 38.44767  ? 136 TRP   A C    1 
ATOM   1046 O  O    . TRP   A 1 136 ? -42.80429 -4.53891  15.38658  1.000 37.59947  ? 136 TRP   A O    1 
ATOM   1047 C  CB   . TRP   A 1 136 ? -41.62645 -4.16147  18.32776  1.000 39.08200  ? 136 TRP   A CB   1 
ATOM   1048 C  CG   . TRP   A 1 136 ? -40.42081 -3.29281  18.06379  1.000 47.53471  ? 136 TRP   A CG   1 
ATOM   1049 C  CD1  . TRP   A 1 136 ? -39.23063 -3.32477  18.73069  1.000 45.40048  ? 136 TRP   A CD1  1 
ATOM   1050 C  CD2  . TRP   A 1 136 ? -40.30868 -2.23565  17.09741  1.000 41.06163  ? 136 TRP   A CD2  1 
ATOM   1051 N  NE1  . TRP   A 1 136 ? -38.37780 -2.37230  18.22735  1.000 42.64676  ? 136 TRP   A NE1  1 
ATOM   1052 C  CE2  . TRP   A 1 136 ? -39.01475 -1.68977  17.22448  1.000 47.15235  ? 136 TRP   A CE2  1 
ATOM   1053 C  CE3  . TRP   A 1 136 ? -41.17123 -1.70699  16.13048  1.000 36.90150  ? 136 TRP   A CE3  1 
ATOM   1054 C  CZ2  . TRP   A 1 136 ? -38.56342 -0.63977  16.42307  1.000 44.78963  ? 136 TRP   A CZ2  1 
ATOM   1055 C  CZ3  . TRP   A 1 136 ? -40.72116 -0.66572  15.33485  1.000 36.61061  ? 136 TRP   A CZ3  1 
ATOM   1056 C  CH2  . TRP   A 1 136 ? -39.42876 -0.14340  15.48658  1.000 40.53010  ? 136 TRP   A CH2  1 
ATOM   1057 N  N    . ILE   A 1 137 ? -40.61600 -5.06292  15.29068  1.000 36.67019  ? 137 ILE   A N    1 
ATOM   1058 C  CA   . ILE   A 1 137 ? -40.53174 -4.77563  13.86239  1.000 32.04627  ? 137 ILE   A CA   1 
ATOM   1059 C  C    . ILE   A 1 137 ? -41.23458 -5.86165  13.05674  1.000 34.85387  ? 137 ILE   A C    1 
ATOM   1060 O  O    . ILE   A 1 137 ? -41.92900 -5.57286  12.07452  1.000 32.36033  ? 137 ILE   A O    1 
ATOM   1061 C  CB   . ILE   A 1 137 ? -39.05996 -4.61182  13.44137  1.000 39.25377  ? 137 ILE   A CB   1 
ATOM   1062 C  CG1  . ILE   A 1 137 ? -38.44703 -3.39170  14.13530  1.000 41.79972  ? 137 ILE   A CG1  1 
ATOM   1063 C  CG2  . ILE   A 1 137 ? -38.93941 -4.50611  11.92500  1.000 30.47045  ? 137 ILE   A CG2  1 
ATOM   1064 C  CD1  . ILE   A 1 137 ? -37.07720 -3.01087  13.61454  1.000 48.61370  ? 137 ILE   A CD1  1 
ATOM   1065 N  N    . GLN   A 1 138 ? -41.07131 -7.12546  13.45766  1.000 27.48540  ? 138 GLN   A N    1 
ATOM   1066 C  CA   . GLN   A 1 138 ? -41.77464 -8.21217  12.78292  1.000 32.12517  ? 138 GLN   A CA   1 
ATOM   1067 C  C    . GLN   A 1 138 ? -43.28287 -8.05044  12.91053  1.000 28.20090  ? 138 GLN   A C    1 
ATOM   1068 O  O    . GLN   A 1 138 ? -44.02034 -8.20194  11.92963  1.000 28.86142  ? 138 GLN   A O    1 
ATOM   1069 C  CB   . GLN   A 1 138 ? -41.33488 -9.56190  13.35166  1.000 24.82734  ? 138 GLN   A CB   1 
ATOM   1070 C  CG   . GLN   A 1 138 ? -39.88011 -9.88940  13.12303  1.000 30.16907  ? 138 GLN   A CG   1 
ATOM   1071 C  CD   . GLN   A 1 138 ? -39.56249 -11.34230 13.41973  1.000 39.67026  ? 138 GLN   A CD   1 
ATOM   1072 O  OE1  . GLN   A 1 138 ? -40.39364 -12.07428 13.95776  1.000 52.84113  ? 138 GLN   A OE1  1 
ATOM   1073 N  NE2  . GLN   A 1 138 ? -38.36421 -11.77081 13.05290  1.000 29.77178  ? 138 GLN   A NE2  1 
ATOM   1074 N  N    . ARG   A 1 139 ? -43.76156 -7.74980  14.12081  1.000 28.43295  ? 139 ARG   A N    1 
ATOM   1075 C  CA   . ARG   A 1 139 ? -45.19901 -7.60361  14.32853  1.000 31.46226  ? 139 ARG   A CA   1 
ATOM   1076 C  C    . ARG   A 1 139 ? -45.75213 -6.42458  13.54060  1.000 29.51737  ? 139 ARG   A C    1 
ATOM   1077 O  O    . ARG   A 1 139 ? -46.86652 -6.49256  13.00877  1.000 35.18860  ? 139 ARG   A O    1 
ATOM   1078 C  CB   . ARG   A 1 139 ? -45.50471 -7.44260  15.81700  1.000 38.68501  ? 139 ARG   A CB   1 
ATOM   1079 C  CG   . ARG   A 1 139 ? -45.12620 -8.64464  16.66145  1.000 48.94672  ? 139 ARG   A CG   1 
ATOM   1080 C  CD   . ARG   A 1 139 ? -45.71044 -8.53552  18.05928  1.000 62.05591  ? 139 ARG   A CD   1 
ATOM   1081 N  NE   . ARG   A 1 139 ? -45.06356 -7.48249  18.83267  1.000 69.88495  ? 139 ARG   A NE   1 
ATOM   1082 C  CZ   . ARG   A 1 139 ? -44.10447 -7.68927  19.72431  1.000 64.57940  ? 139 ARG   A CZ   1 
ATOM   1083 N  NH1  . ARG   A 1 139 ? -43.65254 -8.90571  19.98366  1.000 70.70921  ? 139 ARG   A NH1  1 
ATOM   1084 N  NH2  . ARG   A 1 139 ? -43.58423 -6.64932  20.37003  1.000 56.41831  ? 139 ARG   A NH2  1 
ATOM   1085 N  N    . LEU   A 1 140 ? -44.98584 -5.33494  13.45241  1.000 32.28259  ? 140 LEU   A N    1 
ATOM   1086 C  CA   . LEU   A 1 140 ? -45.42838 -4.18146  12.67658  1.000 27.18540  ? 140 LEU   A CA   1 
ATOM   1087 C  C    . LEU   A 1 140 ? -45.50557 -4.51068  11.19098  1.000 29.82449  ? 140 LEU   A C    1 
ATOM   1088 O  O    . LEU   A 1 140 ? -46.46547 -4.12511  10.51386  1.000 28.46145  ? 140 LEU   A O    1 
ATOM   1089 C  CB   . LEU   A 1 140 ? -44.49242 -2.99723  12.91520  1.000 31.04051  ? 140 LEU   A CB   1 
ATOM   1090 C  CG   . LEU   A 1 140 ? -44.74680 -1.77453  12.03029  1.000 47.84068  ? 140 LEU   A CG   1 
ATOM   1091 C  CD1  . LEU   A 1 140 ? -45.87866 -0.93413  12.60200  1.000 34.66127  ? 140 LEU   A CD1  1 
ATOM   1092 C  CD2  . LEU   A 1 140 ? -43.48324 -0.93899  11.87463  1.000 51.46694  ? 140 LEU   A CD2  1 
ATOM   1093 N  N    . PHE   A 1 141 ? -44.50828 -5.22747  10.66619  1.000 24.87551  ? 141 PHE   A N    1 
ATOM   1094 C  CA   . PHE   A 1 141 ? -44.51665 -5.55726  9.24509   1.000 27.08501  ? 141 PHE   A CA   1 
ATOM   1095 C  C    . PHE   A 1 141 ? -45.65525 -6.51383  8.91057   1.000 25.17780  ? 141 PHE   A C    1 
ATOM   1096 O  O    . PHE   A 1 141 ? -46.34154 -6.33933  7.89699   1.000 26.10873  ? 141 PHE   A O    1 
ATOM   1097 C  CB   . PHE   A 1 141 ? -43.16617 -6.15144  8.83415   1.000 24.30683  ? 141 PHE   A CB   1 
ATOM   1098 C  CG   . PHE   A 1 141 ? -43.12571 -6.64988  7.41371   1.000 24.63421  ? 141 PHE   A CG   1 
ATOM   1099 C  CD1  . PHE   A 1 141 ? -42.87453 -5.77805  6.36785   1.000 25.20496  ? 141 PHE   A CD1  1 
ATOM   1100 C  CD2  . PHE   A 1 141 ? -43.32761 -7.99345  7.12624   1.000 25.31204  ? 141 PHE   A CD2  1 
ATOM   1101 C  CE1  . PHE   A 1 141 ? -42.83366 -6.23008  5.05928   1.000 27.44457  ? 141 PHE   A CE1  1 
ATOM   1102 C  CE2  . PHE   A 1 141 ? -43.28841 -8.45374  5.81956   1.000 26.51562  ? 141 PHE   A CE2  1 
ATOM   1103 C  CZ   . PHE   A 1 141 ? -43.03896 -7.57235  4.78507   1.000 21.97978  ? 141 PHE   A CZ   1 
ATOM   1104 N  N    . LEU   A 1 142 ? -45.87800 -7.52350  9.75693   1.000 28.21752  ? 142 LEU   A N    1 
ATOM   1105 C  CA   . LEU   A 1 142 ? -46.92058 -8.51034  9.49563   1.000 26.33468  ? 142 LEU   A CA   1 
ATOM   1106 C  C    . LEU   A 1 142 ? -48.32018 -7.92658  9.62437   1.000 27.30720  ? 142 LEU   A C    1 
ATOM   1107 O  O    . LEU   A 1 142 ? -49.26430 -8.48743  9.05851   1.000 27.06005  ? 142 LEU   A O    1 
ATOM   1108 C  CB   . LEU   A 1 142 ? -46.76892 -9.70290  10.44292  1.000 26.56731  ? 142 LEU   A CB   1 
ATOM   1109 C  CG   . LEU   A 1 142 ? -45.52455 -10.57005 10.23849  1.000 27.49654  ? 142 LEU   A CG   1 
ATOM   1110 C  CD1  . LEU   A 1 142 ? -45.38087 -11.58211 11.36421  1.000 33.25753  ? 142 LEU   A CD1  1 
ATOM   1111 C  CD2  . LEU   A 1 142 ? -45.57609 -11.27017 8.88939   1.000 24.79507  ? 142 LEU   A CD2  1 
ATOM   1112 N  N    . ALA   A 1 143 ? -48.47881 -6.81967  10.35295  1.000 32.44852  ? 143 ALA   A N    1 
ATOM   1113 C  CA   . ALA   A 1 143 ? -49.78413 -6.18109  10.46230  1.000 32.25586  ? 143 ALA   A CA   1 
ATOM   1114 C  C    . ALA   A 1 143 ? -50.14389 -5.36342  9.22890   1.000 31.89288  ? 143 ALA   A C    1 
ATOM   1115 O  O    . ALA   A 1 143 ? -51.31949 -5.02658  9.04637   1.000 37.71928  ? 143 ALA   A O    1 
ATOM   1116 C  CB   . ALA   A 1 143 ? -49.83557 -5.28949  11.70472  1.000 30.37929  ? 143 ALA   A CB   1 
ATOM   1117 N  N    . LEU   A 1 144 ? -49.16921 -5.03678  8.38568   1.000 28.27875  ? 144 LEU   A N    1 
ATOM   1118 C  CA   . LEU   A 1 144 ? -49.45181 -4.26773  7.18600   1.000 28.29895  ? 144 LEU   A CA   1 
ATOM   1119 C  C    . LEU   A 1 144 ? -50.30193 -5.08574  6.21496   1.000 29.68506  ? 144 LEU   A C    1 
ATOM   1120 O  O    . LEU   A 1 144 ? -50.25816 -6.31885  6.22667   1.000 30.05531  ? 144 LEU   A O    1 
ATOM   1121 C  CB   . LEU   A 1 144 ? -48.15430 -3.84258  6.50568   1.000 22.71357  ? 144 LEU   A CB   1 
ATOM   1122 C  CG   . LEU   A 1 144 ? -47.28069 -2.86969  7.29652   1.000 26.85231  ? 144 LEU   A CG   1 
ATOM   1123 C  CD1  . LEU   A 1 144 ? -45.91720 -2.73500  6.64787   1.000 27.77167  ? 144 LEU   A CD1  1 
ATOM   1124 C  CD2  . LEU   A 1 144 ? -47.96120 -1.50759  7.42118   1.000 22.91566  ? 144 LEU   A CD2  1 
ATOM   1125 N  N    . PRO   A 1 145 ? -51.09534 -4.42276  5.37298   1.000 33.61188  ? 145 PRO   A N    1 
ATOM   1126 C  CA   . PRO   A 1 145 ? -51.85837 -5.15670  4.35797   1.000 35.58857  ? 145 PRO   A CA   1 
ATOM   1127 C  C    . PRO   A 1 145 ? -50.93155 -5.95140  3.45394   1.000 34.50179  ? 145 PRO   A C    1 
ATOM   1128 O  O    . PRO   A 1 145 ? -49.77602 -5.57934  3.23516   1.000 24.35742  ? 145 PRO   A O    1 
ATOM   1129 C  CB   . PRO   A 1 145 ? -52.58250 -4.04964  3.58305   1.000 32.21902  ? 145 PRO   A CB   1 
ATOM   1130 C  CG   . PRO   A 1 145 ? -52.63383 -2.89525  4.52837   1.000 30.17252  ? 145 PRO   A CG   1 
ATOM   1131 C  CD   . PRO   A 1 145 ? -51.37771 -2.97681  5.34128   1.000 27.85358  ? 145 PRO   A CD   1 
ATOM   1132 N  N    . LEU   A 1 146 ? -51.45971 -7.06346  2.93220   1.000 28.46666  ? 146 LEU   A N    1 
ATOM   1133 C  CA   . LEU   A 1 146 ? -50.65757 -7.96041  2.10570   1.000 27.98305  ? 146 LEU   A CA   1 
ATOM   1134 C  C    . LEU   A 1 146 ? -50.05698 -7.23278  0.91060   1.000 27.69175  ? 146 LEU   A C    1 
ATOM   1135 O  O    . LEU   A 1 146 ? -48.87059 -7.39997  0.60817   1.000 24.74835  ? 146 LEU   A O    1 
ATOM   1136 C  CB   . LEU   A 1 146 ? -51.50753 -9.14047  1.63160   1.000 22.75055  ? 146 LEU   A CB   1 
ATOM   1137 C  CG   . LEU   A 1 146 ? -51.45696 -10.41495 2.47238   1.000 40.88132  ? 146 LEU   A CG   1 
ATOM   1138 C  CD1  . LEU   A 1 146 ? -52.57205 -11.36390 2.05853   1.000 36.17359  ? 146 LEU   A CD1  1 
ATOM   1139 C  CD2  . LEU   A 1 146 ? -50.09542 -11.08578 2.33902   1.000 32.92894  ? 146 LEU   A CD2  1 
ATOM   1140 N  N    . PHE   A 1 147 ? -50.85660 -6.42062  0.21412   1.000 26.50126  ? 147 PHE   A N    1 
ATOM   1141 C  CA   . PHE   A 1 147 ? -50.32372 -5.73221  -0.95489  1.000 30.07118  ? 147 PHE   A CA   1 
ATOM   1142 C  C    . PHE   A 1 147 ? -49.23152 -4.73746  -0.58194  1.000 30.33170  ? 147 PHE   A C    1 
ATOM   1143 O  O    . PHE   A 1 147 ? -48.34023 -4.48471  -1.39863  1.000 27.31425  ? 147 PHE   A O    1 
ATOM   1144 C  CB   . PHE   A 1 147 ? -51.45161 -5.04962  -1.74157  1.000 28.72076  ? 147 PHE   A CB   1 
ATOM   1145 C  CG   . PHE   A 1 147 ? -51.97255 -3.77571  -1.12191  1.000 38.88624  ? 147 PHE   A CG   1 
ATOM   1146 C  CD1  . PHE   A 1 147 ? -52.88276 -3.81352  -0.07551  1.000 44.69508  ? 147 PHE   A CD1  1 
ATOM   1147 C  CD2  . PHE   A 1 147 ? -51.58988 -2.54015  -1.62067  1.000 45.19701  ? 147 PHE   A CD2  1 
ATOM   1148 C  CE1  . PHE   A 1 147 ? -53.37891 -2.64249  0.47971   1.000 33.63631  ? 147 PHE   A CE1  1 
ATOM   1149 C  CE2  . PHE   A 1 147 ? -52.08361 -1.36635  -1.06927  1.000 39.23760  ? 147 PHE   A CE2  1 
ATOM   1150 C  CZ   . PHE   A 1 147 ? -52.97891 -1.42078  -0.01634  1.000 34.12744  ? 147 PHE   A CZ   1 
ATOM   1151 N  N    . ILE   A 1 148 ? -49.25739 -4.20108  0.63919   1.000 25.99485  ? 148 ILE   A N    1 
ATOM   1152 C  CA   . ILE   A 1 148 ? -48.18726 -3.31005  1.07487   1.000 27.39435  ? 148 ILE   A CA   1 
ATOM   1153 C  C    . ILE   A 1 148 ? -46.91933 -4.10162  1.36546   1.000 28.21714  ? 148 ILE   A C    1 
ATOM   1154 O  O    . ILE   A 1 148 ? -45.81909 -3.69249  0.97792   1.000 26.74788  ? 148 ILE   A O    1 
ATOM   1155 C  CB   . ILE   A 1 148 ? -48.63800 -2.49091  2.29685   1.000 22.89422  ? 148 ILE   A CB   1 
ATOM   1156 C  CG1  . ILE   A 1 148 ? -49.78544 -1.54859  1.91916   1.000 32.45833  ? 148 ILE   A CG1  1 
ATOM   1157 C  CG2  . ILE   A 1 148 ? -47.46271 -1.70046  2.87196   1.000 25.88733  ? 148 ILE   A CG2  1 
ATOM   1158 C  CD1  . ILE   A 1 148 ? -49.37799 -0.43740  0.97522   1.000 34.49397  ? 148 ILE   A CD1  1 
ATOM   1159 N  N    . ARG   A 1 149 ? -47.05354 -5.24405  2.04783   1.000 25.69070  ? 149 ARG   A N    1 
ATOM   1160 C  CA   . ARG   A 1 149 ? -45.90073 -6.10446  2.30202   1.000 27.08580  ? 149 ARG   A CA   1 
ATOM   1161 C  C    . ARG   A 1 149 ? -45.25217 -6.55738  1.00025   1.000 29.76968  ? 149 ARG   A C    1 
ATOM   1162 O  O    . ARG   A 1 149 ? -44.02025 -6.60446  0.89577   1.000 30.52939  ? 149 ARG   A O    1 
ATOM   1163 C  CB   . ARG   A 1 149 ? -46.32330 -7.31575  3.13642   1.000 23.59444  ? 149 ARG   A CB   1 
ATOM   1164 C  CG   . ARG   A 1 149 ? -46.50290 -7.02796  4.61978   1.000 25.38502  ? 149 ARG   A CG   1 
ATOM   1165 C  CD   . ARG   A 1 149 ? -46.94141 -8.27515  5.38293   1.000 22.77671  ? 149 ARG   A CD   1 
ATOM   1166 N  NE   . ARG   A 1 149 ? -48.39438 -8.36462  5.49211   1.000 24.45844  ? 149 ARG   A NE   1 
ATOM   1167 C  CZ   . ARG   A 1 149 ? -49.07463 -9.49904  5.59413   1.000 31.49254  ? 149 ARG   A CZ   1 
ATOM   1168 N  NH1  . ARG   A 1 149 ? -48.46490 -10.67507 5.59848   1.000 17.91086  ? 149 ARG   A NH1  1 
ATOM   1169 N  NH2  . ARG   A 1 149 ? -50.39968 -9.45258  5.70119   1.000 25.32571  ? 149 ARG   A NH2  1 
ATOM   1170 N  N    . HIS   A 1 150 ? -46.06725 -6.90162  -0.00124  1.000 31.15673  ? 150 HIS   A N    1 
ATOM   1171 C  CA   . HIS   A 1 150 ? -45.53025 -7.31747  -1.29470  1.000 29.14368  ? 150 HIS   A CA   1 
ATOM   1172 C  C    . HIS   A 1 150 ? -44.66419 -6.22429  -1.90536  1.000 29.33844  ? 150 HIS   A C    1 
ATOM   1173 O  O    . HIS   A 1 150 ? -43.53570 -6.48082  -2.34027  1.000 32.83349  ? 150 HIS   A O    1 
ATOM   1174 C  CB   . HIS   A 1 150 ? -46.67138 -7.68615  -2.24404  1.000 32.60365  ? 150 HIS   A CB   1 
ATOM   1175 C  CG   . HIS   A 1 150 ? -46.88519 -9.15940  -2.39015  1.000 49.12361  ? 150 HIS   A CG   1 
ATOM   1176 N  ND1  . HIS   A 1 150 ? -45.95895 -9.98857  -2.98465  1.000 60.25012  ? 150 HIS   A ND1  1 
ATOM   1177 C  CD2  . HIS   A 1 150 ? -47.92081 -9.95229  -2.02490  1.000 56.91134  ? 150 HIS   A CD2  1 
ATOM   1178 C  CE1  . HIS   A 1 150 ? -46.41134 -11.22965 -2.97427  1.000 57.06872  ? 150 HIS   A CE1  1 
ATOM   1179 N  NE2  . HIS   A 1 150 ? -47.60007 -11.23518 -2.39803  1.000 56.21042  ? 150 HIS   A NE2  1 
ATOM   1180 N  N    . ARG   A 1 151 ? -45.17916 -4.99151  -1.94534  1.000 25.29844  ? 151 ARG   A N    1 
ATOM   1181 C  CA   . ARG   A 1 151 ? -44.41722 -3.89656  -2.53535  1.000 30.10130  ? 151 ARG   A CA   1 
ATOM   1182 C  C    . ARG   A 1 151 ? -43.15212 -3.60044  -1.73799  1.000 31.62758  ? 151 ARG   A C    1 
ATOM   1183 O  O    . ARG   A 1 151 ? -42.10584 -3.30840  -2.32811  1.000 33.05708  ? 151 ARG   A O    1 
ATOM   1184 C  CB   . ARG   A 1 151 ? -45.30020 -2.65092  -2.65503  1.000 31.21523  ? 151 ARG   A CB   1 
ATOM   1185 C  CG   . ARG   A 1 151 ? -46.50521 -2.86993  -3.56621  1.000 43.41323  ? 151 ARG   A CG   1 
ATOM   1186 C  CD   . ARG   A 1 151 ? -47.21750 -1.58284  -3.95905  1.000 42.97013  ? 151 ARG   A CD   1 
ATOM   1187 N  NE   . ARG   A 1 151 ? -47.04320 -0.51027  -2.98869  1.000 63.58371  ? 151 ARG   A NE   1 
ATOM   1188 C  CZ   . ARG   A 1 151 ? -47.94180 0.43754   -2.75678  1.000 75.36873  ? 151 ARG   A CZ   1 
ATOM   1189 N  NH1  . ARG   A 1 151 ? -49.10077 0.46423   -3.39712  1.000 64.54881  ? 151 ARG   A NH1  1 
ATOM   1190 N  NH2  . ARG   A 1 151 ? -47.67141 1.38251   -1.86062  1.000 63.86492  ? 151 ARG   A NH2  1 
ATOM   1191 N  N    . ILE   A 1 152 ? -43.21873 -3.69068  -0.40658  1.000 29.25938  ? 152 ILE   A N    1 
ATOM   1192 C  CA   . ILE   A 1 152 ? -42.02572 -3.49261  0.41625   1.000 31.80487  ? 152 ILE   A CA   1 
ATOM   1193 C  C    . ILE   A 1 152 ? -40.97344 -4.54127  0.08217   1.000 34.08715  ? 152 ILE   A C    1 
ATOM   1194 O  O    . ILE   A 1 152 ? -39.80117 -4.22111  -0.15128  1.000 32.34979  ? 152 ILE   A O    1 
ATOM   1195 C  CB   . ILE   A 1 152 ? -42.38702 -3.52763  1.91227   1.000 33.34508  ? 152 ILE   A CB   1 
ATOM   1196 C  CG1  . ILE   A 1 152 ? -43.23253 -2.30992  2.29317   1.000 28.22624  ? 152 ILE   A CG1  1 
ATOM   1197 C  CG2  . ILE   A 1 152 ? -41.12245 -3.59550  2.76515   1.000 29.02038  ? 152 ILE   A CG2  1 
ATOM   1198 C  CD1  . ILE   A 1 152 ? -43.69220 -2.33086  3.72891   1.000 26.52667  ? 152 ILE   A CD1  1 
ATOM   1199 N  N    . ALA   A 1 153 ? -41.38163 -5.81290  0.05039   1.000 29.57573  ? 153 ALA   A N    1 
ATOM   1200 C  CA   . ALA   A 1 153 ? -40.43156 -6.89343  -0.19591  1.000 35.19064  ? 153 ALA   A CA   1 
ATOM   1201 C  C    . ALA   A 1 153 ? -39.84083 -6.80642  -1.59730  1.000 36.52591  ? 153 ALA   A C    1 
ATOM   1202 O  O    . ALA   A 1 153 ? -38.63495 -7.00969  -1.78196  1.000 36.49729  ? 153 ALA   A O    1 
ATOM   1203 C  CB   . ALA   A 1 153 ? -41.10846 -8.24707  0.01942   1.000 24.76826  ? 153 ALA   A CB   1 
ATOM   1204 N  N    . ALA   A 1 154 ? -40.67270 -6.50534  -2.59655  1.000 34.48496  ? 154 ALA   A N    1 
ATOM   1205 C  CA   . ALA   A 1 154 ? -40.17014 -6.38114  -3.96056  1.000 40.87958  ? 154 ALA   A CA   1 
ATOM   1206 C  C    . ALA   A 1 154 ? -39.14395 -5.26022  -4.07020  1.000 40.78694  ? 154 ALA   A C    1 
ATOM   1207 O  O    . ALA   A 1 154 ? -38.13180 -5.40063  -4.76655  1.000 41.52711  ? 154 ALA   A O    1 
ATOM   1208 C  CB   . ALA   A 1 154 ? -41.33035 -6.14621  -4.92753  1.000 36.94001  ? 154 ALA   A CB   1 
ATOM   1209 N  N    . ARG   A 1 155 ? -39.38303 -4.14011  -3.38471  1.000 33.98294  ? 155 ARG   A N    1 
ATOM   1210 C  CA   . ARG   A 1 155 ? -38.42716 -3.03810  -3.42743  1.000 31.47444  ? 155 ARG   A CA   1 
ATOM   1211 C  C    . ARG   A 1 155 ? -37.15577 -3.38067  -2.65896  1.000 48.23413  ? 155 ARG   A C    1 
ATOM   1212 O  O    . ARG   A 1 155 ? -36.04554 -3.09228  -3.12238  1.000 42.87466  ? 155 ARG   A O    1 
ATOM   1213 C  CB   . ARG   A 1 155 ? -39.06627 -1.76483  -2.87218  1.000 40.48449  ? 155 ARG   A CB   1 
ATOM   1214 C  CG   . ARG   A 1 155 ? -38.07190 -0.66242  -2.52593  1.000 37.48648  ? 155 ARG   A CG   1 
ATOM   1215 C  CD   . ARG   A 1 155 ? -37.30784 -0.17920  -3.75320  1.000 50.36322  ? 155 ARG   A CD   1 
ATOM   1216 N  NE   . ARG   A 1 155 ? -37.82790 1.08579   -4.25630  1.000 74.14400  ? 155 ARG   A NE   1 
ATOM   1217 C  CZ   . ARG   A 1 155 ? -37.36540 2.27752   -3.90356  1.000 63.28941  ? 155 ARG   A CZ   1 
ATOM   1218 N  NH1  . ARG   A 1 155 ? -36.36175 2.40537   -3.04963  1.000 60.31765  ? 155 ARG   A NH1  1 
ATOM   1219 N  NH2  . ARG   A 1 155 ? -37.92555 3.36813   -4.41780  1.000 65.49360  ? 155 ARG   A NH2  1 
ATOM   1220 N  N    . MET   A 1 156 ? -37.29552 -3.99875  -1.48409  1.000 37.77285  ? 156 MET   A N    1 
ATOM   1221 C  CA   . MET   A 1 156 ? -36.11998 -4.34440  -0.69184  1.000 41.70473  ? 156 MET   A CA   1 
ATOM   1222 C  C    . MET   A 1 156 ? -35.24621 -5.37370  -1.39713  1.000 47.51803  ? 156 MET   A C    1 
ATOM   1223 O  O    . MET   A 1 156 ? -34.01884 -5.35535  -1.24369  1.000 49.93137  ? 156 MET   A O    1 
ATOM   1224 C  CB   . MET   A 1 156 ? -36.54802 -4.85944  0.67999   1.000 35.70902  ? 156 MET   A CB   1 
ATOM   1225 C  CG   . MET   A 1 156 ? -36.61350 -3.78412  1.74239   1.000 49.75892  ? 156 MET   A CG   1 
ATOM   1226 S  SD   . MET   A 1 156 ? -37.52019 -4.34025  3.19198   1.000 41.21124  ? 156 MET   A SD   1 
ATOM   1227 C  CE   . MET   A 1 156 ? -36.21649 -4.34740  4.42012   1.000 55.76325  ? 156 MET   A CE   1 
ATOM   1228 N  N    . ARG   A 1 157 ? -35.85270 -6.27496  -2.17249  1.000 41.41777  ? 157 ARG   A N    1 
ATOM   1229 C  CA   . ARG   A 1 157 ? -35.06174 -7.23407  -2.93611  1.000 44.26893  ? 157 ARG   A CA   1 
ATOM   1230 C  C    . ARG   A 1 157 ? -34.27581 -6.53894  -4.04046  1.000 48.11472  ? 157 ARG   A C    1 
ATOM   1231 O  O    . ARG   A 1 157 ? -33.09149 -6.83054  -4.24542  1.000 48.81262  ? 157 ARG   A O    1 
ATOM   1232 C  CB   . ARG   A 1 157 ? -35.96881 -8.31910  -3.51626  1.000 40.98954  ? 157 ARG   A CB   1 
ATOM   1233 C  CG   . ARG   A 1 157 ? -36.42933 -9.34800  -2.49545  1.000 34.68586  ? 157 ARG   A CG   1 
ATOM   1234 C  CD   . ARG   A 1 157 ? -37.05018 -10.55768 -3.17052  1.000 35.83045  ? 157 ARG   A CD   1 
ATOM   1235 N  NE   . ARG   A 1 157 ? -38.23017 -10.20366 -3.94939  1.000 45.33829  ? 157 ARG   A NE   1 
ATOM   1236 C  CZ   . ARG   A 1 157 ? -39.46492 -10.17407 -3.46612  1.000 50.65312  ? 157 ARG   A CZ   1 
ATOM   1237 N  NH1  . ARG   A 1 157 ? -39.71689 -10.45139 -2.19722  1.000 37.87052  ? 157 ARG   A NH1  1 
ATOM   1238 N  NH2  . ARG   A 1 157 ? -40.47197 -9.85586  -4.27588  1.000 41.08331  ? 157 ARG   A NH2  1 
ATOM   1239 N  N    . ALA   A 1 158 ? -34.91784 -5.61387  -4.75894  1.000 47.18251  ? 158 ALA   A N    1 
ATOM   1240 C  CA   . ALA   A 1 158 ? -34.21453 -4.84824  -5.78157  1.000 50.01801  ? 158 ALA   A CA   1 
ATOM   1241 C  C    . ALA   A 1 158 ? -33.12711 -3.96966  -5.17714  1.000 59.99719  ? 158 ALA   A C    1 
ATOM   1242 O  O    . ALA   A 1 158 ? -32.08055 -3.76476  -5.80183  1.000 62.41793  ? 158 ALA   A O    1 
ATOM   1243 C  CB   . ALA   A 1 158 ? -35.20415 -3.99630  -6.57504  1.000 45.10836  ? 158 ALA   A CB   1 
ATOM   1244 N  N    . ASP   A 1 159 ? -33.35573 -3.43861  -3.97342  1.000 54.59401  ? 159 ASP   A N    1 
ATOM   1245 C  CA   . ASP   A 1 159 ? -32.32589 -2.65045  -3.30500  1.000 45.06938  ? 159 ASP   A CA   1 
ATOM   1246 C  C    . ASP   A 1 159 ? -31.11326 -3.50780  -2.96738  1.000 52.97851  ? 159 ASP   A C    1 
ATOM   1247 O  O    . ASP   A 1 159 ? -29.97404 -3.03041  -3.00929  1.000 51.02107  ? 159 ASP   A O    1 
ATOM   1248 C  CB   . ASP   A 1 159 ? -32.89356 -2.01354  -2.03710  1.000 48.64608  ? 159 ASP   A CB   1 
ATOM   1249 C  CG   . ASP   A 1 159 ? -33.77116 -0.81088  -2.32502  1.000 54.22873  ? 159 ASP   A CG   1 
ATOM   1250 O  OD1  . ASP   A 1 159 ? -33.93490 -0.44778  -3.50972  1.000 53.93350  ? 159 ASP   A OD1  1 
ATOM   1251 O  OD2  . ASP   A 1 159 ? -34.30070 -0.22966  -1.35725  1.000 49.90116  ? 159 ASP   A OD2  1 
ATOM   1252 N  N    A SER   A 1 160 ? -31.34108 -4.77805  -2.62312  0.547 51.62814  ? 160 SER   A N    1 
ATOM   1253 N  N    B SER   A 1 160 ? -31.33581 -4.77895  -2.63112  0.453 51.65937  ? 160 SER   A N    1 
ATOM   1254 C  CA   A SER   A 1 160 ? -30.23581 -5.66567  -2.27988  0.547 57.09551  ? 160 SER   A CA   1 
ATOM   1255 C  CA   B SER   A 1 160 ? -30.22553 -5.65579  -2.28089  0.453 57.08904  ? 160 SER   A CA   1 
ATOM   1256 C  C    A SER   A 1 160 ? -29.47005 -6.11547  -3.51647  0.547 60.26016  ? 160 SER   A C    1 
ATOM   1257 C  C    B SER   A 1 160 ? -29.47737 -6.15171  -3.51038  0.453 60.24951  ? 160 SER   A C    1 
ATOM   1258 O  O    A SER   A 1 160 ? -28.25942 -6.35347  -3.44026  0.547 65.63152  ? 160 SER   A O    1 
ATOM   1259 O  O    B SER   A 1 160 ? -28.28326 -6.45735  -3.42043  0.453 65.59693  ? 160 SER   A O    1 
ATOM   1260 C  CB   A SER   A 1 160 ? -30.75758 -6.87804  -1.50815  0.547 54.49673  ? 160 SER   A CB   1 
ATOM   1261 C  CB   B SER   A 1 160 ? -30.73399 -6.83753  -1.45715  0.453 54.55174  ? 160 SER   A CB   1 
ATOM   1262 O  OG   A SER   A 1 160 ? -29.84215 -7.95661  -1.57291  0.547 51.36457  ? 160 SER   A OG   1 
ATOM   1263 O  OG   B SER   A 1 160 ? -31.14427 -6.40463  -0.17307  0.453 51.66212  ? 160 SER   A OG   1 
ATOM   1264 N  N    . LYS   A 1 161 ? -30.15085 -6.23868  -4.65761  1.000 61.40256  ? 161 LYS   A N    1 
ATOM   1265 C  CA   . LYS   A 1 161 ? -29.48663 -6.63202  -5.89317  1.000 68.63520  ? 161 LYS   A CA   1 
ATOM   1266 C  C    . LYS   A 1 161 ? -28.64463 -5.51120  -6.48893  1.000 74.11072  ? 161 LYS   A C    1 
ATOM   1267 O  O    . LYS   A 1 161 ? -27.84815 -5.77390  -7.39656  1.000 87.39646  ? 161 LYS   A O    1 
ATOM   1268 C  CB   . LYS   A 1 161 ? -30.51814 -7.10417  -6.92081  1.000 58.91875  ? 161 LYS   A CB   1 
ATOM   1269 N  N    . ALA   A 1 162 ? -28.79541 -4.28208  -6.00383  1.000 60.95157  ? 162 ALA   A N    1 
ATOM   1270 C  CA   . ALA   A 1 162 ? -28.01527 -3.15503  -6.50123  1.000 60.93185  ? 162 ALA   A CA   1 
ATOM   1271 C  C    . ALA   A 1 162 ? -26.88665 -2.80247  -5.53551  1.000 70.03662  ? 162 ALA   A C    1 
ATOM   1272 O  O    . ALA   A 1 162 ? -26.89057 -3.22266  -4.37707  1.000 65.39496  ? 162 ALA   A O    1 
ATOM   1273 N  N    . ILE   A 1 171 ? -22.31071 -13.90337 -1.43341  1.000 84.51798  ? 171 ILE   A N    1 
ATOM   1274 C  CA   . ILE   A 1 171 ? -22.54041 -14.23817 -0.03403  1.000 83.58174  ? 171 ILE   A CA   1 
ATOM   1275 C  C    . ILE   A 1 171 ? -21.21019 -14.36125 0.69916   1.000 88.65892  ? 171 ILE   A C    1 
ATOM   1276 O  O    . ILE   A 1 171 ? -20.31733 -15.09086 0.26490   1.000 89.80761  ? 171 ILE   A O    1 
ATOM   1277 C  CB   . ILE   A 1 171 ? -23.36279 -15.53437 0.10337   1.000 82.86932  ? 171 ILE   A CB   1 
ATOM   1278 C  CG1  . ILE   A 1 171 ? -24.69529 -15.40520 -0.63790  1.000 65.63079  ? 171 ILE   A CG1  1 
ATOM   1279 C  CG2  . ILE   A 1 171 ? -23.59621 -15.86670 1.57006   1.000 71.34562  ? 171 ILE   A CG2  1 
ATOM   1280 C  CD1  . ILE   A 1 171 ? -25.38345 -16.72768 -0.88600  1.000 45.88706  ? 171 ILE   A CD1  1 
ATOM   1281 N  N    . MET   A 1 172 ? -21.08216 -13.64127 1.81124   1.000 87.00908  ? 172 MET   A N    1 
ATOM   1282 C  CA   . MET   A 1 172 ? -19.86266 -13.70232 2.60436   1.000 81.77707  ? 172 MET   A CA   1 
ATOM   1283 C  C    . MET   A 1 172 ? -19.75133 -15.04817 3.30993   1.000 82.26929  ? 172 MET   A C    1 
ATOM   1284 O  O    . MET   A 1 172 ? -20.74633 -15.60589 3.78244   1.000 78.69521  ? 172 MET   A O    1 
ATOM   1285 C  CB   . MET   A 1 172 ? -19.83417 -12.56867 3.62879   1.000 76.91825  ? 172 MET   A CB   1 
ATOM   1286 C  CG   . MET   A 1 172 ? -18.45198 -12.28128 4.19271   1.000 83.63225  ? 172 MET   A CG   1 
ATOM   1287 S  SD   . MET   A 1 172 ? -18.08111 -10.51870 4.26872   1.000 103.16510 ? 172 MET   A SD   1 
ATOM   1288 C  CE   . MET   A 1 172 ? -16.30232 -10.55441 4.46737   1.000 76.98985  ? 172 MET   A CE   1 
ATOM   1289 N  N    . ASP   A 1 173 ? -18.52831 -15.56862 3.38029   1.000 84.60107  ? 173 ASP   A N    1 
ATOM   1290 C  CA   . ASP   A 1 173 ? -18.28728 -16.85768 4.00570   1.000 68.07976  ? 173 ASP   A CA   1 
ATOM   1291 C  C    . ASP   A 1 173 ? -18.27503 -16.71160 5.52685   1.000 64.43482  ? 173 ASP   A C    1 
ATOM   1292 O  O    . ASP   A 1 173 ? -18.37100 -15.61070 6.07865   1.000 71.29157  ? 173 ASP   A O    1 
ATOM   1293 C  CB   . ASP   A 1 173 ? -16.98215 -17.45924 3.49089   1.000 70.85708  ? 173 ASP   A CB   1 
ATOM   1294 C  CG   . ASP   A 1 173 ? -17.01366 -18.97653 3.45584   1.000 70.84403  ? 173 ASP   A CG   1 
ATOM   1295 O  OD1  . ASP   A 1 173 ? -17.91911 -19.57318 4.07856   1.000 50.12447  ? 173 ASP   A OD1  1 
ATOM   1296 O  OD2  . ASP   A 1 173 ? -16.13559 -19.57267 2.79799   1.000 77.60890  ? 173 ASP   A OD2  1 
ATOM   1297 N  N    . VAL   A 1 174 ? -18.14999 -17.84414 6.21515   1.000 52.55108  ? 174 VAL   A N    1 
ATOM   1298 C  CA   . VAL   A 1 174 ? -18.25363 -17.85701 7.66763   1.000 43.70421  ? 174 VAL   A CA   1 
ATOM   1299 C  C    . VAL   A 1 174 ? -16.94031 -17.39905 8.29388   1.000 48.71424  ? 174 VAL   A C    1 
ATOM   1300 O  O    . VAL   A 1 174 ? -15.87055 -17.44397 7.68079   1.000 43.12874  ? 174 VAL   A O    1 
ATOM   1301 C  CB   . VAL   A 1 174 ? -18.65210 -19.25352 8.17596   1.000 43.01950  ? 174 VAL   A CB   1 
ATOM   1302 C  CG1  . VAL   A 1 174 ? -19.91835 -19.72997 7.47896   1.000 42.47180  ? 174 VAL   A CG1  1 
ATOM   1303 C  CG2  . VAL   A 1 174 ? -17.50887 -20.23583 7.96609   1.000 46.59315  ? 174 VAL   A CG2  1 
ATOM   1304 N  N    . ASN   A 1 175 ? -17.03420 -16.95474 9.54633   1.000 48.61226  ? 175 ASN   A N    1 
ATOM   1305 C  CA   . ASN   A 1 175 ? -15.87941 -16.59246 10.35800  1.000 44.08098  ? 175 ASN   A CA   1 
ATOM   1306 C  C    . ASN   A 1 175 ? -15.34025 -17.82890 11.06579  1.000 52.33344  ? 175 ASN   A C    1 
ATOM   1307 O  O    . ASN   A 1 175 ? -16.09307 -18.49743 11.78454  1.000 42.21051  ? 175 ASN   A O    1 
ATOM   1308 C  CB   . ASN   A 1 175 ? -16.24885 -15.53631 11.38748  1.000 43.89281  ? 175 ASN   A CB   1 
ATOM   1309 C  CG   . ASN   A 1 175 ? -15.04003 -14.98552 12.11183  1.000 59.82367  ? 175 ASN   A CG   1 
ATOM   1310 O  OD1  . ASN   A 1 175 ? -14.74040 -15.39235 13.23341  1.000 51.50071  ? 175 ASN   A OD1  1 
ATOM   1311 N  ND2  . ASN   A 1 175 ? -14.34582 -14.04327 11.48056  1.000 62.61686  ? 175 ASN   A ND2  1 
ATOM   1312 N  N    . PRO   A 1 176 ? -14.05374 -18.15124 10.89770  1.000 51.18510  ? 176 PRO   A N    1 
ATOM   1313 C  CA   . PRO   A 1 176 ? -13.53134 -19.40315 11.47520  1.000 48.09401  ? 176 PRO   A CA   1 
ATOM   1314 C  C    . PRO   A 1 176 ? -13.67453 -19.49133 12.98478  1.000 44.91179  ? 176 PRO   A C    1 
ATOM   1315 O  O    . PRO   A 1 176 ? -13.93385 -20.57968 13.51229  1.000 42.16217  ? 176 PRO   A O    1 
ATOM   1316 C  CB   . PRO   A 1 176 ? -12.05727 -19.39016 11.04538  1.000 49.18147  ? 176 PRO   A CB   1 
ATOM   1317 C  CG   . PRO   A 1 176 ? -12.03009 -18.53215 9.82070   1.000 55.46461  ? 176 PRO   A CG   1 
ATOM   1318 C  CD   . PRO   A 1 176 ? -13.05064 -17.45938 10.07139  1.000 53.20194  ? 176 PRO   A CD   1 
ATOM   1319 N  N    . GLN   A 1 177 ? -13.51651 -18.37597 13.70015  1.000 43.01136  ? 177 GLN   A N    1 
ATOM   1320 C  CA   . GLN   A 1 177 ? -13.62112 -18.42310 15.15437  1.000 47.01652  ? 177 GLN   A CA   1 
ATOM   1321 C  C    . GLN   A 1 177 ? -15.06772 -18.56786 15.61106  1.000 54.31070  ? 177 GLN   A C    1 
ATOM   1322 O  O    . GLN   A 1 177 ? -15.32702 -19.18300 16.65278  1.000 49.10264  ? 177 GLN   A O    1 
ATOM   1323 C  CB   . GLN   A 1 177 ? -12.98515 -17.17632 15.76964  1.000 51.40574  ? 177 GLN   A CB   1 
ATOM   1324 C  CG   . GLN   A 1 177 ? -12.91501 -17.20733 17.28812  1.000 63.50565  ? 177 GLN   A CG   1 
ATOM   1325 C  CD   . GLN   A 1 177 ? -12.21225 -18.44477 17.81801  1.000 74.58495  ? 177 GLN   A CD   1 
ATOM   1326 O  OE1  . GLN   A 1 177 ? -11.12816 -18.80467 17.35686  1.000 72.76464  ? 177 GLN   A OE1  1 
ATOM   1327 N  NE2  . GLN   A 1 177 ? -12.83269 -19.10669 18.78863  1.000 75.06126  ? 177 GLN   A NE2  1 
ATOM   1328 N  N    . ALA   A 1 178 ? -16.01953 -18.01553 14.85265  1.000 42.82757  ? 178 ALA   A N    1 
ATOM   1329 C  CA   . ALA   A 1 178 ? -17.42802 -18.20944 15.18600  1.000 53.46767  ? 178 ALA   A CA   1 
ATOM   1330 C  C    . ALA   A 1 178 ? -17.81699 -19.67841 15.08238  1.000 35.86049  ? 178 ALA   A C    1 
ATOM   1331 O  O    . ALA   A 1 178 ? -18.60715 -20.17850 15.89176  1.000 41.55083  ? 178 ALA   A O    1 
ATOM   1332 C  CB   . ALA   A 1 178 ? -18.31143 -17.35614 14.27653  1.000 43.14493  ? 178 ALA   A CB   1 
ATOM   1333 N  N    . VAL   A 1 179 ? -17.26607 -20.38489 14.09206  1.000 44.24397  ? 179 VAL   A N    1 
ATOM   1334 C  CA   . VAL   A 1 179 ? -17.50046 -21.82213 13.96939  1.000 42.07778  ? 179 VAL   A CA   1 
ATOM   1335 C  C    . VAL   A 1 179 ? -17.00873 -22.54590 15.21558  1.000 45.48818  ? 179 VAL   A C    1 
ATOM   1336 O  O    . VAL   A 1 179 ? -17.74046 -23.33298 15.82845  1.000 40.10786  ? 179 VAL   A O    1 
ATOM   1337 C  CB   . VAL   A 1 179 ? -16.82399 -22.36913 12.69889  1.000 45.47471  ? 179 VAL   A CB   1 
ATOM   1338 C  CG1  . VAL   A 1 179 ? -16.86983 -23.89468 12.68099  1.000 34.33620  ? 179 VAL   A CG1  1 
ATOM   1339 C  CG2  . VAL   A 1 179 ? -17.48590 -21.79564 11.45443  1.000 37.40984  ? 179 VAL   A CG2  1 
ATOM   1340 N  N    . VAL   A 1 180 ? -15.75860 -22.28674 15.60865  1.000 41.22229  ? 180 VAL   A N    1 
ATOM   1341 C  CA   . VAL   A 1 180 ? -15.19872 -22.92672 16.79565  1.000 41.39429  ? 180 VAL   A CA   1 
ATOM   1342 C  C    . VAL   A 1 180 ? -16.02863 -22.58760 18.02708  1.000 46.64936  ? 180 VAL   A C    1 
ATOM   1343 O  O    . VAL   A 1 180 ? -16.35465 -23.46715 18.83420  1.000 43.02902  ? 180 VAL   A O    1 
ATOM   1344 C  CB   . VAL   A 1 180 ? -13.72386 -22.52014 16.97720  1.000 52.98740  ? 180 VAL   A CB   1 
ATOM   1345 C  CG1  . VAL   A 1 180 ? -13.17049 -23.08194 18.27841  1.000 48.18648  ? 180 VAL   A CG1  1 
ATOM   1346 C  CG2  . VAL   A 1 180 ? -12.89074 -22.98771 15.79138  1.000 42.59229  ? 180 VAL   A CG2  1 
ATOM   1347 N  N    . ASP   A 1 181 ? -16.39412 -21.31142 18.18359  1.000 39.93795  ? 181 ASP   A N    1 
ATOM   1348 C  CA   . ASP   A 1 181 ? -17.17199 -20.90101 19.34945  1.000 51.57951  ? 181 ASP   A CA   1 
ATOM   1349 C  C    . ASP   A 1 181 ? -18.50669 -21.63174 19.40765  1.000 42.09883  ? 181 ASP   A C    1 
ATOM   1350 O  O    . ASP   A 1 181 ? -18.93040 -22.08060 20.47878  1.000 46.15118  ? 181 ASP   A O    1 
ATOM   1351 C  CB   . ASP   A 1 181 ? -17.39599 -19.38840 19.33140  1.000 42.12585  ? 181 ASP   A CB   1 
ATOM   1352 C  CG   . ASP   A 1 181 ? -16.15046 -18.60760 19.70585  1.000 61.06745  ? 181 ASP   A CG   1 
ATOM   1353 O  OD1  . ASP   A 1 181 ? -15.23746 -19.19076 20.33048  1.000 59.59967  ? 181 ASP   A OD1  1 
ATOM   1354 O  OD2  . ASP   A 1 181 ? -16.09154 -17.40270 19.38423  1.000 73.49761  ? 181 ASP   A OD2  1 
ATOM   1355 N  N    . ALA   A 1 182 ? -19.17952 -21.76863 18.26329  1.000 40.10178  ? 182 ALA   A N    1 
ATOM   1356 C  CA   . ALA   A 1 182 ? -20.47538 -22.44007 18.24355  1.000 44.61641  ? 182 ALA   A CA   1 
ATOM   1357 C  C    . ALA   A 1 182 ? -20.33851 -23.92564 18.55557  1.000 48.44227  ? 182 ALA   A C    1 
ATOM   1358 O  O    . ALA   A 1 182 ? -21.13771 -24.48126 19.31840  1.000 43.43939  ? 182 ALA   A O    1 
ATOM   1359 C  CB   . ALA   A 1 182 ? -21.14966 -22.23604 16.88844  1.000 42.40565  ? 182 ALA   A CB   1 
ATOM   1360 N  N    . MET   A 1 183 ? -19.32960 -24.58547 17.98071  1.000 41.80898  ? 183 MET   A N    1 
ATOM   1361 C  CA   . MET   A 1 183 ? -19.14430 -26.01188 18.21876  1.000 37.97122  ? 183 MET   A CA   1 
ATOM   1362 C  C    . MET   A 1 183 ? -18.64725 -26.30331 19.62699  1.000 44.46662  ? 183 MET   A C    1 
ATOM   1363 O  O    . MET   A 1 183 ? -18.87098 -27.40827 20.13321  1.000 44.83327  ? 183 MET   A O    1 
ATOM   1364 C  CB   . MET   A 1 183 ? -18.17864 -26.59476 17.18584  1.000 39.43509  ? 183 MET   A CB   1 
ATOM   1365 C  CG   . MET   A 1 183 ? -18.63215 -26.39592 15.74884  1.000 36.16822  ? 183 MET   A CG   1 
ATOM   1366 S  SD   . MET   A 1 183 ? -17.63329 -27.31144 14.56249  1.000 34.17084  ? 183 MET   A SD   1 
ATOM   1367 C  CE   . MET   A 1 183 ? -18.17149 -28.98874 14.88663  1.000 33.62479  ? 183 MET   A CE   1 
ATOM   1368 N  N    . GLU   A 1 184 ? -17.98031 -25.34593 20.26934  1.000 43.59804  ? 184 GLU   A N    1 
ATOM   1369 C  CA   . GLU   A 1 184 ? -17.56979 -25.52439 21.65516  1.000 52.97230  ? 184 GLU   A CA   1 
ATOM   1370 C  C    . GLU   A 1 184 ? -18.65143 -25.09730 22.63693  1.000 46.60072  ? 184 GLU   A C    1 
ATOM   1371 O  O    . GLU   A 1 184 ? -18.73374 -25.65608 23.73689  1.000 54.78979  ? 184 GLU   A O    1 
ATOM   1372 C  CB   . GLU   A 1 184 ? -16.27051 -24.75756 21.92504  1.000 54.61478  ? 184 GLU   A CB   1 
ATOM   1373 C  CG   . GLU   A 1 184 ? -15.09355 -25.26009 21.09434  1.000 53.90135  ? 184 GLU   A CG   1 
ATOM   1374 C  CD   . GLU   A 1 184 ? -13.74838 -24.79922 21.62255  1.000 61.58340  ? 184 GLU   A CD   1 
ATOM   1375 O  OE1  . GLU   A 1 184 ? -13.69874 -23.75251 22.30317  1.000 61.65729  ? 184 GLU   A OE1  1 
ATOM   1376 O  OE2  . GLU   A 1 184 ? -12.73922 -25.48607 21.35075  1.000 54.09396  ? 184 GLU   A OE2  1 
ATOM   1377 N  N    . ARG   A 1 185 ? -19.48943 -24.12820 22.26038  1.000 49.18620  ? 185 ARG   A N    1 
ATOM   1378 C  CA   . ARG   A 1 185 ? -20.64525 -23.79040 23.08482  1.000 47.85322  ? 185 ARG   A CA   1 
ATOM   1379 C  C    . ARG   A 1 185 ? -21.57261 -24.98840 23.24069  1.000 57.54486  ? 185 ARG   A C    1 
ATOM   1380 O  O    . ARG   A 1 185 ? -22.13290 -25.21597 24.31942  1.000 57.56290  ? 185 ARG   A O    1 
ATOM   1381 C  CB   . ARG   A 1 185 ? -21.40062 -22.61202 22.47202  1.000 57.23742  ? 185 ARG   A CB   1 
ATOM   1382 C  CG   . ARG   A 1 185 ? -20.93646 -21.24549 22.94777  1.000 66.07691  ? 185 ARG   A CG   1 
ATOM   1383 C  CD   . ARG   A 1 185 ? -21.92856 -20.16698 22.54468  1.000 56.07134  ? 185 ARG   A CD   1 
ATOM   1384 N  NE   . ARG   A 1 185 ? -22.07396 -20.06959 21.09657  1.000 57.81720  ? 185 ARG   A NE   1 
ATOM   1385 C  CZ   . ARG   A 1 185 ? -23.16104 -20.43094 20.42813  1.000 50.64144  ? 185 ARG   A CZ   1 
ATOM   1386 N  NH1  . ARG   A 1 185 ? -24.21497 -20.93824 21.04612  1.000 42.35491  ? 185 ARG   A NH1  1 
ATOM   1387 N  NH2  . ARG   A 1 185 ? -23.19064 -20.28155 19.10656  1.000 45.40924  ? 185 ARG   A NH2  1 
ATOM   1388 N  N    . HIS   A 1 186 ? -21.74176 -25.76774 22.17292  1.000 43.27651  ? 186 HIS   A N    1 
ATOM   1389 C  CA   . HIS   A 1 186 ? -22.58660 -26.95227 22.18542  1.000 41.68383  ? 186 HIS   A CA   1 
ATOM   1390 C  C    . HIS   A 1 186 ? -21.80611 -28.24063 22.41568  1.000 50.46470  ? 186 HIS   A C    1 
ATOM   1391 O  O    . HIS   A 1 186 ? -22.42334 -29.30370 22.53917  1.000 46.65252  ? 186 HIS   A O    1 
ATOM   1392 C  CB   . HIS   A 1 186 ? -23.36342 -27.05131 20.86657  1.000 43.62129  ? 186 HIS   A CB   1 
ATOM   1393 C  CG   . HIS   A 1 186 ? -24.31896 -25.92016 20.64363  1.000 45.59486  ? 186 HIS   A CG   1 
ATOM   1394 N  ND1  . HIS   A 1 186 ? -25.65846 -26.00617 20.95406  1.000 35.70970  ? 186 HIS   A ND1  1 
ATOM   1395 C  CD2  . HIS   A 1 186 ? -24.12661 -24.67368 20.14994  1.000 48.43911  ? 186 HIS   A CD2  1 
ATOM   1396 C  CE1  . HIS   A 1 186 ? -26.25198 -24.86406 20.65597  1.000 48.71521  ? 186 HIS   A CE1  1 
ATOM   1397 N  NE2  . HIS   A 1 186 ? -25.34449 -24.03829 20.16694  1.000 49.69640  ? 186 HIS   A NE2  1 
ATOM   1398 N  N    . HIS   A 1 187 ? -20.47424 -28.16847 22.47441  1.000 50.80543  ? 187 HIS   A N    1 
ATOM   1399 C  CA   . HIS   A 1 187 ? -19.61672 -29.32739 22.73295  1.000 52.68003  ? 187 HIS   A CA   1 
ATOM   1400 C  C    . HIS   A 1 187 ? -19.88060 -30.45112 21.73134  1.000 45.76384  ? 187 HIS   A C    1 
ATOM   1401 O  O    . HIS   A 1 187 ? -20.14746 -31.59636 22.10042  1.000 51.43567  ? 187 HIS   A O    1 
ATOM   1402 C  CB   . HIS   A 1 187 ? -19.78062 -29.82472 24.17195  1.000 55.72467  ? 187 HIS   A CB   1 
ATOM   1403 C  CG   . HIS   A 1 187 ? -18.63387 -30.65721 24.65685  1.000 78.41779  ? 187 HIS   A CG   1 
ATOM   1404 N  ND1  . HIS   A 1 187 ? -17.38471 -30.13056 24.90859  1.000 80.31726  ? 187 HIS   A ND1  1 
ATOM   1405 C  CD2  . HIS   A 1 187 ? -18.54569 -31.98047 24.93140  1.000 71.73592  ? 187 HIS   A CD2  1 
ATOM   1406 C  CE1  . HIS   A 1 187 ? -16.57733 -31.09234 25.31910  1.000 73.23307  ? 187 HIS   A CE1  1 
ATOM   1407 N  NE2  . HIS   A 1 187 ? -17.25713 -32.22458 25.34191  1.000 68.39216  ? 187 HIS   A NE2  1 
ATOM   1408 N  N    . VAL   A 1 188 ? -19.80026 -30.11306 20.44631  1.000 46.19566  ? 188 VAL   A N    1 
ATOM   1409 C  CA   . VAL   A 1 188 ? -20.01319 -31.07493 19.37499  1.000 42.37822  ? 188 VAL   A CA   1 
ATOM   1410 C  C    . VAL   A 1 188 ? -18.76268 -31.13940 18.50767  1.000 50.77281  ? 188 VAL   A C    1 
ATOM   1411 O  O    . VAL   A 1 188 ? -17.92772 -30.22962 18.49735  1.000 36.80046  ? 188 VAL   A O    1 
ATOM   1412 C  CB   . VAL   A 1 188 ? -21.24864 -30.73009 18.51715  1.000 40.37642  ? 188 VAL   A CB   1 
ATOM   1413 C  CG1  . VAL   A 1 188 ? -22.52031 -30.87200 19.33622  1.000 41.13035  ? 188 VAL   A CG1  1 
ATOM   1414 C  CG2  . VAL   A 1 188 ? -21.12614 -29.32330 17.95743  1.000 33.53101  ? 188 VAL   A CG2  1 
ATOM   1415 N  N    . GLN   A 1 189 ? -18.63930 -32.24633 17.77824  1.000 37.91680  ? 189 GLN   A N    1 
ATOM   1416 C  CA   . GLN   A 1 189 ? -17.59433 -32.41635 16.78005  1.000 44.18548  ? 189 GLN   A CA   1 
ATOM   1417 C  C    . GLN   A 1 189 ? -18.13837 -32.37599 15.36019  1.000 34.69545  ? 189 GLN   A C    1 
ATOM   1418 O  O    . GLN   A 1 189 ? -17.36240 -32.50750 14.40831  1.000 33.83852  ? 189 GLN   A O    1 
ATOM   1419 C  CB   . GLN   A 1 189 ? -16.84145 -33.73572 17.00873  1.000 37.99588  ? 189 GLN   A CB   1 
ATOM   1420 C  CG   . GLN   A 1 189 ? -16.34568 -33.94830 18.43418  1.000 37.12452  ? 189 GLN   A CG   1 
ATOM   1421 C  CD   . GLN   A 1 189 ? -15.57728 -32.75512 18.97426  1.000 46.37326  ? 189 GLN   A CD   1 
ATOM   1422 O  OE1  . GLN   A 1 189 ? -15.89810 -32.22687 20.03904  1.000 45.88216  ? 189 GLN   A OE1  1 
ATOM   1423 N  NE2  . GLN   A 1 189 ? -14.55624 -32.32493 18.24029  1.000 41.10749  ? 189 GLN   A NE2  1 
ATOM   1424 N  N    . TRP   A 1 190 ? -19.44733 -32.19932 15.19254  1.000 34.69462  ? 190 TRP   A N    1 
ATOM   1425 C  CA   . TRP   A 1 190 ? -20.07703 -32.15911 13.88209  1.000 33.04599  ? 190 TRP   A CA   1 
ATOM   1426 C  C    . TRP   A 1 190 ? -21.01273 -30.96366 13.80147  1.000 33.91701  ? 190 TRP   A C    1 
ATOM   1427 O  O    . TRP   A 1 190 ? -21.73081 -30.65777 14.75827  1.000 36.59897  ? 190 TRP   A O    1 
ATOM   1428 C  CB   . TRP   A 1 190 ? -20.85221 -33.44999 13.59872  1.000 35.72647  ? 190 TRP   A CB   1 
ATOM   1429 C  CG   . TRP   A 1 190 ? -19.96316 -34.59274 13.24485  1.000 35.35109  ? 190 TRP   A CG   1 
ATOM   1430 C  CD1  . TRP   A 1 190 ? -19.45101 -35.52621 14.09764  1.000 32.66659  ? 190 TRP   A CD1  1 
ATOM   1431 C  CD2  . TRP   A 1 190 ? -19.46853 -34.92313 11.94233  1.000 30.71320  ? 190 TRP   A CD2  1 
ATOM   1432 N  NE1  . TRP   A 1 190 ? -18.66813 -36.42004 13.40612  1.000 30.93250  ? 190 TRP   A NE1  1 
ATOM   1433 C  CE2  . TRP   A 1 190 ? -18.66242 -36.07099 12.08086  1.000 37.53943  ? 190 TRP   A CE2  1 
ATOM   1434 C  CE3  . TRP   A 1 190 ? -19.62763 -34.35949 10.67284  1.000 36.79907  ? 190 TRP   A CE3  1 
ATOM   1435 C  CZ2  . TRP   A 1 190 ? -18.01835 -36.66590 10.99802  1.000 41.72444  ? 190 TRP   A CZ2  1 
ATOM   1436 C  CZ3  . TRP   A 1 190 ? -18.98802 -34.95379 9.59799   1.000 33.27340  ? 190 TRP   A CZ3  1 
ATOM   1437 C  CH2  . TRP   A 1 190 ? -18.19376 -36.09419 9.76823   1.000 36.40071  ? 190 TRP   A CH2  1 
ATOM   1438 N  N    . LEU   A 1 191 ? -21.00195 -30.29489 12.65157  1.000 35.43042  ? 191 LEU   A N    1 
ATOM   1439 C  CA   . LEU   A 1 191 ? -21.86012 -29.14488 12.40266  1.000 31.64431  ? 191 LEU   A CA   1 
ATOM   1440 C  C    . LEU   A 1 191 ? -22.33846 -29.19563 10.96101  1.000 32.53787  ? 191 LEU   A C    1 
ATOM   1441 O  O    . LEU   A 1 191 ? -21.53874 -29.41445 10.04598  1.000 27.22635  ? 191 LEU   A O    1 
ATOM   1442 C  CB   . LEU   A 1 191 ? -21.11710 -27.82871 12.68099  1.000 33.08113  ? 191 LEU   A CB   1 
ATOM   1443 C  CG   . LEU   A 1 191 ? -21.63580 -26.53847 12.03552  1.000 35.38036  ? 191 LEU   A CG   1 
ATOM   1444 C  CD1  . LEU   A 1 191 ? -23.00838 -26.11935 12.57865  1.000 27.32311  ? 191 LEU   A CD1  1 
ATOM   1445 C  CD2  . LEU   A 1 191 ? -20.61626 -25.42286 12.22608  1.000 29.00161  ? 191 LEU   A CD2  1 
ATOM   1446 N  N    . ILE   A 1 192 ? -23.64249 -29.01858 10.76530  1.000 29.44338  ? 192 ILE   A N    1 
ATOM   1447 C  CA   . ILE   A 1 192 ? -24.24696 -28.95238 9.44094   1.000 30.88303  ? 192 ILE   A CA   1 
ATOM   1448 C  C    . ILE   A 1 192 ? -24.94863 -27.60913 9.31210   1.000 34.07329  ? 192 ILE   A C    1 
ATOM   1449 O  O    . ILE   A 1 192 ? -25.71153 -27.21588 10.20219  1.000 30.55661  ? 192 ILE   A O    1 
ATOM   1450 C  CB   . ILE   A 1 192 ? -25.24078 -30.10447 9.20336   1.000 28.81487  ? 192 ILE   A CB   1 
ATOM   1451 C  CG1  . ILE   A 1 192 ? -24.56678 -31.45798 9.43043   1.000 29.66774  ? 192 ILE   A CG1  1 
ATOM   1452 C  CG2  . ILE   A 1 192 ? -25.82071 -30.02520 7.80068   1.000 25.24163  ? 192 ILE   A CG2  1 
ATOM   1453 C  CD1  . ILE   A 1 192 ? -25.54612 -32.61488 9.47134   1.000 29.69201  ? 192 ILE   A CD1  1 
ATOM   1454 N  N    . HIS   A 1 193 ? -24.69108 -26.90730 8.21192   1.000 22.17469  ? 193 HIS   A N    1 
ATOM   1455 C  CA   . HIS   A 1 193 ? -25.36048 -25.64353 7.94816   1.000 27.31654  ? 193 HIS   A CA   1 
ATOM   1456 C  C    . HIS   A 1 193 ? -25.41140 -25.42083 6.44361   1.000 23.65596  ? 193 HIS   A C    1 
ATOM   1457 O  O    . HIS   A 1 193 ? -24.89752 -26.22123 5.65635   1.000 24.44794  ? 193 HIS   A O    1 
ATOM   1458 C  CB   . HIS   A 1 193 ? -24.67114 -24.48586 8.68478   1.000 25.29050  ? 193 HIS   A CB   1 
ATOM   1459 C  CG   . HIS   A 1 193 ? -23.33788 -24.09787 8.11760   1.000 25.61997  ? 193 HIS   A CG   1 
ATOM   1460 N  ND1  . HIS   A 1 193 ? -23.20272 -23.27444 7.01991   1.000 30.14041  ? 193 HIS   A ND1  1 
ATOM   1461 C  CD2  . HIS   A 1 193 ? -22.07886 -24.39281 8.52129   1.000 29.33817  ? 193 HIS   A CD2  1 
ATOM   1462 C  CE1  . HIS   A 1 193 ? -21.91936 -23.09145 6.76271   1.000 28.33613  ? 193 HIS   A CE1  1 
ATOM   1463 N  NE2  . HIS   A 1 193 ? -21.21601 -23.75926 7.65923   1.000 30.55409  ? 193 HIS   A NE2  1 
ATOM   1464 N  N    . GLY   A 1 194 ? -26.06424 -24.33215 6.05029   1.000 27.98811  ? 194 GLY   A N    1 
ATOM   1465 C  CA   . GLY   A 1 194 ? -26.13043 -23.93538 4.66002   1.000 27.51233  ? 194 GLY   A CA   1 
ATOM   1466 C  C    . GLY   A 1 194 ? -25.74029 -22.48324 4.48346   1.000 32.51898  ? 194 GLY   A C    1 
ATOM   1467 O  O    . GLY   A 1 194 ? -24.65398 -22.07377 4.90670   1.000 30.44605  ? 194 GLY   A O    1 
ATOM   1468 N  N    . HIS   A 1 195 ? -26.62710 -21.70691 3.85226   1.000 36.70228  ? 195 HIS   A N    1 
ATOM   1469 C  CA   . HIS   A 1 195 ? -26.50517 -20.26090 3.66540   1.000 34.93097  ? 195 HIS   A CA   1 
ATOM   1470 C  C    . HIS   A 1 195 ? -25.39017 -19.85260 2.70590   1.000 32.43953  ? 195 HIS   A C    1 
ATOM   1471 O  O    . HIS   A 1 195 ? -25.61417 -19.02990 1.81250   1.000 33.51637  ? 195 HIS   A O    1 
ATOM   1472 C  CB   . HIS   A 1 195 ? -26.29591 -19.54268 5.00233   1.000 28.27418  ? 195 HIS   A CB   1 
ATOM   1473 C  CG   . HIS   A 1 195 ? -26.18564 -18.05521 4.86511   1.000 33.86203  ? 195 HIS   A CG   1 
ATOM   1474 N  ND1  . HIS   A 1 195 ? -27.23858 -17.27042 4.44720   1.000 27.19091  ? 195 HIS   A ND1  1 
ATOM   1475 C  CD2  . HIS   A 1 195 ? -25.14627 -17.21136 5.07031   1.000 37.56446  ? 195 HIS   A CD2  1 
ATOM   1476 C  CE1  . HIS   A 1 195 ? -26.85600 -16.00673 4.40834   1.000 37.92439  ? 195 HIS   A CE1  1 
ATOM   1477 N  NE2  . HIS   A 1 195 ? -25.59081 -15.94326 4.78266   1.000 34.78594  ? 195 HIS   A NE2  1 
ATOM   1478 N  N    . THR   A 1 196 ? -24.18576 -20.39530 2.88258   1.000 30.55031  ? 196 THR   A N    1 
ATOM   1479 C  CA   . THR   A 1 196 ? -23.04611 -19.94367 2.09162   1.000 37.43798  ? 196 THR   A CA   1 
ATOM   1480 C  C    . THR   A 1 196 ? -23.03515 -20.49311 0.67047   1.000 43.88801  ? 196 THR   A C    1 
ATOM   1481 O  O    . THR   A 1 196 ? -22.26662 -19.99066 -0.15652  1.000 33.16072  ? 196 THR   A O    1 
ATOM   1482 C  CB   . THR   A 1 196 ? -21.73939 -20.31481 2.79176   1.000 39.37421  ? 196 THR   A CB   1 
ATOM   1483 O  OG1  . THR   A 1 196 ? -21.62857 -21.74138 2.87268   1.000 44.00638  ? 196 THR   A OG1  1 
ATOM   1484 C  CG2  . THR   A 1 196 ? -21.70288 -19.71843 4.18961   1.000 41.13943  ? 196 THR   A CG2  1 
ATOM   1485 N  N    . HIS   A 1 197 ? -23.85636 -21.50194 0.36819   1.000 38.94607  ? 197 HIS   A N    1 
ATOM   1486 C  CA   . HIS   A 1 197 ? -23.94285 -22.07732 -0.97574  1.000 34.36540  ? 197 HIS   A CA   1 
ATOM   1487 C  C    . HIS   A 1 197 ? -22.59541 -22.62550 -1.44921  1.000 37.27032  ? 197 HIS   A C    1 
ATOM   1488 O  O    . HIS   A 1 197 ? -22.31075 -22.65273 -2.64974  1.000 35.77957  ? 197 HIS   A O    1 
ATOM   1489 C  CB   . HIS   A 1 197 ? -24.48731 -21.05907 -1.98578  1.000 30.57732  ? 197 HIS   A CB   1 
ATOM   1490 C  CG   . HIS   A 1 197 ? -25.85701 -20.54460 -1.65941  1.000 38.48206  ? 197 HIS   A CG   1 
ATOM   1491 N  ND1  . HIS   A 1 197 ? -26.54638 -19.69111 -2.49444  1.000 47.17420  ? 197 HIS   A ND1  1 
ATOM   1492 C  CD2  . HIS   A 1 197 ? -26.66967 -20.76941 -0.59900  1.000 30.00074  ? 197 HIS   A CD2  1 
ATOM   1493 C  CE1  . HIS   A 1 197 ? -27.72017 -19.40557 -1.95904  1.000 34.57729  ? 197 HIS   A CE1  1 
ATOM   1494 N  NE2  . HIS   A 1 197 ? -27.82013 -20.04758 -0.80885  1.000 40.22742  ? 197 HIS   A NE2  1 
ATOM   1495 N  N    . ARG   A 1 198 ? -21.74775 -23.06472 -0.51408  1.000 31.67580  ? 198 ARG   A N    1 
ATOM   1496 C  CA   . ARG   A 1 198 ? -20.44333 -23.64971 -0.82649  1.000 33.23957  ? 198 ARG   A CA   1 
ATOM   1497 C  C    . ARG   A 1 198 ? -20.38270 -25.04690 -0.22045  1.000 34.05633  ? 198 ARG   A C    1 
ATOM   1498 O  O    . ARG   A 1 198 ? -19.78094 -25.24272 0.84667   1.000 39.50068  ? 198 ARG   A O    1 
ATOM   1499 C  CB   . ARG   A 1 198 ? -19.29032 -22.79461 -0.30208  1.000 33.25801  ? 198 ARG   A CB   1 
ATOM   1500 C  CG   . ARG   A 1 198 ? -19.09282 -21.45795 -0.99483  1.000 43.50553  ? 198 ARG   A CG   1 
ATOM   1501 C  CD   . ARG   A 1 198 ? -18.07738 -20.62578 -0.21972  1.000 53.57514  ? 198 ARG   A CD   1 
ATOM   1502 N  NE   . ARG   A 1 198 ? -17.85639 -19.30589 -0.79702  1.000 64.24901  ? 198 ARG   A NE   1 
ATOM   1503 C  CZ   . ARG   A 1 198 ? -18.52755 -18.21456 -0.45620  1.000 77.77358  ? 198 ARG   A CZ   1 
ATOM   1504 N  NH1  . ARG   A 1 198 ? -19.48566 -18.24878 0.45561   1.000 72.72694  ? 198 ARG   A NH1  1 
ATOM   1505 N  NH2  . ARG   A 1 198 ? -18.22651 -17.05876 -1.04203  1.000 76.50272  ? 198 ARG   A NH2  1 
ATOM   1506 N  N    . PRO   A 1 199 ? -20.97877 -26.04218 -0.87530  1.000 34.77938  ? 199 PRO   A N    1 
ATOM   1507 C  CA   . PRO   A 1 199 ? -21.00982 -27.38989 -0.29114  1.000 31.44999  ? 199 PRO   A CA   1 
ATOM   1508 C  C    . PRO   A 1 199 ? -19.60539 -27.95132 -0.12153  1.000 36.04967  ? 199 PRO   A C    1 
ATOM   1509 O  O    . PRO   A 1 199 ? -18.80187 -27.95800 -1.05672  1.000 35.38496  ? 199 PRO   A O    1 
ATOM   1510 C  CB   . PRO   A 1 199 ? -21.83533 -28.19919 -1.30029  1.000 34.11386  ? 199 PRO   A CB   1 
ATOM   1511 C  CG   . PRO   A 1 199 ? -21.77688 -27.42134 -2.56704  1.000 35.84559  ? 199 PRO   A CG   1 
ATOM   1512 C  CD   . PRO   A 1 199 ? -21.67031 -25.98111 -2.17334  1.000 37.39863  ? 199 PRO   A CD   1 
ATOM   1513 N  N    . ALA   A 1 200 ? -19.31568 -28.42082 1.08919   1.000 27.88141  ? 200 ALA   A N    1 
ATOM   1514 C  CA   . ALA   A 1 200 ? -17.96221 -28.81122 1.46085   1.000 39.24619  ? 200 ALA   A CA   1 
ATOM   1515 C  C    . ALA   A 1 200 ? -18.00666 -29.53193 2.80061   1.000 39.16806  ? 200 ALA   A C    1 
ATOM   1516 O  O    . ALA   A 1 200 ? -19.01973 -29.52012 3.50523   1.000 31.09275  ? 200 ALA   A O    1 
ATOM   1517 C  CB   . ALA   A 1 200 ? -17.03029 -27.59727 1.53666   1.000 32.97883  ? 200 ALA   A CB   1 
ATOM   1518 N  N    . VAL   A 1 201 ? -16.88303 -30.15953 3.13915   1.000 39.45913  ? 201 VAL   A N    1 
ATOM   1519 C  CA   . VAL   A 1 201 ? -16.64679 -30.75576 4.44930   1.000 39.12762  ? 201 VAL   A CA   1 
ATOM   1520 C  C    . VAL   A 1 201 ? -15.33510 -30.17486 4.96273   1.000 33.04356  ? 201 VAL   A C    1 
ATOM   1521 O  O    . VAL   A 1 201 ? -14.26428 -30.48103 4.42388   1.000 37.90376  ? 201 VAL   A O    1 
ATOM   1522 C  CB   . VAL   A 1 201 ? -16.58349 -32.28889 4.39251   1.000 39.77456  ? 201 VAL   A CB   1 
ATOM   1523 C  CG1  . VAL   A 1 201 ? -16.20317 -32.85684 5.75100   1.000 37.61147  ? 201 VAL   A CG1  1 
ATOM   1524 C  CG2  . VAL   A 1 201 ? -17.91668 -32.85914 3.93217   1.000 33.44481  ? 201 VAL   A CG2  1 
ATOM   1525 N  N    . HIS   A 1 202 ? -15.41349 -29.32767 5.98477   1.000 34.19859  ? 202 HIS   A N    1 
ATOM   1526 C  CA   . HIS   A 1 202 ? -14.24325 -28.66206 6.54208   1.000 43.70762  ? 202 HIS   A CA   1 
ATOM   1527 C  C    . HIS   A 1 202 ? -13.82775 -29.35281 7.83158   1.000 36.86119  ? 202 HIS   A C    1 
ATOM   1528 O  O    . HIS   A 1 202 ? -14.64472 -29.51590 8.74283   1.000 38.62740  ? 202 HIS   A O    1 
ATOM   1529 C  CB   . HIS   A 1 202 ? -14.52573 -27.18435 6.82124   1.000 31.55337  ? 202 HIS   A CB   1 
ATOM   1530 C  CG   . HIS   A 1 202 ? -14.98913 -26.41656 5.62439   1.000 43.80593  ? 202 HIS   A CG   1 
ATOM   1531 N  ND1  . HIS   A 1 202 ? -14.11877 -25.79168 4.75751   1.000 41.93976  ? 202 HIS   A ND1  1 
ATOM   1532 C  CD2  . HIS   A 1 202 ? -16.23372 -26.16829 5.15253   1.000 38.30495  ? 202 HIS   A CD2  1 
ATOM   1533 C  CE1  . HIS   A 1 202 ? -14.80731 -25.19124 3.80302   1.000 46.09596  ? 202 HIS   A CE1  1 
ATOM   1534 N  NE2  . HIS   A 1 202 ? -16.09282 -25.40422 4.01954   1.000 41.82070  ? 202 HIS   A NE2  1 
ATOM   1535 N  N    . GLU   A 1 203 ? -12.56229 -29.74790 7.90977   1.000 41.50428  ? 203 GLU   A N    1 
ATOM   1536 C  CA   . GLU   A 1 203 ? -12.01181 -30.29212 9.14032   1.000 38.44661  ? 203 GLU   A CA   1 
ATOM   1537 C  C    . GLU   A 1 203 ? -11.39327 -29.17101 9.96409   1.000 36.62403  ? 203 GLU   A C    1 
ATOM   1538 O  O    . GLU   A 1 203 ? -10.77364 -28.25176 9.42196   1.000 44.52091  ? 203 GLU   A O    1 
ATOM   1539 C  CB   . GLU   A 1 203 ? -10.96921 -31.37128 8.84485   1.000 36.21095  ? 203 GLU   A CB   1 
ATOM   1540 C  CG   . GLU   A 1 203 ? -10.47773 -32.10095 10.08428  1.000 47.82465  ? 203 GLU   A CG   1 
ATOM   1541 C  CD   . GLU   A 1 203 ? -9.48276  -33.19710 9.76106   1.000 60.65042  ? 203 GLU   A CD   1 
ATOM   1542 O  OE1  . GLU   A 1 203 ? -8.89569  -33.16468 8.65887   1.000 64.67005  ? 203 GLU   A OE1  1 
ATOM   1543 O  OE2  . GLU   A 1 203 ? -9.28773  -34.09161 10.61018  1.000 67.66443  ? 203 GLU   A OE2  1 
ATOM   1544 N  N    . LEU   A 1 204 ? -11.58220 -29.24541 11.27673  1.000 47.88125  ? 204 LEU   A N    1 
ATOM   1545 C  CA   . LEU   A 1 204 ? -11.06426 -28.24700 12.20073  1.000 37.59781  ? 204 LEU   A CA   1 
ATOM   1546 C  C    . LEU   A 1 204 ? -10.84505 -28.92645 13.54633  1.000 39.92442  ? 204 LEU   A C    1 
ATOM   1547 O  O    . LEU   A 1 204 ? -10.87696 -30.15572 13.65103  1.000 39.38977  ? 204 LEU   A O    1 
ATOM   1548 C  CB   . LEU   A 1 204 ? -12.02127 -27.05139 12.29826  1.000 34.95368  ? 204 LEU   A CB   1 
ATOM   1549 C  CG   . LEU   A 1 204 ? -13.39993 -27.32891 12.90569  1.000 37.15297  ? 204 LEU   A CG   1 
ATOM   1550 C  CD1  . LEU   A 1 204 ? -13.81818 -26.20227 13.83697  1.000 41.75160  ? 204 LEU   A CD1  1 
ATOM   1551 C  CD2  . LEU   A 1 204 ? -14.44598 -27.54100 11.81656  1.000 43.77156  ? 204 LEU   A CD2  1 
ATOM   1552 N  N    . GLN   A 1 205 ? -10.61651 -28.12501 14.58274  1.000 42.76556  ? 205 GLN   A N    1 
ATOM   1553 C  CA   . GLN   A 1 205 ? -10.48858 -28.63453 15.94044  1.000 47.68314  ? 205 GLN   A CA   1 
ATOM   1554 C  C    . GLN   A 1 205 ? -11.42998 -27.86675 16.85382  1.000 37.01571  ? 205 GLN   A C    1 
ATOM   1555 O  O    . GLN   A 1 205 ? -11.48906 -26.63463 16.80054  1.000 44.52847  ? 205 GLN   A O    1 
ATOM   1556 C  CB   . GLN   A 1 205 ? -9.04415  -28.53653 16.44627  1.000 54.33673  ? 205 GLN   A CB   1 
ATOM   1557 C  CG   . GLN   A 1 205 ? -7.99640  -28.83042 15.38655  1.000 51.93508  ? 205 GLN   A CG   1 
ATOM   1558 C  CD   . GLN   A 1 205 ? -7.59834  -30.29399 15.35350  1.000 72.85450  ? 205 GLN   A CD   1 
ATOM   1559 O  OE1  . GLN   A 1 205 ? -7.63503  -30.98219 16.37383  1.000 76.07261  ? 205 GLN   A OE1  1 
ATOM   1560 N  NE2  . GLN   A 1 205 ? -7.22396  -30.77991 14.17518  1.000 77.46384  ? 205 GLN   A NE2  1 
ATOM   1561 N  N    . ALA   A 1 206 ? -12.17065 -28.60118 17.67791  1.000 39.05925  ? 206 ALA   A N    1 
ATOM   1562 C  CA   . ALA   A 1 206 ? -13.07993 -28.01245 18.64721  1.000 42.76558  ? 206 ALA   A CA   1 
ATOM   1563 C  C    . ALA   A 1 206 ? -13.10149 -28.90819 19.87349  1.000 49.49043  ? 206 ALA   A C    1 
ATOM   1564 O  O    . ALA   A 1 206 ? -13.11828 -30.13568 19.74670  1.000 51.32399  ? 206 ALA   A O    1 
ATOM   1565 C  CB   . ALA   A 1 206 ? -14.49266 -27.85190 18.07258  1.000 36.45561  ? 206 ALA   A CB   1 
ATOM   1566 N  N    . ASN   A 1 207 ? -13.09308 -28.28780 21.05425  1.000 46.76511  ? 207 ASN   A N    1 
ATOM   1567 C  CA   . ASN   A 1 207 ? -13.02942 -29.01151 22.32422  1.000 58.47648  ? 207 ASN   A CA   1 
ATOM   1568 C  C    . ASN   A 1 207 ? -11.79333 -29.90403 22.40215  1.000 56.34778  ? 207 ASN   A C    1 
ATOM   1569 O  O    . ASN   A 1 207 ? -11.83300 -30.98755 22.99051  1.000 52.84154  ? 207 ASN   A O    1 
ATOM   1570 C  CB   . ASN   A 1 207 ? -14.29877 -29.83620 22.56239  1.000 52.66036  ? 207 ASN   A CB   1 
ATOM   1571 C  CG   . ASN   A 1 207 ? -15.56024 -29.07711 22.20759  1.000 53.68829  ? 207 ASN   A CG   1 
ATOM   1572 O  OD1  . ASN   A 1 207 ? -15.83116 -28.01263 22.76075  1.000 56.57065  ? 207 ASN   A OD1  1 
ATOM   1573 N  ND2  . ASN   A 1 207 ? -16.33683 -29.61877 21.27571  1.000 45.70812  ? 207 ASN   A ND2  1 
ATOM   1574 N  N    . GLY   A 1 208 ? -10.69205 -29.45936 21.80122  1.000 51.80504  ? 208 GLY   A N    1 
ATOM   1575 C  CA   . GLY   A 1 208 ? -9.46029  -30.22522 21.82688  1.000 60.15548  ? 208 GLY   A CA   1 
ATOM   1576 C  C    . GLY   A 1 208 ? -9.50955  -31.53716 21.07529  1.000 66.38375  ? 208 GLY   A C    1 
ATOM   1577 O  O    . GLY   A 1 208 ? -8.76417  -32.46092 21.41006  1.000 68.93801  ? 208 GLY   A O    1 
ATOM   1578 N  N    . GLN   A 1 209 ? -10.35844 -31.64100 20.05969  1.000 62.27193  ? 209 GLN   A N    1 
ATOM   1579 C  CA   . GLN   A 1 209 ? -10.52247 -32.86251 19.28626  1.000 56.93999  ? 209 GLN   A CA   1 
ATOM   1580 C  C    . GLN   A 1 209 ? -10.86524 -32.47308 17.85733  1.000 56.99049  ? 209 GLN   A C    1 
ATOM   1581 O  O    . GLN   A 1 209 ? -11.33268 -31.35361 17.61214  1.000 57.19157  ? 209 GLN   A O    1 
ATOM   1582 C  CB   . GLN   A 1 209 ? -11.62002 -33.75522 19.88577  1.000 59.97427  ? 209 GLN   A CB   1 
ATOM   1583 C  CG   . GLN   A 1 209 ? -11.16514 -34.69861 21.00061  1.000 70.35911  ? 209 GLN   A CG   1 
ATOM   1584 C  CD   . GLN   A 1 209 ? -9.85890  -35.41698 20.69583  1.000 76.54590  ? 209 GLN   A CD   1 
ATOM   1585 O  OE1  . GLN   A 1 209 ? -8.82045  -35.12762 21.29303  1.000 77.74236  ? 209 GLN   A OE1  1 
ATOM   1586 N  NE2  . GLN   A 1 209 ? -9.91165  -36.37443 19.77906  1.000 82.21974  ? 209 GLN   A NE2  1 
ATOM   1587 N  N    . PRO   A 1 210 ? -10.63184 -33.35998 16.88839  1.000 57.38095  ? 210 PRO   A N    1 
ATOM   1588 C  CA   . PRO   A 1 210 ? -11.00969 -33.04516 15.50501  1.000 50.47138  ? 210 PRO   A CA   1 
ATOM   1589 C  C    . PRO   A 1 210 ? -12.51425 -32.85726 15.36890  1.000 43.89793  ? 210 PRO   A C    1 
ATOM   1590 O  O    . PRO   A 1 210 ? -13.30835 -33.57252 15.98320  1.000 44.38923  ? 210 PRO   A O    1 
ATOM   1591 C  CB   . PRO   A 1 210 ? -10.51925 -34.26450 14.71374  1.000 50.21624  ? 210 PRO   A CB   1 
ATOM   1592 C  CG   . PRO   A 1 210 ? -9.48173  -34.89629 15.58061  1.000 43.72489  ? 210 PRO   A CG   1 
ATOM   1593 C  CD   . PRO   A 1 210 ? -9.93071  -34.65253 16.98531  1.000 52.10208  ? 210 PRO   A CD   1 
ATOM   1594 N  N    . ALA   A 1 211 ? -12.89944 -31.87632 14.55557  1.000 37.40901  ? 211 ALA   A N    1 
ATOM   1595 C  CA   . ALA   A 1 211 ? -14.30043 -31.57763 14.30031  1.000 34.34181  ? 211 ALA   A CA   1 
ATOM   1596 C  C    . ALA   A 1 211 ? -14.48627 -31.30923 12.81403  1.000 33.56747  ? 211 ALA   A C    1 
ATOM   1597 O  O    . ALA   A 1 211 ? -13.52726 -31.03003 12.09134  1.000 34.24369  ? 211 ALA   A O    1 
ATOM   1598 C  CB   . ALA   A 1 211 ? -14.78582 -30.38085 15.12780  1.000 39.71528  ? 211 ALA   A CB   1 
ATOM   1599 N  N    . TRP   A 1 212 ? -15.73763 -31.39571 12.35917  1.000 35.14008  ? 212 TRP   A N    1 
ATOM   1600 C  CA   . TRP   A 1 212 ? -16.05490 -31.24120 10.94621  1.000 32.75983  ? 212 TRP   A CA   1 
ATOM   1601 C  C    . TRP   A 1 212 ? -17.26536 -30.33837 10.75971  1.000 36.27759  ? 212 TRP   A C    1 
ATOM   1602 O  O    . TRP   A 1 212 ? -18.26116 -30.45023 11.48209  1.000 28.39947  ? 212 TRP   A O    1 
ATOM   1603 C  CB   . TRP   A 1 212 ? -16.30462 -32.60173 10.27728  1.000 36.80237  ? 212 TRP   A CB   1 
ATOM   1604 C  CG   . TRP   A 1 212 ? -15.09206 -33.47949 10.28443  1.000 36.58843  ? 212 TRP   A CG   1 
ATOM   1605 C  CD1  . TRP   A 1 212 ? -14.12919 -33.55950 9.31904   1.000 36.98490  ? 212 TRP   A CD1  1 
ATOM   1606 C  CD2  . TRP   A 1 212 ? -14.70255 -34.39121 11.31704  1.000 38.67137  ? 212 TRP   A CD2  1 
ATOM   1607 N  NE1  . TRP   A 1 212 ? -13.16521 -34.47062 9.68654   1.000 39.23903  ? 212 TRP   A NE1  1 
ATOM   1608 C  CE2  . TRP   A 1 212 ? -13.49471 -34.99415 10.90940  1.000 39.83777  ? 212 TRP   A CE2  1 
ATOM   1609 C  CE3  . TRP   A 1 212 ? -15.25868 -34.75785 12.54618  1.000 38.45959  ? 212 TRP   A CE3  1 
ATOM   1610 C  CZ2  . TRP   A 1 212 ? -12.83620 -35.94485 11.68631  1.000 53.46668  ? 212 TRP   A CZ2  1 
ATOM   1611 C  CZ3  . TRP   A 1 212 ? -14.60126 -35.70206 13.31722  1.000 42.98560  ? 212 TRP   A CZ3  1 
ATOM   1612 C  CH2  . TRP   A 1 212 ? -13.40412 -36.28390 12.88463  1.000 41.29838  ? 212 TRP   A CH2  1 
ATOM   1613 N  N    . ARG   A 1 213 ? -17.16120 -29.43755 9.78638   1.000 31.90926  ? 213 ARG   A N    1 
ATOM   1614 C  CA   . ARG   A 1 213 ? -18.23976 -28.53770 9.39844   1.000 31.09492  ? 213 ARG   A CA   1 
ATOM   1615 C  C    . ARG   A 1 213 ? -18.69512 -28.94378 8.00356   1.000 34.34359  ? 213 ARG   A C    1 
ATOM   1616 O  O    . ARG   A 1 213 ? -17.92772 -28.84101 7.03999   1.000 36.55629  ? 213 ARG   A O    1 
ATOM   1617 C  CB   . ARG   A 1 213 ? -17.77899 -27.08117 9.42756   1.000 31.72723  ? 213 ARG   A CB   1 
ATOM   1618 C  CG   . ARG   A 1 213 ? -18.85085 -26.08585 9.01424   1.000 29.01488  ? 213 ARG   A CG   1 
ATOM   1619 C  CD   . ARG   A 1 213 ? -18.44709 -24.66138 9.36060   1.000 30.95068  ? 213 ARG   A CD   1 
ATOM   1620 N  NE   . ARG   A 1 213 ? -17.24762 -24.23634 8.64873   1.000 37.75687  ? 213 ARG   A NE   1 
ATOM   1621 C  CZ   . ARG   A 1 213 ? -17.25821 -23.62623 7.47146   1.000 41.46853  ? 213 ARG   A CZ   1 
ATOM   1622 N  NH1  . ARG   A 1 213 ? -18.38987 -23.37053 6.83709   1.000 34.76078  ? 213 ARG   A NH1  1 
ATOM   1623 N  NH2  . ARG   A 1 213 ? -16.10561 -23.25571 6.92068   1.000 36.86468  ? 213 ARG   A NH2  1 
ATOM   1624 N  N    . VAL   A 1 214 ? -19.93575 -29.41079 7.89966   1.000 35.73918  ? 214 VAL   A N    1 
ATOM   1625 C  CA   . VAL   A 1 214 ? -20.50870 -29.87023 6.64052   1.000 28.91130  ? 214 VAL   A CA   1 
ATOM   1626 C  C    . VAL   A 1 214 ? -21.45486 -28.79797 6.12400   1.000 31.73276  ? 214 VAL   A C    1 
ATOM   1627 O  O    . VAL   A 1 214 ? -22.35107 -28.34897 6.84941   1.000 27.73092  ? 214 VAL   A O    1 
ATOM   1628 C  CB   . VAL   A 1 214 ? -21.23843 -31.21196 6.81848   1.000 28.10490  ? 214 VAL   A CB   1 
ATOM   1629 C  CG1  . VAL   A 1 214 ? -21.81568 -31.67604 5.49353   1.000 26.85475  ? 214 VAL   A CG1  1 
ATOM   1630 C  CG2  . VAL   A 1 214 ? -20.28826 -32.25585 7.38868   1.000 28.24571  ? 214 VAL   A CG2  1 
ATOM   1631 N  N    . VAL   A 1 215 ? -21.26220 -28.38976 4.87261   1.000 27.54093  ? 215 VAL   A N    1 
ATOM   1632 C  CA   . VAL   A 1 215 ? -21.99693 -27.27874 4.27959   1.000 31.00132  ? 215 VAL   A CA   1 
ATOM   1633 C  C    . VAL   A 1 215 ? -22.86191 -27.81099 3.14752   1.000 30.05199  ? 215 VAL   A C    1 
ATOM   1634 O  O    . VAL   A 1 215 ? -22.37969 -28.55471 2.28455   1.000 26.50169  ? 215 VAL   A O    1 
ATOM   1635 C  CB   . VAL   A 1 215 ? -21.04926 -26.17818 3.77299   1.000 32.82385  ? 215 VAL   A CB   1 
ATOM   1636 C  CG1  . VAL   A 1 215 ? -21.85348 -24.95830 3.33568   1.000 29.86034  ? 215 VAL   A CG1  1 
ATOM   1637 C  CG2  . VAL   A 1 215 ? -20.04102 -25.80843 4.84923   1.000 29.75369  ? 215 VAL   A CG2  1 
ATOM   1638 N  N    . LEU   A 1 216 ? -24.13593 -27.42770 3.15342   1.000 23.28195  ? 216 LEU   A N    1 
ATOM   1639 C  CA   . LEU   A 1 216 ? -25.06950 -27.82657 2.11464   1.000 26.17612  ? 216 LEU   A CA   1 
ATOM   1640 C  C    . LEU   A 1 216 ? -24.94982 -26.91496 0.89750   1.000 33.30718  ? 216 LEU   A C    1 
ATOM   1641 O  O    . LEU   A 1 216 ? -24.45368 -25.78683 0.97332   1.000 25.08482  ? 216 LEU   A O    1 
ATOM   1642 C  CB   . LEU   A 1 216 ? -26.50379 -27.78981 2.63896   1.000 23.67811  ? 216 LEU   A CB   1 
ATOM   1643 C  CG   . LEU   A 1 216 ? -26.91783 -28.95731 3.52868   1.000 26.06448  ? 216 LEU   A CG   1 
ATOM   1644 C  CD1  . LEU   A 1 216 ? -28.04847 -28.54091 4.45696   1.000 28.61455  ? 216 LEU   A CD1  1 
ATOM   1645 C  CD2  . LEU   A 1 216 ? -27.32227 -30.13503 2.66277   1.000 24.37525  ? 216 LEU   A CD2  1 
ATOM   1646 N  N    . GLY   A 1 217 ? -25.42827 -27.41580 -0.23525  1.000 28.29869  ? 217 GLY   A N    1 
ATOM   1647 C  CA   . GLY   A 1 217 ? -25.44846 -26.65497 -1.46809  1.000 26.68440  ? 217 GLY   A CA   1 
ATOM   1648 C  C    . GLY   A 1 217 ? -26.81356 -26.05039 -1.74100  1.000 36.65671  ? 217 GLY   A C    1 
ATOM   1649 O  O    . GLY   A 1 217 ? -27.83662 -26.54823 -1.27498  1.000 28.39085  ? 217 GLY   A O    1 
ATOM   1650 N  N    . ALA   A 1 218 ? -26.81348 -24.95745 -2.49685  1.000 29.76713  ? 218 ALA   A N    1 
ATOM   1651 C  CA   . ALA   A 1 218 ? -28.05188 -24.36665 -2.97131  1.000 29.85430  ? 218 ALA   A CA   1 
ATOM   1652 C  C    . ALA   A 1 218 ? -28.55815 -25.11887 -4.19447  1.000 36.69545  ? 218 ALA   A C    1 
ATOM   1653 O  O    . ALA   A 1 218 ? -27.78034 -25.66770 -4.98160  1.000 31.25138  ? 218 ALA   A O    1 
ATOM   1654 C  CB   . ALA   A 1 218 ? -27.85413 -22.88925 -3.31589  1.000 27.73723  ? 218 ALA   A CB   1 
ATOM   1655 N  N    . TRP   A 1 219 ? -29.88135 -25.13197 -4.35206  1.000 23.07225  ? 219 TRP   A N    1 
ATOM   1656 C  CA   . TRP   A 1 219 ? -30.52439 -25.81185 -5.47557  1.000 31.72952  ? 219 TRP   A CA   1 
ATOM   1657 C  C    . TRP   A 1 219 ? -30.59750 -24.84138 -6.65164  1.000 36.39835  ? 219 TRP   A C    1 
ATOM   1658 O  O    . TRP   A 1 219 ? -31.63439 -24.24447 -6.94820  1.000 45.13830  ? 219 TRP   A O    1 
ATOM   1659 C  CB   . TRP   A 1 219 ? -31.90696 -26.31495 -5.07916  1.000 24.32851  ? 219 TRP   A CB   1 
ATOM   1660 C  CG   . TRP   A 1 219 ? -31.90477 -27.38460 -4.02401  1.000 24.61302  ? 219 TRP   A CG   1 
ATOM   1661 C  CD1  . TRP   A 1 219 ? -31.12062 -27.43956 -2.90700  1.000 21.97880  ? 219 TRP   A CD1  1 
ATOM   1662 C  CD2  . TRP   A 1 219 ? -32.73328 -28.55140 -3.98906  1.000 25.72093  ? 219 TRP   A CD2  1 
ATOM   1663 N  NE1  . TRP   A 1 219 ? -31.40918 -28.56969 -2.17938  1.000 22.50029  ? 219 TRP   A NE1  1 
ATOM   1664 C  CE2  . TRP   A 1 219 ? -32.39605 -29.26920 -2.82311  1.000 21.52721  ? 219 TRP   A CE2  1 
ATOM   1665 C  CE3  . TRP   A 1 219 ? -33.72844 -29.05922 -4.82996  1.000 28.97940  ? 219 TRP   A CE3  1 
ATOM   1666 C  CZ2  . TRP   A 1 219 ? -33.01874 -30.46386 -2.47757  1.000 22.43998  ? 219 TRP   A CZ2  1 
ATOM   1667 C  CZ3  . TRP   A 1 219 ? -34.34412 -30.25078 -4.48520  1.000 22.24800  ? 219 TRP   A CZ3  1 
ATOM   1668 C  CH2  . TRP   A 1 219 ? -33.98707 -30.93814 -3.31897  1.000 22.86908  ? 219 TRP   A CH2  1 
ATOM   1669 N  N    . HIS   A 1 220 ? -29.46233 -24.67831 -7.33006  1.000 43.51442  ? 220 HIS   A N    1 
ATOM   1670 C  CA   . HIS   A 1 220 ? -29.39987 -23.80962 -8.50176  1.000 50.23629  ? 220 HIS   A CA   1 
ATOM   1671 C  C    . HIS   A 1 220 ? -29.63539 -24.60693 -9.78083  1.000 44.07748  ? 220 HIS   A C    1 
ATOM   1672 O  O    . HIS   A 1 220 ? -30.59314 -24.35056 -10.51675 1.000 54.63670  ? 220 HIS   A O    1 
ATOM   1673 C  CB   . HIS   A 1 220 ? -28.04970 -23.08285 -8.55201  1.000 50.49006  ? 220 HIS   A CB   1 
ATOM   1674 C  CG   . HIS   A 1 220 ? -27.92323 -21.96362 -7.56397  1.000 65.05208  ? 220 HIS   A CG   1 
ATOM   1675 N  ND1  . HIS   A 1 220 ? -26.73769 -21.66243 -6.92734  1.000 75.33789  ? 220 HIS   A ND1  1 
ATOM   1676 C  CD2  . HIS   A 1 220 ? -28.83147 -21.06736 -7.10971  1.000 79.83398  ? 220 HIS   A CD2  1 
ATOM   1677 C  CE1  . HIS   A 1 220 ? -26.92233 -20.63298 -6.11989  1.000 78.73373  ? 220 HIS   A CE1  1 
ATOM   1678 N  NE2  . HIS   A 1 220 ? -28.18430 -20.25315 -6.21171  1.000 90.04387  ? 220 HIS   A NE2  1 
ATOM   1679 N  N    A SER   A 1 221 ? -28.76921 -25.58178 -10.04577 0.611 43.88123  ? 221 SER   A N    1 
ATOM   1680 N  N    B SER   A 1 221 ? -28.76748 -25.58043 -10.05997 0.389 43.97299  ? 221 SER   A N    1 
ATOM   1681 C  CA   A SER   A 1 221 ? -28.87123 -26.44203 -11.21520 0.611 46.09110  ? 221 SER   A CA   1 
ATOM   1682 C  CA   B SER   A 1 221 ? -28.92916 -26.43854 -11.22402 0.389 46.02823  ? 221 SER   A CA   1 
ATOM   1683 C  C    A SER   A 1 221 ? -29.25077 -27.87427 -10.87495 0.611 46.84836  ? 221 SER   A C    1 
ATOM   1684 C  C    B SER   A 1 221 ? -29.26614 -27.87918 -10.87301 0.389 46.73375  ? 221 SER   A C    1 
ATOM   1685 O  O    A SER   A 1 221 ? -29.82867 -28.56582 -11.71801 0.611 44.57111  ? 221 SER   A O    1 
ATOM   1686 O  O    B SER   A 1 221 ? -29.83517 -28.58291 -11.71362 0.389 44.52634  ? 221 SER   A O    1 
ATOM   1687 C  CB   A SER   A 1 221 ? -27.54110 -26.45100 -11.98323 0.611 47.67237  ? 221 SER   A CB   1 
ATOM   1688 C  CB   B SER   A 1 221 ? -27.65728 -26.42104 -12.08647 0.389 47.73224  ? 221 SER   A CB   1 
ATOM   1689 O  OG   A SER   A 1 221 ? -27.19384 -25.15343 -12.43710 0.611 47.38772  ? 221 SER   A OG   1 
ATOM   1690 O  OG   B SER   A 1 221 ? -27.89542 -26.99953 -13.35904 0.389 47.25830  ? 221 SER   A OG   1 
ATOM   1691 N  N    . GLU   A 1 222 ? -28.94651 -28.32610 -9.65992  1.000 34.27046  ? 222 GLU   A N    1 
ATOM   1692 C  CA   . GLU   A 1 222 ? -29.22155 -29.69099 -9.24127  1.000 36.51802  ? 222 GLU   A CA   1 
ATOM   1693 C  C    . GLU   A 1 222 ? -29.48004 -29.69611 -7.74183  1.000 31.85587  ? 222 GLU   A C    1 
ATOM   1694 O  O    . GLU   A 1 222 ? -29.21764 -28.71509 -7.04245  1.000 30.57982  ? 222 GLU   A O    1 
ATOM   1695 C  CB   . GLU   A 1 222 ? -28.05991 -30.62850 -9.60346  1.000 39.40388  ? 222 GLU   A CB   1 
ATOM   1696 N  N    . GLY   A 1 223 ? -30.00583 -30.82052 -7.25356  1.000 28.31540  ? 223 GLY   A N    1 
ATOM   1697 C  CA   . GLY   A 1 223 ? -30.29374 -30.94800 -5.84306  1.000 29.31131  ? 223 GLY   A CA   1 
ATOM   1698 C  C    . GLY   A 1 223 ? -29.06097 -31.27199 -5.01412  1.000 32.20393  ? 223 GLY   A C    1 
ATOM   1699 O  O    . GLY   A 1 223 ? -28.03066 -31.72180 -5.51629  1.000 28.05332  ? 223 GLY   A O    1 
ATOM   1700 N  N    . SER   A 1 224 ? -29.18625 -31.03738 -3.70931  1.000 25.89555  ? 224 SER   A N    1 
ATOM   1701 C  CA   . SER   A 1 224 ? -28.10754 -31.27889 -2.76276  1.000 24.23019  ? 224 SER   A CA   1 
ATOM   1702 C  C    . SER   A 1 224 ? -28.71011 -31.68260 -1.42599  1.000 23.04470  ? 224 SER   A C    1 
ATOM   1703 O  O    . SER   A 1 224 ? -29.73041 -31.13026 -1.00845  1.000 23.85853  ? 224 SER   A O    1 
ATOM   1704 C  CB   . SER   A 1 224 ? -27.22621 -30.03337 -2.59142  1.000 27.45388  ? 224 SER   A CB   1 
ATOM   1705 O  OG   . SER   A 1 224 ? -26.28517 -30.21197 -1.54920  1.000 40.85832  ? 224 SER   A OG   1 
ATOM   1706 N  N    . MET   A 1 225 ? -28.07696 -32.64242 -0.75839  1.000 22.49983  ? 225 MET   A N    1 
ATOM   1707 C  CA   . MET   A 1 225 ? -28.54288 -33.06862 0.55257   1.000 18.72325  ? 225 MET   A CA   1 
ATOM   1708 C  C    . MET   A 1 225 ? -27.36933 -33.63145 1.33541   1.000 24.33978  ? 225 MET   A C    1 
ATOM   1709 O  O    . MET   A 1 225 ? -26.36610 -34.06404 0.76285   1.000 25.27108  ? 225 MET   A O    1 
ATOM   1710 C  CB   . MET   A 1 225 ? -29.66847 -34.10700 0.44288   1.000 21.32678  ? 225 MET   A CB   1 
ATOM   1711 C  CG   . MET   A 1 225 ? -29.21059 -35.50557 0.02822   1.000 24.62452  ? 225 MET   A CG   1 
ATOM   1712 S  SD   . MET   A 1 225 ? -30.56360 -36.70568 0.01833   1.000 28.82098  ? 225 MET   A SD   1 
ATOM   1713 C  CE   . MET   A 1 225 ? -29.66024 -38.25129 0.02391   1.000 35.83496  ? 225 MET   A CE   1 
ATOM   1714 N  N    . VAL   A 1 226 ? -27.50502 -33.60605 2.65806   1.000 22.05083  ? 226 VAL   A N    1 
ATOM   1715 C  CA   . VAL   A 1 226 ? -26.62009 -34.33425 3.55710   1.000 18.42723  ? 226 VAL   A CA   1 
ATOM   1716 C  C    . VAL   A 1 226 ? -27.41486 -35.49387 4.13849   1.000 25.21071  ? 226 VAL   A C    1 
ATOM   1717 O  O    . VAL   A 1 226 ? -28.53734 -35.30689 4.62603   1.000 22.53044  ? 226 VAL   A O    1 
ATOM   1718 C  CB   . VAL   A 1 226 ? -26.04793 -33.43237 4.66509   1.000 22.65246  ? 226 VAL   A CB   1 
ATOM   1719 C  CG1  . VAL   A 1 226 ? -25.40660 -34.27554 5.75740   1.000 21.16730  ? 226 VAL   A CG1  1 
ATOM   1720 C  CG2  . VAL   A 1 226 ? -25.02719 -32.47150 4.08043   1.000 19.91464  ? 226 VAL   A CG2  1 
ATOM   1721 N  N    . LYS   A 1 227 ? -26.85340 -36.69257 4.03946   1.000 24.24658  ? 227 LYS   A N    1 
ATOM   1722 C  CA   . LYS   A 1 227 ? -27.44329 -37.90931 4.57970   1.000 22.02508  ? 227 LYS   A CA   1 
ATOM   1723 C  C    . LYS   A 1 227 ? -26.54820 -38.40086 5.70677   1.000 26.66881  ? 227 LYS   A C    1 
ATOM   1724 O  O    . LYS   A 1 227 ? -25.36180 -38.66513 5.48702   1.000 27.42081  ? 227 LYS   A O    1 
ATOM   1725 C  CB   . LYS   A 1 227 ? -27.58138 -38.97498 3.49132   1.000 26.46813  ? 227 LYS   A CB   1 
ATOM   1726 C  CG   . LYS   A 1 227 ? -28.13493 -40.30779 3.96775   1.000 24.83530  ? 227 LYS   A CG   1 
ATOM   1727 C  CD   . LYS   A 1 227 ? -28.93373 -40.99731 2.87088   1.000 34.08083  ? 227 LYS   A CD   1 
ATOM   1728 C  CE   . LYS   A 1 227 ? -28.43376 -42.40699 2.62108   1.000 39.94228  ? 227 LYS   A CE   1 
ATOM   1729 N  NZ   . LYS   A 1 227 ? -29.37956 -43.18888 1.77394   1.000 43.36020  ? 227 LYS   A NZ   1 
ATOM   1730 N  N    . VAL   A 1 228 ? -27.10266 -38.50166 6.91015   1.000 25.32084  ? 228 VAL   A N    1 
ATOM   1731 C  CA   . VAL   A 1 228 ? -26.36849 -38.99477 8.06971   1.000 22.75245  ? 228 VAL   A CA   1 
ATOM   1732 C  C    . VAL   A 1 228 ? -26.87799 -40.39318 8.38458   1.000 33.60687  ? 228 VAL   A C    1 
ATOM   1733 O  O    . VAL   A 1 228 ? -28.08281 -40.59195 8.58343   1.000 24.22725  ? 228 VAL   A O    1 
ATOM   1734 C  CB   . VAL   A 1 228 ? -26.52010 -38.06681 9.28375   1.000 26.92620  ? 228 VAL   A CB   1 
ATOM   1735 C  CG1  . VAL   A 1 228 ? -25.74992 -38.62954 10.47430  1.000 23.27770  ? 228 VAL   A CG1  1 
ATOM   1736 C  CG2  . VAL   A 1 228 ? -26.04156 -36.65960 8.94500   1.000 22.08875  ? 228 VAL   A CG2  1 
ATOM   1737 N  N    . THR   A 1 229 ? -25.96310 -41.36232 8.41778   1.000 24.70846  ? 229 THR   A N    1 
ATOM   1738 C  CA   . THR   A 1 229 ? -26.28786 -42.73412 8.78424   1.000 27.88551  ? 229 THR   A CA   1 
ATOM   1739 C  C    . THR   A 1 229 ? -25.53473 -43.08205 10.06342  1.000 31.42991  ? 229 THR   A C    1 
ATOM   1740 O  O    . THR   A 1 229 ? -24.69597 -42.29188 10.51462  1.000 28.26546  ? 229 THR   A O    1 
ATOM   1741 C  CB   . THR   A 1 229 ? -25.91557 -43.70705 7.66000   1.000 28.39024  ? 229 THR   A CB   1 
ATOM   1742 O  OG1  . THR   A 1 229 ? -24.49219 -43.87084 7.61898   1.000 33.86997  ? 229 THR   A OG1  1 
ATOM   1743 C  CG2  . THR   A 1 229 ? -26.40878 -43.19404 6.31409   1.000 30.99706  ? 229 THR   A CG2  1 
ATOM   1744 N  N    . PRO   A 1 230 ? -25.79893 -44.23381 10.68770  1.000 27.91836  ? 230 PRO   A N    1 
ATOM   1745 C  CA   . PRO   A 1 230 ? -24.94606 -44.65146 11.81154  1.000 44.09079  ? 230 PRO   A CA   1 
ATOM   1746 C  C    . PRO   A 1 230 ? -23.48523 -44.82691 11.42757  1.000 28.50725  ? 230 PRO   A C    1 
ATOM   1747 O  O    . PRO   A 1 230 ? -22.61964 -44.75435 12.30732  1.000 35.70559  ? 230 PRO   A O    1 
ATOM   1748 C  CB   . PRO   A 1 230 ? -25.57167 -45.98139 12.26446  1.000 42.54236  ? 230 PRO   A CB   1 
ATOM   1749 C  CG   . PRO   A 1 230 ? -26.56378 -46.35346 11.20367  1.000 39.10301  ? 230 PRO   A CG   1 
ATOM   1750 C  CD   . PRO   A 1 230 ? -26.99203 -45.08782 10.56047  1.000 27.96595  ? 230 PRO   A CD   1 
ATOM   1751 N  N    . ASP   A 1 231 ? -23.18054 -45.02121 10.14355  1.000 25.82786  ? 231 ASP   A N    1 
ATOM   1752 C  CA   . ASP   A 1 231 ? -21.83082 -45.36055 9.70898   1.000 29.83097  ? 231 ASP   A CA   1 
ATOM   1753 C  C    . ASP   A 1 231 ? -21.05170 -44.19800 9.10976   1.000 38.01640  ? 231 ASP   A C    1 
ATOM   1754 O  O    . ASP   A 1 231 ? -19.81719 -44.23323 9.13081   1.000 33.70957  ? 231 ASP   A O    1 
ATOM   1755 C  CB   . ASP   A 1 231 ? -21.87228 -46.49276 8.67676   1.000 33.65503  ? 231 ASP   A CB   1 
ATOM   1756 C  CG   . ASP   A 1 231 ? -22.44413 -47.77525 9.24063   1.000 43.12434  ? 231 ASP   A CG   1 
ATOM   1757 O  OD1  . ASP   A 1 231 ? -22.34744 -47.97861 10.46832  1.000 42.20934  ? 231 ASP   A OD1  1 
ATOM   1758 O  OD2  . ASP   A 1 231 ? -22.98257 -48.58246 8.45392   1.000 57.09764  ? 231 ASP   A OD2  1 
ATOM   1759 N  N    . ASP   A 1 232 ? -21.71168 -43.18257 8.55586   1.000 30.91002  ? 232 ASP   A N    1 
ATOM   1760 C  CA   . ASP   A 1 232 ? -20.97399 -42.14620 7.84248   1.000 31.23587  ? 232 ASP   A CA   1 
ATOM   1761 C  C    . ASP   A 1 232 ? -21.82627 -40.88811 7.72338   1.000 32.25797  ? 232 ASP   A C    1 
ATOM   1762 O  O    . ASP   A 1 232 ? -22.98593 -40.84559 8.14603   1.000 27.73516  ? 232 ASP   A O    1 
ATOM   1763 C  CB   . ASP   A 1 232 ? -20.52980 -42.63852 6.45810   1.000 25.65681  ? 232 ASP   A CB   1 
ATOM   1764 C  CG   . ASP   A 1 232 ? -21.66882 -43.23804 5.64871   1.000 29.39198  ? 232 ASP   A CG   1 
ATOM   1765 O  OD1  . ASP   A 1 232 ? -22.80382 -42.72189 5.71830   1.000 28.07674  ? 232 ASP   A OD1  1 
ATOM   1766 O  OD2  . ASP   A 1 232 ? -21.42443 -44.22716 4.92760   1.000 35.82035  ? 232 ASP   A OD2  1 
ATOM   1767 N  N    . VAL   A 1 233 ? -21.22406 -39.85692 7.13663   1.000 26.82970  ? 233 VAL   A N    1 
ATOM   1768 C  CA   . VAL   A 1 233 ? -21.90047 -38.62009 6.76362   1.000 25.55361  ? 233 VAL   A CA   1 
ATOM   1769 C  C    . VAL   A 1 233 ? -21.67266 -38.41733 5.27291   1.000 27.45289  ? 233 VAL   A C    1 
ATOM   1770 O  O    . VAL   A 1 233 ? -20.53245 -38.49723 4.80138   1.000 23.78743  ? 233 VAL   A O    1 
ATOM   1771 C  CB   . VAL   A 1 233 ? -21.37668 -37.42023 7.57372   1.000 29.23927  ? 233 VAL   A CB   1 
ATOM   1772 C  CG1  . VAL   A 1 233 ? -22.10081 -36.13535 7.17257   1.000 24.07310  ? 233 VAL   A CG1  1 
ATOM   1773 C  CG2  . VAL   A 1 233 ? -21.52580 -37.68527 9.06358   1.000 26.25701  ? 233 VAL   A CG2  1 
ATOM   1774 N  N    . GLU   A 1 234 ? -22.75079 -38.17510 4.53110   1.000 23.29300  ? 234 GLU   A N    1 
ATOM   1775 C  CA   . GLU   A 1 234 ? -22.70699 -38.16623 3.07298   1.000 21.75937  ? 234 GLU   A CA   1 
ATOM   1776 C  C    . GLU   A 1 234 ? -23.22588 -36.83774 2.54222   1.000 28.50747  ? 234 GLU   A C    1 
ATOM   1777 O  O    . GLU   A 1 234 ? -24.34476 -36.42875 2.86689   1.000 25.38771  ? 234 GLU   A O    1 
ATOM   1778 C  CB   . GLU   A 1 234 ? -23.52268 -39.32686 2.50106   1.000 21.75143  ? 234 GLU   A CB   1 
ATOM   1779 C  CG   . GLU   A 1 234 ? -23.31056 -40.63807 3.23799   1.000 21.83153  ? 234 GLU   A CG   1 
ATOM   1780 C  CD   . GLU   A 1 234 ? -24.15826 -41.76715 2.68889   1.000 32.69018  ? 234 GLU   A CD   1 
ATOM   1781 O  OE1  . GLU   A 1 234 ? -24.85250 -41.55667 1.67472   1.000 29.04540  ? 234 GLU   A OE1  1 
ATOM   1782 O  OE2  . GLU   A 1 234 ? -24.12073 -42.87293 3.26748   1.000 37.74566  ? 234 GLU   A OE2  1 
ATOM   1783 N  N    . LEU   A 1 235 ? -22.41060 -36.17017 1.73099   1.000 21.86319  ? 235 LEU   A N    1 
ATOM   1784 C  CA   . LEU   A 1 235 ? -22.82341 -34.99366 0.97649   1.000 26.08799  ? 235 LEU   A CA   1 
ATOM   1785 C  C    . LEU   A 1 235 ? -23.12266 -35.43917 -0.44939  1.000 24.45106  ? 235 LEU   A C    1 
ATOM   1786 O  O    . LEU   A 1 235 ? -22.22887 -35.92730 -1.14970  1.000 22.81834  ? 235 LEU   A O    1 
ATOM   1787 C  CB   . LEU   A 1 235 ? -21.73343 -33.92251 0.99974   1.000 27.05317  ? 235 LEU   A CB   1 
ATOM   1788 C  CG   . LEU   A 1 235 ? -21.98249 -32.64032 0.20361   1.000 33.18532  ? 235 LEU   A CG   1 
ATOM   1789 C  CD1  . LEU   A 1 235 ? -23.26834 -31.95877 0.65403   1.000 32.79298  ? 235 LEU   A CD1  1 
ATOM   1790 C  CD2  . LEU   A 1 235 ? -20.78526 -31.69988 0.32920   1.000 26.88520  ? 235 LEU   A CD2  1 
ATOM   1791 N  N    . ILE   A 1 236 ? -24.37308 -35.27907 -0.87589  1.000 23.85014  ? 236 ILE   A N    1 
ATOM   1792 C  CA   . ILE   A 1 236 ? -24.87521 -35.93989 -2.07378  1.000 21.88746  ? 236 ILE   A CA   1 
ATOM   1793 C  C    . ILE   A 1 236 ? -25.48400 -34.90693 -3.01059  1.000 28.89886  ? 236 ILE   A C    1 
ATOM   1794 O  O    . ILE   A 1 236 ? -26.33086 -34.10722 -2.59674  1.000 29.10808  ? 236 ILE   A O    1 
ATOM   1795 C  CB   . ILE   A 1 236 ? -25.90262 -37.03153 -1.71560  1.000 26.16554  ? 236 ILE   A CB   1 
ATOM   1796 C  CG1  . ILE   A 1 236 ? -25.23182 -38.11485 -0.86109  1.000 22.78894  ? 236 ILE   A CG1  1 
ATOM   1797 C  CG2  . ILE   A 1 236 ? -26.51792 -37.63361 -2.97491  1.000 24.11132  ? 236 ILE   A CG2  1 
ATOM   1798 C  CD1  . ILE   A 1 236 ? -26.17672 -39.18484 -0.36012  1.000 29.12500  ? 236 ILE   A CD1  1 
ATOM   1799 N  N    . HIS   A 1 237 ? -25.05450 -34.92781 -4.27074  1.000 24.66396  ? 237 HIS   A N    1 
ATOM   1800 C  CA   . HIS   A 1 237 ? -25.64169 -34.10674 -5.32020  1.000 30.69137  ? 237 HIS   A CA   1 
ATOM   1801 C  C    . HIS   A 1 237 ? -26.38963 -34.99253 -6.30743  1.000 31.25811  ? 237 HIS   A C    1 
ATOM   1802 O  O    . HIS   A 1 237 ? -25.89821 -36.05541 -6.69859  1.000 26.09393  ? 237 HIS   A O    1 
ATOM   1803 C  CB   . HIS   A 1 237 ? -24.57653 -33.28408 -6.05058  1.000 26.95351  ? 237 HIS   A CB   1 
ATOM   1804 C  CG   . HIS   A 1 237 ? -24.07992 -32.11483 -5.25920  1.000 45.61430  ? 237 HIS   A CG   1 
ATOM   1805 N  ND1  . HIS   A 1 237 ? -23.61926 -32.23466 -3.96519  1.000 40.08951  ? 237 HIS   A ND1  1 
ATOM   1806 C  CD2  . HIS   A 1 237 ? -24.01427 -30.79652 -5.56130  1.000 42.86934  ? 237 HIS   A CD2  1 
ATOM   1807 C  CE1  . HIS   A 1 237 ? -23.26747 -31.04426 -3.51339  1.000 47.98447  ? 237 HIS   A CE1  1 
ATOM   1808 N  NE2  . HIS   A 1 237 ? -23.49926 -30.15398 -4.46162  1.000 45.93990  ? 237 HIS   A NE2  1 
ATOM   1809 N  N    . PHE   A 1 238 ? -27.57768 -34.54779 -6.70822  1.000 25.80815  ? 238 PHE   A N    1 
ATOM   1810 C  CA   . PHE   A 1 238 ? -28.47444 -35.34325 -7.53365  1.000 30.28049  ? 238 PHE   A CA   1 
ATOM   1811 C  C    . PHE   A 1 238 ? -29.25053 -34.40797 -8.44269  1.000 31.33816  ? 238 PHE   A C    1 
ATOM   1812 O  O    . PHE   A 1 238 ? -29.42370 -33.22784 -8.11098  1.000 29.23083  ? 238 PHE   A O    1 
ATOM   1813 C  CB   . PHE   A 1 238 ? -29.43911 -36.17304 -6.66914  1.000 25.55479  ? 238 PHE   A CB   1 
ATOM   1814 C  CG   . PHE   A 1 238 ? -30.21805 -35.35299 -5.67341  1.000 30.47773  ? 238 PHE   A CG   1 
ATOM   1815 C  CD1  . PHE   A 1 238 ? -29.69436 -35.07730 -4.41864  1.000 22.79466  ? 238 PHE   A CD1  1 
ATOM   1816 C  CD2  . PHE   A 1 238 ? -31.46929 -34.85266 -5.99628  1.000 29.85536  ? 238 PHE   A CD2  1 
ATOM   1817 C  CE1  . PHE   A 1 238 ? -30.40295 -34.31967 -3.50449  1.000 26.57009  ? 238 PHE   A CE1  1 
ATOM   1818 C  CE2  . PHE   A 1 238 ? -32.18443 -34.09583 -5.08708  1.000 25.47164  ? 238 PHE   A CE2  1 
ATOM   1819 C  CZ   . PHE   A 1 238 ? -31.65131 -33.82894 -3.83881  1.000 27.91816  ? 238 PHE   A CZ   1 
ATOM   1820 N  N    . PRO   A 1 239 ? -29.72544 -34.88608 -9.58889  1.000 36.17307  ? 239 PRO   A N    1 
ATOM   1821 C  CA   . PRO   A 1 239 ? -30.49391 -34.02561 -10.48904 1.000 31.71409  ? 239 PRO   A CA   1 
ATOM   1822 C  C    . PRO   A 1 239 ? -31.92447 -33.82375 -10.00617 1.000 34.09620  ? 239 PRO   A C    1 
ATOM   1823 O  O    . PRO   A 1 239 ? -32.47393 -34.61190 -9.23320  1.000 31.36316  ? 239 PRO   A O    1 
ATOM   1824 C  CB   . PRO   A 1 239 ? -30.46247 -34.78912 -11.81668 1.000 38.94230  ? 239 PRO   A CB   1 
ATOM   1825 C  CG   . PRO   A 1 239 ? -30.35417 -36.21738 -11.40695 1.000 45.77944  ? 239 PRO   A CG   1 
ATOM   1826 C  CD   . PRO   A 1 239 ? -29.50001 -36.22649 -10.16547 1.000 37.38866  ? 239 PRO   A CD   1 
ATOM   1827 N  N    . PHE   A 1 240 ? -32.51956 -32.72618 -10.47896 1.000 32.37865  ? 240 PHE   A N    1 
ATOM   1828 C  CA   . PHE   A 1 240 ? -33.90218 -32.41078 -10.13299 1.000 35.08319  ? 240 PHE   A CA   1 
ATOM   1829 C  C    . PHE   A 1 240 ? -34.85012 -33.50111 -10.61359 1.000 41.88955  ? 240 PHE   A C    1 
ATOM   1830 O  O    . PHE   A 1 240 ? -35.58557 -34.10128 -9.82136  1.000 34.70851  ? 240 PHE   A O    1 
ATOM   1831 C  CB   . PHE   A 1 240 ? -34.30090 -31.06284 -10.73594 1.000 29.31333  ? 240 PHE   A CB   1 
ATOM   1832 C  CG   . PHE   A 1 240 ? -33.65498 -29.88387 -10.07534 1.000 38.25418  ? 240 PHE   A CG   1 
ATOM   1833 C  CD1  . PHE   A 1 240 ? -33.22501 -29.95758 -8.76175  1.000 36.43488  ? 240 PHE   A CD1  1 
ATOM   1834 C  CD2  . PHE   A 1 240 ? -33.48431 -28.69574 -10.76782 1.000 34.94603  ? 240 PHE   A CD2  1 
ATOM   1835 C  CE1  . PHE   A 1 240 ? -32.63321 -28.86892 -8.15159  1.000 38.75111  ? 240 PHE   A CE1  1 
ATOM   1836 C  CE2  . PHE   A 1 240 ? -32.89207 -27.60474 -10.16494 1.000 36.80519  ? 240 PHE   A CE2  1 
ATOM   1837 C  CZ   . PHE   A 1 240 ? -32.46516 -27.69057 -8.85416  1.000 35.39607  ? 240 PHE   A CZ   1 
ATOM   1838 N  N    . LEU   A 1 241 ? -34.84516 -33.76696 -11.91531 1.000 45.58542  ? 241 LEU   A N    1 
ATOM   1839 C  CA   . LEU   A 1 241 ? -35.78934 -34.67210 -12.55114 1.000 48.75935  ? 241 LEU   A CA   1 
ATOM   1840 C  C    . LEU   A 1 241 ? -35.10586 -35.98317 -12.91802 1.000 58.04469  ? 241 LEU   A C    1 
ATOM   1841 O  O    . LEU   A 1 241 ? -33.87738 -36.09992 -12.91844 1.000 48.73794  ? 241 LEU   A O    1 
ATOM   1842 C  CB   . LEU   A 1 241 ? -36.40444 -34.02484 -13.79958 1.000 53.23130  ? 241 LEU   A CB   1 
ATOM   1843 C  CG   . LEU   A 1 241 ? -37.44422 -32.91510 -13.60095 1.000 54.04064  ? 241 LEU   A CG   1 
ATOM   1844 C  CD1  . LEU   A 1 241 ? -38.36217 -33.22654 -12.42448 1.000 50.10757  ? 241 LEU   A CD1  1 
ATOM   1845 C  CD2  . LEU   A 1 241 ? -36.78482 -31.54989 -13.43191 1.000 56.80424  ? 241 LEU   A CD2  1 
ATOM   1846 N  N    . GLU   A 1 242 ? -35.92988 -36.97745 -13.23786 1.000 68.48516  ? 242 GLU   A N    1 
ATOM   1847 C  CA   . GLU   A 1 242 ? -35.44331 -38.29859 -13.62787 1.000 76.11484  ? 242 GLU   A CA   1 
ATOM   1848 C  C    . GLU   A 1 242 ? -34.83885 -38.21050 -15.02256 1.000 77.56730  ? 242 GLU   A C    1 
ATOM   1849 O  O    . GLU   A 1 242 ? -35.55532 -38.17669 -16.02531 1.000 75.68663  ? 242 GLU   A O    1 
ATOM   1850 C  CB   . GLU   A 1 242 ? -36.57591 -39.31779 -13.58008 1.000 66.63531  ? 242 GLU   A CB   1 
ATOM   1851 N  N    . GLU   A 1 243 ? -33.50909 -38.16854 -15.09009 1.000 86.91763  ? 243 GLU   A N    1 
ATOM   1852 C  CA   . GLU   A 1 243 ? -32.81197 -38.11528 -16.36822 1.000 91.87677  ? 243 GLU   A CA   1 
ATOM   1853 C  C    . GLU   A 1 243 ? -32.91919 -39.45297 -17.08852 1.000 100.80936 ? 243 GLU   A C    1 
ATOM   1854 O  O    . GLU   A 1 243 ? -32.05361 -40.32029 -16.92763 1.000 92.72890  ? 243 GLU   A O    1 
ATOM   1855 C  CB   . GLU   A 1 243 ? -31.34353 -37.73606 -16.16473 1.000 91.10587  ? 243 GLU   A CB   1 
ATOM   1856 C  CG   . GLU   A 1 243 ? -31.12785 -36.51398 -15.28582 1.000 86.58865  ? 243 GLU   A CG   1 
ATOM   1857 C  CD   . GLU   A 1 243 ? -31.32798 -35.21240 -16.03786 1.000 91.84093  ? 243 GLU   A CD   1 
ATOM   1858 O  OE1  . GLU   A 1 243 ? -30.89648 -35.12676 -17.20697 1.000 100.10839 ? 243 GLU   A OE1  1 
ATOM   1859 O  OE2  . GLU   A 1 243 ? -31.91442 -34.27317 -15.45872 1.000 85.13654  ? 243 GLU   A OE2  1 
ATOM   1860 N  N    . ASN   A 1 244 ? -33.98037 -39.63040 -17.87508 1.000 104.69351 ? 244 ASN   A N    1 
ATOM   1861 C  CA   . ASN   A 1 244 ? -34.17185 -40.87103 -18.61624 1.000 95.96593  ? 244 ASN   A CA   1 
ATOM   1862 C  C    . ASN   A 1 244 ? -33.02386 -41.08375 -19.59163 1.000 92.18813  ? 244 ASN   A C    1 
ATOM   1863 O  O    . ASN   A 1 244 ? -32.80633 -40.27360 -20.49842 1.000 90.07044  ? 244 ASN   A O    1 
ATOM   1864 C  CB   . ASN   A 1 244 ? -35.50619 -40.84370 -19.35862 1.000 94.74678  ? 244 ASN   A CB   1 
ATOM   1865 C  CG   . ASN   A 1 244 ? -36.65891 -41.31317 -18.49656 1.000 101.79607 ? 244 ASN   A CG   1 
ATOM   1866 O  OD1  . ASN   A 1 244 ? -36.45678 -41.79895 -17.38325 1.000 99.07994  ? 244 ASN   A OD1  1 
ATOM   1867 N  ND2  . ASN   A 1 244 ? -37.87629 -41.17695 -19.00856 1.000 100.03272 ? 244 ASN   A ND2  1 
ATOM   1868 N  N    . LEU   A 1 245 ? -32.28682 -42.17326 -19.39828 1.000 85.83397  ? 245 LEU   A N    1 
ATOM   1869 C  CA   . LEU   A 1 245 ? -31.12866 -42.44919 -20.23430 1.000 69.89829  ? 245 LEU   A CA   1 
ATOM   1870 C  C    . LEU   A 1 245 ? -31.57092 -42.83412 -21.64016 1.000 57.62639  ? 245 LEU   A C    1 
ATOM   1871 O  O    . LEU   A 1 245 ? -32.51876 -43.60507 -21.82022 1.000 55.78151  ? 245 LEU   A O    1 
ATOM   1872 C  CB   . LEU   A 1 245 ? -30.27973 -43.56014 -19.61321 1.000 64.17448  ? 245 LEU   A CB   1 
ATOM   1873 C  CG   . LEU   A 1 245 ? -29.75299 -44.66860 -20.52888 1.000 57.01205  ? 245 LEU   A CG   1 
ATOM   1874 N  N    . TYR   A 1 246 ? -30.89864 -42.26725 -22.63554 1.000 58.49949  ? 246 TYR   A N    1 
ATOM   1875 C  CA   . TYR   A 1 246 ? -31.03574 -42.67612 -24.02248 1.000 50.45537  ? 246 TYR   A CA   1 
ATOM   1876 C  C    . TYR   A 1 246 ? -29.64025 -42.90586 -24.58294 1.000 53.92057  ? 246 TYR   A C    1 
ATOM   1877 O  O    . TYR   A 1 246 ? -28.63396 -42.55233 -23.96296 1.000 68.38655  ? 246 TYR   A O    1 
ATOM   1878 C  CB   . TYR   A 1 246 ? -31.79962 -41.63462 -24.85515 1.000 53.34316  ? 246 TYR   A CB   1 
ATOM   1879 C  CG   . TYR   A 1 246 ? -31.08953 -40.30725 -25.00085 1.000 59.34341  ? 246 TYR   A CG   1 
ATOM   1880 C  CD1  . TYR   A 1 246 ? -31.22014 -39.31698 -24.03661 1.000 64.01487  ? 246 TYR   A CD1  1 
ATOM   1881 C  CD2  . TYR   A 1 246 ? -30.29248 -40.04256 -26.10808 1.000 63.13205  ? 246 TYR   A CD2  1 
ATOM   1882 C  CE1  . TYR   A 1 246 ? -30.57282 -38.10147 -24.16870 1.000 74.93662  ? 246 TYR   A CE1  1 
ATOM   1883 C  CE2  . TYR   A 1 246 ? -29.64135 -38.83223 -26.24845 1.000 71.29478  ? 246 TYR   A CE2  1 
ATOM   1884 C  CZ   . TYR   A 1 246 ? -29.78557 -37.86492 -25.27683 1.000 77.45843  ? 246 TYR   A CZ   1 
ATOM   1885 O  OH   . TYR   A 1 246 ? -29.13857 -36.65824 -25.41463 1.000 81.30522  ? 246 TYR   A OH   1 
ATOM   1886 N  N    . PHE   A 1 247 ? -29.57819 -43.50742 -25.76423 1.000 40.50277  ? 247 PHE   A N    1 
ATOM   1887 C  CA   . PHE   A 1 247 ? -28.31229 -43.83860 -26.39756 1.000 42.95026  ? 247 PHE   A CA   1 
ATOM   1888 C  C    . PHE   A 1 247 ? -28.13265 -43.04178 -27.68246 1.000 58.99863  ? 247 PHE   A C    1 
ATOM   1889 O  O    . PHE   A 1 247 ? -29.08271 -42.85456 -28.44953 1.000 48.38560  ? 247 PHE   A O    1 
ATOM   1890 C  CB   . PHE   A 1 247 ? -28.22178 -45.33774 -26.69959 1.000 38.17381  ? 247 PHE   A CB   1 
ATOM   1891 C  CG   . PHE   A 1 247 ? -28.46417 -46.21915 -25.50438 1.000 49.10765  ? 247 PHE   A CG   1 
ATOM   1892 C  CD1  . PHE   A 1 247 ? -27.65351 -46.12974 -24.38320 1.000 41.71019  ? 247 PHE   A CD1  1 
ATOM   1893 C  CD2  . PHE   A 1 247 ? -29.49294 -47.15003 -25.50906 1.000 44.92103  ? 247 PHE   A CD2  1 
ATOM   1894 C  CE1  . PHE   A 1 247 ? -27.86994 -46.94370 -23.28361 1.000 36.35567  ? 247 PHE   A CE1  1 
ATOM   1895 C  CE2  . PHE   A 1 247 ? -29.71402 -47.96938 -24.41222 1.000 34.25587  ? 247 PHE   A CE2  1 
ATOM   1896 C  CZ   . PHE   A 1 247 ? -28.90212 -47.86389 -23.29791 1.000 32.39355  ? 247 PHE   A CZ   1 
ATOM   1897 N  N    . GLN   A 1 248 ? -26.90835 -42.56922 -27.90392 1.000 56.88652  ? 248 GLN   A N    1 
ATOM   1898 C  CA   . GLN   A 1 248 ? -26.49899 -41.96226 -29.16281 1.000 61.06315  ? 248 GLN   A CA   1 
ATOM   1899 C  C    . GLN   A 1 248 ? -25.41948 -42.84031 -29.77501 1.000 57.82494  ? 248 GLN   A C    1 
ATOM   1900 O  O    . GLN   A 1 248 ? -24.45633 -43.20887 -29.09479 1.000 65.53392  ? 248 GLN   A O    1 
ATOM   1901 C  CB   . GLN   A 1 248 ? -25.98091 -40.53546 -28.95608 1.000 72.96529  ? 248 GLN   A CB   1 
ATOM   1902 N  N    . SER   A 1 249 ? -25.58377 -43.18229 -31.05046 1.000 57.07037  ? 249 SER   A N    1 
ATOM   1903 C  CA   . SER   A 1 249 ? -24.69223 -44.14389 -31.68614 1.000 68.97394  ? 249 SER   A CA   1 
ATOM   1904 C  C    . SER   A 1 249 ? -23.30140 -43.56551 -31.92457 1.000 80.24583  ? 249 SER   A C    1 
ATOM   1905 O  O    . SER   A 1 249 ? -22.92943 -43.28709 -33.06883 1.000 90.37040  ? 249 SER   A O    1 
ATOM   1906 C  CB   . SER   A 1 249 ? -25.29520 -44.63361 -33.00525 1.000 59.78658  ? 249 SER   A CB   1 
ATOM   1907 N  N    . HIS   A 1 250 ? -22.52563 -43.38464 -30.85607 1.000 80.22023  ? 250 HIS   A N    1 
ATOM   1908 C  CA   . HIS   A 1 250 ? -21.12283 -43.02643 -31.00883 1.000 78.01040  ? 250 HIS   A CA   1 
ATOM   1909 C  C    . HIS   A 1 250 ? -20.38345 -44.12947 -31.76330 1.000 74.02102  ? 250 HIS   A C    1 
ATOM   1910 O  O    . HIS   A 1 250 ? -20.81297 -45.28530 -31.80666 1.000 70.00057  ? 250 HIS   A O    1 
ATOM   1911 C  CB   . HIS   A 1 250 ? -20.47147 -42.79089 -29.64501 1.000 72.45583  ? 250 HIS   A CB   1 
ATOM   1912 C  CG   . HIS   A 1 250 ? -20.91814 -41.53257 -28.96660 1.000 82.95706  ? 250 HIS   A CG   1 
ATOM   1913 N  ND1  . HIS   A 1 250 ? -20.71478 -41.29978 -27.62309 1.000 82.46621  ? 250 HIS   A ND1  1 
ATOM   1914 C  CD2  . HIS   A 1 250 ? -21.55437 -40.43730 -29.44545 1.000 89.36456  ? 250 HIS   A CD2  1 
ATOM   1915 C  CE1  . HIS   A 1 250 ? -21.20749 -40.11657 -27.30311 1.000 81.44424  ? 250 HIS   A CE1  1 
ATOM   1916 N  NE2  . HIS   A 1 250 ? -21.72297 -39.57251 -28.39087 1.000 99.87443  ? 250 HIS   A NE2  1 
ATOM   1917 N  N    . HIS   A 1 251 ? -19.25512 -43.76298 -32.36609 1.000 78.96105  ? 251 HIS   A N    1 
ATOM   1918 C  CA   . HIS   A 1 251 ? -18.52534 -44.67034 -33.24024 1.000 84.85755  ? 251 HIS   A CA   1 
ATOM   1919 C  C    . HIS   A 1 251 ? -17.07300 -44.78512 -32.80112 1.000 90.22006  ? 251 HIS   A C    1 
ATOM   1920 O  O    . HIS   A 1 251 ? -16.45204 -43.79468 -32.40424 1.000 84.13240  ? 251 HIS   A O    1 
ATOM   1921 C  CB   . HIS   A 1 251 ? -18.59776 -44.20286 -34.69921 1.000 90.18655  ? 251 HIS   A CB   1 
ATOM   1922 C  CG   . HIS   A 1 251 ? -19.93152 -44.43345 -35.33953 1.000 94.92745  ? 251 HIS   A CG   1 
ATOM   1923 N  ND1  . HIS   A 1 251 ? -20.31273 -45.65739 -35.84627 1.000 97.82862  ? 251 HIS   A ND1  1 
ATOM   1924 C  CD2  . HIS   A 1 251 ? -20.97471 -43.59684 -35.55299 1.000 87.02119  ? 251 HIS   A CD2  1 
ATOM   1925 C  CE1  . HIS   A 1 251 ? -21.53264 -45.56469 -36.34491 1.000 92.72841  ? 251 HIS   A CE1  1 
ATOM   1926 N  NE2  . HIS   A 1 251 ? -21.95691 -44.32474 -36.17980 1.000 88.95705  ? 251 HIS   A NE2  1 
ATOM   1927 N  N    . HIS   A 1 252 ? -16.53897 -46.00071 -32.87878 1.000 93.91148  ? 252 HIS   A N    1 
ATOM   1928 C  CA   . HIS   A 1 252 ? -15.14382 -46.26020 -32.54052 1.000 93.11970  ? 252 HIS   A CA   1 
ATOM   1929 C  C    . HIS   A 1 252 ? -14.21285 -45.74868 -33.63375 1.000 90.36941  ? 252 HIS   A C    1 
ATOM   1930 O  O    . HIS   A 1 252 ? -13.85489 -46.48732 -34.55248 1.000 92.64788  ? 252 HIS   A O    1 
ATOM   1931 C  CB   . HIS   A 1 252 ? -14.91330 -47.75765 -32.31497 1.000 92.33705  ? 252 HIS   A CB   1 
ATOM   1932 C  CG   . HIS   A 1 252 ? -15.33905 -48.24002 -30.96290 1.000 96.53952  ? 252 HIS   A CG   1 
ATOM   1933 N  ND1  . HIS   A 1 252 ? -16.17270 -49.32366 -30.78746 1.000 91.47233  ? 252 HIS   A ND1  1 
ATOM   1934 C  CD2  . HIS   A 1 252 ? -15.04039 -47.79065 -29.72085 1.000 95.87987  ? 252 HIS   A CD2  1 
ATOM   1935 C  CE1  . HIS   A 1 252 ? -16.37256 -49.51856 -29.49616 1.000 85.31957  ? 252 HIS   A CE1  1 
ATOM   1936 N  NE2  . HIS   A 1 252 ? -15.69668 -48.60188 -28.82715 1.000 88.39146  ? 252 HIS   A NE2  1 
HETATM 1937 N  N12  . A1AV0 B 2 .   ? -39.40510 -8.12199  4.99674   1.000 22.78607  ? 301 A1AV0 A N12  1 
HETATM 1938 C  C13  . A1AV0 B 2 .   ? -39.63198 -7.64381  3.65161   1.000 29.69495  ? 301 A1AV0 A C13  1 
HETATM 1939 C  C17  . A1AV0 B 2 .   ? -39.65182 -9.54536  5.10649   1.000 24.83149  ? 301 A1AV0 A C17  1 
HETATM 1940 C  C21  . A1AV0 B 2 .   ? -36.28804 -10.61688 1.93438   1.000 23.00044  ? 301 A1AV0 A C21  1 
HETATM 1941 C  C22  . A1AV0 B 2 .   ? -35.59005 -9.53445  1.40892   1.000 29.08807  ? 301 A1AV0 A C22  1 
HETATM 1942 C  C24  . A1AV0 B 2 .   ? -33.56024 -10.37307 2.42084   1.000 30.69561  ? 301 A1AV0 A C24  1 
HETATM 1943 C  C26  . A1AV0 B 2 .   ? -35.63921 -11.58325 2.71326   1.000 29.76869  ? 301 A1AV0 A C26  1 
HETATM 1944 C  C28  . A1AV0 B 2 .   ? -31.11266 -10.72095 3.28016   1.000 40.54393  ? 301 A1AV0 A C28  1 
HETATM 1945 C  C02  . A1AV0 B 2 .   ? -39.57909 -7.17806  8.43273   1.000 25.95941  ? 301 A1AV0 A C02  1 
HETATM 1946 C  C04  . A1AV0 B 2 .   ? -39.46056 -7.28395  6.15858   1.000 25.20874  ? 301 A1AV0 A C04  1 
HETATM 1947 C  C05  . A1AV0 B 2 .   ? -39.42631 -5.90575  6.05019   1.000 19.98678  ? 301 A1AV0 A C05  1 
HETATM 1948 C  C06  . A1AV0 B 2 .   ? -39.48508 -5.14559  7.20384   1.000 33.22401  ? 301 A1AV0 A C06  1 
HETATM 1949 C  C07  . A1AV0 B 2 .   ? -39.56468 -5.79226  8.42999   1.000 24.14306  ? 301 A1AV0 A C07  1 
HETATM 1950 C  C08  . A1AV0 B 2 .   ? -39.47025 -3.62327  7.11715   1.000 27.91819  ? 301 A1AV0 A C08  1 
HETATM 1951 C  C14  . A1AV0 B 2 .   ? -38.66101 -8.36848  2.72830   1.000 27.18682  ? 301 A1AV0 A C14  1 
HETATM 1952 C  C16  . A1AV0 B 2 .   ? -38.71714 -10.29836 4.17585   1.000 21.96015  ? 301 A1AV0 A C16  1 
HETATM 1953 C  C23  . A1AV0 B 2 .   ? -34.21263 -9.41702  1.65398   1.000 30.65856  ? 301 A1AV0 A C23  1 
HETATM 1954 C  C25  . A1AV0 B 2 .   ? -34.27619 -11.46274 2.95200   1.000 34.51156  ? 301 A1AV0 A C25  1 
HETATM 1955 C  C30  . A1AV0 B 2 .   ? -29.66870 -10.21307 3.27688   1.000 30.63873  ? 301 A1AV0 A C30  1 
HETATM 1956 C  C31  . A1AV0 B 2 .   ? -31.87447 -8.80983  1.72823   1.000 37.24737  ? 301 A1AV0 A C31  1 
HETATM 1957 C  C32  . A1AV0 B 2 .   ? -33.21162 -8.36101  1.20910   1.000 36.31768  ? 301 A1AV0 A C32  1 
HETATM 1958 F  F09  . A1AV0 B 2 .   ? -38.26470 -3.15151  7.47304   1.000 33.11689  ? 301 A1AV0 A F09  1 
HETATM 1959 F  F10  . A1AV0 B 2 .   ? -40.40266 -3.12303  7.94720   1.000 36.87064  ? 301 A1AV0 A F10  1 
HETATM 1960 F  F11  . A1AV0 B 2 .   ? -39.75466 -3.23077  5.86024   1.000 33.74520  ? 301 A1AV0 A F11  1 
HETATM 1961 N  N03  . A1AV0 B 2 .   ? -39.53078 -7.86948  7.32551   1.000 24.27135  ? 301 A1AV0 A N03  1 
HETATM 1962 N  N15  . A1AV0 B 2 .   ? -38.81253 -9.81489  2.80956   1.000 28.06627  ? 301 A1AV0 A N15  1 
HETATM 1963 N  N27  . A1AV0 B 2 .   ? -32.11539 -10.00711 2.52066   1.000 44.11112  ? 301 A1AV0 A N27  1 
HETATM 1964 O  O19  . A1AV0 B 2 .   ? -38.52091 -12.14780 1.74366   1.000 31.32898  ? 301 A1AV0 A O19  1 
HETATM 1965 O  O20  . A1AV0 B 2 .   ? -38.42955 -10.35861 0.27439   1.000 22.97829  ? 301 A1AV0 A O20  1 
HETATM 1966 O  O29  . A1AV0 B 2 .   ? -31.41136 -11.68933 3.89759   1.000 32.50274  ? 301 A1AV0 A O29  1 
HETATM 1967 S  S18  . A1AV0 B 2 .   ? -38.06242 -10.76471 1.63015   1.000 25.29737  ? 301 A1AV0 A S18  1 
HETATM 1968 CL CL01 . A1AV0 B 2 .   ? -39.67548 -8.07702  9.96229   1.000 31.92788  ? 301 A1AV0 A CL01 1 
HETATM 1969 C  C1   . PEG   C 3 .   ? -42.81514 -18.14567 14.56334  1.000 57.74304  ? 302 PEG   A C1   1 
HETATM 1970 O  O1   . PEG   C 3 .   ? -42.69201 -18.98141 15.70199  1.000 64.45352  ? 302 PEG   A O1   1 
HETATM 1971 C  C2   . PEG   C 3 .   ? -41.53913 -18.09106 13.78208  1.000 46.91714  ? 302 PEG   A C2   1 
HETATM 1972 O  O2   . PEG   C 3 .   ? -41.23916 -16.74092 13.45854  1.000 52.95507  ? 302 PEG   A O2   1 
HETATM 1973 C  C3   . PEG   C 3 .   ? -42.19136 -16.15153 12.58571  1.000 52.82570  ? 302 PEG   A C3   1 
HETATM 1974 C  C4   . PEG   C 3 .   ? -41.99573 -14.66596 12.56235  1.000 54.75738  ? 302 PEG   A C4   1 
HETATM 1975 O  O4   . PEG   C 3 .   ? -42.51252 -14.05417 13.73309  1.000 69.71170  ? 302 PEG   A O4   1 
HETATM 1976 C  C1   . PEG   D 3 .   ? -42.17695 -1.25536  21.37828  1.000 56.21209  ? 303 PEG   A C1   1 
HETATM 1977 O  O1   . PEG   D 3 .   ? -42.44435 -2.06078  22.51431  1.000 79.90853  ? 303 PEG   A O1   1 
HETATM 1978 C  C2   . PEG   D 3 .   ? -43.26290 -1.37881  20.35435  1.000 55.82925  ? 303 PEG   A C2   1 
HETATM 1979 O  O2   . PEG   D 3 .   ? -43.02747 -0.45842  19.29922  1.000 44.59192  ? 303 PEG   A O2   1 
HETATM 1980 C  C3   . PEG   D 3 .   ? -44.12974 -0.34656  18.41045  1.000 43.52127  ? 303 PEG   A C3   1 
HETATM 1981 C  C4   . PEG   D 3 .   ? -44.30228 -1.63045  17.66001  1.000 40.87963  ? 303 PEG   A C4   1 
HETATM 1982 O  O4   . PEG   D 3 .   ? -45.62475 -1.77178  17.16828  1.000 61.85876  ? 303 PEG   A O4   1 
HETATM 1983 MN MN   . MN    E 4 .   ? -29.42369 -19.52034 0.68880   1.000 32.68499  ? 304 MN    A MN   1 
HETATM 1984 MN MN   . MN    F 4 .   ? -29.19802 -18.00334 3.60332   1.000 25.61868  ? 305 MN    A MN   1 
HETATM 1985 O  O    . HOH   G 5 .   ? -43.72296 -25.79222 15.19288  1.000 27.02648  ? 401 HOH   A O    1 
HETATM 1986 O  O    . HOH   G 5 .   ? -31.42864 -42.55763 -28.45731 1.000 37.03439  ? 402 HOH   A O    1 
HETATM 1987 O  O    . HOH   G 5 .   ? -27.67214 -41.93279 21.10172  1.000 41.21048  ? 403 HOH   A O    1 
HETATM 1988 O  O    . HOH   G 5 .   ? -28.63635 -18.29808 1.76232   1.000 41.62882  ? 404 HOH   A O    1 
HETATM 1989 O  O    . HOH   G 5 .   ? -13.27497 -35.81687 16.81419  1.000 44.80803  ? 405 HOH   A O    1 
HETATM 1990 O  O    . HOH   G 5 .   ? -24.51499 -42.46121 -26.81000 0.50  64.72605  ? 406 HOH   A O    1 
HETATM 1991 O  O    . HOH   G 5 .   ? -30.03690 -41.90191 -0.56101  1.000 52.48510  ? 407 HOH   A O    1 
HETATM 1992 O  O    . HOH   G 5 .   ? -33.39919 -41.72837 2.01446   1.000 51.68249  ? 408 HOH   A O    1 
HETATM 1993 O  O    . HOH   G 5 .   ? -42.59081 -17.24866 -1.18932  1.000 34.57067  ? 409 HOH   A O    1 
HETATM 1994 O  O    . HOH   G 5 .   ? -48.46870 -13.53236 -2.96449  1.000 48.10164  ? 410 HOH   A O    1 
HETATM 1995 O  O    . HOH   G 5 .   ? -50.61851 -19.77978 0.41214   1.000 31.23383  ? 411 HOH   A O    1 
HETATM 1996 O  O    . HOH   G 5 .   ? -48.13185 -17.77206 11.35780  1.000 32.33410  ? 412 HOH   A O    1 
HETATM 1997 O  O    . HOH   G 5 .   ? -18.29438 -13.44437 7.36048   1.000 63.26716  ? 413 HOH   A O    1 
HETATM 1998 O  O    . HOH   G 5 .   ? -25.03247 -4.86831  -3.84778  1.000 59.85195  ? 414 HOH   A O    1 
HETATM 1999 O  O    . HOH   G 5 .   ? -17.97333 -24.19415 2.33460   1.000 34.07173  ? 415 HOH   A O    1 
HETATM 2000 O  O    . HOH   G 5 .   ? -20.11439 -34.58863 18.01259  1.000 40.34100  ? 416 HOH   A O    1 
HETATM 2001 O  O    . HOH   G 5 .   ? -33.17866 -32.55172 -14.01786 1.000 57.48532  ? 417 HOH   A O    1 
HETATM 2002 O  O    . HOH   G 5 .   ? -44.00157 -34.35750 -3.40937  1.000 32.96496  ? 418 HOH   A O    1 
HETATM 2003 O  O    . HOH   G 5 .   ? -42.23978 -22.86627 -8.63491  1.000 43.22769  ? 419 HOH   A O    1 
HETATM 2004 O  O    . HOH   G 5 .   ? -40.16009 -34.44627 17.02392  1.000 36.63586  ? 420 HOH   A O    1 
HETATM 2005 O  O    . HOH   G 5 .   ? -51.02973 -35.92640 3.09991   1.000 33.63500  ? 421 HOH   A O    1 
HETATM 2006 O  O    . HOH   G 5 .   ? -31.47949 -14.41234 -3.06187  1.000 52.72545  ? 422 HOH   A O    1 
HETATM 2007 O  O    . HOH   G 5 .   ? -48.26344 -18.30257 2.66335   1.000 26.41358  ? 423 HOH   A O    1 
HETATM 2008 O  O    . HOH   G 5 .   ? -29.78291 -20.67944 12.24387  1.000 26.14365  ? 424 HOH   A O    1 
HETATM 2009 O  O    . HOH   G 5 .   ? -32.20406 -19.45069 11.88076  1.000 29.82211  ? 425 HOH   A O    1 
HETATM 2010 O  O    . HOH   G 5 .   ? -26.53144 -18.66751 16.03741  1.000 52.88184  ? 426 HOH   A O    1 
HETATM 2011 O  O    . HOH   G 5 .   ? -38.70307 -22.89458 -7.15921  1.000 27.07896  ? 427 HOH   A O    1 
HETATM 2012 O  O    . HOH   G 5 .   ? -27.34945 -9.38249  13.72110  1.000 57.43669  ? 428 HOH   A O    1 
HETATM 2013 O  O    . HOH   G 5 .   ? -25.46779 -23.43936 1.57021   1.000 30.84005  ? 429 HOH   A O    1 
HETATM 2014 O  O    . HOH   G 5 .   ? -34.09128 -36.61437 14.36806  1.000 28.85035  ? 430 HOH   A O    1 
HETATM 2015 O  O    . HOH   G 5 .   ? -39.30531 -43.74850 6.18948   1.000 46.03785  ? 431 HOH   A O    1 
HETATM 2016 O  O    . HOH   G 5 .   ? -35.48444 -21.07084 13.20964  1.000 25.58012  ? 432 HOH   A O    1 
HETATM 2017 O  O    . HOH   G 5 .   ? -44.05800 -21.91294 -11.40147 1.000 42.29934  ? 433 HOH   A O    1 
HETATM 2018 O  O    . HOH   G 5 .   ? -18.96478 -22.04241 4.06657   1.000 31.20837  ? 434 HOH   A O    1 
HETATM 2019 O  O    . HOH   G 5 .   ? -30.91495 -17.21983 10.86090  1.000 34.46385  ? 435 HOH   A O    1 
HETATM 2020 O  O    . HOH   G 5 .   ? -24.38622 -24.02109 -3.66927  1.000 39.74961  ? 436 HOH   A O    1 
HETATM 2021 O  O    . HOH   G 5 .   ? -40.50827 -17.45740 -3.11343  1.000 27.94333  ? 437 HOH   A O    1 
HETATM 2022 O  O    . HOH   G 5 .   ? -31.91882 -21.90745 -5.64444  1.000 53.11312  ? 438 HOH   A O    1 
HETATM 2023 O  O    . HOH   G 5 .   ? -50.00398 -30.15330 11.18771  1.000 37.42683  ? 439 HOH   A O    1 
HETATM 2024 O  O    . HOH   G 5 .   ? -42.99891 -33.03951 11.46616  1.000 24.17646  ? 440 HOH   A O    1 
HETATM 2025 O  O    . HOH   G 5 .   ? -48.66556 -8.29391  13.91278  1.000 37.25232  ? 441 HOH   A O    1 
HETATM 2026 O  O    . HOH   G 5 .   ? -50.84150 -33.55989 1.78642   1.000 32.65852  ? 442 HOH   A O    1 
HETATM 2027 O  O    . HOH   G 5 .   ? -44.78511 -35.54649 -1.00250  1.000 28.69853  ? 443 HOH   A O    1 
HETATM 2028 O  O    . HOH   G 5 .   ? -35.15705 -34.42708 -7.14691  1.000 31.42331  ? 444 HOH   A O    1 
HETATM 2029 O  O    . HOH   G 5 .   ? -33.11272 -38.75630 13.12456  1.000 35.22696  ? 445 HOH   A O    1 
HETATM 2030 O  O    . HOH   G 5 .   ? -53.30667 -33.52863 5.51760   1.000 49.57426  ? 446 HOH   A O    1 
HETATM 2031 O  O    . HOH   G 5 .   ? -27.14655 -19.42913 11.42289  1.000 35.96343  ? 447 HOH   A O    1 
HETATM 2032 O  O    . HOH   G 5 .   ? -15.74395 -21.88866 4.56324   1.000 45.57822  ? 448 HOH   A O    1 
HETATM 2033 O  O    . HOH   G 5 .   ? -46.13204 -24.77076 -9.23724  1.000 54.10956  ? 449 HOH   A O    1 
HETATM 2034 O  O    . HOH   G 5 .   ? -48.72069 -39.53212 2.63615   1.000 31.47775  ? 450 HOH   A O    1 
HETATM 2035 O  O    . HOH   G 5 .   ? -49.09663 -20.26071 4.76651   1.000 29.31726  ? 451 HOH   A O    1 
HETATM 2036 O  O    . HOH   G 5 .   ? -26.94874 -26.41424 -8.10187  1.000 40.11636  ? 452 HOH   A O    1 
HETATM 2037 O  O    . HOH   G 5 .   ? -9.90946  -27.23445 20.30751  1.000 53.27128  ? 453 HOH   A O    1 
HETATM 2038 O  O    . HOH   G 5 .   ? -45.21316 -14.98518 2.32435   1.000 22.79731  ? 454 HOH   A O    1 
HETATM 2039 O  O    . HOH   G 5 .   ? -37.48836 -39.82583 13.59979  1.000 38.75671  ? 455 HOH   A O    1 
HETATM 2040 O  O    . HOH   G 5 .   ? -33.18276 -15.98127 10.21882  1.000 39.77312  ? 456 HOH   A O    1 
HETATM 2041 O  O    . HOH   G 5 .   ? -35.18299 -16.43964 12.43910  1.000 38.75232  ? 457 HOH   A O    1 
HETATM 2042 O  O    . HOH   G 5 .   ? -29.47732 -45.43773 7.97248   1.000 28.03238  ? 458 HOH   A O    1 
HETATM 2043 O  O    . HOH   G 5 .   ? -36.93073 -37.12908 14.57739  1.000 34.41491  ? 459 HOH   A O    1 
HETATM 2044 O  O    . HOH   G 5 .   ? -18.44056 -40.23538 10.14967  1.000 43.64685  ? 460 HOH   A O    1 
HETATM 2045 O  O    . HOH   G 5 .   ? -46.58114 -15.27049 9.39529   1.000 43.58632  ? 461 HOH   A O    1 
HETATM 2046 O  O    . HOH   G 5 .   ? -48.52492 -30.54977 -3.60782  1.000 32.10203  ? 462 HOH   A O    1 
HETATM 2047 O  O    . HOH   G 5 .   ? -42.26677 -42.95121 12.15329  1.000 44.39611  ? 463 HOH   A O    1 
HETATM 2048 O  O    . HOH   G 5 .   ? -39.05191 -13.80798 5.65217   1.000 21.94230  ? 464 HOH   A O    1 
HETATM 2049 O  O    . HOH   G 5 .   ? -18.22970 -46.52168 8.53843   1.000 46.20070  ? 465 HOH   A O    1 
HETATM 2050 O  O    . HOH   G 5 .   ? -39.92982 -39.52429 -6.54511  1.000 53.65676  ? 466 HOH   A O    1 
HETATM 2051 O  O    . HOH   G 5 .   ? -29.51545 -28.47206 0.16401   1.000 25.48097  ? 467 HOH   A O    1 
HETATM 2052 O  O    . HOH   G 5 .   ? -45.30720 -15.16019 -7.19498  1.000 48.97819  ? 468 HOH   A O    1 
HETATM 2053 O  O    . HOH   G 5 .   ? -31.00412 -31.27113 -12.43677 1.000 37.27048  ? 469 HOH   A O    1 
HETATM 2054 O  O    . HOH   G 5 .   ? -51.82077 -26.71269 1.77979   1.000 37.37826  ? 470 HOH   A O    1 
HETATM 2055 O  O    . HOH   G 5 .   ? -38.65009 -21.11576 15.12767  1.000 44.61029  ? 471 HOH   A O    1 
HETATM 2056 O  O    . HOH   G 5 .   ? -36.66816 -39.03744 -4.96745  1.000 47.64309  ? 472 HOH   A O    1 
HETATM 2057 O  O    . HOH   G 5 .   ? -48.38028 -40.39211 0.42289   1.000 55.28324  ? 473 HOH   A O    1 
HETATM 2058 O  O    . HOH   G 5 .   ? -13.19894 -23.05692 12.20764  1.000 37.57842  ? 474 HOH   A O    1 
HETATM 2059 O  O    . HOH   G 5 .   ? -50.14434 -11.23042 8.74793   1.000 51.23697  ? 475 HOH   A O    1 
HETATM 2060 O  O    . HOH   G 5 .   ? -52.94383 -33.73976 10.31661  1.000 48.20859  ? 476 HOH   A O    1 
HETATM 2061 O  O    . HOH   G 5 .   ? -20.55168 -18.55672 17.30513  1.000 43.93721  ? 477 HOH   A O    1 
HETATM 2062 O  O    . HOH   G 5 .   ? -11.83763 -13.51721 12.87706  1.000 58.51283  ? 478 HOH   A O    1 
HETATM 2063 O  O    . HOH   G 5 .   ? -11.27402 -25.73915 5.41063   1.000 49.01592  ? 479 HOH   A O    1 
HETATM 2064 O  O    . HOH   G 5 .   ? -31.18724 -28.55754 21.36816  1.000 44.56379  ? 480 HOH   A O    1 
HETATM 2065 O  O    . HOH   G 5 .   ? -23.64677 -38.78092 22.42014  1.000 49.91358  ? 481 HOH   A O    1 
HETATM 2066 O  O    . HOH   G 5 .   ? -46.11847 -17.82411 14.12581  1.000 44.60405  ? 482 HOH   A O    1 
HETATM 2067 O  O    . HOH   G 5 .   ? -54.39534 -11.21490 5.09784   1.000 53.54877  ? 483 HOH   A O    1 
HETATM 2068 O  O    . HOH   G 5 .   ? -39.49174 -42.25296 10.60411  1.000 36.63193  ? 484 HOH   A O    1 
HETATM 2069 O  O    . HOH   G 5 .   ? -53.78033 -6.73492  0.33324   1.000 35.32776  ? 485 HOH   A O    1 
HETATM 2070 O  O    . HOH   G 5 .   ? -42.81990 -10.21905 -2.52679  1.000 47.34626  ? 486 HOH   A O    1 
HETATM 2071 O  O    . HOH   G 5 .   ? -31.77994 -35.35026 18.77947  1.000 42.83962  ? 487 HOH   A O    1 
HETATM 2072 O  O    . HOH   G 5 .   ? -36.94034 -23.23486 -13.36403 1.000 41.32720  ? 488 HOH   A O    1 
HETATM 2073 O  O    . HOH   G 5 .   ? -30.75353 -40.75695 16.06959  1.000 41.84232  ? 489 HOH   A O    1 
HETATM 2074 O  O    . HOH   G 5 .   ? -52.16018 -8.27418  8.40966   1.000 52.70404  ? 490 HOH   A O    1 
HETATM 2075 O  O    . HOH   G 5 .   ? -17.84561 -25.43266 -2.34077  1.000 42.68383  ? 491 HOH   A O    1 
HETATM 2076 O  O    . HOH   G 5 .   ? -54.16373 -19.80949 -1.83414  1.000 45.05579  ? 492 HOH   A O    1 
HETATM 2077 O  O    . HOH   G 5 .   ? -35.42590 -12.66990 -5.68151  1.000 49.62183  ? 493 HOH   A O    1 
HETATM 2078 O  O    . HOH   G 5 .   ? -53.84300 -8.24473  4.38699   1.000 39.05229  ? 494 HOH   A O    1 
HETATM 2079 O  O    . HOH   G 5 .   ? -37.50258 -16.42558 12.86284  1.000 44.39825  ? 495 HOH   A O    1 
HETATM 2080 O  O    . HOH   G 5 .   ? -44.60224 -42.93226 1.30895   1.000 46.43553  ? 496 HOH   A O    1 
HETATM 2081 O  O    . HOH   G 5 .   ? -23.95208 -45.96695 5.13226   1.000 41.75431  ? 497 HOH   A O    1 
HETATM 2082 O  O    . HOH   G 5 .   ? -10.03744 -24.24715 20.54886  1.000 66.61652  ? 498 HOH   A O    1 
HETATM 2083 O  O    . HOH   G 5 .   ? -46.87328 -32.56426 12.68387  1.000 48.23153  ? 499 HOH   A O    1 
HETATM 2084 O  O    . HOH   G 5 .   ? -29.43229 -15.93707 0.84977   1.000 33.56177  ? 500 HOH   A O    1 
HETATM 2085 O  O    . HOH   G 5 .   ? -33.94496 -1.59344  1.43064   1.000 56.49751  ? 501 HOH   A O    1 
HETATM 2086 O  O    . HOH   G 5 .   ? -42.80044 -17.17232 -5.37492  1.000 27.37844  ? 502 HOH   A O    1 
HETATM 2087 O  O    . HOH   G 5 .   ? -9.76742  -25.13439 14.23878  1.000 51.47862  ? 503 HOH   A O    1 
HETATM 2088 O  O    . HOH   G 5 .   ? -14.17425 -23.99336 9.49664   1.000 35.22157  ? 504 HOH   A O    1 
HETATM 2089 O  O    . HOH   G 5 .   ? -29.53305 -12.92454 0.71194   1.000 47.85971  ? 505 HOH   A O    1 
HETATM 2090 O  O    . HOH   G 5 .   ? -49.34924 -14.03138 8.83051   1.000 50.91244  ? 506 HOH   A O    1 
HETATM 2091 O  O    . HOH   G 5 .   ? -51.923   -24.458   -5.072    1.000 53.36632  ? 507 HOH   A O    1 
HETATM 2092 O  O    . HOH   G 5 .   ? -51.69874 -29.19253 3.22535   1.000 52.62815  ? 508 HOH   A O    1 
HETATM 2093 O  O    . HOH   G 5 .   ? -32.63175 -36.62850 16.93959  1.000 46.43215  ? 509 HOH   A O    1 
HETATM 2094 O  O    . HOH   G 5 .   ? -32.40665 -38.45154 -4.67599  1.000 51.37190  ? 510 HOH   A O    1 
HETATM 2095 O  O    . HOH   G 5 .   ? -32.36457 -43.45323 3.39833   1.000 57.69756  ? 511 HOH   A O    1 
HETATM 2096 O  O    . HOH   G 5 .   ? -54.10295 -27.24390 0.13330   1.000 56.05012  ? 512 HOH   A O    1 
HETATM 2097 O  O    . HOH   G 5 .   ? -54.29526 -25.52280 10.11566  1.000 59.53829  ? 513 HOH   A O    1 
HETATM 2098 O  O    . HOH   G 5 .   ? -34.77826 -36.92945 -5.57957  1.000 38.91346  ? 514 HOH   A O    1 
HETATM 2099 O  O    . HOH   G 5 .   ? -52.686   -26.149   -6.479    1.000 51.55260  ? 515 HOH   A O    1 
HETATM 2100 O  O    . HOH   G 5 .   ? -47.42800 -35.18693 -2.85169  1.000 54.64621  ? 516 HOH   A O    1 
HETATM 2101 O  O    . HOH   G 5 .   ? -34.18365 -18.54822 13.89715  1.000 39.85743  ? 517 HOH   A O    1 
HETATM 2102 O  O    . HOH   G 5 .   ? -7.19770  -28.57435 19.31109  1.000 64.01655  ? 518 HOH   A O    1 
HETATM 2103 O  O    . HOH   G 5 .   ? -46.00494 -27.19220 -10.08592 1.000 49.74833  ? 519 HOH   A O    1 
HETATM 2104 O  O    . HOH   G 5 .   ? -48.89119 -33.20115 -2.79550  1.000 44.61697  ? 520 HOH   A O    1 
HETATM 2105 O  O    . HOH   G 5 .   ? -52.43341 -31.44221 2.83366   1.000 43.33577  ? 521 HOH   A O    1 
HETATM 2106 O  O    . HOH   G 5 .   ? -51.553   -11.318   -2.112    1.000 44.09470  ? 522 HOH   A O    1 
HETATM 2107 O  O    . HOH   G 5 .   ? -41.35566 -44.61434 8.05905   1.000 51.64613  ? 523 HOH   A O    1 
HETATM 2108 O  O    . HOH   G 5 .   ? -28.94874 -45.60871 5.00099   1.000 44.14528  ? 524 HOH   A O    1 
HETATM 2109 O  O    . HOH   G 5 .   ? -51.123   -8.465    -3.324    1.000 49.29146  ? 525 HOH   A O    1 
HETATM 2110 O  O    . HOH   G 5 .   ? -44.06811 -34.43051 13.30509  1.000 38.05392  ? 526 HOH   A O    1 
HETATM 2111 O  O    . HOH   G 5 .   ? -49.92221 -41.87477 3.53963   1.000 53.31859  ? 527 HOH   A O    1 
HETATM 2112 O  O    . HOH   G 5 .   ? -44.48251 -25.55016 -10.59340 1.000 55.15901  ? 528 HOH   A O    1 
HETATM 2113 O  O    . HOH   G 5 .   ? -50.56638 -15.57845 10.28504  1.000 54.65450  ? 529 HOH   A O    1 
HETATM 2114 O  O    . HOH   G 5 .   ? -32.18196 -1.15877  11.35865  1.000 63.14163  ? 530 HOH   A O    1 
HETATM 2115 O  O    . HOH   G 5 .   ? -32.75297 -41.00480 14.95392  1.000 53.01493  ? 531 HOH   A O    1 
HETATM 2116 O  O    . HOH   G 5 .   ? -10.32880 -23.12760 11.96361  1.000 53.45605  ? 532 HOH   A O    1 
HETATM 2117 O  O    . HOH   G 5 .   ? -23.48708 -6.40777  -4.95416  1.000 69.13184  ? 533 HOH   A O    1 
HETATM 2118 O  O    . HOH   G 5 .   ? -51.07495 -38.19778 1.33847   1.000 53.31457  ? 534 HOH   A O    1 
HETATM 2119 O  O    . HOH   G 5 .   ? -55.36053 -27.54138 10.47989  1.000 68.80375  ? 535 HOH   A O    1 
HETATM 2120 O  O    . HOH   G 5 .   ? -21.24971 -4.50813  -5.33317  1.000 67.31990  ? 536 HOH   A O    1 
HETATM 2121 O  O    . HOH   G 5 .   ? -15.88389 -8.18406  -0.21215  1.000 75.46661  ? 537 HOH   A O    1 
# 
loop_
_atom_site_anisotrop.id 
_atom_site_anisotrop.type_symbol 
_atom_site_anisotrop.pdbx_label_atom_id 
_atom_site_anisotrop.pdbx_label_alt_id 
_atom_site_anisotrop.pdbx_label_comp_id 
_atom_site_anisotrop.pdbx_label_asym_id 
_atom_site_anisotrop.pdbx_label_seq_id 
_atom_site_anisotrop.pdbx_PDB_ins_code 
_atom_site_anisotrop.U[1][1] 
_atom_site_anisotrop.U[2][2] 
_atom_site_anisotrop.U[3][3] 
_atom_site_anisotrop.U[1][2] 
_atom_site_anisotrop.U[1][3] 
_atom_site_anisotrop.U[2][3] 
_atom_site_anisotrop.pdbx_auth_seq_id 
_atom_site_anisotrop.pdbx_auth_comp_id 
_atom_site_anisotrop.pdbx_auth_asym_id 
_atom_site_anisotrop.pdbx_auth_atom_id 
1    N N   . ALA A 2   ? 0.35632 0.30728 0.41306 0.05354  -0.00615 0.03750  2   ALA A N   
2    C CA  . ALA A 2   ? 0.37875 0.34342 0.43620 0.05368  -0.00484 0.03730  2   ALA A CA  
3    C C   . ALA A 2   ? 0.33602 0.30871 0.39282 0.04492  -0.01003 0.03410  2   ALA A C   
4    O O   . ALA A 2   ? 0.31372 0.27655 0.36474 0.03967  -0.01396 0.02923  2   ALA A O   
5    C CB  . ALA A 2   ? 0.34673 0.30109 0.39565 0.05919  -0.00042 0.03269  2   ALA A CB  
6    N N   . THR A 3   ? 0.29117 0.28193 0.35433 0.04337  -0.00996 0.03668  3   THR A N   
7    C CA  . THR A 3   ? 0.27101 0.27044 0.33442 0.03555  -0.01427 0.03388  3   THR A CA  
8    C C   . THR A 3   ? 0.32774 0.32864 0.38713 0.03635  -0.01118 0.03059  3   THR A C   
9    O O   . THR A 3   ? 0.25719 0.26462 0.32036 0.04173  -0.00629 0.03345  3   THR A O   
10   C CB  . THR A 3   ? 0.27194 0.29176 0.34704 0.03247  -0.01700 0.03905  3   THR A CB  
11   O OG1 . THR A 3   ? 0.31212 0.33069 0.39055 0.03238  -0.01952 0.04276  3   THR A OG1 
12   C CG2 . THR A 3   ? 0.19555 0.22380 0.27101 0.02445  -0.02139 0.03571  3   THR A CG2 
13   N N   . LEU A 4   ? 0.26567 0.26091 0.31758 0.03133  -0.01374 0.02497  4   LEU A N   
14   C CA  . LEU A 4   ? 0.22214 0.21646 0.26868 0.03252  -0.01047 0.02179  4   LEU A CA  
15   C C   . LEU A 4   ? 0.30985 0.31853 0.36196 0.02634  -0.01230 0.02206  4   LEU A C   
16   O O   . LEU A 4   ? 0.29619 0.31002 0.35102 0.01977  -0.01762 0.02161  4   LEU A O   
17   C CB  . LEU A 4   ? 0.23115 0.20807 0.26405 0.03269  -0.01117 0.01490  4   LEU A CB  
18   C CG  . LEU A 4   ? 0.36521 0.32591 0.39201 0.03810  -0.00987 0.01287  4   LEU A CG  
19   C CD1 . LEU A 4   ? 0.30617 0.25202 0.31976 0.03838  -0.01064 0.00503  4   LEU A CD1 
20   C CD2 . LEU A 4   ? 0.37946 0.34138 0.40926 0.04668  -0.00370 0.01675  4   LEU A CD2 
21   N N   . PHE A 5   ? 0.23202 0.24699 0.28611 0.02867  -0.00760 0.02284  5   PHE A N   
22   C CA  . PHE A 5   ? 0.21822 0.24519 0.27770 0.02330  -0.00812 0.02267  5   PHE A CA  
23   C C   . PHE A 5   ? 0.25899 0.27954 0.31061 0.02563  -0.00361 0.01995  5   PHE A C   
24   O O   . PHE A 5   ? 0.24294 0.25933 0.29177 0.03267  0.00192  0.02100  5   PHE A O   
25   C CB  . PHE A 5   ? 0.23505 0.28085 0.30935 0.02341  -0.00639 0.02767  5   PHE A CB  
26   C CG  . PHE A 5   ? 0.28722 0.34146 0.36942 0.02220  -0.01047 0.03088  5   PHE A CG  
27   C CD1 . PHE A 5   ? 0.20964 0.26027 0.29228 0.02842  -0.00876 0.03421  5   PHE A CD1 
28   C CD2 . PHE A 5   ? 0.26302 0.32876 0.35192 0.01537  -0.01583 0.03072  5   PHE A CD2 
29   C CE1 . PHE A 5   ? 0.21926 0.27791 0.30896 0.02804  -0.01203 0.03787  5   PHE A CE1 
30   C CE2 . PHE A 5   ? 0.21527 0.28971 0.31105 0.01503  -0.01944 0.03402  5   PHE A CE2 
31   C CZ  . PHE A 5   ? 0.26284 0.33383 0.35903 0.02148  -0.01738 0.03787  5   PHE A CZ  
32   N N   . ILE A 6   ? 0.21519 0.23501 0.26288 0.02024  -0.00581 0.01671  6   ILE A N   
33   C CA  . ILE A 6   ? 0.29064 0.30660 0.33183 0.02201  -0.00144 0.01485  6   ILE A CA  
34   C C   . ILE A 6   ? 0.25083 0.27783 0.29924 0.01525  -0.00243 0.01523  6   ILE A C   
35   O O   . ILE A 6   ? 0.24197 0.27741 0.29777 0.00912  -0.00747 0.01555  6   ILE A O   
36   C CB  . ILE A 6   ? 0.22965 0.22939 0.25488 0.02362  -0.00281 0.00933  6   ILE A CB  
37   C CG1 . ILE A 6   ? 0.23777 0.23552 0.25999 0.01615  -0.00995 0.00597  6   ILE A CG1 
38   C CG2 . ILE A 6   ? 0.25927 0.24741 0.27798 0.03025  -0.00181 0.00811  6   ILE A CG2 
39   C CD1 . ILE A 6   ? 0.23027 0.21345 0.23758 0.01713  -0.01202 0.00001  6   ILE A CD1 
40   N N   . ALA A 7   ? 0.20637 0.23331 0.25276 0.01676  0.00269  0.01527  7   ALA A N   
41   C CA  . ALA A 7   ? 0.18978 0.22571 0.24311 0.01082  0.00292  0.01559  7   ALA A CA  
42   C C   . ALA A 7   ? 0.32338 0.35478 0.37084 0.01448  0.00955  0.01576  7   ALA A C   
43   O O   . ALA A 7   ? 0.21823 0.24269 0.25859 0.02199  0.01434  0.01636  7   ALA A O   
44   C CB  . ALA A 7   ? 0.21288 0.26572 0.28382 0.00787  0.00357  0.01924  7   ALA A CB  
45   N N   . ASP A 8   ? 0.23760 0.27308 0.28807 0.00942  0.00992  0.01536  8   ASP A N   
46   C CA  . ASP A 8   ? 0.23890 0.27295 0.28730 0.01227  0.01708  0.01690  8   ASP A CA  
47   C C   . ASP A 8   ? 0.27260 0.29285 0.30341 0.01917  0.01930  0.01464  8   ASP A C   
48   O O   . ASP A 8   ? 0.30687 0.32502 0.33457 0.02601  0.02634  0.01694  8   ASP A O   
49   C CB  . ASP A 8   ? 0.28991 0.33376 0.35113 0.01517  0.02398  0.02183  8   ASP A CB  
50   C CG  . ASP A 8   ? 0.30099 0.35989 0.38020 0.00818  0.02187  0.02323  8   ASP A CG  
51   O OD1 . ASP A 8   ? 0.37674 0.43985 0.46142 0.00212  0.02137  0.02240  8   ASP A OD1 
52   O OD2 . ASP A 8   ? 0.32842 0.39510 0.41609 0.00888  0.02049  0.02485  8   ASP A OD2 
53   N N   . LEU A 9   ? 0.26771 0.27922 0.28713 0.01752  0.01316  0.00992  9   LEU A N   
54   C CA  . LEU A 9   ? 0.29392 0.29346 0.29653 0.02326  0.01443  0.00657  9   LEU A CA  
55   C C   . LEU A 9   ? 0.26416 0.26331 0.26216 0.02295  0.01794  0.00683  9   LEU A C   
56   O O   . LEU A 9   ? 0.31797 0.31100 0.30502 0.02996  0.02260  0.00637  9   LEU A O   
57   C CB  . LEU A 9   ? 0.29911 0.29019 0.29222 0.02113  0.00665  0.00110  9   LEU A CB  
58   C CG  . LEU A 9   ? 0.34995 0.33703 0.34344 0.02392  0.00439  0.00035  9   LEU A CG  
59   C CD1 . LEU A 9   ? 0.26858 0.26485 0.27602 0.01810  0.00049  0.00310  9   LEU A CD1 
60   C CD2 . LEU A 9   ? 0.34485 0.31981 0.32490 0.02484  -0.00054 -0.00583 9   LEU A CD2 
61   N N   . HIS A 10  ? 0.23191 0.23777 0.23813 0.01542  0.01603  0.00765  10  HIS A N   
62   C CA  . HIS A 10  ? 0.33236 0.33786 0.33541 0.01458  0.01945  0.00831  10  HIS A CA  
63   C C   . HIS A 10  ? 0.27159 0.26653 0.25596 0.01894  0.01831  0.00420  10  HIS A C   
64   O O   . HIS A 10  ? 0.30756 0.29954 0.28450 0.02480  0.02445  0.00558  10  HIS A O   
65   C CB  . HIS A 10  ? 0.35761 0.36800 0.36831 0.01855  0.02909  0.01386  10  HIS A CB  
66   C CG  . HIS A 10  ? 0.37012 0.39223 0.40016 0.01391  0.03049  0.01747  10  HIS A CG  
67   N ND1 . HIS A 10  ? 0.39967 0.42947 0.44202 0.00700  0.03120  0.01888  10  HIS A ND1 
68   C CD2 . HIS A 10  ? 0.39410 0.42210 0.43350 0.01533  0.03122  0.01957  10  HIS A CD2 
69   C CE1 . HIS A 10  ? 0.37995 0.42044 0.43869 0.00422  0.03211  0.02128  10  HIS A CE1 
70   N NE2 . HIS A 10  ? 0.40501 0.44493 0.46211 0.00931  0.03216  0.02200  10  HIS A NE2 
71   N N   . LEU A 11  ? 0.33277 0.32256 0.30975 0.01638  0.01049  -0.00087 11  LEU A N   
72   C CA  . LEU A 11  ? 0.36073 0.34142 0.32054 0.02005  0.00848  -0.00579 11  LEU A CA  
73   C C   . LEU A 11  ? 0.35777 0.33909 0.31275 0.01871  0.01021  -0.00547 11  LEU A C   
74   O O   . LEU A 11  ? 0.32784 0.31491 0.29166 0.01178  0.00877  -0.00377 11  LEU A O   
75   C CB  . LEU A 11  ? 0.28247 0.25866 0.23786 0.01588  -0.00051 -0.01114 11  LEU A CB  
76   C CG  . LEU A 11  ? 0.39330 0.36688 0.35185 0.01742  -0.00271 -0.01196 11  LEU A CG  
77   C CD1 . LEU A 11  ? 0.32841 0.29881 0.28535 0.01165  -0.01138 -0.01617 11  LEU A CD1 
78   C CD2 . LEU A 11  ? 0.38125 0.34722 0.32950 0.02695  0.00141  -0.01393 11  LEU A CD2 
79   N N   . GLN A 12  ? 0.31285 0.28847 0.25357 0.02587  0.01341  -0.00722 12  GLN A N   
80   C CA  . GLN A 12  ? 0.40641 0.38192 0.34035 0.02643  0.01583  -0.00668 12  GLN A CA  
81   C C   . GLN A 12  ? 0.43531 0.40413 0.35094 0.03482  0.01657  -0.01083 12  GLN A C   
82   O O   . GLN A 12  ? 0.37856 0.34410 0.28895 0.04207  0.01901  -0.01194 12  GLN A O   
83   C CB  . GLN A 12  ? 0.34545 0.32629 0.28879 0.02785  0.02484  0.00034  12  GLN A CB  
84   C CG  . GLN A 12  ? 0.38473 0.36548 0.32819 0.03666  0.03288  0.00404  12  GLN A CG  
85   C CD  . GLN A 12  ? 0.62287 0.60955 0.57827 0.03705  0.04186  0.01140  12  GLN A CD  
86   O OE1 . GLN A 12  ? 0.58606 0.57753 0.55369 0.03712  0.04551  0.01518  12  GLN A OE1 
87   N NE2 . GLN A 12  ? 0.50298 0.48950 0.45533 0.03733  0.04568  0.01354  12  GLN A NE2 
88   N N   . THR A 13  ? 0.37131 0.33874 0.27718 0.03410  0.01442  -0.01335 13  THR A N   
89   C CA  . THR A 13  ? 0.37839 0.34086 0.26646 0.04177  0.01412  -0.01825 13  THR A CA  
90   C C   . THR A 13  ? 0.40194 0.36438 0.28414 0.05274  0.02348  -0.01471 13  THR A C   
91   O O   . THR A 13  ? 0.45632 0.41512 0.32506 0.06072  0.02354  -0.01915 13  THR A O   
92   C CB  . THR A 13  ? 0.45325 0.41586 0.33276 0.03917  0.01074  -0.02073 13  THR A CB  
93   O OG1 . THR A 13  ? 0.44958 0.41668 0.33772 0.03544  0.01498  -0.01465 13  THR A OG1 
94   C CG2 . THR A 13  ? 0.53461 0.49570 0.41403 0.03100  0.00038  -0.02664 13  THR A CG2 
95   N N   . GLU A 14  ? 0.38706 0.35388 0.27939 0.05347  0.03142  -0.00698 14  GLU A N   
96   C CA  . GLU A 14  ? 0.46461 0.43211 0.35288 0.06399  0.04100  -0.00250 14  GLU A CA  
97   C C   . GLU A 14  ? 0.51184 0.47841 0.40292 0.06873  0.04277  -0.00248 14  GLU A C   
98   O O   . GLU A 14  ? 0.49524 0.46244 0.38199 0.07834  0.05039  0.00079  14  GLU A O   
99   C CB  . GLU A 14  ? 0.44914 0.42156 0.34875 0.06272  0.04939  0.00612  14  GLU A CB  
100  C CG  . GLU A 14  ? 0.62812 0.60087 0.52345 0.06056  0.04995  0.00714  14  GLU A CG  
101  C CD  . GLU A 14  ? 0.79867 0.77302 0.70413 0.04834  0.04305  0.00558  14  GLU A CD  
102  O OE1 . GLU A 14  ? 0.58656 0.56249 0.50283 0.04175  0.03816  0.00415  14  GLU A OE1 
103  O OE2 . GLU A 14  ? 0.89818 0.87258 0.80058 0.04579  0.04265  0.00592  14  GLU A OE2 
104  N N   . GLU A 15  ? 0.40972 0.37502 0.30778 0.06279  0.03627  -0.00566 15  GLU A N   
105  C CA  . GLU A 15  ? 0.50037 0.46429 0.40120 0.06709  0.03747  -0.00586 15  GLU A CA  
106  C C   . GLU A 15  ? 0.47378 0.43115 0.36690 0.06612  0.02895  -0.01428 15  GLU A C   
107  O O   . GLU A 15  ? 0.44568 0.40250 0.34771 0.05994  0.02398  -0.01535 15  GLU A O   
108  C CB  . GLU A 15  ? 0.36282 0.33245 0.28254 0.06120  0.03921  -0.00019 15  GLU A CB  
109  C CG  . GLU A 15  ? 0.52091 0.49703 0.45030 0.06264  0.04852  0.00808  15  GLU A CG  
110  C CD  . GLU A 15  ? 0.61832 0.59415 0.54123 0.07442  0.05722  0.01136  15  GLU A CD  
111  O OE1 . GLU A 15  ? 0.69431 0.66638 0.61019 0.08064  0.05619  0.00803  15  GLU A OE1 
112  O OE2 . GLU A 15  ? 0.75552 0.73486 0.68063 0.07767  0.06533  0.01742  15  GLU A OE2 
113  N N   . PRO A 16  ? 0.53019 0.48280 0.40707 0.07233  0.02725  -0.02047 16  PRO A N   
114  C CA  . PRO A 16  ? 0.46405 0.41012 0.33443 0.07060  0.01895  -0.02920 16  PRO A CA  
115  C C   . PRO A 16  ? 0.42184 0.36390 0.29492 0.07428  0.01912  -0.03077 16  PRO A C   
116  O O   . PRO A 16  ? 0.48440 0.42118 0.35781 0.07028  0.01235  -0.03635 16  PRO A O   
117  C CB  . PRO A 16  ? 0.43252 0.37620 0.28517 0.07751  0.01833  -0.03525 16  PRO A CB  
118  C CG  . PRO A 16  ? 0.57583 0.52361 0.42457 0.08697  0.02800  -0.02938 16  PRO A CG  
119  C CD  . PRO A 16  ? 0.46071 0.41422 0.32478 0.08153  0.03291  -0.01992 16  PRO A CD  
120  N N   . ALA A 17  ? 0.48003 0.42434 0.35536 0.08184  0.02684  -0.02580 17  ALA A N   
121  C CA  . ALA A 17  ? 0.48438 0.42499 0.36241 0.08571  0.02728  -0.02694 17  ALA A CA  
122  C C   . ALA A 17  ? 0.40621 0.34810 0.29965 0.07679  0.02374  -0.02414 17  ALA A C   
123  O O   . ALA A 17  ? 0.44262 0.37885 0.33696 0.07602  0.01955  -0.02811 17  ALA A O   
124  C CB  . ALA A 17  ? 0.42535 0.36940 0.30301 0.09580  0.03670  -0.02140 17  ALA A CB  
125  N N   . ILE A 18  ? 0.44075 0.39027 0.34663 0.07025  0.02549  -0.01741 18  ILE A N   
126  C CA  . ILE A 18  ? 0.49665 0.44923 0.41712 0.06188  0.02178  -0.01489 18  ILE A CA  
127  C C   . ILE A 18  ? 0.41814 0.36587 0.33643 0.05457  0.01250  -0.02089 18  ILE A C   
128  O O   . ILE A 18  ? 0.36434 0.30966 0.28847 0.05157  0.00856  -0.02194 18  ILE A O   
129  C CB  . ILE A 18  ? 0.43608 0.39857 0.36995 0.05621  0.02509  -0.00766 18  ILE A CB  
130  C CG1 . ILE A 18  ? 0.47177 0.43890 0.40775 0.06350  0.03488  -0.00159 18  ILE A CG1 
131  C CG2 . ILE A 18  ? 0.36885 0.33633 0.31799 0.04892  0.02169  -0.00505 18  ILE A CG2 
132  C CD1 . ILE A 18  ? 0.49812 0.47442 0.44727 0.05807  0.03882  0.00494  18  ILE A CD1 
133  N N   . THR A 19  ? 0.38901 0.33558 0.29915 0.05180  0.00918  -0.02448 19  THR A N   
134  C CA  . THR A 19  ? 0.41448 0.35669 0.32187 0.04518  0.00053  -0.03035 19  THR A CA  
135  C C   . THR A 19  ? 0.42992 0.36282 0.33013 0.04917  -0.00251 -0.03708 19  THR A C   
136  O O   . THR A 19  ? 0.34031 0.26978 0.24545 0.04394  -0.00800 -0.03922 19  THR A O   
137  C CB  . THR A 19  ? 0.38524 0.32796 0.28328 0.04324  -0.00175 -0.03334 19  THR A CB  
138  O OG1 . THR A 19  ? 0.42199 0.37259 0.32809 0.03856  0.00066  -0.02728 19  THR A OG1 
139  C CG2 . THR A 19  ? 0.33844 0.27687 0.23320 0.03679  -0.01063 -0.03972 19  THR A CG2 
140  N N   . ALA A 20  ? 0.39170 0.32052 0.28053 0.05867  0.00120  -0.04049 20  ALA A N   
141  C CA  . ALA A 20  ? 0.45070 0.37038 0.33287 0.06302  -0.00136 -0.04768 20  ALA A CA  
142  C C   . ALA A 20  ? 0.40353 0.32113 0.29604 0.06325  -0.00023 -0.04456 20  ALA A C   
143  O O   . ALA A 20  ? 0.43725 0.34754 0.33066 0.06128  -0.00474 -0.04910 20  ALA A O   
144  C CB  . ALA A 20  ? 0.43012 0.34749 0.29841 0.07415  0.00298  -0.05162 20  ALA A CB  
145  N N   . GLY A 21  ? 0.40341 0.32753 0.30426 0.06572  0.00599  -0.03668 21  GLY A N   
146  C CA  . GLY A 21  ? 0.40072 0.32438 0.31174 0.06619  0.00726  -0.03310 21  GLY A CA  
147  C C   . GLY A 21  ? 0.35965 0.28503 0.28210 0.05647  0.00168  -0.03119 21  GLY A C   
148  O O   . GLY A 21  ? 0.36515 0.28595 0.29230 0.05632  -0.00006 -0.03162 21  GLY A O   
149  N N   . PHE A 22  ? 0.32552 0.25755 0.25244 0.04870  -0.00102 -0.02896 22  PHE A N   
150  C CA  . PHE A 22  ? 0.36383 0.29866 0.30108 0.03978  -0.00657 -0.02720 22  PHE A CA  
151  C C   . PHE A 22  ? 0.43253 0.35804 0.36425 0.03664  -0.01335 -0.03407 22  PHE A C   
152  O O   . PHE A 22  ? 0.33807 0.26141 0.27698 0.03337  -0.01645 -0.03327 22  PHE A O   
153  C CB  . PHE A 22  ? 0.32183 0.26625 0.26462 0.03280  -0.00768 -0.02366 22  PHE A CB  
154  C CG  . PHE A 22  ? 0.28028 0.22978 0.23417 0.02417  -0.01307 -0.02132 22  PHE A CG  
155  C CD1 . PHE A 22  ? 0.28852 0.24008 0.25262 0.02401  -0.01307 -0.01774 22  PHE A CD1 
156  C CD2 . PHE A 22  ? 0.27643 0.22933 0.23032 0.01682  -0.01796 -0.02244 22  PHE A CD2 
157  C CE1 . PHE A 22  ? 0.29457 0.25198 0.26859 0.01690  -0.01784 -0.01526 22  PHE A CE1 
158  C CE2 . PHE A 22  ? 0.29900 0.25747 0.26279 0.00949  -0.02289 -0.02021 22  PHE A CE2 
159  C CZ  . PHE A 22  ? 0.29871 0.25969 0.27255 0.00964  -0.02283 -0.01658 22  PHE A CZ  
160  N N   . LEU A 23  ? 0.32879 0.24910 0.24811 0.03780  -0.01549 -0.04078 23  LEU A N   
161  C CA  . LEU A 23  ? 0.35412 0.26570 0.26851 0.03478  -0.02180 -0.04807 23  LEU A CA  
162  C C   . LEU A 23  ? 0.37212 0.27412 0.28641 0.03965  -0.02106 -0.05111 23  LEU A C   
163  O O   . LEU A 23  ? 0.44023 0.33659 0.35887 0.03539  -0.02539 -0.05309 23  LEU A O   
164  C CB  . LEU A 23  ? 0.38080 0.28981 0.28151 0.03630  -0.02373 -0.05514 23  LEU A CB  
165  C CG  . LEU A 23  ? 0.45028 0.36743 0.34984 0.03154  -0.02485 -0.05284 23  LEU A CG  
166  C CD1 . LEU A 23  ? 0.44828 0.36303 0.33337 0.03441  -0.02639 -0.05993 23  LEU A CD1 
167  C CD2 . LEU A 23  ? 0.34168 0.26234 0.25053 0.02147  -0.03060 -0.05056 23  LEU A CD2 
168  N N   . ARG A 24  ? 0.47117 0.37109 0.38081 0.04879  -0.01532 -0.05126 24  ARG A N   
169  C CA  . ARG A 24  ? 0.46455 0.35530 0.37438 0.05400  -0.01412 -0.05391 24  ARG A CA  
170  C C   . ARG A 24  ? 0.50345 0.39638 0.42706 0.05116  -0.01350 -0.04683 24  ARG A C   
171  O O   . ARG A 24  ? 0.43833 0.32301 0.36506 0.05068  -0.01553 -0.04892 24  ARG A O   
172  C CB  . ARG A 24  ? 0.53050 0.42005 0.43247 0.06494  -0.00778 -0.05490 24  ARG A CB  
173  C CG  . ARG A 24  ? 0.54832 0.42832 0.45004 0.07127  -0.00606 -0.05774 24  ARG A CG  
174  C CD  . ARG A 24  ? 0.77949 0.65922 0.67261 0.08264  0.00016  -0.05883 24  ARG A CD  
175  N NE  . ARG A 24  ? 0.78715 0.67385 0.68826 0.08647  0.00647  -0.04967 24  ARG A NE  
176  C CZ  . ARG A 24  ? 0.84154 0.72468 0.74876 0.08984  0.00875  -0.04711 24  ARG A CZ  
177  N NH1 . ARG A 24  ? 0.86718 0.73883 0.77371 0.09006  0.00566  -0.05276 24  ARG A NH1 
178  N NH2 . ARG A 24  ? 0.75471 0.64609 0.66930 0.09313  0.01446  -0.03864 24  ARG A NH2 
179  N N   . PHE A 25  ? 0.36633 0.27062 0.29862 0.04949  -0.01053 -0.03849 25  PHE A N   
180  C CA  . PHE A 25  ? 0.41170 0.32068 0.35741 0.04657  -0.01037 -0.03163 25  PHE A CA  
181  C C   . PHE A 25  ? 0.39356 0.30059 0.34441 0.03816  -0.01701 -0.03250 25  PHE A C   
182  O O   . PHE A 25  ? 0.35128 0.25416 0.30849 0.03787  -0.01789 -0.03088 25  PHE A O   
183  C CB  . PHE A 25  ? 0.35519 0.27823 0.30930 0.04520  -0.00684 -0.02384 25  PHE A CB  
184  C CG  . PHE A 25  ? 0.35793 0.28898 0.32624 0.04114  -0.00765 -0.01708 25  PHE A CG  
185  C CD1 . PHE A 25  ? 0.34597 0.27844 0.32065 0.04653  -0.00344 -0.01263 25  PHE A CD1 
186  C CD2 . PHE A 25  ? 0.30515 0.24337 0.28024 0.03251  -0.01251 -0.01510 25  PHE A CD2 
187  C CE1 . PHE A 25  ? 0.32989 0.27114 0.31741 0.04349  -0.00414 -0.00639 25  PHE A CE1 
188  C CE2 . PHE A 25  ? 0.38708 0.33409 0.37495 0.02948  -0.01334 -0.00908 25  PHE A CE2 
189  C CZ  . PHE A 25  ? 0.31755 0.26638 0.31168 0.03505  -0.00914 -0.00470 25  PHE A CZ  
190  N N   . LEU A 26  ? 0.32664 0.23668 0.27473 0.03165  -0.02144 -0.03475 26  LEU A N   
191  C CA  . LEU A 26  ? 0.39236 0.30174 0.34522 0.02357  -0.02773 -0.03521 26  LEU A CA  
192  C C   . LEU A 26  ? 0.46997 0.36571 0.41834 0.02400  -0.03070 -0.04195 26  LEU A C   
193  O O   . LEU A 26  ? 0.42060 0.31367 0.37600 0.01974  -0.03382 -0.04052 26  LEU A O   
194  C CB  . LEU A 26  ? 0.30580 0.22133 0.25548 0.01728  -0.03152 -0.03656 26  LEU A CB  
195  C CG  . LEU A 26  ? 0.30483 0.23404 0.26150 0.01433  -0.02994 -0.03006 26  LEU A CG  
196  C CD1 . LEU A 26  ? 0.29665 0.22963 0.24872 0.00854  -0.03390 -0.03245 26  LEU A CD1 
197  C CD2 . LEU A 26  ? 0.24572 0.18262 0.21620 0.01090  -0.03083 -0.02333 26  LEU A CD2 
198  N N   . GLN A 27  ? 0.41267 0.30000 0.34975 0.02922  -0.02966 -0.04944 27  GLN A N   
199  C CA  . GLN A 27  ? 0.50394 0.37817 0.43685 0.02961  -0.03252 -0.05725 27  GLN A CA  
200  C C   . GLN A 27  ? 0.51396 0.38001 0.45152 0.03487  -0.02921 -0.05608 27  GLN A C   
201  O O   . GLN A 27  ? 0.56292 0.41803 0.50123 0.03369  -0.03161 -0.06087 27  GLN A O   
202  C CB  . GLN A 27  ? 0.58501 0.45435 0.50399 0.03385  -0.03282 -0.06651 27  GLN A CB  
203  C CG  . GLN A 27  ? 0.71730 0.58798 0.63096 0.02744  -0.03862 -0.07180 27  GLN A CG  
204  C CD  . GLN A 27  ? 0.89825 0.77180 0.79900 0.03206  -0.03743 -0.07668 27  GLN A CD  
205  O OE1 . GLN A 27  ? 1.03935 0.90704 0.93145 0.03954  -0.03528 -0.08288 27  GLN A OE1 
206  N NE2 . GLN A 27  ? 0.81130 0.69413 0.71057 0.02808  -0.03868 -0.07386 27  GLN A NE2 
207  N N   . GLY A 28  ? 0.42894 0.29998 0.37004 0.04062  -0.02362 -0.04983 28  GLY A N   
208  C CA  . GLY A 28  ? 0.48983 0.35338 0.43446 0.04664  -0.02000 -0.04858 28  GLY A CA  
209  C C   . GLY A 28  ? 0.53471 0.40551 0.49212 0.04565  -0.01797 -0.03858 28  GLY A C   
210  O O   . GLY A 28  ? 0.54043 0.40823 0.50544 0.04145  -0.02050 -0.03634 28  GLY A O   
211  N N   . GLU A 29  ? 0.51534 0.39643 0.47545 0.04967  -0.01326 -0.03242 29  GLU A N   
212  C CA  . GLU A 29  ? 0.50544 0.39470 0.47740 0.05030  -0.01070 -0.02332 29  GLU A CA  
213  C C   . GLU A 29  ? 0.42529 0.32195 0.40663 0.04171  -0.01533 -0.01884 29  GLU A C   
214  O O   . GLU A 29  ? 0.43461 0.33083 0.42430 0.04133  -0.01549 -0.01430 29  GLU A O   
215  C CB  . GLU A 29  ? 0.47985 0.38118 0.45351 0.05442  -0.00558 -0.01818 29  GLU A CB  
216  C CG  . GLU A 29  ? 0.63845 0.54998 0.62432 0.05585  -0.00264 -0.00926 29  GLU A CG  
217  C CD  . GLU A 29  ? 0.64927 0.55336 0.63531 0.06439  0.00188  -0.00815 29  GLU A CD  
218  O OE1 . GLU A 29  ? 0.76618 0.66217 0.74305 0.07113  0.00499  -0.01280 29  GLU A OE1 
219  O OE2 . GLU A 29  ? 0.58085 0.48762 0.57600 0.06486  0.00246  -0.00252 29  GLU A OE2 
220  N N   . ALA A 30  ? 0.45047 0.35421 0.43034 0.03521  -0.01898 -0.01988 30  ALA A N   
221  C CA  . ALA A 30  ? 0.37205 0.28534 0.36087 0.02757  -0.02314 -0.01520 30  ALA A CA  
222  C C   . ALA A 30  ? 0.40623 0.31093 0.39748 0.02362  -0.02734 -0.01660 30  ALA A C   
223  O O   . ALA A 30  ? 0.35615 0.26798 0.35667 0.01969  -0.02948 -0.01096 30  ALA A O   
224  C CB  . ALA A 30  ? 0.36045 0.28159 0.34598 0.02188  -0.02609 -0.01692 30  ALA A CB  
225  N N   . ARG A 31  ? 0.38743 0.27744 0.37098 0.02469  -0.02849 -0.02408 31  ARG A N   
226  C CA  . ARG A 31  ? 0.47561 0.35676 0.46228 0.02048  -0.03219 -0.02570 31  ARG A CA  
227  C C   . ARG A 31  ? 0.49000 0.36827 0.48592 0.02376  -0.02938 -0.01954 31  ARG A C   
228  O O   . ARG A 31  ? 0.46066 0.33565 0.46260 0.01973  -0.03195 -0.01757 31  ARG A O   
229  C CB  . ARG A 31  ? 0.45146 0.31762 0.42851 0.02112  -0.03379 -0.03601 31  ARG A CB  
230  C CG  . ARG A 31  ? 0.46128 0.32981 0.42801 0.01891  -0.03641 -0.04257 31  ARG A CG  
231  C CD  . ARG A 31  ? 0.48705 0.36484 0.45649 0.01031  -0.04156 -0.04060 31  ARG A CD  
232  N NE  . ARG A 31  ? 0.49724 0.37691 0.45643 0.00869  -0.04381 -0.04673 31  ARG A NE  
233  C CZ  . ARG A 31  ? 0.56582 0.43884 0.51885 0.00513  -0.04815 -0.05446 31  ARG A CZ  
234  N NH1 . ARG A 31  ? 0.50028 0.36387 0.45697 0.00214  -0.05079 -0.05727 31  ARG A NH1 
235  N NH2 . ARG A 31  ? 0.45367 0.32980 0.39699 0.00471  -0.04966 -0.05940 31  ARG A NH2 
236  N N   . GLN A 32  ? 0.48521 0.36492 0.48252 0.03126  -0.02392 -0.01606 32  GLN A N   
237  C CA  . GLN A 32  ? 0.53284 0.40992 0.53825 0.03558  -0.02062 -0.01000 32  GLN A CA  
238  C C   . GLN A 32  ? 0.51092 0.40495 0.52674 0.03513  -0.01971 -0.00004 32  GLN A C   
239  O O   . GLN A 32  ? 0.40239 0.29659 0.42547 0.03895  -0.01698 0.00604  32  GLN A O   
240  C CB  . GLN A 32  ? 0.49244 0.36078 0.49319 0.04484  -0.01506 -0.01220 32  GLN A CB  
241  C CG  . GLN A 32  ? 0.54500 0.40078 0.53382 0.04662  -0.01562 -0.02283 32  GLN A CG  
242  C CD  . GLN A 32  ? 0.77705 0.61644 0.76489 0.04429  -0.01819 -0.02911 32  GLN A CD  
243  O OE1 . GLN A 32  ? 0.92330 0.75865 0.90621 0.03875  -0.02277 -0.03601 32  GLN A OE1 
244  N NE2 . GLN A 32  ? 0.99514 0.82509 0.98811 0.04853  -0.01510 -0.02677 32  GLN A NE2 
245  N N   . ALA A 33  ? 0.36805 0.27648 0.38499 0.03080  -0.02189 0.00157  33  ALA A N   
246  C CA  . ALA A 33  ? 0.40885 0.33473 0.43572 0.03077  -0.02101 0.00986  33  ALA A CA  
247  C C   . ALA A 33  ? 0.38589 0.31777 0.42076 0.02537  -0.02516 0.01448  33  ALA A C   
248  O O   . ALA A 33  ? 0.37457 0.29968 0.40696 0.01986  -0.02943 0.01109  33  ALA A O   
249  C CB  . ALA A 33  ? 0.29121 0.23001 0.31693 0.02846  -0.02126 0.00934  33  ALA A CB  
250  N N   . ASP A 34  ? 0.31815 0.26384 0.36288 0.02738  -0.02377 0.02242  34  ASP A N   
251  C CA  . ASP A 34  ? 0.31995 0.27562 0.37257 0.02279  -0.02770 0.02749  34  ASP A CA  
252  C C   . ASP A 34  ? 0.41138 0.37961 0.46408 0.01569  -0.03240 0.02579  34  ASP A C   
253  O O   . ASP A 34  ? 0.31790 0.28980 0.37308 0.01021  -0.03704 0.02682  34  ASP A O   
254  C CB  . ASP A 34  ? 0.34836 0.31664 0.41122 0.02789  -0.02482 0.03623  34  ASP A CB  
255  C CG  . ASP A 34  ? 0.39099 0.34713 0.45440 0.03532  -0.01992 0.03884  34  ASP A CG  
256  O OD1 . ASP A 34  ? 0.37350 0.33732 0.44165 0.04183  -0.01565 0.04385  34  ASP A OD1 
257  O OD2 . ASP A 34  ? 0.38986 0.32883 0.44930 0.03464  -0.02026 0.03570  34  ASP A OD2 
258  N N   . ALA A 35  ? 0.31477 0.28979 0.36523 0.01592  -0.03099 0.02355  35  ALA A N   
259  C CA  . ALA A 35  ? 0.30449 0.29046 0.35496 0.00961  -0.03471 0.02159  35  ALA A CA  
260  C C   . ALA A 35  ? 0.30373 0.29033 0.34947 0.01143  -0.03136 0.01820  35  ALA A C   
261  O O   . ALA A 35  ? 0.29248 0.27700 0.33812 0.01782  -0.02614 0.01935  35  ALA A O   
262  C CB  . ALA A 35  ? 0.23970 0.24543 0.30139 0.00762  -0.03682 0.02751  35  ALA A CB  
263  N N   . LEU A 36  ? 0.22107 0.21075 0.26299 0.00603  -0.03415 0.01441  36  LEU A N   
264  C CA  . LEU A 36  ? 0.28937 0.28041 0.32712 0.00715  -0.03097 0.01168  36  LEU A CA  
265  C C   . LEU A 36  ? 0.31578 0.32292 0.36035 0.00198  -0.03294 0.01313  36  LEU A C   
266  O O   . LEU A 36  ? 0.30217 0.31204 0.34610 -0.00418 -0.03806 0.01151  36  LEU A O   
267  C CB  . LEU A 36  ? 0.32648 0.30319 0.35116 0.00644  -0.03169 0.00472  36  LEU A CB  
268  C CG  . LEU A 36  ? 0.32471 0.30331 0.34424 0.00702  -0.02882 0.00211  36  LEU A CG  
269  C CD1 . LEU A 36  ? 0.28177 0.26142 0.30280 0.01433  -0.02200 0.00444  36  LEU A CD1 
270  C CD2 . LEU A 36  ? 0.27040 0.23655 0.27680 0.00611  -0.03054 -0.00477 36  LEU A CD2 
271  N N   . TYR A 37  ? 0.27012 0.28792 0.32153 0.00446  -0.02886 0.01592  37  TYR A N   
272  C CA  . TYR A 37  ? 0.21960 0.25249 0.27860 -0.00019 -0.02996 0.01668  37  TYR A CA  
273  C C   . TYR A 37  ? 0.24313 0.27342 0.29748 0.00053  -0.02580 0.01408  37  TYR A C   
274  O O   . TYR A 37  ? 0.20520 0.23141 0.25761 0.00646  -0.02015 0.01487  37  TYR A O   
275  C CB  . TYR A 37  ? 0.19827 0.24772 0.27095 0.00153  -0.02858 0.02189  37  TYR A CB  
276  C CG  . TYR A 37  ? 0.26477 0.32079 0.34346 0.00063  -0.03285 0.02524  37  TYR A CG  
277  C CD1 . TYR A 37  ? 0.21609 0.26335 0.29256 0.00535  -0.03197 0.02768  37  TYR A CD1 
278  C CD2 . TYR A 37  ? 0.19373 0.26508 0.28067 -0.00446 -0.03743 0.02615  37  TYR A CD2 
279  C CE1 . TYR A 37  ? 0.22239 0.27579 0.30460 0.00512  -0.03521 0.03161  37  TYR A CE1 
280  C CE2 . TYR A 37  ? 0.25572 0.33418 0.34797 -0.00448 -0.04105 0.02971  37  TYR A CE2 
281  C CZ  . TYR A 37  ? 0.27834 0.34779 0.36822 0.00041  -0.03973 0.03281  37  TYR A CZ  
282  O OH  . TYR A 37  ? 0.25198 0.32858 0.34733 0.00091  -0.04273 0.03715  37  TYR A OH  
283  N N   . ILE A 38  ? 0.21189 0.24468 0.26447 -0.00510 -0.02831 0.01135  38  ILE A N   
284  C CA  . ILE A 38  ? 0.26796 0.29956 0.31711 -0.00490 -0.02428 0.00956  38  ILE A CA  
285  C C   . ILE A 38  ? 0.29666 0.34451 0.35852 -0.00915 -0.02409 0.01150  38  ILE A C   
286  O O   . ILE A 38  ? 0.23769 0.29185 0.30262 -0.01530 -0.02908 0.01023  38  ILE A O   
287  C CB  . ILE A 38  ? 0.26907 0.28972 0.30547 -0.00746 -0.02679 0.00466  38  ILE A CB  
288  C CG1 . ILE A 38  ? 0.29936 0.30507 0.32480 -0.00395 -0.02795 0.00191  38  ILE A CG1 
289  C CG2 . ILE A 38  ? 0.27342 0.29251 0.30573 -0.00601 -0.02172 0.00359  38  ILE A CG2 
290  C CD1 . ILE A 38  ? 0.25257 0.24795 0.26517 -0.00599 -0.03071 -0.00351 38  ILE A CD1 
291  N N   . LEU A 39  ? 0.23418 0.23333 0.26854 0.00535  -0.01052 0.00301  39  LEU A N   
292  C CA  . LEU A 39  ? 0.20663 0.21094 0.24982 0.00594  -0.01565 -0.00183 39  LEU A CA  
293  C C   . LEU A 39  ? 0.20718 0.20699 0.25698 0.00351  -0.01577 -0.00486 39  LEU A C   
294  O O   . LEU A 39  ? 0.24099 0.24112 0.30373 0.00203  -0.01667 -0.00633 39  LEU A O   
295  C CB  . LEU A 39  ? 0.22457 0.23268 0.27728 0.00649  -0.01627 -0.00055 39  LEU A CB  
296  C CG  . LEU A 39  ? 0.33537 0.34715 0.38162 0.00962  -0.01591 0.00287  39  LEU A CG  
297  C CD1 . LEU A 39  ? 0.35139 0.36842 0.40863 0.01093  -0.01800 0.00290  39  LEU A CD1 
298  C CD2 . LEU A 39  ? 0.20961 0.22594 0.24541 0.01347  -0.01948 0.00095  39  LEU A CD2 
299  N N   . GLY A 40  ? 0.22223 0.21775 0.26449 0.00319  -0.01463 -0.00554 40  GLY A N   
300  C CA  . GLY A 40  ? 0.20941 0.20079 0.25602 0.00198  -0.01551 -0.00897 40  GLY A CA  
301  C C   . GLY A 40  ? 0.30787 0.29007 0.35635 0.00034  -0.00943 -0.00528 40  GLY A C   
302  O O   . GLY A 40  ? 0.27107 0.25047 0.32054 0.00014  -0.00487 -0.00058 40  GLY A O   
303  N N   . ASP A 41  ? 0.24723 0.22401 0.29504 0.00015  -0.00917 -0.00737 41  ASP A N   
304  C CA  . ASP A 41  ? 0.24150 0.20815 0.28785 0.00027  -0.00322 -0.00388 41  ASP A CA  
305  C C   . ASP A 41  ? 0.25897 0.22149 0.29274 0.00210  -0.00010 -0.00016 41  ASP A C   
306  O O   . ASP A 41  ? 0.28360 0.23875 0.31521 0.00338  0.00523  0.00411  41  ASP A O   
307  C CB  . ASP A 41  ? 0.28260 0.24628 0.34250 -0.00117 0.00126  -0.00078 41  ASP A CB  
308  C CG  . ASP A 41  ? 0.34942 0.31409 0.42405 -0.00337 -0.00161 -0.00487 41  ASP A CG  
309  O OD1 . ASP A 41  ? 0.32413 0.29089 0.39613 -0.00314 -0.00744 -0.01054 41  ASP A OD1 
310  O OD2 . ASP A 41  ? 0.32923 0.29244 0.41901 -0.00516 0.00205  -0.00245 41  ASP A OD2 
311  N N   . LEU A 42  ? 0.22474 0.19178 0.25058 0.00268  -0.00345 -0.00184 42  LEU A N   
312  C CA  . LEU A 42  ? 0.25056 0.21316 0.26640 0.00412  -0.00202 0.00018  42  LEU A CA  
313  C C   . LEU A 42  ? 0.30702 0.26054 0.31697 0.00638  -0.00039 -0.00015 42  LEU A C   
314  O O   . LEU A 42  ? 0.28780 0.23319 0.29088 0.00879  0.00243  0.00240  42  LEU A O   
315  C CB  . LEU A 42  ? 0.27196 0.24183 0.28419 0.00387  -0.00548 -0.00142 42  LEU A CB  
316  C CG  . LEU A 42  ? 0.28810 0.25501 0.29365 0.00460  -0.00562 -0.00057 42  LEU A CG  
317  C CD1 . LEU A 42  ? 0.29433 0.25540 0.29738 0.00491  -0.00310 0.00286  42  LEU A CD1 
318  C CD2 . LEU A 42  ? 0.25486 0.23042 0.26121 0.00385  -0.00779 -0.00128 42  LEU A CD2 
319  N N   . PHE A 43  ? 0.25951 0.21338 0.27096 0.00657  -0.00224 -0.00339 43  PHE A N   
320  C CA  . PHE A 43  ? 0.24916 0.19425 0.25468 0.00944  -0.00076 -0.00371 43  PHE A CA  
321  C C   . PHE A 43  ? 0.29262 0.23206 0.30551 0.00912  0.00267  -0.00286 43  PHE A C   
322  O O   . PHE A 43  ? 0.28194 0.22651 0.30584 0.00620  0.00107  -0.00472 43  PHE A O   
323  C CB  . PHE A 43  ? 0.34477 0.29377 0.34610 0.01055  -0.00517 -0.00784 43  PHE A CB  
324  C CG  . PHE A 43  ? 0.30600 0.26032 0.30306 0.01069  -0.00785 -0.00823 43  PHE A CG  
325  C CD1 . PHE A 43  ? 0.28683 0.23528 0.27634 0.01342  -0.00825 -0.00782 43  PHE A CD1 
326  C CD2 . PHE A 43  ? 0.23154 0.19622 0.23262 0.00855  -0.00999 -0.00898 43  PHE A CD2 
327  C CE1 . PHE A 43  ? 0.29827 0.25170 0.28737 0.01284  -0.01127 -0.00863 43  PHE A CE1 
328  C CE2 . PHE A 43  ? 0.25958 0.22890 0.25950 0.00822  -0.01139 -0.00852 43  PHE A CE2 
329  C CZ  . PHE A 43  ? 0.22608 0.19004 0.22154 0.00976  -0.01227 -0.00856 43  PHE A CZ  
330  N N   . GLU A 44  ? 0.29717 0.22547 0.30421 0.01263  0.00730  -0.00007 44  GLU A N   
331  C CA  . GLU A 44  ? 0.31303 0.23434 0.32787 0.01258  0.01199  0.00177  44  GLU A CA  
332  C C   . GLU A 44  ? 0.41777 0.34079 0.43699 0.01136  0.00790  -0.00324 44  GLU A C   
333  O O   . GLU A 44  ? 0.33872 0.25958 0.37022 0.00907  0.00938  -0.00360 44  GLU A O   
334  C CB  . GLU A 44  ? 0.37140 0.27917 0.37584 0.01831  0.01872  0.00667  44  GLU A CB  
335  C CG  . GLU A 44  ? 0.43104 0.32953 0.44264 0.01914  0.02512  0.00970  44  GLU A CG  
336  C CD  . GLU A 44  ? 0.57044 0.47076 0.60053 0.01497  0.03011  0.01321  44  GLU A CD  
337  O OE1 . GLU A 44  ? 0.57617 0.48378 0.61089 0.01271  0.02941  0.01405  44  GLU A OE1 
338  O OE2 . GLU A 44  ? 0.56959 0.46420 0.61109 0.01391  0.03464  0.01507  44  GLU A OE2 
339  N N   . ALA A 45  ? 0.36425 0.29106 0.37479 0.01298  0.00273  -0.00726 45  ALA A N   
340  C CA  . ALA A 45  ? 0.32249 0.25044 0.33485 0.01308  -0.00112 -0.01216 45  ALA A CA  
341  C C   . ALA A 45  ? 0.34667 0.28441 0.35290 0.01384  -0.00693 -0.01609 45  ALA A C   
342  O O   . ALA A 45  ? 0.34291 0.28391 0.34275 0.01480  -0.00745 -0.01473 45  ALA A O   
343  C CB  . ALA A 45  ? 0.34087 0.25678 0.34733 0.01715  0.00231  -0.01094 45  ALA A CB  
344  N N   . TRP A 46  ? 0.34407 0.28613 0.35303 0.01373  -0.01112 -0.02096 46  TRP A N   
345  C CA  . TRP A 46  ? 0.39770 0.34865 0.40109 0.01559  -0.01528 -0.02410 46  TRP A CA  
346  C C   . TRP A 46  ? 0.34443 0.29406 0.34748 0.01783  -0.01829 -0.02905 46  TRP A C   
347  O O   . TRP A 46  ? 0.32440 0.27217 0.33458 0.01631  -0.02009 -0.03195 46  TRP A O   
348  C CB  . TRP A 46  ? 0.30452 0.26635 0.31077 0.01357  -0.01741 -0.02427 46  TRP A CB  
349  C CG  . TRP A 46  ? 0.35102 0.32158 0.35197 0.01548  -0.01886 -0.02451 46  TRP A CG  
350  C CD1 . TRP A 46  ? 0.25532 0.23259 0.25396 0.01821  -0.02146 -0.02772 46  TRP A CD1 
351  C CD2 . TRP A 46  ? 0.26942 0.24283 0.26812 0.01501  -0.01743 -0.02122 46  TRP A CD2 
352  N NE1 . TRP A 46  ? 0.28524 0.27004 0.28176 0.01922  -0.02065 -0.02575 46  TRP A NE1 
353  C CE2 . TRP A 46  ? 0.26649 0.24905 0.26405 0.01681  -0.01871 -0.02212 46  TRP A CE2 
354  C CE3 . TRP A 46  ? 0.26336 0.23198 0.26117 0.01368  -0.01526 -0.01776 46  TRP A CE3 
355  C CZ2 . TRP A 46  ? 0.29986 0.28734 0.29835 0.01623  -0.01799 -0.01967 46  TRP A CZ2 
356  C CZ3 . TRP A 46  ? 0.27563 0.24828 0.27238 0.01354  -0.01570 -0.01631 46  TRP A CZ3 
357  C CH2 . TRP A 46  ? 0.28177 0.26397 0.28029 0.01429  -0.01711 -0.01725 46  TRP A CH2 
358  N N   . ILE A 47  ? 0.28474 0.23530 0.28033 0.02168  -0.01932 -0.03044 47  ILE A N   
359  C CA  . ILE A 47  ? 0.36276 0.31167 0.35615 0.02495  -0.02197 -0.03510 47  ILE A CA  
360  C C   . ILE A 47  ? 0.35887 0.31888 0.34791 0.02803  -0.02470 -0.03744 47  ILE A C   
361  O O   . ILE A 47  ? 0.35841 0.31783 0.34353 0.03211  -0.02653 -0.04096 47  ILE A O   
362  C CB  . ILE A 47  ? 0.32567 0.26373 0.31405 0.02828  -0.01985 -0.03441 47  ILE A CB  
363  C CG1 . ILE A 47  ? 0.39725 0.33790 0.37854 0.03111  -0.01915 -0.03197 47  ILE A CG1 
364  C CG2 . ILE A 47  ? 0.32332 0.24924 0.31659 0.02610  -0.01568 -0.03142 47  ILE A CG2 
365  C CD1 . ILE A 47  ? 0.47549 0.40740 0.44945 0.03646  -0.01849 -0.03226 47  ILE A CD1 
366  N N   . GLY A 48  ? 0.33367 0.30337 0.32355 0.02660  -0.02428 -0.03504 48  GLY A N   
367  C CA  . GLY A 48  ? 0.34165 0.32219 0.32884 0.02970  -0.02503 -0.03567 48  GLY A CA  
368  C C   . GLY A 48  ? 0.32988 0.31702 0.31868 0.02856  -0.02294 -0.03153 48  GLY A C   
369  O O   . GLY A 48  ? 0.31941 0.30168 0.30843 0.02730  -0.02222 -0.02971 48  GLY A O   
370  N N   . ASP A 49  ? 0.26774 0.26556 0.25770 0.02959  -0.02197 -0.03007 49  ASP A N   
371  C CA  . ASP A 49  ? 0.31182 0.31650 0.30660 0.02775  -0.01991 -0.02606 49  ASP A CA  
372  C C   . ASP A 49  ? 0.40774 0.41519 0.40448 0.03011  -0.02042 -0.02657 49  ASP A C   
373  O O   . ASP A 49  ? 0.29235 0.30413 0.29532 0.02810  -0.01999 -0.02419 49  ASP A O   
374  C CB  . ASP A 49  ? 0.29382 0.30863 0.29027 0.02864  -0.01740 -0.02336 49  ASP A CB  
375  C CG  . ASP A 49  ? 0.30143 0.31470 0.29654 0.02658  -0.01738 -0.02238 49  ASP A CG  
376  O OD1 . ASP A 49  ? 0.32045 0.32587 0.31591 0.02344  -0.01895 -0.02331 49  ASP A OD1 
377  O OD2 . ASP A 49  ? 0.30051 0.32056 0.29426 0.02880  -0.01542 -0.02033 49  ASP A OD2 
378  N N   . ASP A 50  ? 0.29306 0.29832 0.28557 0.03454  -0.02181 -0.02994 50  ASP A N   
379  C CA  . ASP A 50  ? 0.27403 0.28196 0.26853 0.03752  -0.02293 -0.03079 50  ASP A CA  
380  C C   . ASP A 50  ? 0.31741 0.31493 0.30889 0.03723  -0.02528 -0.03173 50  ASP A C   
381  O O   . ASP A 50  ? 0.33096 0.32940 0.32285 0.04057  -0.02737 -0.03312 50  ASP A O   
382  C CB  . ASP A 50  ? 0.25976 0.26969 0.24999 0.04357  -0.02315 -0.03379 50  ASP A CB  
383  C CG  . ASP A 50  ? 0.35532 0.35346 0.33739 0.04502  -0.02474 -0.03736 50  ASP A CG  
384  O OD1 . ASP A 50  ? 0.36627 0.35723 0.34776 0.04104  -0.02490 -0.03704 50  ASP A OD1 
385  O OD2 . ASP A 50  ? 0.39312 0.38911 0.37062 0.05016  -0.02573 -0.04046 50  ASP A OD2 
386  N N   . ASP A 51  ? 0.31425 0.30212 0.30250 0.03418  -0.02479 -0.03080 51  ASP A N   
387  C CA  . ASP A 51  ? 0.30630 0.28299 0.28959 0.03512  -0.02572 -0.03068 51  ASP A CA  
388  C C   . ASP A 51  ? 0.36636 0.34646 0.35303 0.03466  -0.02797 -0.02988 51  ASP A C   
389  O O   . ASP A 51  ? 0.34368 0.32830 0.33590 0.03043  -0.02732 -0.02774 51  ASP A O   
390  C CB  . ASP A 51  ? 0.28981 0.25708 0.27100 0.03192  -0.02329 -0.02881 51  ASP A CB  
391  C CG  . ASP A 51  ? 0.34719 0.30120 0.32145 0.03426  -0.02240 -0.02765 51  ASP A CG  
392  O OD1 . ASP A 51  ? 0.28805 0.23991 0.25777 0.03844  -0.02467 -0.02853 51  ASP A OD1 
393  O OD2 . ASP A 51  ? 0.38647 0.33212 0.36003 0.03251  -0.01926 -0.02569 51  ASP A OD2 
394  N N   . PRO A 52  ? 0.35945 0.33715 0.34317 0.03924  -0.03124 -0.03194 52  PRO A N   
395  C CA  . PRO A 52  ? 0.36107 0.34148 0.34886 0.03926  -0.03521 -0.03259 52  PRO A CA  
396  C C   . PRO A 52  ? 0.39900 0.36760 0.37926 0.03932  -0.03580 -0.03160 52  PRO A C   
397  O O   . PRO A 52  ? 0.30713 0.27533 0.28825 0.04087  -0.04051 -0.03339 52  PRO A O   
398  C CB  . PRO A 52  ? 0.30576 0.28771 0.29217 0.04562  -0.03938 -0.03600 52  PRO A CB  
399  C CG  . PRO A 52  ? 0.39810 0.37001 0.37342 0.04974  -0.03696 -0.03626 52  PRO A CG  
400  C CD  . PRO A 52  ? 0.33830 0.31124 0.31542 0.04521  -0.03216 -0.03433 52  PRO A CD  
401  N N   . ASN A 53  ? 0.30383 0.26294 0.27747 0.03814  -0.03139 -0.02901 53  ASN A N   
402  C CA  . ASN A 53  ? 0.31526 0.26312 0.28140 0.03886  -0.03033 -0.02707 53  ASN A CA  
403  C C   . ASN A 53  ? 0.30000 0.25264 0.27192 0.03583  -0.03347 -0.02734 53  ASN A C   
404  O O   . ASN A 53  ? 0.29473 0.25624 0.27633 0.03003  -0.03194 -0.02579 53  ASN A O   
405  C CB  . ASN A 53  ? 0.33800 0.28018 0.30315 0.03570  -0.02426 -0.02351 53  ASN A CB  
406  C CG  . ASN A 53  ? 0.43683 0.36669 0.39380 0.03759  -0.02142 -0.02051 53  ASN A CG  
407  O OD1 . ASN A 53  ? 0.39824 0.32449 0.34994 0.04042  -0.02444 -0.02125 53  ASN A OD1 
408  N ND2 . ASN A 53  ? 0.33624 0.25942 0.29269 0.03649  -0.01564 -0.01724 53  ASN A ND2 
409  N N   . PRO A 54  ? 0.34974 0.29636 0.31586 0.04016  -0.03827 -0.02959 54  PRO A N   
410  C CA  . PRO A 54  ? 0.35835 0.30924 0.33191 0.03715  -0.04253 -0.03095 54  PRO A CA  
411  C C   . PRO A 54  ? 0.37786 0.32582 0.35187 0.03248  -0.03834 -0.02725 54  PRO A C   
412  O O   . PRO A 54  ? 0.26571 0.22030 0.24996 0.02763  -0.03972 -0.02708 54  PRO A O   
413  C CB  . PRO A 54  ? 0.38218 0.32375 0.34559 0.04469  -0.04927 -0.03500 54  PRO A CB  
414  C CG  . PRO A 54  ? 0.40285 0.34058 0.35744 0.05136  -0.04930 -0.03612 54  PRO A CG  
415  C CD  . PRO A 54  ? 0.34190 0.27742 0.29436 0.04879  -0.04076 -0.03151 54  PRO A CD  
416  N N   . LEU A 55  ? 0.32931 0.26760 0.29372 0.03391  -0.03282 -0.02391 55  LEU A N   
417  C CA  . LEU A 55  ? 0.36880 0.30522 0.33453 0.02986  -0.02856 -0.02020 55  LEU A CA  
418  C C   . LEU A 55  ? 0.33996 0.28911 0.31875 0.02284  -0.02659 -0.01860 55  LEU A C   
419  O O   . LEU A 55  ? 0.32749 0.27906 0.31115 0.01909  -0.02595 -0.01687 55  LEU A O   
420  C CB  . LEU A 55  ? 0.36123 0.28737 0.31831 0.03231  -0.02212 -0.01647 55  LEU A CB  
421  C CG  . LEU A 55  ? 0.39741 0.32224 0.35698 0.02865  -0.01704 -0.01227 55  LEU A CG  
422  C CD1 . LEU A 55  ? 0.34077 0.25926 0.29461 0.03065  -0.01894 -0.01226 55  LEU A CD1 
423  C CD2 . LEU A 55  ? 0.40561 0.32264 0.36161 0.03043  -0.01024 -0.00849 55  LEU A CD2 
424  N N   . HIS A 56  ? 0.29339 0.25008 0.27674 0.02195  -0.02564 -0.01917 56  HIS A N   
425  C CA  . HIS A 56  ? 0.30420 0.27208 0.29703 0.01722  -0.02351 -0.01758 56  HIS A CA  
426  C C   . HIS A 56  ? 0.26902 0.24546 0.27158 0.01440  -0.02567 -0.01756 56  HIS A C   
427  O O   . HIS A 56  ? 0.29258 0.27388 0.30069 0.01068  -0.02311 -0.01465 56  HIS A O   
428  C CB  . HIS A 56  ? 0.25302 0.22626 0.24691 0.01849  -0.02283 -0.01901 56  HIS A CB  
429  C CG  . HIS A 56  ? 0.26274 0.22786 0.25050 0.02014  -0.02041 -0.01891 56  HIS A CG  
430  N ND1 . HIS A 56  ? 0.31198 0.27920 0.29984 0.02148  -0.02015 -0.02076 56  HIS A ND1 
431  C CD2 . HIS A 56  ? 0.28390 0.23845 0.26652 0.02078  -0.01777 -0.01699 56  HIS A CD2 
432  C CE1 . HIS A 56  ? 0.32839 0.28652 0.31292 0.02214  -0.01787 -0.02024 56  HIS A CE1 
433  N NE2 . HIS A 56  ? 0.31111 0.26187 0.29295 0.02172  -0.01583 -0.01750 56  HIS A NE2 
434  N N   . GLN A 57  ? 0.25121 0.22957 0.25706 0.01631  -0.03037 -0.02068 57  GLN A N   
435  C CA  . GLN A 57  ? 0.31326 0.30000 0.33223 0.01304  -0.03233 -0.02062 57  GLN A CA  
436  C C   . GLN A 57  ? 0.27182 0.25174 0.29094 0.01106  -0.03418 -0.02030 57  GLN A C   
437  O O   . GLN A 57  ? 0.30018 0.28542 0.33005 0.00675  -0.03304 -0.01811 57  GLN A O   
438  C CB  . GLN A 57  ? 0.28122 0.27324 0.30678 0.01559  -0.03757 -0.02462 57  GLN A CB  
439  C CG  . GLN A 57  ? 0.54320 0.54306 0.56985 0.01790  -0.03551 -0.02482 57  GLN A CG  
440  C CD  . GLN A 57  ? 0.78283 0.78981 0.81192 0.01539  -0.02895 -0.02065 57  GLN A CD  
441  O OE1 . GLN A 57  ? 0.62295 0.62796 0.64385 0.01747  -0.02657 -0.02062 57  GLN A OE1 
442  N NE2 . GLN A 57  ? 0.70246 0.71718 0.74281 0.01150  -0.02624 -0.01728 57  GLN A NE2 
443  N N   . GLN A 58  ? 0.30016 0.26758 0.30694 0.01484  -0.03658 -0.02215 58  GLN A N   
444  C CA  . GLN A 58  ? 0.34218 0.30141 0.34635 0.01423  -0.03826 -0.02210 58  GLN A CA  
445  C C   . GLN A 58  ? 0.29635 0.25619 0.30136 0.01024  -0.03201 -0.01695 58  GLN A C   
446  O O   . GLN A 58  ? 0.30257 0.26256 0.31377 0.00699  -0.03220 -0.01568 58  GLN A O   
447  C CB  . GLN A 58  ? 0.41387 0.35887 0.40152 0.02103  -0.04072 -0.02441 58  GLN A CB  
448  C CG  . GLN A 58  ? 0.65807 0.60118 0.64356 0.02624  -0.04855 -0.03023 58  GLN A CG  
449  C CD  . GLN A 58  ? 0.73094 0.65920 0.69689 0.03493  -0.04990 -0.03175 58  GLN A CD  
450  O OE1 . GLN A 58  ? 0.64206 0.56707 0.60243 0.04109  -0.05615 -0.03637 58  GLN A OE1 
451  N NE2 . GLN A 58  ? 0.81253 0.73173 0.76795 0.03625  -0.04369 -0.02752 58  GLN A NE2 
452  N N   . ILE A 59  ? 0.30217 0.26212 0.30177 0.01064  -0.02684 -0.01420 59  ILE A N   
453  C CA  . ILE A 59  ? 0.34517 0.30701 0.34630 0.00752  -0.02175 -0.00984 59  ILE A CA  
454  C C   . ILE A 59  ? 0.27848 0.25210 0.29101 0.00351  -0.02004 -0.00768 59  ILE A C   
455  O O   . ILE A 59  ? 0.27436 0.24892 0.29059 0.00089  -0.01786 -0.00455 59  ILE A O   
456  C CB  . ILE A 59  ? 0.31087 0.27062 0.30618 0.00897  -0.01788 -0.00841 59  ILE A CB  
457  C CG1 . ILE A 59  ? 0.30202 0.24899 0.28648 0.01330  -0.01727 -0.00858 59  ILE A CG1 
458  C CG2 . ILE A 59  ? 0.29734 0.26137 0.29619 0.00608  -0.01394 -0.00479 59  ILE A CG2 
459  C CD1 . ILE A 59  ? 0.30753 0.24659 0.28760 0.01418  -0.01724 -0.00729 59  ILE A CD1 
460  N N   . ALA A 60  ? 0.29258 0.27484 0.31014 0.00380  -0.02037 -0.00881 60  ALA A N   
461  C CA  . ALA A 60  ? 0.28933 0.28260 0.31676 0.00142  -0.01746 -0.00591 60  ALA A CA  
462  C C   . ALA A 60  ? 0.30528 0.29960 0.34326 -0.00180 -0.01828 -0.00458 60  ALA A C   
463  O O   . ALA A 60  ? 0.26306 0.26084 0.30606 -0.00411 -0.01416 -0.00012 60  ALA A O   
464  C CB  . ALA A 60  ? 0.27217 0.27379 0.30301 0.00339  -0.01772 -0.00758 60  ALA A CB  
465  N N   . SER A 61  ? 0.25279 0.24345 0.29437 -0.00160 -0.02394 -0.00860 61  SER A N   
466  C CA  . SER A 61  ? 0.25017 0.24138 0.30458 -0.00508 -0.02595 -0.00839 61  SER A CA  
467  C C   . SER A 61  ? 0.30696 0.28930 0.35709 -0.00667 -0.02481 -0.00624 61  SER A C   
468  O O   . SER A 61  ? 0.32462 0.30879 0.38527 -0.01029 -0.02267 -0.00307 61  SER A O   
469  C CB  . SER A 61  ? 0.28098 0.26946 0.33973 -0.00367 -0.03425 -0.01472 61  SER A CB  
470  O OG  . SER A 61  ? 0.55947 0.55614 0.62188 -0.00152 -0.03547 -0.01678 61  SER A OG  
471  N N   . ALA A 62  ? 0.35438 0.32675 0.38965 -0.00365 -0.02556 -0.00743 62  ALA A N   
472  C CA  . ALA A 62  ? 0.33572 0.29938 0.36609 -0.00420 -0.02435 -0.00544 62  ALA A CA  
473  C C   . ALA A 62  ? 0.29695 0.26580 0.32880 -0.00625 -0.01743 0.00069  62  ALA A C   
474  O O   . ALA A 62  ? 0.30986 0.27616 0.34548 -0.00837 -0.01563 0.00364  62  ALA A O   
475  C CB  . ALA A 62  ? 0.29199 0.24431 0.30653 0.00052  -0.02567 -0.00748 62  ALA A CB  
476  N N   . ILE A 63  ? 0.25592 0.23137 0.28432 -0.00504 -0.01401 0.00232  63  ILE A N   
477  C CA  . ILE A 63  ? 0.28757 0.26849 0.31647 -0.00566 -0.00862 0.00735  63  ILE A CA  
478  C C   . ILE A 63  ? 0.28401 0.27264 0.32439 -0.00797 -0.00559 0.01098  63  ILE A C   
479  O O   . ILE A 63  ? 0.26738 0.25631 0.30955 -0.00878 -0.00154 0.01579  63  ILE A O   
480  C CB  . ILE A 63  ? 0.28267 0.26833 0.30557 -0.00321 -0.00727 0.00684  63  ILE A CB  
481  C CG1 . ILE A 63  ? 0.22758 0.20514 0.24183 -0.00138 -0.00852 0.00480  63  ILE A CG1 
482  C CG2 . ILE A 63  ? 0.30443 0.29642 0.32726 -0.00255 -0.00309 0.01107  63  ILE A CG2 
483  C CD1 . ILE A 63  ? 0.21556 0.19658 0.22667 0.00035  -0.00789 0.00365  63  ILE A CD1 
484  N N   . LYS A 64  ? 0.27618 0.27101 0.32509 -0.00863 -0.00693 0.00927  64  LYS A N   
485  C CA  . LYS A 64  ? 0.27187 0.27458 0.33418 -0.01066 -0.00275 0.01359  64  LYS A CA  
486  C C   . LYS A 64  ? 0.28289 0.28004 0.35495 -0.01449 -0.00290 0.01544  64  LYS A C   
487  O O   . LYS A 64  ? 0.25636 0.25703 0.33681 -0.01598 0.00302  0.02148  64  LYS A O   
488  C CB  . LYS A 64  ? 0.29343 0.30405 0.36506 -0.01052 -0.00451 0.01104  64  LYS A CB  
489  C CG  . LYS A 64  ? 0.36079 0.38116 0.44821 -0.01205 0.00143  0.01648  64  LYS A CG  
490  C CD  . LYS A 64  ? 0.45376 0.48108 0.53411 -0.00800 0.00888  0.02185  64  LYS A CD  
491  C CE  . LYS A 64  ? 0.51524 0.54977 0.60899 -0.00857 0.01727  0.02963  64  LYS A CE  
492  N NZ  . LYS A 64  ? 0.58378 0.62290 0.69911 -0.01271 0.01625  0.02912  64  LYS A NZ  
493  N N   . ALA A 65  ? 0.23659 0.22414 0.30707 -0.01543 -0.00944 0.01039  65  ALA A N   
494  C CA  . ALA A 65  ? 0.28609 0.26637 0.36473 -0.01867 -0.01072 0.01106  65  ALA A CA  
495  C C   . ALA A 65  ? 0.29911 0.27427 0.37005 -0.01815 -0.00560 0.01633  65  ALA A C   
496  O O   . ALA A 65  ? 0.31449 0.28666 0.39432 -0.02088 -0.00300 0.02002  65  ALA A O   
497  C CB  . ALA A 65  ? 0.29594 0.26585 0.37108 -0.01794 -0.01985 0.00347  65  ALA A CB  
498  N N   . VAL A 66  ? 0.27102 0.24506 0.32682 -0.01462 -0.00418 0.01676  66  VAL A N   
499  C CA  . VAL A 66  ? 0.27283 0.24391 0.32195 -0.01338 0.00047  0.02174  66  VAL A CA  
500  C C   . VAL A 66  ? 0.34433 0.32434 0.39820 -0.01303 0.00759  0.02848  66  VAL A C   
501  O O   . VAL A 66  ? 0.32271 0.30017 0.37879 -0.01338 0.01204  0.03389  66  VAL A O   
502  C CB  . VAL A 66  ? 0.32373 0.29250 0.35857 -0.00976 -0.00036 0.02003  66  VAL A CB  
503  C CG1 . VAL A 66  ? 0.33242 0.30094 0.36189 -0.00788 0.00412  0.02505  66  VAL A CG1 
504  C CG2 . VAL A 66  ? 0.25435 0.21252 0.28275 -0.00871 -0.00556 0.01495  66  VAL A CG2 
505  N N   . VAL A 67  ? 0.26306 0.25285 0.31740 -0.01140 0.00905  0.02845  67  VAL A N   
506  C CA  . VAL A 67  ? 0.27398 0.27206 0.33054 -0.00926 0.01614  0.03485  67  VAL A CA  
507  C C   . VAL A 67  ? 0.36232 0.36118 0.43495 -0.01268 0.02064  0.03980  67  VAL A C   
508  O O   . VAL A 67  ? 0.33185 0.33125 0.40571 -0.01130 0.02773  0.04713  67  VAL A O   
509  C CB  . VAL A 67  ? 0.28600 0.29332 0.33941 -0.00618 0.01603  0.03276  67  VAL A CB  
510  C CG1 . VAL A 67  ? 0.28624 0.30177 0.34122 -0.00262 0.02380  0.03946  67  VAL A CG1 
511  C CG2 . VAL A 67  ? 0.21511 0.22110 0.25477 -0.00311 0.01206  0.02832  67  VAL A CG2 
512  N N   . ASP A 68  ? 0.27736 0.27605 0.36338 -0.01690 0.01654  0.03594  68  ASP A N   
513  C CA  . ASP A 68  ? 0.26430 0.26400 0.37016 -0.02114 0.02010  0.04002  68  ASP A CA  
514  C C   . ASP A 68  ? 0.34898 0.33782 0.45723 -0.02366 0.02087  0.04259  68  ASP A C   
515  O O   . ASP A 68  ? 0.29144 0.28022 0.41409 -0.02626 0.02691  0.04884  68  ASP A O   
516  C CB  . ASP A 68  ? 0.31810 0.31992 0.43891 -0.02496 0.01333  0.03368  68  ASP A CB  
517  C CG  . ASP A 68  ? 0.38691 0.40043 0.50945 -0.02257 0.01407  0.03251  68  ASP A CG  
518  O OD1 . ASP A 68  ? 0.35947 0.38047 0.47732 -0.01874 0.02178  0.03829  68  ASP A OD1 
519  O OD2 . ASP A 68  ? 0.31972 0.33447 0.44737 -0.02368 0.00669  0.02560  68  ASP A OD2 
520  N N   . ALA A 69  ? 0.35847 0.33768 0.45343 -0.02266 0.01544  0.03826  69  ALA A N   
521  C CA  . ALA A 69  ? 0.35478 0.32268 0.44920 -0.02395 0.01585  0.04023  69  ALA A CA  
522  C C   . ALA A 69  ? 0.43147 0.39945 0.51628 -0.02013 0.02385  0.04821  69  ALA A C   
523  O O   . ALA A 69  ? 0.47673 0.43515 0.55805 -0.02002 0.02454  0.05016  69  ALA A O   
524  C CB  . ALA A 69  ? 0.37012 0.32758 0.45307 -0.02303 0.00748  0.03275  69  ALA A CB  
525  N N   . GLY A 70  ? 0.33276 0.31073 0.41223 -0.01615 0.02939  0.05247  70  GLY A N   
526  C CA  . GLY A 70  ? 0.32487 0.30355 0.39469 -0.01113 0.03650  0.05989  70  GLY A CA  
527  C C   . GLY A 70  ? 0.33903 0.31815 0.39046 -0.00593 0.03365  0.05743  70  GLY A C   
528  O O   . GLY A 70  ? 0.37886 0.35782 0.42161 -0.00111 0.03805  0.06270  70  GLY A O   
529  N N   . VAL A 71  ? 0.32163 0.30136 0.36777 -0.00641 0.02658  0.04983  71  VAL A N   
530  C CA  . VAL A 71  ? 0.29402 0.27431 0.32653 -0.00233 0.02376  0.04729  71  VAL A CA  
531  C C   . VAL A 71  ? 0.32572 0.31569 0.35359 0.00066  0.02252  0.04460  71  VAL A C   
532  O O   . VAL A 71  ? 0.24416 0.23564 0.27410 -0.00140 0.01822  0.03904  71  VAL A O   
533  C CB  . VAL A 71  ? 0.26173 0.23383 0.29132 -0.00430 0.01781  0.04154  71  VAL A CB  
534  C CG1 . VAL A 71  ? 0.26235 0.23600 0.28154 -0.00046 0.01597  0.03975  71  VAL A CG1 
535  C CG2 . VAL A 71  ? 0.27949 0.24073 0.31248 -0.00646 0.01837  0.04342  71  VAL A CG2 
536  N N   . PRO A 72  ? 0.24543 0.24132 0.26608 0.00625  0.02575  0.04805  72  PRO A N   
537  C CA  . PRO A 72  ? 0.27807 0.28194 0.29324 0.00982  0.02353  0.04448  72  PRO A CA  
538  C C   . PRO A 72  ? 0.31131 0.31394 0.32250 0.00911  0.01670  0.03744  72  PRO A C   
539  O O   . PRO A 72  ? 0.24252 0.24101 0.25072 0.00938  0.01489  0.03693  72  PRO A O   
540  C CB  . PRO A 72  ? 0.34691 0.35496 0.35278 0.01735  0.02740  0.04929  72  PRO A CB  
541  C CG  . PRO A 72  ? 0.39993 0.40163 0.40455 0.01776  0.03008  0.05419  72  PRO A CG  
542  C CD  . PRO A 72  ? 0.27267 0.26727 0.28860 0.01055  0.03116  0.05508  72  PRO A CD  
543  N N   . CYS A 73  ? 0.20141 0.20752 0.21347 0.00840  0.01355  0.03248  73  CYS A N   
544  C CA  . CYS A 73  ? 0.23940 0.24373 0.24955 0.00741  0.00810  0.02631  73  CYS A CA  
545  C C   . CYS A 73  ? 0.29701 0.30778 0.30223 0.01159  0.00556  0.02284  73  CYS A C   
546  O O   . CYS A 73  ? 0.28256 0.29850 0.28675 0.01395  0.00705  0.02312  73  CYS A O   
547  C CB  . CYS A 73  ? 0.31138 0.31165 0.32658 0.00309  0.00591  0.02285  73  CYS A CB  
548  S SG  . CYS A 73  ? 0.30716 0.29741 0.32646 -0.00095 0.00609  0.02427  73  CYS A SG  
549  N N   . TYR A 74  ? 0.25970 0.27001 0.26281 0.01272  0.00165  0.01938  74  TYR A N   
550  C CA  . TYR A 74  ? 0.24496 0.26035 0.24437 0.01679  -0.00226 0.01501  74  TYR A CA  
551  C C   . TYR A 74  ? 0.34312 0.35571 0.34663 0.01398  -0.00649 0.00938  74  TYR A C   
552  O O   . TYR A 74  ? 0.32314 0.33023 0.33073 0.01036  -0.00606 0.00970  74  TYR A O   
553  C CB  . TYR A 74  ? 0.29525 0.31386 0.29001 0.02200  -0.00375 0.01592  74  TYR A CB  
554  C CG  . TYR A 74  ? 0.29636 0.31640 0.28571 0.02590  0.00145  0.02258  74  TYR A CG  
555  C CD1 . TYR A 74  ? 0.27835 0.29407 0.26974 0.02384  0.00526  0.02791  74  TYR A CD1 
556  C CD2 . TYR A 74  ? 0.29230 0.31710 0.27392 0.03236  0.00318  0.02394  74  TYR A CD2 
557  C CE1 . TYR A 74  ? 0.27509 0.29096 0.26233 0.02738  0.01083  0.03470  74  TYR A CE1 
558  C CE2 . TYR A 74  ? 0.26509 0.29041 0.24169 0.03661  0.00946  0.03128  74  TYR A CE2 
559  C CZ  . TYR A 74  ? 0.34767 0.36840 0.32777 0.03375  0.01336  0.03677  74  TYR A CZ  
560  O OH  . TYR A 74  ? 0.31787 0.33801 0.29377 0.03793  0.02037  0.04472  74  TYR A OH  
561  N N   . PHE A 75  ? 0.26412 0.27981 0.26605 0.01638  -0.01019 0.00445  75  PHE A N   
562  C CA  . PHE A 75  ? 0.27776 0.29020 0.28441 0.01389  -0.01357 -0.00060 75  PHE A CA  
563  C C   . PHE A 75  ? 0.24354 0.25954 0.25020 0.01744  -0.01934 -0.00611 75  PHE A C   
564  O O   . PHE A 75  ? 0.30665 0.32679 0.30659 0.02241  -0.02119 -0.00810 75  PHE A O   
565  C CB  . PHE A 75  ? 0.25578 0.26601 0.26197 0.01226  -0.01260 -0.00198 75  PHE A CB  
566  C CG  . PHE A 75  ? 0.31198 0.31727 0.32203 0.01022  -0.01498 -0.00624 75  PHE A CG  
567  C CD1 . PHE A 75  ? 0.24402 0.24259 0.25811 0.00689  -0.01320 -0.00480 75  PHE A CD1 
568  C CD2 . PHE A 75  ? 0.31672 0.32312 0.32564 0.01235  -0.01837 -0.01126 75  PHE A CD2 
569  C CE1 . PHE A 75  ? 0.29209 0.28522 0.30957 0.00567  -0.01391 -0.00748 75  PHE A CE1 
570  C CE2 . PHE A 75  ? 0.28564 0.28634 0.29877 0.01049  -0.01983 -0.01456 75  PHE A CE2 
571  C CZ  . PHE A 75  ? 0.22714 0.22123 0.24481 0.00711  -0.01715 -0.01225 75  PHE A CZ  
572  N N   . ILE A 76  ? 0.24349 0.25772 0.25822 0.01536  -0.02217 -0.00858 76  ILE A N   
573  C CA  . ILE A 76  ? 0.26260 0.27865 0.28194 0.01706  -0.02879 -0.01527 76  ILE A CA  
574  C C   . ILE A 76  ? 0.30756 0.31762 0.33413 0.01281  -0.02850 -0.01777 76  ILE A C   
575  O O   . ILE A 76  ? 0.29640 0.30136 0.32738 0.00884  -0.02394 -0.01414 76  ILE A O   
576  C CB  . ILE A 76  ? 0.29697 0.31636 0.32380 0.01786  -0.03238 -0.01621 76  ILE A CB  
577  C CG1 . ILE A 76  ? 0.30068 0.32565 0.31788 0.02411  -0.03368 -0.01454 76  ILE A CG1 
578  C CG2 . ILE A 76  ? 0.23058 0.25061 0.26805 0.01757  -0.03962 -0.02371 76  ILE A CG2 
579  C CD1 . ILE A 76  ? 0.31461 0.34383 0.33843 0.02627  -0.03853 -0.01622 76  ILE A CD1 
580  N N   . HIS A 77  ? 0.26273 0.27241 0.28918 0.01449  -0.03309 -0.02378 77  HIS A N   
581  C CA  . HIS A 77  ? 0.31563 0.31861 0.34789 0.01116  -0.03233 -0.02581 77  HIS A CA  
582  C C   . HIS A 77  ? 0.34145 0.34131 0.38876 0.00716  -0.03238 -0.02605 77  HIS A C   
583  O O   . HIS A 77  ? 0.30146 0.30571 0.35713 0.00756  -0.03663 -0.02833 77  HIS A O   
584  C CB  . HIS A 77  ? 0.27313 0.27578 0.30193 0.01439  -0.03761 -0.03256 77  HIS A CB  
585  C CG  . HIS A 77  ? 0.32727 0.33242 0.34274 0.01846  -0.03594 -0.03166 77  HIS A CG  
586  N ND1 . HIS A 77  ? 0.31447 0.32608 0.32052 0.02417  -0.03746 -0.03170 77  HIS A ND1 
587  C CD2 . HIS A 77  ? 0.32933 0.33173 0.34010 0.01819  -0.03245 -0.03027 77  HIS A CD2 
588  C CE1 . HIS A 77  ? 0.37500 0.38803 0.37247 0.02681  -0.03414 -0.02988 77  HIS A CE1 
589  N NE2 . HIS A 77  ? 0.33530 0.34333 0.33613 0.02305  -0.03162 -0.02938 77  HIS A NE2 
590  N N   . GLY A 78  ? 0.26419 0.25648 0.31533 0.00390  -0.02735 -0.02342 78  GLY A N   
591  C CA  . GLY A 78  ? 0.27167 0.25973 0.33802 0.00049  -0.02574 -0.02301 78  GLY A CA  
592  C C   . GLY A 78  ? 0.32330 0.30609 0.39592 -0.00031 -0.02839 -0.02804 78  GLY A C   
593  O O   . GLY A 78  ? 0.30145 0.28421 0.36571 0.00227  -0.03234 -0.03257 78  GLY A O   
594  N N   . ASN A 79  ? 0.37410 0.35193 0.46230 -0.00368 -0.02552 -0.02679 79  ASN A N   
595  C CA  . ASN A 79  ? 0.39527 0.36631 0.49137 -0.00491 -0.02706 -0.03084 79  ASN A CA  
596  C C   . ASN A 79  ? 0.32770 0.28941 0.41237 -0.00374 -0.02114 -0.02762 79  ASN A C   
597  O O   . ASN A 79  ? 0.36994 0.32615 0.45490 -0.00319 -0.02327 -0.03162 79  ASN A O   
598  C CB  . ASN A 79  ? 0.33796 0.30677 0.45767 -0.00911 -0.02523 -0.02999 79  ASN A CB  
599  C CG  . ASN A 79  ? 0.41234 0.37715 0.53554 -0.01050 -0.01445 -0.02057 79  ASN A CG  
600  O OD1 . ASN A 79  ? 0.37036 0.34036 0.48966 -0.00973 -0.01238 -0.01667 79  ASN A OD1 
601  N ND2 . ASN A 79  ? 0.35853 0.31327 0.48857 -0.01181 -0.00719 -0.01665 79  ASN A ND2 
602  N N   . ARG A 80  ? 0.33307 0.29255 0.40713 -0.00270 -0.01455 -0.02108 80  ARG A N   
603  C CA  . ARG A 80  ? 0.41567 0.36669 0.47784 -0.00047 -0.01010 -0.01859 80  ARG A CA  
604  C C   . ARG A 80  ? 0.34509 0.30028 0.39208 0.00260  -0.01412 -0.02162 80  ARG A C   
605  O O   . ARG A 80  ? 0.35152 0.30170 0.39209 0.00474  -0.01428 -0.02336 80  ARG A O   
606  C CB  . ARG A 80  ? 0.35468 0.30026 0.41195 0.00034  -0.00206 -0.01098 80  ARG A CB  
607  C CG  . ARG A 80  ? 0.39218 0.33413 0.46424 -0.00181 0.00395  -0.00633 80  ARG A CG  
608  C CD  . ARG A 80  ? 0.45557 0.38900 0.53893 -0.00292 0.00685  -0.00647 80  ARG A CD  
609  N NE  . ARG A 80  ? 0.47604 0.39860 0.54597 0.00095  0.01143  -0.00392 80  ARG A NE  
610  C CZ  . ARG A 80  ? 0.45179 0.36372 0.52741 0.00149  0.01672  -0.00163 80  ARG A CZ  
611  N NH1 . ARG A 80  ? 0.36904 0.27965 0.46598 -0.00247 0.01849  -0.00146 80  ARG A NH1 
612  N NH2 . ARG A 80  ? 0.49976 0.40200 0.56022 0.00634  0.02025  0.00057  80  ARG A NH2 
613  N N   . ASP A 81  ? 0.35957 0.32384 0.40147 0.00321  -0.01683 -0.02184 81  ASP A N   
614  C CA  . ASP A 81  ? 0.31402 0.28280 0.34348 0.00601  -0.01863 -0.02286 81  ASP A CA  
615  C C   . ASP A 81  ? 0.31370 0.29107 0.34172 0.00802  -0.02458 -0.02767 81  ASP A C   
616  O O   . ASP A 81  ? 0.31692 0.30111 0.33791 0.00986  -0.02486 -0.02643 81  ASP A O   
617  C CB  . ASP A 81  ? 0.25828 0.22875 0.28151 0.00590  -0.01519 -0.01777 81  ASP A CB  
618  C CG  . ASP A 81  ? 0.30206 0.27591 0.33091 0.00395  -0.01407 -0.01483 81  ASP A CG  
619  O OD1 . ASP A 81  ? 0.28980 0.26715 0.32738 0.00299  -0.01688 -0.01712 81  ASP A OD1 
620  O OD2 . ASP A 81  ? 0.29175 0.26460 0.31645 0.00375  -0.01092 -0.01061 81  ASP A OD2 
621  N N   . PHE A 82  ? 0.29947 0.27584 0.33391 0.00831  -0.02934 -0.03324 82  PHE A N   
622  C CA  . PHE A 82  ? 0.23782 0.22089 0.26862 0.01197  -0.03586 -0.03875 82  PHE A CA  
623  C C   . PHE A 82  ? 0.29042 0.27538 0.30867 0.01664  -0.03640 -0.04045 82  PHE A C   
624  O O   . PHE A 82  ? 0.30976 0.30064 0.32137 0.02128  -0.04020 -0.04354 82  PHE A O   
625  C CB  . PHE A 82  ? 0.30409 0.28437 0.34578 0.01140  -0.04216 -0.04555 82  PHE A CB  
626  C CG  . PHE A 82  ? 0.31349 0.28415 0.35905 0.01035  -0.04158 -0.04795 82  PHE A CG  
627  C CD1 . PHE A 82  ? 0.37655 0.33945 0.43294 0.00592  -0.03629 -0.04409 82  PHE A CD1 
628  C CD2 . PHE A 82  ? 0.36438 0.33312 0.40202 0.01462  -0.04563 -0.05355 82  PHE A CD2 
629  C CE1 . PHE A 82  ? 0.36544 0.31840 0.42489 0.00553  -0.03487 -0.04547 82  PHE A CE1 
630  C CE2 . PHE A 82  ? 0.34755 0.30652 0.38831 0.01403  -0.04493 -0.05557 82  PHE A CE2 
631  C CZ  . PHE A 82  ? 0.45275 0.40360 0.50451 0.00937  -0.03946 -0.05137 82  PHE A CZ  
632  N N   . LEU A 83  ? 0.26228 0.24252 0.27680 0.01648  -0.03262 -0.03842 83  LEU A N   
633  C CA  . LEU A 83  ? 0.29215 0.27531 0.29675 0.02102  -0.03270 -0.03962 83  LEU A CA  
634  C C   . LEU A 83  ? 0.29990 0.28997 0.29948 0.02151  -0.02865 -0.03425 83  LEU A C   
635  O O   . LEU A 83  ? 0.28570 0.27938 0.27959 0.02494  -0.02771 -0.03424 83  LEU A O   
636  C CB  . LEU A 83  ? 0.25387 0.22881 0.25747 0.02155  -0.03163 -0.04094 83  LEU A CB  
637  C CG  . LEU A 83  ? 0.32056 0.28799 0.32877 0.02199  -0.03574 -0.04694 83  LEU A CG  
638  C CD1 . LEU A 83  ? 0.36132 0.31954 0.36763 0.02289  -0.03342 -0.04690 83  LEU A CD1 
639  C CD2 . LEU A 83  ? 0.32429 0.29622 0.32717 0.02711  -0.04180 -0.05333 83  LEU A CD2 
640  N N   . VAL A 84  ? 0.26250 0.25442 0.26528 0.01822  -0.02614 -0.02968 84  VAL A N   
641  C CA  . VAL A 84  ? 0.24175 0.23978 0.24164 0.01840  -0.02275 -0.02494 84  VAL A CA  
642  C C   . VAL A 84  ? 0.30371 0.31005 0.29827 0.02318  -0.02346 -0.02551 84  VAL A C   
643  O O   . VAL A 84  ? 0.31861 0.32705 0.31181 0.02523  -0.02625 -0.02743 84  VAL A O   
644  C CB  . VAL A 84  ? 0.26273 0.25991 0.26653 0.01450  -0.02035 -0.02043 84  VAL A CB  
645  C CG1 . VAL A 84  ? 0.27442 0.27791 0.27661 0.01472  -0.01739 -0.01595 84  VAL A CG1 
646  C CG2 . VAL A 84  ? 0.22600 0.21452 0.23217 0.01159  -0.01843 -0.01898 84  VAL A CG2 
647  N N   . GLY A 85  ? 0.22931 0.24047 0.22090 0.02577  -0.02087 -0.02379 85  GLY A N   
648  C CA  . GLY A 85  ? 0.33146 0.34984 0.31684 0.03182  -0.02007 -0.02364 85  GLY A CA  
649  C C   . GLY A 85  ? 0.39733 0.42299 0.38415 0.03210  -0.01436 -0.01701 85  GLY A C   
650  O O   . GLY A 85  ? 0.28817 0.31309 0.28114 0.02702  -0.01209 -0.01302 85  GLY A O   
651  N N   . GLN A 86  ? 0.33227 0.36440 0.31368 0.03847  -0.01164 -0.01565 86  GLN A N   
652  C CA  . GLN A 86  ? 0.37043 0.40958 0.35423 0.03947  -0.00496 -0.00840 86  GLN A CA  
653  C C   . GLN A 86  ? 0.39748 0.43968 0.39209 0.03533  -0.00145 -0.00510 86  GLN A C   
654  O O   . GLN A 86  ? 0.37629 0.42218 0.37802 0.03284  0.00334  0.00088  86  GLN A O   
655  C CB  . GLN A 86  ? 0.44906 0.49379 0.42311 0.04892  -0.00195 -0.00722 86  GLN A CB  
656  C CG  . GLN A 86  ? 0.66047 0.70536 0.62587 0.05338  -0.00193 -0.00557 86  GLN A CG  
657  C CD  . GLN A 86  ? 0.64645 0.69267 0.61848 0.04885  0.00307  0.00180  86  GLN A CD  
658  O OE1 . GLN A 86  ? 0.53230 0.57547 0.50233 0.04758  0.00046  0.00159  86  GLN A OE1 
659  N NE2 . GLN A 86  ? 0.71296 0.76376 0.69412 0.04650  0.01012  0.00822  86  GLN A NE2 
660  N N   . ARG A 87  ? 0.32045 0.36095 0.31705 0.03486  -0.00412 -0.00909 87  ARG A N   
661  C CA  . ARG A 87  ? 0.38435 0.42752 0.39181 0.03122  -0.00271 -0.00725 87  ARG A CA  
662  C C   . ARG A 87  ? 0.32695 0.36469 0.34054 0.02419  -0.00435 -0.00616 87  ARG A C   
663  O O   . ARG A 87  ? 0.27134 0.31247 0.29471 0.02095  -0.00183 -0.00227 87  ARG A O   
664  C CB  . ARG A 87  ? 0.32658 0.36787 0.33279 0.03327  -0.00608 -0.01227 87  ARG A CB  
665  C CG  . ARG A 87  ? 0.33685 0.38033 0.35380 0.03024  -0.00661 -0.01177 87  ARG A CG  
666  C CD  . ARG A 87  ? 0.39079 0.43599 0.40664 0.03470  -0.00828 -0.01537 87  ARG A CD  
667  N NE  . ARG A 87  ? 0.44301 0.49033 0.46917 0.03247  -0.01026 -0.01577 87  ARG A NE  
668  C CZ  . ARG A 87  ? 0.62253 0.66833 0.64768 0.03535  -0.01362 -0.01964 87  ARG A CZ  
669  N NH1 . ARG A 87  ? 0.39308 0.43463 0.40781 0.04016  -0.01476 -0.02316 87  ARG A NH1 
670  N NH2 . ARG A 87  ? 0.56495 0.61313 0.59983 0.03381  -0.01642 -0.02037 87  ARG A NH2 
671  N N   . PHE A 88  ? 0.26222 0.29113 0.27084 0.02206  -0.00839 -0.00951 88  PHE A N   
672  C CA  . PHE A 88  ? 0.29995 0.32295 0.31224 0.01677  -0.00935 -0.00822 88  PHE A CA  
673  C C   . PHE A 88  ? 0.29500 0.32023 0.30922 0.01506  -0.00608 -0.00332 88  PHE A C   
674  O O   . PHE A 88  ? 0.25011 0.27316 0.27003 0.01115  -0.00546 -0.00088 88  PHE A O   
675  C CB  . PHE A 88  ? 0.32013 0.33348 0.32728 0.01568  -0.01275 -0.01175 88  PHE A CB  
676  C CG  . PHE A 88  ? 0.29182 0.29827 0.30081 0.01173  -0.01311 -0.01026 88  PHE A CG  
677  C CD1 . PHE A 88  ? 0.28923 0.29158 0.29991 0.01088  -0.01477 -0.01119 88  PHE A CD1 
678  C CD2 . PHE A 88  ? 0.31107 0.31501 0.31935 0.00986  -0.01215 -0.00819 88  PHE A CD2 
679  C CE1 . PHE A 88  ? 0.32126 0.31616 0.33132 0.00868  -0.01532 -0.01018 88  PHE A CE1 
680  C CE2 . PHE A 88  ? 0.29433 0.29148 0.30322 0.00720  -0.01200 -0.00666 88  PHE A CE2 
681  C CZ  . PHE A 88  ? 0.29342 0.28559 0.30243 0.00684  -0.01351 -0.00770 88  PHE A CZ  
682  N N   . ALA A 89  ? 0.24313 0.27189 0.25181 0.01869  -0.00438 -0.00212 89  ALA A N   
683  C CA  . ALA A 89  ? 0.29741 0.32825 0.30663 0.01841  -0.00072 0.00315  89  ALA A CA  
684  C C   . ALA A 89  ? 0.23887 0.27532 0.25714 0.01725  0.00461  0.00869  89  ALA A C   
685  O O   . ALA A 89  ? 0.28809 0.32278 0.31193 0.01364  0.00675  0.01265  89  ALA A O   
686  C CB  . ALA A 89  ? 0.23917 0.27291 0.23892 0.02451  -0.00044 0.00294  89  ALA A CB  
687  N N   . ARG A 90  ? 0.29573 0.33884 0.31690 0.02031  0.00697  0.00911  90  ARG A N   
688  C CA  . ARG A 90  ? 0.32893 0.37847 0.36273 0.01886  0.01245  0.01454  90  ARG A CA  
689  C C   . ARG A 90  ? 0.31664 0.36297 0.36242 0.01221  0.00902  0.01294  90  ARG A C   
690  O O   . ARG A 90  ? 0.33205 0.37918 0.38893 0.00842  0.01183  0.01715  90  ARG A O   
691  C CB  . ARG A 90  ? 0.38391 0.44182 0.41903 0.02417  0.01571  0.01503  90  ARG A CB  
692  C CG  . ARG A 90  ? 0.50091 0.56331 0.52625 0.03203  0.02171  0.01921  90  ARG A CG  
693  C CD  . ARG A 90  ? 0.69029 0.76119 0.71792 0.03787  0.02633  0.02073  90  ARG A CD  
694  N NE  . ARG A 90  ? 0.78304 0.85200 0.79815 0.04315  0.02126  0.01380  90  ARG A NE  
695  C CZ  . ARG A 90  ? 0.69698 0.76638 0.71587 0.04231  0.01731  0.00889  90  ARG A CZ  
696  N NH1 . ARG A 90  ? 0.76331 0.83575 0.79785 0.03687  0.01695  0.00951  90  ARG A NH1 
697  N NH2 . ARG A 90  ? 0.69297 0.75919 0.69971 0.04747  0.01305  0.00283  90  ARG A NH2 
698  N N   . GLN A 91  ? 0.31366 0.35549 0.35693 0.01134  0.00276  0.00672  91  GLN A N   
699  C CA  . GLN A 91  ? 0.30793 0.34556 0.35949 0.00683  -0.00168 0.00424  91  GLN A CA  
700  C C   . GLN A 91  ? 0.27157 0.30118 0.32222 0.00290  -0.00260 0.00555  91  GLN A C   
701  O O   . GLN A 91  ? 0.27870 0.30656 0.33935 -0.00082 -0.00399 0.00601  91  GLN A O   
702  C CB  . GLN A 91  ? 0.31226 0.34487 0.35729 0.00846  -0.00759 -0.00212 91  GLN A CB  
703  C CG  . GLN A 91  ? 0.49641 0.53634 0.54526 0.01193  -0.00787 -0.00405 91  GLN A CG  
704  C CD  . GLN A 91  ? 0.70605 0.73949 0.74707 0.01419  -0.01338 -0.00990 91  GLN A CD  
705  O OE1 . GLN A 91  ? 0.55481 0.57821 0.58680 0.01352  -0.01595 -0.01196 91  GLN A OE1 
706  N NE2 . GLN A 91  ? 0.66263 0.70167 0.70738 0.01738  -0.01451 -0.01203 91  GLN A NE2 
707  N N   . SER A 92  ? 0.26756 0.29217 0.30710 0.00392  -0.00230 0.00576  92  SER A N   
708  C CA  . SER A 92  ? 0.24945 0.26625 0.28697 0.00107  -0.00301 0.00692  92  SER A CA  
709  C C   . SER A 92  ? 0.26635 0.28560 0.30675 0.00042  0.00226  0.01307  92  SER A C   
710  O O   . SER A 92  ? 0.30756 0.32060 0.34830 -0.00205 0.00212  0.01461  92  SER A O   
711  C CB  . SER A 92  ? 0.22618 0.23656 0.25260 0.00247  -0.00527 0.00421  92  SER A CB  
712  O OG  . SER A 92  ? 0.27557 0.29058 0.29651 0.00574  -0.00349 0.00482  92  SER A OG  
713  N N   . GLY A 93  ? 0.29468 0.32197 0.33581 0.00351  0.00729  0.01691  93  GLY A N   
714  C CA  . GLY A 93  ? 0.25377 0.28226 0.29428 0.00460  0.01291  0.02329  93  GLY A CA  
715  C C   . GLY A 93  ? 0.26632 0.29158 0.29438 0.00754  0.01195  0.02300  93  GLY A C   
716  O O   . GLY A 93  ? 0.30931 0.33444 0.33523 0.00911  0.01597  0.02811  93  GLY A O   
717  N N   . MET A 94  ? 0.22755 0.25021 0.24845 0.00852  0.00680  0.01730  94  MET A N   
718  C CA  . MET A 94  ? 0.27720 0.29796 0.28954 0.01108  0.00501  0.01626  94  MET A CA  
719  C C   . MET A 94  ? 0.35785 0.38481 0.36254 0.01775  0.00615  0.01656  94  MET A C   
720  O O   . MET A 94  ? 0.37844 0.41004 0.38230 0.02063  0.00702  0.01548  94  MET A O   
721  C CB  . MET A 94  ? 0.33101 0.34653 0.34133 0.00945  -0.00036 0.01042  94  MET A CB  
722  C CG  . MET A 94  ? 0.40664 0.41430 0.42007 0.00512  -0.00143 0.01031  94  MET A CG  
723  S SD  . MET A 94  ? 0.36117 0.36286 0.37152 0.00488  -0.00494 0.00625  94  MET A SD  
724  C CE  . MET A 94  ? 0.30396 0.30666 0.31330 0.00617  -0.00768 0.00108  94  MET A CE  
725  N N   . ILE A 95  ? 0.26307 0.28985 0.26136 0.02109  0.00573  0.01769  95  ILE A N   
726  C CA  . ILE A 95  ? 0.29972 0.33094 0.28809 0.02889  0.00491  0.01664  95  ILE A CA  
727  C C   . ILE A 95  ? 0.33772 0.36702 0.32347 0.02940  -0.00281 0.00911  95  ILE A C   
728  O O   . ILE A 95  ? 0.30540 0.33119 0.29446 0.02622  -0.00550 0.00801  95  ILE A O   
729  C CB  . ILE A 95  ? 0.29262 0.32497 0.27529 0.03363  0.00900  0.02275  95  ILE A CB  
730  C CG1 . ILE A 95  ? 0.31093 0.34524 0.29792 0.03354  0.01787  0.03087  95  ILE A CG1 
731  C CG2 . ILE A 95  ? 0.28010 0.31570 0.25002 0.04309  0.00598  0.02012  95  ILE A CG2 
732  C CD1 . ILE A 95  ? 0.39241 0.42502 0.37690 0.03591  0.02320  0.03831  95  ILE A CD1 
733  N N   . LEU A 96  ? 0.29363 0.32501 0.27469 0.03343  -0.00613 0.00401  96  LEU A N   
734  C CA  . LEU A 96  ? 0.23470 0.26388 0.21552 0.03373  -0.01372 -0.00357 96  LEU A CA  
735  C C   . LEU A 96  ? 0.34438 0.37583 0.31814 0.04025  -0.01781 -0.00544 96  LEU A C   
736  O O   . LEU A 96  ? 0.32302 0.35797 0.28626 0.04824  -0.01625 -0.00375 96  LEU A O   
737  C CB  . LEU A 96  ? 0.26175 0.29098 0.24037 0.03573  -0.01627 -0.00889 96  LEU A CB  
738  C CG  . LEU A 96  ? 0.31468 0.34256 0.29892 0.03116  -0.01304 -0.00772 96  LEU A CG  
739  C CD1 . LEU A 96  ? 0.37200 0.39994 0.35249 0.03468  -0.01585 -0.01316 96  LEU A CD1 
740  C CD2 . LEU A 96  ? 0.29558 0.31746 0.28833 0.02362  -0.01382 -0.00793 96  LEU A CD2 
741  N N   . LEU A 97  ? 0.29599 0.32553 0.27560 0.03762  -0.02296 -0.00882 97  LEU A N   
742  C CA  . LEU A 97  ? 0.28687 0.31897 0.26226 0.04353  -0.02865 -0.01180 97  LEU A CA  
743  C C   . LEU A 97  ? 0.30663 0.33797 0.28579 0.04440  -0.03790 -0.02141 97  LEU A C   
744  O O   . LEU A 97  ? 0.40159 0.42947 0.38763 0.03949  -0.03888 -0.02477 97  LEU A O   
745  C CB  . LEU A 97  ? 0.22213 0.25379 0.20379 0.04030  -0.02760 -0.00802 97  LEU A CB  
746  C CG  . LEU A 97  ? 0.28529 0.31628 0.26426 0.03930  -0.01912 0.00113  97  LEU A CG  
747  C CD1 . LEU A 97  ? 0.31467 0.34446 0.29914 0.03694  -0.01901 0.00384  97  LEU A CD1 
748  C CD2 . LEU A 97  ? 0.31284 0.34700 0.27869 0.04799  -0.01566 0.00508  97  LEU A CD2 
749  N N   . ALA A 98  ? 0.38964 0.42375 0.36446 0.05116  -0.04511 -0.02605 98  ALA A N   
750  C CA  . ALA A 98  ? 0.33414 0.36753 0.31457 0.05225  -0.05545 -0.03616 98  ALA A CA  
751  C C   . ALA A 98  ? 0.48283 0.51492 0.48254 0.04372  -0.05779 -0.03773 98  ALA A C   
752  O O   . ALA A 98  ? 0.36342 0.39528 0.36934 0.03851  -0.05183 -0.03119 98  ALA A O   
753  C CB  . ALA A 98  ? 0.36885 0.40565 0.33813 0.06333  -0.06364 -0.04140 98  ALA A CB  
754  N N   . GLU A 99  ? 0.39676 0.42757 0.40663 0.04265  -0.06633 -0.04644 99  GLU A N   
755  C CA  . GLU A 99  ? 0.34322 0.37284 0.37384 0.03461  -0.06734 -0.04730 99  GLU A CA  
756  C C   . GLU A 99  ? 0.26848 0.30348 0.30591 0.03552  -0.06950 -0.04565 99  GLU A C   
757  O O   . GLU A 99  ? 0.35512 0.38975 0.40778 0.02896  -0.06608 -0.04235 99  GLU A O   
758  C CB  . GLU A 99  ? 0.42153 0.44832 0.46422 0.03305  -0.07587 -0.05691 99  GLU A CB  
759  C CG  . GLU A 99  ? 0.41768 0.44800 0.45835 0.04079  -0.08869 -0.06678 99  GLU A CG  
760  C CD  . GLU A 99  ? 0.64207 0.66887 0.69990 0.03753  -0.09752 -0.07652 99  GLU A CD  
761  O OE1 . GLU A 99  ? 0.54708 0.56752 0.60230 0.03618  -0.09648 -0.07889 99  GLU A OE1 
762  O OE2 . GLU A 99  ? 0.54497 0.57533 0.62013 0.03634  -0.10555 -0.08182 99  GLU A OE2 
763  N N   . GLU A 100 ? 0.34321 0.38295 0.36886 0.04442  -0.07466 -0.04750 100 GLU A N   
764  C CA  . GLU A 100 ? 0.33179 0.37675 0.36029 0.04694  -0.07609 -0.04498 100 GLU A CA  
765  C C   . GLU A 100 ? 0.42811 0.47415 0.43557 0.05440  -0.07072 -0.03826 100 GLU A C   
766  O O   . GLU A 100 ? 0.42571 0.47115 0.41630 0.06195  -0.07174 -0.03979 100 GLU A O   
767  C CB  . GLU A 100 ? 0.38090 0.43082 0.41778 0.05197  -0.08979 -0.05500 100 GLU A CB  
768  C CG  . GLU A 100 ? 0.45974 0.50930 0.52229 0.04423  -0.09521 -0.06137 100 GLU A CG  
769  C CD  . GLU A 100 ? 0.61034 0.66551 0.68378 0.04914  -0.11007 -0.07209 100 GLU A CD  
770  O OE1 . GLU A 100 ? 0.47149 0.53061 0.53000 0.05956  -0.11646 -0.07464 100 GLU A OE1 
771  O OE2 . GLU A 100 ? 0.60664 0.66200 0.70404 0.04299  -0.11548 -0.07800 100 GLU A OE2 
772  N N   . GLU A 101 ? 0.35953 0.40657 0.36815 0.05268  -0.06435 -0.03040 101 GLU A N   
773  C CA  . GLU A 101 ? 0.35889 0.40638 0.35006 0.05956  -0.05884 -0.02328 101 GLU A CA  
774  C C   . GLU A 101 ? 0.38211 0.43293 0.37744 0.06154  -0.05968 -0.02025 101 GLU A C   
775  O O   . GLU A 101 ? 0.40382 0.45515 0.41561 0.05457  -0.05887 -0.01941 101 GLU A O   
776  C CB  . GLU A 101 ? 0.39996 0.44270 0.38592 0.05458  -0.04674 -0.01438 101 GLU A CB  
777  C CG  . GLU A 101 ? 0.45176 0.49194 0.43250 0.05360  -0.04478 -0.01615 101 GLU A CG  
778  C CD  . GLU A 101 ? 0.44735 0.48912 0.40964 0.06438  -0.04544 -0.01661 101 GLU A CD  
779  O OE1 . GLU A 101 ? 0.49690 0.54113 0.44884 0.07328  -0.04749 -0.01548 101 GLU A OE1 
780  O OE2 . GLU A 101 ? 0.50559 0.54592 0.46292 0.06481  -0.04352 -0.01779 101 GLU A OE2 
781  N N   . ARG A 102 ? 0.37615 0.42893 0.35578 0.07191  -0.06069 -0.01814 102 ARG A N   
782  C CA  . ARG A 102 ? 0.42849 0.48393 0.40832 0.07570  -0.06075 -0.01426 102 ARG A CA  
783  C C   . ARG A 102 ? 0.35889 0.40966 0.32691 0.07624  -0.04850 -0.00278 102 ARG A C   
784  O O   . ARG A 102 ? 0.53871 0.58747 0.48987 0.08287  -0.04427 0.00084  102 ARG A O   
785  C CB  . ARG A 102 ? 0.49318 0.55354 0.46333 0.08845  -0.07169 -0.02056 102 ARG A CB  
786  C CG  . ARG A 102 ? 0.57886 0.64292 0.55058 0.09327  -0.07366 -0.01788 102 ARG A CG  
787  C CD  . ARG A 102 ? 0.62028 0.69076 0.59085 0.10374  -0.08867 -0.02792 102 ARG A CD  
788  N NE  . ARG A 102 ? 0.84922 0.91798 0.79469 0.11729  -0.09191 -0.02993 102 ARG A NE  
789  C CZ  . ARG A 102 ? 0.92391 0.99180 0.86371 0.12059  -0.09875 -0.03822 102 ARG A CZ  
790  N NH1 . ARG A 102 ? 0.69905 0.76739 0.65722 0.11083  -0.10339 -0.04548 102 ARG A NH1 
791  N NH2 . ARG A 102 ? 1.04002 1.10578 0.95433 0.13476  -0.10047 -0.03889 102 ARG A NH2 
792  N N   . LEU A 103 ? 0.41381 0.46241 0.39123 0.06956  -0.04251 0.00302  103 LEU A N   
793  C CA  . LEU A 103 ? 0.36874 0.41176 0.33821 0.06877  -0.03149 0.01331  103 LEU A CA  
794  C C   . LEU A 103 ? 0.51506 0.55885 0.48045 0.07500  -0.03107 0.01776  103 LEU A C   
795  O O   . LEU A 103 ? 0.42512 0.47371 0.39992 0.07608  -0.03782 0.01373  103 LEU A O   
796  C CB  . LEU A 103 ? 0.39162 0.42932 0.37237 0.05719  -0.02466 0.01665  103 LEU A CB  
797  C CG  . LEU A 103 ? 0.34479 0.38102 0.33175 0.05010  -0.02482 0.01254  103 LEU A CG  
798  C CD1 . LEU A 103 ? 0.34392 0.37448 0.34069 0.04072  -0.01913 0.01570  103 LEU A CD1 
799  C CD2 . LEU A 103 ? 0.38903 0.42409 0.36407 0.05305  -0.02119 0.01433  103 LEU A CD2 
800  N N   . ASP A 104 ? 0.38015 0.41920 0.33260 0.07921  -0.02275 0.02643  104 ASP A N   
801  C CA  . ASP A 104 ? 0.42924 0.46636 0.37728 0.08406  -0.01965 0.03272  104 ASP A CA  
802  C C   . ASP A 104 ? 0.40118 0.43071 0.35616 0.07484  -0.01029 0.03959  104 ASP A C   
803  O O   . ASP A 104 ? 0.45755 0.48132 0.40810 0.07214  -0.00217 0.04529  104 ASP A O   
804  C CB  . ASP A 104 ? 0.49484 0.53046 0.42292 0.09638  -0.01644 0.03814  104 ASP A CB  
805  C CG  . ASP A 104 ? 0.65925 0.69226 0.58168 0.10257  -0.01347 0.04473  104 ASP A CG  
806  O OD1 . ASP A 104 ? 0.71496 0.75347 0.63999 0.10771  -0.02186 0.04020  104 ASP A OD1 
807  O OD2 . ASP A 104 ? 0.69393 0.71935 0.61048 0.10231  -0.00286 0.05438  104 ASP A OD2 
808  N N   . LEU A 105 ? 0.44419 0.47371 0.41080 0.07030  -0.01166 0.03875  105 LEU A N   
809  C CA  . LEU A 105 ? 0.36273 0.38420 0.33506 0.06258  -0.00421 0.04394  105 LEU A CA  
810  C C   . LEU A 105 ? 0.40271 0.42126 0.37127 0.06773  -0.00154 0.04962  105 LEU A C   
811  O O   . LEU A 105 ? 0.35981 0.38242 0.33586 0.06905  -0.00568 0.04732  105 LEU A O   
812  C CB  . LEU A 105 ? 0.33645 0.35862 0.32361 0.05398  -0.00649 0.03904  105 LEU A CB  
813  C CG  . LEU A 105 ? 0.38985 0.41431 0.38129 0.04906  -0.00938 0.03320  105 LEU A CG  
814  C CD1 . LEU A 105 ? 0.33720 0.36237 0.34323 0.04239  -0.01145 0.02901  105 LEU A CD1 
815  C CD2 . LEU A 105 ? 0.35668 0.37485 0.34245 0.04520  -0.00304 0.03675  105 LEU A CD2 
816  N N   . TYR A 106 ? 0.43156 0.44308 0.38950 0.07085  0.00578  0.05737  106 TYR A N   
817  C CA  . TYR A 106 ? 0.41828 0.42463 0.37107 0.07590  0.00970  0.06389  106 TYR A CA  
818  C C   . TYR A 106 ? 0.44847 0.46285 0.39766 0.08603  0.00264  0.06143  106 TYR A C   
819  O O   . TYR A 106 ? 0.49735 0.51108 0.44899 0.08865  0.00239  0.06331  106 TYR A O   
820  C CB  . TYR A 106 ? 0.43614 0.43529 0.39797 0.06854  0.01314  0.06543  106 TYR A CB  
821  C CG  . TYR A 106 ? 0.39792 0.39129 0.36569 0.05847  0.01644  0.06446  106 TYR A CG  
822  C CD1 . TYR A 106 ? 0.45099 0.43596 0.41510 0.05584  0.02332  0.06988  106 TYR A CD1 
823  C CD2 . TYR A 106 ? 0.44271 0.43912 0.42060 0.05200  0.01264  0.05819  106 TYR A CD2 
824  C CE1 . TYR A 106 ? 0.44391 0.42443 0.41450 0.04715  0.02502  0.06815  106 TYR A CE1 
825  C CE2 . TYR A 106 ? 0.35760 0.34860 0.33942 0.04407  0.01496  0.05699  106 TYR A CE2 
826  C CZ  . TYR A 106 ? 0.37166 0.35513 0.34987 0.04175  0.02049  0.06151  106 TYR A CZ  
827  O OH  . TYR A 106 ? 0.37381 0.35264 0.35700 0.03434  0.02154  0.05952  106 TYR A OH  
828  N N   . GLY A 107 ? 0.47375 0.49579 0.41700 0.09243  -0.00379 0.05667  107 GLY A N   
829  C CA  . GLY A 107 ? 0.55564 0.58533 0.49356 0.10370  -0.01200 0.05338  107 GLY A CA  
830  C C   . GLY A 107 ? 0.67338 0.71409 0.62471 0.10224  -0.02380 0.04255  107 GLY A C   
831  O O   . GLY A 107 ? 0.70675 0.75466 0.65273 0.11175  -0.03295 0.03716  107 GLY A O   
832  N N   . ARG A 108 ? 0.50963 0.55126 0.47837 0.09114  -0.02392 0.03920  108 ARG A N   
833  C CA  . ARG A 108 ? 0.56544 0.61690 0.55065 0.08878  -0.03390 0.02983  108 ARG A CA  
834  C C   . ARG A 108 ? 0.47767 0.53075 0.46340 0.08522  -0.03769 0.02348  108 ARG A C   
835  O O   . ARG A 108 ? 0.46201 0.50862 0.44479 0.07862  -0.03086 0.02622  108 ARG A O   
836  C CB  . ARG A 108 ? 0.58345 0.63481 0.58730 0.08006  -0.03104 0.03041  108 ARG A CB  
837  C CG  . ARG A 108 ? 0.69055 0.73454 0.69900 0.06907  -0.02394 0.03201  108 ARG A CG  
838  C CD  . ARG A 108 ? 0.57711 0.62192 0.60339 0.06261  -0.02213 0.03166  108 ARG A CD  
839  N NE  . ARG A 108 ? 0.68650 0.72154 0.70835 0.06048  -0.01293 0.03907  108 ARG A NE  
840  C CZ  . ARG A 108 ? 0.69542 0.73068 0.72494 0.06148  -0.01055 0.04182  108 ARG A CZ  
841  N NH1 . ARG A 108 ? 0.78255 0.82845 0.82704 0.06398  -0.01612 0.03834  108 ARG A NH1 
842  N NH2 . ARG A 108 ? 0.60758 0.63213 0.63051 0.06017  -0.00258 0.04798  108 ARG A NH2 
843  N N   . GLU A 109 ? 0.44694 0.50851 0.43639 0.09023  -0.04919 0.01459  109 GLU A N   
844  C CA  . GLU A 109 ? 0.55489 0.61787 0.54495 0.08793  -0.05415 0.00746  109 GLU A CA  
845  C C   . GLU A 109 ? 0.53068 0.59526 0.54304 0.07625  -0.05508 0.00315  109 GLU A C   
846  O O   . GLU A 109 ? 0.48633 0.55718 0.51694 0.07440  -0.06016 -0.00042 109 GLU A O   
847  C CB  . GLU A 109 ? 0.52941 0.59946 0.51358 0.09895  -0.06713 -0.00118 109 GLU A CB  
848  N N   . VAL A 110 ? 0.39947 0.45844 0.41093 0.06886  -0.04970 0.00392  110 VAL A N   
849  C CA  . VAL A 110 ? 0.38178 0.43990 0.41129 0.05832  -0.04834 0.00155  110 VAL A CA  
850  C C   . VAL A 110 ? 0.51990 0.57787 0.54916 0.05630  -0.05281 -0.00522 110 VAL A C   
851  O O   . VAL A 110 ? 0.38519 0.43928 0.39882 0.05854  -0.04989 -0.00368 110 VAL A O   
852  C CB  . VAL A 110 ? 0.38241 0.43202 0.41121 0.05109  -0.03665 0.00964  110 VAL A CB  
853  C CG1 . VAL A 110 ? 0.31478 0.36299 0.36051 0.04213  -0.03498 0.00764  110 VAL A CG1 
854  C CG2 . VAL A 110 ? 0.39008 0.43825 0.41654 0.05408  -0.03208 0.01637  110 VAL A CG2 
855  N N   . LEU A 111 ? 0.36989 0.43193 0.41751 0.05217  -0.05940 -0.01237 111 LEU A N   
856  C CA  . LEU A 111 ? 0.38279 0.44349 0.43299 0.04918  -0.06346 -0.01901 111 LEU A CA  
857  C C   . LEU A 111 ? 0.46734 0.52161 0.52575 0.03911  -0.05490 -0.01538 111 LEU A C   
858  O O   . LEU A 111 ? 0.38801 0.44183 0.46026 0.03403  -0.05047 -0.01196 111 LEU A O   
859  C CB  . LEU A 111 ? 0.42451 0.49227 0.49140 0.05055  -0.07608 -0.02931 111 LEU A CB  
860  C CG  . LEU A 111 ? 0.39565 0.46158 0.47136 0.04624  -0.08116 -0.03713 111 LEU A CG  
861  C CD1 . LEU A 111 ? 0.35002 0.41243 0.40376 0.05216  -0.08314 -0.03986 111 LEU A CD1 
862  C CD2 . LEU A 111 ? 0.43114 0.50430 0.52810 0.04695  -0.09383 -0.04692 111 LEU A CD2 
863  N N   . ILE A 112 ? 0.33658 0.38575 0.38552 0.03727  -0.05234 -0.01588 112 ILE A N   
864  C CA  . ILE A 112 ? 0.28228 0.32483 0.33644 0.02914  -0.04517 -0.01311 112 ILE A CA  
865  C C   . ILE A 112 ? 0.31199 0.35331 0.37010 0.02718  -0.04998 -0.02020 112 ILE A C   
866  O O   . ILE A 112 ? 0.28784 0.33114 0.33649 0.03261  -0.05621 -0.02546 112 ILE A O   
867  C CB  . ILE A 112 ? 0.28731 0.32370 0.32668 0.02819  -0.03599 -0.00563 112 ILE A CB  
868  C CG1 . ILE A 112 ? 0.28783 0.32477 0.31059 0.03367  -0.03705 -0.00636 112 ILE A CG1 
869  C CG2 . ILE A 112 ? 0.26722 0.30272 0.30450 0.02916  -0.03074 0.00140  112 ILE A CG2 
870  C CD1 . ILE A 112 ? 0.26368 0.29507 0.27706 0.03121  -0.02853 -0.00013 112 ILE A CD1 
871  N N   . MET A 113 ? 0.27514 0.31238 0.34639 0.02025  -0.04673 -0.02008 113 MET A N   
872  C CA  . MET A 113 ? 0.27793 0.31188 0.35392 0.01747  -0.04953 -0.02562 113 MET A CA  
873  C C   . MET A 113 ? 0.34073 0.36783 0.42564 0.01062  -0.04138 -0.02117 113 MET A C   
874  O O   . MET A 113 ? 0.32471 0.35036 0.41328 0.00865  -0.03483 -0.01487 113 MET A O   
875  C CB  . MET A 113 ? 0.28765 0.32647 0.37821 0.01869  -0.06039 -0.03477 113 MET A CB  
876  C CG  . MET A 113 ? 0.37319 0.41659 0.48612 0.01575  -0.06147 -0.03442 113 MET A CG  
877  S SD  . MET A 113 ? 0.49994 0.54980 0.63330 0.01704  -0.07620 -0.04654 113 MET A SD  
878  C CE  . MET A 113 ? 0.32628 0.38425 0.44465 0.02777  -0.08573 -0.05027 113 MET A CE  
879  N N   . HIS A 114 ? 0.26579 0.28788 0.35277 0.00802  -0.04168 -0.02441 114 HIS A N   
880  C CA  . HIS A 114 ? 0.28701 0.30174 0.38181 0.00283  -0.03405 -0.02028 114 HIS A CA  
881  C C   . HIS A 114 ? 0.26953 0.28605 0.38745 -0.00039 -0.03389 -0.02032 114 HIS A C   
882  O O   . HIS A 114 ? 0.27471 0.28729 0.39860 -0.00282 -0.02553 -0.01384 114 HIS A O   
883  C CB  . HIS A 114 ? 0.27621 0.28463 0.36684 0.00163  -0.03423 -0.02343 114 HIS A CB  
884  C CG  . HIS A 114 ? 0.26605 0.26590 0.36300 -0.00231 -0.02642 -0.01912 114 HIS A CG  
885  N ND1 . HIS A 114 ? 0.25601 0.25064 0.34447 -0.00261 -0.01806 -0.01193 114 HIS A ND1 
886  C CD2 . HIS A 114 ? 0.34008 0.33486 0.45069 -0.00533 -0.02551 -0.02077 114 HIS A CD2 
887  C CE1 . HIS A 114 ? 0.27474 0.26141 0.36919 -0.00471 -0.01221 -0.00920 114 HIS A CE1 
888  N NE2 . HIS A 114 ? 0.31880 0.30537 0.42723 -0.00664 -0.01591 -0.01392 114 HIS A NE2 
889  N N   . GLY A 115 ? 0.24056 0.26296 0.37224 0.00006  -0.04311 -0.02765 115 GLY A N   
890  C CA  . GLY A 115 ? 0.25349 0.27955 0.41131 -0.00316 -0.04410 -0.02841 115 GLY A CA  
891  C C   . GLY A 115 ? 0.31377 0.33621 0.48981 -0.00721 -0.04707 -0.03367 115 GLY A C   
892  O O   . GLY A 115 ? 0.34109 0.36794 0.54271 -0.01000 -0.04998 -0.03594 115 GLY A O   
893  N N   . ASP A 116 ? 0.32571 0.34031 0.49102 -0.00762 -0.04649 -0.03568 116 ASP A N   
894  C CA  . ASP A 116 ? 0.29100 0.30021 0.47371 -0.01157 -0.04819 -0.03993 116 ASP A CA  
895  C C   . ASP A 116 ? 0.35727 0.37210 0.55286 -0.01052 -0.06246 -0.05144 116 ASP A C   
896  O O   . ASP A 116 ? 0.42682 0.43970 0.64654 -0.01478 -0.06525 -0.05539 116 ASP A O   
897  C CB  . ASP A 116 ? 0.41563 0.41458 0.58221 -0.01140 -0.04405 -0.03916 116 ASP A CB  
898  C CG  . ASP A 116 ? 0.44541 0.44597 0.58925 -0.00614 -0.05110 -0.04471 116 ASP A CG  
899  O OD1 . ASP A 116 ? 0.38976 0.39613 0.51884 -0.00231 -0.05171 -0.04281 116 ASP A OD1 
900  O OD2 . ASP A 116 ? 0.41640 0.41209 0.55753 -0.00546 -0.05554 -0.05064 116 ASP A OD2 
901  N N   . THR A 117 ? 0.35211 0.37327 0.53228 -0.00440 -0.07166 -0.05698 117 THR A N   
902  C CA  . THR A 117 ? 0.39874 0.42479 0.58840 -0.00156 -0.08662 -0.06885 117 THR A CA  
903  C C   . THR A 117 ? 0.50447 0.53956 0.72100 -0.00347 -0.09181 -0.07094 117 THR A C   
904  O O   . THR A 117 ? 0.44670 0.48614 0.67581 -0.00153 -0.10551 -0.08170 117 THR A O   
905  C CB  . THR A 117 ? 0.42497 0.45456 0.58775 0.00745  -0.09415 -0.07342 117 THR A CB  
906  O OG1 . THR A 117 ? 0.38721 0.42294 0.53888 0.01054  -0.08960 -0.06643 117 THR A OG1 
907  C CG2 . THR A 117 ? 0.51240 0.53419 0.65214 0.00956  -0.09006 -0.07247 117 THR A CG2 
908  N N   . LEU A 118 ? 0.40247 0.44058 0.62795 -0.00652 -0.08181 -0.06138 118 LEU A N   
909  C CA  . LEU A 118 ? 0.42567 0.47292 0.67960 -0.00871 -0.08488 -0.06203 118 LEU A CA  
910  C C   . LEU A 118 ? 0.43070 0.47482 0.71789 -0.01675 -0.08040 -0.06083 118 LEU A C   
911  O O   . LEU A 118 ? 0.39232 0.44467 0.70927 -0.01925 -0.08452 -0.06304 118 LEU A O   
912  C CB  . LEU A 118 ? 0.42710 0.47913 0.67448 -0.00713 -0.07571 -0.05192 118 LEU A CB  
913  C CG  . LEU A 118 ? 0.42447 0.47859 0.64040 0.00023  -0.07682 -0.05022 118 LEU A CG  
914  C CD1 . LEU A 118 ? 0.29365 0.34944 0.50544 0.00043  -0.06583 -0.03937 118 LEU A CD1 
915  C CD2 . LEU A 118 ? 0.42024 0.48302 0.63399 0.00712  -0.09222 -0.06011 118 LEU A CD2 
916  N N   . CYS A 119 ? 0.41739 0.44998 0.70119 -0.02051 -0.07175 -0.05704 119 CYS A N   
917  C CA  . CYS A 119 ? 0.56322 0.59084 0.87721 -0.02769 -0.06520 -0.05421 119 CYS A CA  
918  C C   . CYS A 119 ? 0.66580 0.69089 0.99738 -0.03004 -0.07775 -0.06634 119 CYS A C   
919  O O   . CYS A 119 ? 0.63073 0.64470 0.96272 -0.03285 -0.07441 -0.06669 119 CYS A O   
920  C CB  . CYS A 119 ? 0.57323 0.58861 0.87369 -0.02935 -0.04905 -0.04339 119 CYS A CB  
921  S SG  . CYS A 119 ? 0.65461 0.67017 0.92799 -0.02529 -0.03642 -0.03117 119 CYS A SG  
922  N N   . THR A 120 ? 0.52180 0.55705 0.86813 -0.02828 -0.09303 -0.07682 120 THR A N   
923  C CA  . THR A 120 ? 0.75944 0.79295 1.12105 -0.02909 -0.10834 -0.09072 120 THR A CA  
924  C C   . THR A 120 ? 0.71908 0.74944 1.12282 -0.03804 -0.10577 -0.09086 120 THR A C   
925  O O   . THR A 120 ? 0.56514 0.59214 0.98234 -0.03878 -0.11748 -0.10187 120 THR A O   
926  C CB  . THR A 120 ? 0.72913 0.77449 1.09202 -0.02298 -0.12649 -0.10235 120 THR A CB  
927  O OG1 . THR A 120 ? 0.51014 0.56736 0.90265 -0.02579 -0.12616 -0.09961 120 THR A OG1 
928  C CG2 . THR A 120 ? 0.53451 0.58200 0.85568 -0.01355 -0.12773 -0.10119 120 THR A CG2 
929  N N   . ASP A 121 ? 0.72715 0.75729 1.14884 -0.04335 -0.08960 -0.07809 121 ASP A N   
930  C CA  . ASP A 121 ? 0.69748 0.72307 1.15549 -0.05047 -0.08319 -0.07514 121 ASP A CA  
931  C C   . ASP A 121 ? 0.77998 0.78921 1.23148 -0.05381 -0.07095 -0.06882 121 ASP A C   
932  O O   . ASP A 121 ? 0.76113 0.76402 1.23313 -0.05672 -0.06592 -0.06675 121 ASP A O   
933  C CB  . ASP A 121 ? 0.66321 0.69707 1.14455 -0.05282 -0.07106 -0.06385 121 ASP A CB  
934  C CG  . ASP A 121 ? 0.83186 0.88104 1.32425 -0.04941 -0.08318 -0.07026 121 ASP A CG  
935  O OD1 . ASP A 121 ? 0.71341 0.77184 1.21055 -0.04887 -0.07597 -0.06223 121 ASP A OD1 
936  O OD2 . ASP A 121 ? 0.64914 0.70038 1.14440 -0.04652 -0.09976 -0.08325 121 ASP A OD2 
937  N N   . ASP A 122 ? 0.74950 0.75134 1.16297 -0.04961 -0.06425 -0.06385 122 ASP A N   
938  C CA  . ASP A 122 ? 0.69598 0.68189 1.09733 -0.05069 -0.05331 -0.05810 122 ASP A CA  
939  C C   . ASP A 122 ? 0.73140 0.71058 1.11889 -0.04848 -0.06680 -0.07076 122 ASP A C   
940  O O   . ASP A 122 ? 0.66187 0.63862 1.01364 -0.04251 -0.06935 -0.07267 122 ASP A O   
941  C CB  . ASP A 122 ? 0.83206 0.81388 1.19957 -0.04624 -0.03921 -0.04608 122 ASP A CB  
942  C CG  . ASP A 122 ? 0.79444 0.76044 1.15495 -0.04715 -0.02502 -0.03741 122 ASP A CG  
943  O OD1 . ASP A 122 ? 0.83065 0.78742 1.20258 -0.04998 -0.02792 -0.04229 122 ASP A OD1 
944  O OD2 . ASP A 122 ? 0.86609 0.82818 1.20877 -0.04434 -0.01131 -0.02594 122 ASP A OD2 
945  N N   . GLN A 123 ? 0.73790 0.71412 1.15419 -0.05270 -0.07514 -0.07920 123 GLN A N   
946  C CA  . GLN A 123 ? 0.66399 0.63359 1.06699 -0.04926 -0.08835 -0.09160 123 GLN A CA  
947  C C   . GLN A 123 ? 0.65746 0.61114 1.03898 -0.04882 -0.07978 -0.08764 123 GLN A C   
948  O O   . GLN A 123 ? 0.57089 0.52017 0.92725 -0.04348 -0.08855 -0.09579 123 GLN A O   
949  C CB  . GLN A 123 ? 0.60131 0.57153 1.03174 -0.05053 -0.09573 -0.09808 123 GLN A CB  
950  N N   . GLY A 124 ? 0.64723 0.59275 1.03398 -0.05211 -0.06169 -0.07408 124 GLY A N   
951  C CA  . GLY A 124 ? 0.48089 0.41232 0.84216 -0.04928 -0.05245 -0.06872 124 GLY A CA  
952  C C   . GLY A 124 ? 0.71256 0.64734 1.03159 -0.04186 -0.05135 -0.06632 124 GLY A C   
953  O O   . GLY A 124 ? 0.53040 0.45855 0.82473 -0.03742 -0.05470 -0.07040 124 GLY A O   
954  N N   . TYR A 125 ? 0.58262 0.52774 0.89411 -0.04039 -0.04649 -0.05958 125 TYR A N   
955  C CA  . TYR A 125 ? 0.64478 0.59360 0.91944 -0.03396 -0.04596 -0.05755 125 TYR A CA  
956  C C   . TYR A 125 ? 0.57373 0.52923 0.83363 -0.02927 -0.06213 -0.07001 125 TYR A C   
957  O O   . TYR A 125 ? 0.60340 0.55643 0.83452 -0.02396 -0.06341 -0.07147 125 TYR A O   
958  C CB  . TYR A 125 ? 0.52532 0.48295 0.79670 -0.03341 -0.03803 -0.04831 125 TYR A CB  
959  C CG  . TYR A 125 ? 0.57350 0.53722 0.81227 -0.02740 -0.04111 -0.04879 125 TYR A CG  
960  C CD1 . TYR A 125 ? 0.52629 0.48299 0.73733 -0.02369 -0.03523 -0.04473 125 TYR A CD1 
961  C CD2 . TYR A 125 ? 0.40924 0.38557 0.64596 -0.02514 -0.05010 -0.05340 125 TYR A CD2 
962  C CE1 . TYR A 125 ? 0.59457 0.55697 0.77925 -0.01879 -0.03762 -0.04491 125 TYR A CE1 
963  C CE2 . TYR A 125 ? 0.52382 0.50485 0.73203 -0.01967 -0.05178 -0.05298 125 TYR A CE2 
964  C CZ  . TYR A 125 ? 0.46530 0.43947 0.64884 -0.01696 -0.04530 -0.04862 125 TYR A CZ  
965  O OH  . TYR A 125 ? 0.53270 0.51175 0.69134 -0.01213 -0.04645 -0.04784 125 TYR A OH  
966  N N   . LEU A 126 ? 0.59254 0.55672 0.87179 -0.03037 -0.07450 -0.07895 126 LEU A N   
967  C CA  . LEU A 126 ? 0.65554 0.62585 0.91884 -0.02410 -0.08992 -0.09061 126 LEU A CA  
968  C C   . LEU A 126 ? 0.67196 0.63207 0.92370 -0.02109 -0.09680 -0.09925 126 LEU A C   
969  O O   . LEU A 126 ? 0.61499 0.57698 0.84026 -0.01368 -0.10375 -0.10477 126 LEU A O   
970  C CB  . LEU A 126 ? 0.73544 0.71591 1.02376 -0.02526 -0.10286 -0.09934 126 LEU A CB  
971  C CG  . LEU A 126 ? 0.83304 0.82618 1.10441 -0.01853 -0.11054 -0.10212 126 LEU A CG  
972  C CD1 . LEU A 126 ? 0.88474 0.88220 1.14080 -0.01809 -0.09673 -0.08872 126 LEU A CD1 
973  C CD2 . LEU A 126 ? 0.86206 0.86514 1.16116 -0.01960 -0.12330 -0.11055 126 LEU A CD2 
974  N N   . ALA A 127 ? 0.55211 0.50091 0.82314 -0.02621 -0.09420 -0.10000 127 ALA A N   
975  C CA  . ALA A 127 ? 0.56837 0.50577 0.82727 -0.02313 -0.09912 -0.10713 127 ALA A CA  
976  C C   . ALA A 127 ? 0.59218 0.52475 0.81861 -0.01861 -0.08881 -0.09931 127 ALA A C   
977  O O   . ALA A 127 ? 0.51763 0.44795 0.72072 -0.01203 -0.09473 -0.10532 127 ALA A O   
978  C CB  . ALA A 127 ? 0.51250 0.43788 0.80132 -0.03003 -0.09743 -0.10857 127 ALA A CB  
979  N N   . PHE A 128 ? 0.65639 0.58741 0.88112 -0.02140 -0.07361 -0.08612 128 PHE A N   
980  C CA  . PHE A 128 ? 0.59405 0.52183 0.78931 -0.01695 -0.06481 -0.07902 128 PHE A CA  
981  C C   . PHE A 128 ? 0.51233 0.45129 0.68264 -0.01080 -0.06949 -0.08064 128 PHE A C   
982  O O   . PHE A 128 ? 0.53105 0.46845 0.67753 -0.00525 -0.07003 -0.08188 128 PHE A O   
983  C CB  . PHE A 128 ? 0.61872 0.54286 0.81715 -0.02014 -0.04897 -0.06537 128 PHE A CB  
984  C CG  . PHE A 128 ? 0.61015 0.53224 0.77973 -0.01542 -0.04110 -0.05848 128 PHE A CG  
985  C CD1 . PHE A 128 ? 0.76330 0.67468 0.91991 -0.01248 -0.03845 -0.05852 128 PHE A CD1 
986  C CD2 . PHE A 128 ? 0.57555 0.50631 0.73205 -0.01377 -0.03692 -0.05236 128 PHE A CD2 
987  C CE1 . PHE A 128 ? 0.57920 0.48964 0.71142 -0.00797 -0.03233 -0.05289 128 PHE A CE1 
988  C CE2 . PHE A 128 ? 0.56170 0.49073 0.69433 -0.00973 -0.03090 -0.04694 128 PHE A CE2 
989  C CZ  . PHE A 128 ? 0.67748 0.59689 0.79852 -0.00684 -0.02889 -0.04737 128 PHE A CZ  
990  N N   . ARG A 129 ? 0.42029 0.37063 0.59659 -0.01140 -0.07245 -0.08026 129 ARG A N   
991  C CA  . ARG A 129 ? 0.47948 0.43976 0.63306 -0.00544 -0.07568 -0.08062 129 ARG A CA  
992  C C   . ARG A 129 ? 0.47318 0.43447 0.61341 0.00143  -0.08818 -0.09190 129 ARG A C   
993  O O   . ARG A 129 ? 0.49205 0.45546 0.60748 0.00762  -0.08741 -0.09117 129 ARG A O   
994  C CB  . ARG A 129 ? 0.48023 0.45145 0.64414 -0.00698 -0.07672 -0.07824 129 ARG A CB  
995  C CG  . ARG A 129 ? 0.59860 0.57893 0.73931 -0.00093 -0.07793 -0.07665 129 ARG A CG  
996  C CD  . ARG A 129 ? 0.43043 0.42126 0.58105 -0.00102 -0.08173 -0.07656 129 ARG A CD  
997  N NE  . ARG A 129 ? 0.47494 0.47248 0.60407 0.00373  -0.07869 -0.07151 129 ARG A NE  
998  C CZ  . ARG A 129 ? 0.56248 0.56385 0.67162 0.01128  -0.08479 -0.07583 129 ARG A CZ  
999  N NH1 . ARG A 129 ? 0.56571 0.56505 0.67107 0.01597  -0.09516 -0.08601 129 ARG A NH1 
1000 N NH2 . ARG A 129 ? 0.54974 0.55641 0.64211 0.01475  -0.08004 -0.06958 129 ARG A NH2 
1001 N N   . ALA A 130 ? 0.49204 0.45172 0.64889 0.00095  -0.09984 -0.10252 130 ALA A N   
1002 C CA  . ALA A 130 ? 0.54720 0.50590 0.68998 0.00881  -0.11241 -0.11418 130 ALA A CA  
1003 C C   . ALA A 130 ? 0.55326 0.50220 0.67896 0.01210  -0.10894 -0.11448 130 ALA A C   
1004 O O   . ALA A 130 ? 0.54098 0.49093 0.64407 0.02070  -0.11391 -0.11934 130 ALA A O   
1005 C CB  . ALA A 130 ? 0.56212 0.51895 0.72854 0.00721  -0.12638 -0.12645 130 ALA A CB  
1006 N N   . LYS A 131 ? 0.51631 0.45570 0.65187 0.00624  -0.09989 -0.10885 131 LYS A N   
1007 C CA  . LYS A 131 ? 0.52417 0.45404 0.64431 0.00959  -0.09634 -0.10876 131 LYS A CA  
1008 C C   . LYS A 131 ? 0.57900 0.51449 0.67289 0.01450  -0.08851 -0.10119 131 LYS A C   
1009 O O   . LYS A 131 ? 0.50398 0.44050 0.57764 0.02219  -0.09206 -0.10522 131 LYS A O   
1010 C CB  . LYS A 131 ? 0.56346 0.48131 0.70035 0.00279  -0.08779 -0.10354 131 LYS A CB  
1011 C CG  . LYS A 131 ? 0.68072 0.58761 0.80302 0.00653  -0.08444 -0.10366 131 LYS A CG  
1012 N N   . VAL A 132 ? 0.49297 0.43219 0.58767 0.01046  -0.07782 -0.09023 132 VAL A N   
1013 C CA  . VAL A 132 ? 0.42615 0.36967 0.49963 0.01403  -0.07032 -0.08303 132 VAL A CA  
1014 C C   . VAL A 132 ? 0.43140 0.38680 0.49056 0.01936  -0.07387 -0.08380 132 VAL A C   
1015 O O   . VAL A 132 ? 0.45306 0.41282 0.49613 0.02256  -0.06837 -0.07848 132 VAL A O   
1016 C CB  . VAL A 132 ? 0.45770 0.40003 0.53560 0.00884  -0.05866 -0.07187 132 VAL A CB  
1017 C CG1 . VAL A 132 ? 0.33201 0.26131 0.41928 0.00561  -0.05305 -0.06944 132 VAL A CG1 
1018 C CG2 . VAL A 132 ? 0.41027 0.35938 0.50208 0.00439  -0.05797 -0.06868 132 VAL A CG2 
1019 N N   . HIS A 133 ? 0.52540 0.48604 0.59050 0.02079  -0.08285 -0.09010 133 HIS A N   
1020 C CA  . HIS A 133 ? 0.52897 0.49948 0.57856 0.02759  -0.08645 -0.09111 133 HIS A CA  
1021 C C   . HIS A 133 ? 0.64235 0.61157 0.67789 0.03686  -0.09581 -0.10085 133 HIS A C   
1022 O O   . HIS A 133 ? 0.56810 0.54438 0.58777 0.04449  -0.09816 -0.10150 133 HIS A O   
1023 C CB  . HIS A 133 ? 0.51158 0.48933 0.57315 0.02530  -0.09030 -0.09127 133 HIS A CB  
1024 C CG  . HIS A 133 ? 0.50386 0.48598 0.56913 0.02003  -0.08022 -0.08036 133 HIS A CG  
1025 N ND1 . HIS A 133 ? 0.55531 0.53286 0.63739 0.01212  -0.07353 -0.07497 133 HIS A ND1 
1026 C CD2 . HIS A 133 ? 0.45360 0.44324 0.50730 0.02216  -0.07541 -0.07374 133 HIS A CD2 
1027 C CE1 . HIS A 133 ? 0.43215 0.41416 0.51162 0.01006  -0.06574 -0.06617 133 HIS A CE1 
1028 N NE2 . HIS A 133 ? 0.51648 0.50574 0.57968 0.01557  -0.06700 -0.06546 133 HIS A NE2 
1029 N N   . THR A 134 ? 0.53523 0.49481 0.57535 0.03711  -0.10071 -0.10809 134 THR A N   
1030 C CA  . THR A 134 ? 0.51672 0.47333 0.54132 0.04691  -0.10919 -0.11751 134 THR A CA  
1031 C C   . THR A 134 ? 0.44856 0.40782 0.45081 0.05324  -0.10126 -0.11179 134 THR A C   
1032 O O   . THR A 134 ? 0.52316 0.47886 0.52618 0.04939  -0.09265 -0.10562 134 THR A O   
1033 C CB  . THR A 134 ? 0.55287 0.49702 0.58924 0.04490  -0.11559 -0.12616 134 THR A CB  
1034 O OG1 . THR A 134 ? 0.58635 0.52879 0.64872 0.03733  -0.12130 -0.12997 134 THR A OG1 
1035 C CG2 . THR A 134 ? 0.58659 0.52688 0.60685 0.05597  -0.12632 -0.13757 134 THR A CG2 
1036 N N   . PRO A 135 ? 0.54876 0.51431 0.53146 0.06340  -0.10349 -0.11323 135 PRO A N   
1037 C CA  . PRO A 135 ? 0.54525 0.51541 0.51034 0.06865  -0.09415 -0.10596 135 PRO A CA  
1038 C C   . PRO A 135 ? 0.55173 0.51442 0.51154 0.07087  -0.09197 -0.10773 135 PRO A C   
1039 O O   . PRO A 135 ? 0.52384 0.48908 0.48071 0.06912  -0.08237 -0.09972 135 PRO A O   
1040 C CB  . PRO A 135 ? 0.51724 0.49352 0.46338 0.08065  -0.09818 -0.10870 135 PRO A CB  
1041 C CG  . PRO A 135 ? 0.56644 0.54473 0.52160 0.07913  -0.10679 -0.11332 135 PRO A CG  
1042 C CD  . PRO A 135 ? 0.53012 0.49990 0.50681 0.07062  -0.11348 -0.12011 135 PRO A CD  
1043 N N   . TRP A 136 ? 0.60153 0.55486 0.56037 0.07500  -0.10111 -0.11835 136 TRP A N   
1044 C CA  . TRP A 136 ? 0.55563 0.50133 0.50842 0.07787  -0.09874 -0.11981 136 TRP A CA  
1045 C C   . TRP A 136 ? 0.51762 0.45700 0.48621 0.06742  -0.09245 -0.11463 136 TRP A C   
1046 O O   . TRP A 136 ? 0.50965 0.44638 0.47258 0.06875  -0.08629 -0.11103 136 TRP A O   
1047 C CB  . TRP A 136 ? 0.53407 0.46982 0.48105 0.08551  -0.11049 -0.13299 136 TRP A CB  
1048 C CG  . TRP A 136 ? 0.63776 0.56315 0.60519 0.07834  -0.11960 -0.14126 136 TRP A CG  
1049 C CD1 . TRP A 136 ? 0.60782 0.53306 0.58413 0.07812  -0.13099 -0.14966 136 TRP A CD1 
1050 C CD2 . TRP A 136 ? 0.55469 0.46819 0.53728 0.07096  -0.11809 -0.14196 136 TRP A CD2 
1051 N NE1 . TRP A 136 ? 0.56894 0.48373 0.56771 0.07009  -0.13653 -0.15546 136 TRP A NE1 
1052 C CE2 . TRP A 136 ? 0.62740 0.53427 0.62991 0.06565  -0.12812 -0.15041 136 TRP A CE2 
1053 C CE3 . TRP A 136 ? 0.50420 0.41196 0.48593 0.06873  -0.10915 -0.13605 136 TRP A CE3 
1054 C CZ2 . TRP A 136 ? 0.59507 0.48933 0.61740 0.05781  -0.12824 -0.15227 136 TRP A CZ2 
1055 C CZ3 . TRP A 136 ? 0.49928 0.39393 0.49782 0.06188  -0.10947 -0.13793 136 TRP A CZ3 
1056 C CH2 . TRP A 136 ? 0.54438 0.43217 0.56341 0.05627  -0.11836 -0.14556 136 TRP A CH2 
1057 N N   . ILE A 137 ? 0.48942 0.42651 0.47737 0.05785  -0.09344 -0.11374 137 ILE A N   
1058 C CA  . ILE A 137 ? 0.42844 0.35936 0.42982 0.04902  -0.08591 -0.10730 137 ILE A CA  
1059 C C   . ILE A 137 ? 0.46295 0.40218 0.45916 0.04682  -0.07510 -0.09587 137 ILE A C   
1060 O O   . ILE A 137 ? 0.43306 0.36811 0.42838 0.04521  -0.06830 -0.09075 137 ILE A O   
1061 C CB  . ILE A 137 ? 0.51347 0.44005 0.53794 0.04020  -0.08907 -0.10894 137 ILE A CB  
1062 C CG1 . ILE A 137 ? 0.54620 0.46297 0.57902 0.04170  -0.10043 -0.12108 137 ILE A CG1 
1063 C CG2 . ILE A 137 ? 0.40017 0.32101 0.43656 0.03219  -0.07914 -0.10016 137 ILE A CG2 
1064 C CD1 . ILE A 137 ? 0.62520 0.53645 0.68544 0.03231  -0.10274 -0.12256 137 ILE A CD1 
1065 N N   . GLN A 138 ? 0.36705 0.31754 0.35972 0.04721  -0.07386 -0.09205 138 GLN A N   
1066 C CA  . GLN A 138 ? 0.42469 0.38289 0.41303 0.04538  -0.06461 -0.08208 138 GLN A CA  
1067 C C   . GLN A 138 ? 0.37880 0.33960 0.35310 0.05192  -0.06072 -0.08031 138 GLN A C   
1068 O O   . GLN A 138 ? 0.38707 0.34795 0.36158 0.04969  -0.05412 -0.07431 138 GLN A O   
1069 C CB  . GLN A 138 ? 0.32926 0.29813 0.31593 0.04551  -0.06444 -0.07888 138 GLN A CB  
1070 C CG  . GLN A 138 ? 0.39211 0.36040 0.39377 0.03900  -0.06728 -0.07932 138 GLN A CG  
1071 C CD  . GLN A 138 ? 0.50979 0.48815 0.50935 0.03872  -0.06504 -0.07409 138 GLN A CD  
1072 O OE1 . GLN A 138 ? 0.67850 0.66394 0.66528 0.04386  -0.06193 -0.07072 138 GLN A OE1 
1073 N NE2 . GLN A 138 ? 0.37977 0.35866 0.39277 0.03286  -0.06588 -0.07282 138 GLN A NE2 
1074 N N   . ARG A 139 ? 0.38511 0.34823 0.34698 0.06084  -0.06490 -0.08562 139 ARG A N   
1075 C CA  . ARG A 139 ? 0.42633 0.39318 0.37591 0.06788  -0.06058 -0.08359 139 ARG A CA  
1076 C C   . ARG A 139 ? 0.40442 0.36167 0.35544 0.06756  -0.05971 -0.08528 139 ARG A C   
1077 O O   . ARG A 139 ? 0.47630 0.43685 0.42385 0.06915  -0.05388 -0.08049 139 ARG A O   
1078 C CB  . ARG A 139 ? 0.52175 0.49165 0.45646 0.07893  -0.06488 -0.08901 139 ARG A CB  
1079 C CG  . ARG A 139 ? 0.65014 0.62956 0.58005 0.08151  -0.06456 -0.08626 139 ARG A CG  
1080 C CD  . ARG A 139 ? 0.82121 0.80385 0.73278 0.09474  -0.06620 -0.08955 139 ARG A CD  
1081 N NE  . ARG A 139 ? 0.92534 0.89861 0.83136 0.10046  -0.07732 -0.10129 139 ARG A NE  
1082 C CZ  . ARG A 139 ? 0.85953 0.83241 0.76178 0.10426  -0.08546 -0.10714 139 ARG A CZ  
1083 N NH1 . ARG A 139 ? 0.93438 0.91554 0.83671 0.10332  -0.08311 -0.10180 139 ARG A NH1 
1084 N NH2 . ARG A 139 ? 0.76056 0.72409 0.65899 0.10952  -0.09682 -0.11903 139 ARG A NH2 
1085 N N   . LEU A 140 ? 0.44141 0.38660 0.39859 0.06568  -0.06560 -0.09208 140 LEU A N   
1086 C CA  . LEU A 140 ? 0.38001 0.31422 0.33869 0.06551  -0.06431 -0.09323 140 LEU A CA  
1087 C C   . LEU A 140 ? 0.41123 0.34399 0.37798 0.05847  -0.05691 -0.08496 140 LEU A C   
1088 O O   . LEU A 140 ? 0.39625 0.32670 0.35845 0.06084  -0.05276 -0.08213 140 LEU A O   
1089 C CB  . LEU A 140 ? 0.43082 0.35158 0.39700 0.06426  -0.07200 -0.10201 140 LEU A CB  
1090 C CG  . LEU A 140 ? 0.64695 0.55384 0.61694 0.06311  -0.07006 -0.10254 140 LEU A CG  
1091 C CD1 . LEU A 140 ? 0.48602 0.38984 0.44111 0.07307  -0.07177 -0.10717 140 LEU A CD1 
1092 C CD2 . LEU A 140 ? 0.69171 0.58585 0.67795 0.05715  -0.07512 -0.10784 140 LEU A CD2 
1093 N N   . PHE A 141 ? 0.34447 0.27840 0.32229 0.05078  -0.05539 -0.08117 141 PHE A N   
1094 C CA  . PHE A 141 ? 0.37144 0.30276 0.35490 0.04540  -0.04848 -0.07352 141 PHE A CA  
1095 C C   . PHE A 141 ? 0.34638 0.28814 0.32213 0.04752  -0.04345 -0.06741 141 PHE A C   
1096 O O   . PHE A 141 ? 0.35993 0.29846 0.33363 0.04803  -0.03938 -0.06365 141 PHE A O   
1097 C CB  . PHE A 141 ? 0.33209 0.26277 0.32869 0.03767  -0.04769 -0.07080 141 PHE A CB  
1098 C CG  . PHE A 141 ? 0.33592 0.26417 0.33590 0.03345  -0.04029 -0.06261 141 PHE A CG  
1099 C CD1 . PHE A 141 ? 0.34585 0.26117 0.35066 0.03181  -0.03661 -0.06056 141 PHE A CD1 
1100 C CD2 . PHE A 141 ? 0.34209 0.27994 0.33971 0.03188  -0.03691 -0.05693 141 PHE A CD2 
1101 C CE1 . PHE A 141 ? 0.37521 0.28726 0.38030 0.02976  -0.02977 -0.05306 141 PHE A CE1 
1102 C CE2 . PHE A 141 ? 0.35800 0.29254 0.35693 0.02919  -0.03105 -0.05030 141 PHE A CE2 
1103 C CZ  . PHE A 141 ? 0.30394 0.22561 0.30559 0.02865  -0.02751 -0.04839 141 PHE A CZ  
1104 N N   . LEU A 142 ? 0.38206 0.33607 0.35401 0.04920  -0.04384 -0.06643 142 LEU A N   
1105 C CA  . LEU A 142 ? 0.35593 0.32041 0.32426 0.05034  -0.03908 -0.06055 142 LEU A CA  
1106 C C   . LEU A 142 ? 0.37004 0.33682 0.33069 0.05727  -0.03800 -0.06147 142 LEU A C   
1107 O O   . LEU A 142 ? 0.36464 0.33794 0.32559 0.05763  -0.03428 -0.05690 142 LEU A O   
1108 C CB  . LEU A 142 ? 0.35544 0.33144 0.32256 0.05072  -0.03884 -0.05865 142 LEU A CB  
1109 C CG  . LEU A 142 ? 0.36453 0.34086 0.33936 0.04414  -0.03901 -0.05629 142 LEU A CG  
1110 C CD1 . LEU A 142 ? 0.43531 0.42168 0.40664 0.04644  -0.03936 -0.05520 142 LEU A CD1 
1111 C CD2 . LEU A 142 ? 0.32877 0.30427 0.30906 0.03860  -0.03429 -0.05001 142 LEU A CD2 
1112 N N   . ALA A 143 ? 0.43890 0.40054 0.39345 0.06305  -0.04161 -0.06763 143 ALA A N   
1113 C CA  . ALA A 143 ? 0.43835 0.40167 0.38556 0.07038  -0.04037 -0.06856 143 ALA A CA  
1114 C C   . ALA A 143 ? 0.43655 0.39025 0.38498 0.06982  -0.03908 -0.06782 143 ALA A C   
1115 O O   . ALA A 143 ? 0.51081 0.46752 0.45483 0.07531  -0.03742 -0.06717 143 ALA A O   
1116 C CB  . ALA A 143 ? 0.41863 0.37882 0.35683 0.07809  -0.04481 -0.07575 143 ALA A CB  
1117 N N   . LEU A 144 ? 0.39258 0.33493 0.34696 0.06407  -0.03935 -0.06747 144 LEU A N   
1118 C CA  . LEU A 144 ? 0.39656 0.32826 0.35041 0.06461  -0.03722 -0.06587 144 LEU A CA  
1119 C C   . LEU A 144 ? 0.41186 0.35072 0.36531 0.06459  -0.03361 -0.06001 144 LEU A C   
1120 O O   . LEU A 144 ? 0.41189 0.36091 0.36917 0.06101  -0.03237 -0.05653 144 LEU A O   
1121 C CB  . LEU A 144 ? 0.32779 0.24603 0.28919 0.05863  -0.03669 -0.06536 144 LEU A CB  
1122 C CG  . LEU A 144 ? 0.38201 0.29095 0.34731 0.05808  -0.04128 -0.07202 144 LEU A CG  
1123 C CD1 . LEU A 144 ? 0.39283 0.29190 0.37046 0.05072  -0.03976 -0.07016 144 LEU A CD1 
1124 C CD2 . LEU A 144 ? 0.33769 0.23684 0.29616 0.06469  -0.04290 -0.07651 144 LEU A CD2 
1125 N N   . PRO A 145 ? 0.46495 0.39830 0.41385 0.06904  -0.03249 -0.05926 145 PRO A N   
1126 C CA  . PRO A 145 ? 0.48811 0.42712 0.43698 0.06957  -0.03069 -0.05483 145 PRO A CA  
1127 C C   . PRO A 145 ? 0.47432 0.40931 0.42728 0.06325  -0.02868 -0.05059 145 PRO A C   
1128 O O   . PRO A 145 ? 0.34867 0.27277 0.30403 0.05956  -0.02740 -0.05018 145 PRO A O   
1129 C CB  . PRO A 145 ? 0.45089 0.38046 0.39282 0.07623  -0.03056 -0.05558 145 PRO A CB  
1130 C CG  . PRO A 145 ? 0.42791 0.35236 0.36615 0.08033  -0.03225 -0.06066 145 PRO A CG  
1131 C CD  . PRO A 145 ? 0.39784 0.31944 0.34103 0.07461  -0.03347 -0.06290 145 PRO A CD  
1132 N N   . LEU A 146 ? 0.39426 0.33826 0.34908 0.06223  -0.02841 -0.04749 146 LEU A N   
1133 C CA  . LEU A 146 ? 0.38828 0.32926 0.34570 0.05714  -0.02670 -0.04362 146 LEU A CA  
1134 C C   . LEU A 146 ? 0.39180 0.31614 0.34422 0.05855  -0.02411 -0.04153 146 LEU A C   
1135 O O   . LEU A 146 ? 0.35587 0.27310 0.31136 0.05411  -0.02131 -0.03901 146 LEU A O   
1136 C CB  . LEU A 146 ? 0.31780 0.26930 0.27731 0.05719  -0.02792 -0.04170 146 LEU A CB  
1137 C CG  . LEU A 146 ? 0.54030 0.50532 0.50769 0.05228  -0.02796 -0.04054 146 LEU A CG  
1138 C CD1 . LEU A 146 ? 0.47570 0.45112 0.44760 0.05311  -0.02972 -0.03953 146 LEU A CD1 
1139 C CD2 . LEU A 146 ? 0.44028 0.40074 0.41013 0.04614  -0.02611 -0.03804 146 LEU A CD2 
1140 N N   . PHE A 147 ? 0.38141 0.29929 0.32623 0.06534  -0.02440 -0.04200 147 PHE A N   
1141 C CA  . PHE A 147 ? 0.43440 0.33534 0.37283 0.06804  -0.02074 -0.03893 147 PHE A CA  
1142 C C   . PHE A 147 ? 0.44026 0.32946 0.38275 0.06517  -0.01763 -0.03910 147 PHE A C   
1143 O O   . PHE A 147 ? 0.40632 0.28282 0.34867 0.06426  -0.01270 -0.03493 147 PHE A O   
1144 C CB  . PHE A 147 ? 0.42229 0.31849 0.35048 0.07717  -0.02202 -0.03947 147 PHE A CB  
1145 C CG  . PHE A 147 ? 0.55291 0.44579 0.47881 0.08157  -0.02291 -0.04299 147 PHE A CG  
1146 C CD1 . PHE A 147 ? 0.62089 0.52744 0.54988 0.08284  -0.02669 -0.04713 147 PHE A CD1 
1147 C CD2 . PHE A 147 ? 0.64054 0.51592 0.56083 0.08523  -0.01937 -0.04171 147 PHE A CD2 
1148 C CE1 . PHE A 147 ? 0.48325 0.38608 0.40869 0.08796  -0.02752 -0.05056 147 PHE A CE1 
1149 C CE2 . PHE A 147 ? 0.56737 0.43845 0.48504 0.08968  -0.02049 -0.04528 147 PHE A CE2 
1150 C CZ  . PHE A 147 ? 0.49740 0.38227 0.41702 0.09125  -0.02490 -0.05002 147 PHE A CZ  
1151 N N   . ILE A 148 ? 0.38258 0.27565 0.32946 0.06396  -0.02037 -0.04384 148 ILE A N   
1152 C CA  . ILE A 148 ? 0.40165 0.28413 0.35508 0.06058  -0.01911 -0.04536 148 ILE A CA  
1153 C C   . ILE A 148 ? 0.40740 0.29318 0.37154 0.05255  -0.01822 -0.04388 148 ILE A C   
1154 O O   . ILE A 148 ? 0.38998 0.26499 0.36132 0.04906  -0.01453 -0.04150 148 ILE A O   
1155 C CB  . ILE A 148 ? 0.34401 0.22877 0.29710 0.06311  -0.02365 -0.05205 148 ILE A CB  
1156 C CG1 . ILE A 148 ? 0.47037 0.34957 0.41333 0.07158  -0.02377 -0.05312 148 ILE A CG1 
1157 C CG2 . ILE A 148 ? 0.38208 0.25705 0.34448 0.05878  -0.02438 -0.05517 148 ILE A CG2 
1158 C CD1 . ILE A 148 ? 0.50343 0.36310 0.44409 0.07389  -0.01939 -0.05045 148 ILE A CD1 
1159 N N   . ARG A 149 ? 0.36970 0.27041 0.33601 0.04976  -0.02110 -0.04483 149 ARG A N   
1160 C CA  . ARG A 149 ? 0.38298 0.28770 0.35846 0.04293  -0.02046 -0.04319 149 ARG A CA  
1161 C C   . ARG A 149 ? 0.41920 0.31663 0.39529 0.04119  -0.01481 -0.03667 149 ARG A C   
1162 O O   . ARG A 149 ? 0.42722 0.32010 0.41265 0.03640  -0.01205 -0.03454 149 ARG A O   
1163 C CB  . ARG A 149 ? 0.33330 0.25444 0.30874 0.04162  -0.02356 -0.04420 149 ARG A CB  
1164 C CG  . ARG A 149 ? 0.35343 0.28167 0.32942 0.04288  -0.02825 -0.04999 149 ARG A CG  
1165 C CD  . ARG A 149 ? 0.31546 0.25914 0.29081 0.04244  -0.02944 -0.04928 149 ARG A CD  
1166 N NE  . ARG A 149 ? 0.33616 0.28764 0.30551 0.04767  -0.02955 -0.04934 149 ARG A NE  
1167 C CZ  . ARG A 149 ? 0.42097 0.38438 0.39123 0.04738  -0.02858 -0.04648 149 ARG A CZ  
1168 N NH1 . ARG A 149 ? 0.24580 0.21402 0.22071 0.04245  -0.02748 -0.04334 149 ARG A NH1 
1169 N NH2 . ARG A 149 ? 0.34126 0.31198 0.30902 0.05217  -0.02857 -0.04668 149 ARG A NH2 
1170 N N   . HIS A 150 ? 0.44037 0.33673 0.40671 0.04572  -0.01326 -0.03363 150 HIS A N   
1171 C CA  . HIS A 150 ? 0.41867 0.30671 0.38194 0.04625  -0.00795 -0.02759 150 HIS A CA  
1172 C C   . HIS A 150 ? 0.42570 0.29738 0.39164 0.04682  -0.00181 -0.02425 150 HIS A C   
1173 O O   . HIS A 150 ? 0.46945 0.33609 0.44199 0.04344  0.00339  -0.01971 150 HIS A O   
1174 C CB  . HIS A 150 ? 0.46664 0.35486 0.41729 0.05290  -0.00906 -0.02649 150 HIS A CB  
1175 C CG  . HIS A 150 ? 0.67252 0.57104 0.62291 0.05097  -0.01137 -0.02576 150 HIS A CG  
1176 N ND1 . HIS A 150 ? 0.81413 0.70953 0.76556 0.04837  -0.00787 -0.02156 150 HIS A ND1 
1177 C CD2 . HIS A 150 ? 0.76687 0.67831 0.71720 0.05133  -0.01652 -0.02852 150 HIS A CD2 
1178 C CE1 . HIS A 150 ? 0.77071 0.67583 0.72181 0.04717  -0.01136 -0.02227 150 HIS A CE1 
1179 N NE2 . HIS A 150 ? 0.75640 0.67146 0.70788 0.04857  -0.01651 -0.02632 150 HIS A NE2 
1180 N N   . ARG A 151 ? 0.37879 0.24184 0.34060 0.05132  -0.00173 -0.02600 151 ARG A N   
1181 C CA  . ARG A 151 ? 0.44406 0.29024 0.40941 0.05207  0.00496  -0.02221 151 ARG A CA  
1182 C C   . ARG A 151 ? 0.45736 0.30306 0.44129 0.04400  0.00537  -0.02370 151 ARG A C   
1183 O O   . ARG A 151 ? 0.47589 0.31153 0.46860 0.04169  0.01249  -0.01833 151 ARG A O   
1184 C CB  . ARG A 151 ? 0.46405 0.30103 0.42095 0.05883  0.00438  -0.02426 151 ARG A CB  
1185 C CG  . ARG A 151 ? 0.62451 0.46114 0.56385 0.06779  0.00369  -0.02275 151 ARG A CG  
1186 C CD  . ARG A 151 ? 0.62619 0.45044 0.55604 0.07582  0.00499  -0.02293 151 ARG A CD  
1187 N NE  . ARG A 151 ? 0.88564 0.70609 0.82416 0.07316  0.00332  -0.02748 151 ARG A NE  
1188 C CZ  . ARG A 151 ? 1.03851 0.85504 0.97013 0.07915  0.00069  -0.03107 151 ARG A CZ  
1189 N NH1 . ARG A 151 ? 0.90613 0.72324 0.82318 0.08803  -0.00072 -0.03062 151 ARG A NH1 
1190 N NH2 . ARG A 151 ? 0.89170 0.70348 0.83140 0.07664  -0.00117 -0.03570 151 ARG A NH2 
1191 N N   . ILE A 152 ? 0.42156 0.27813 0.41202 0.04024  -0.00215 -0.03083 152 ILE A N   
1192 C CA  . ILE A 152 ? 0.44759 0.30503 0.45582 0.03314  -0.00394 -0.03368 152 ILE A CA  
1193 C C   . ILE A 152 ? 0.47201 0.33418 0.48897 0.02802  -0.00027 -0.02876 152 ILE A C   
1194 O O   . ILE A 152 ? 0.44718 0.30281 0.47916 0.02370  0.00420  -0.02582 152 ILE A O   
1195 C CB  . ILE A 152 ? 0.46301 0.33168 0.47227 0.03225  -0.01344 -0.04253 152 ILE A CB  
1196 C CG1 . ILE A 152 ? 0.40262 0.26450 0.40535 0.03742  -0.01664 -0.04771 152 ILE A CG1 
1197 C CG2 . ILE A 152 ? 0.40135 0.27324 0.42805 0.02552  -0.01702 -0.04611 152 ILE A CG2 
1198 C CD1 . ILE A 152 ? 0.37851 0.25062 0.37876 0.03874  -0.02527 -0.05604 152 ILE A CD1 
1199 N N   . ALA A 153 ? 0.41377 0.28734 0.42264 0.02851  -0.00186 -0.02764 153 ALA A N   
1200 C CA  . ALA A 153 ? 0.48090 0.35948 0.49670 0.02423  0.00106  -0.02341 153 ALA A CA  
1201 C C   . ALA A 153 ? 0.50203 0.36845 0.51733 0.02599  0.01095  -0.01490 153 ALA A C   
1202 O O   . ALA A 153 ? 0.49776 0.36271 0.52626 0.02179  0.01559  -0.01105 153 ALA A O   
1203 C CB  . ALA A 153 ? 0.34769 0.23930 0.35409 0.02498  -0.00258 -0.02397 153 ALA A CB  
1204 N N   . ALA A 154 ? 0.48425 0.34189 0.48414 0.03305  0.01446  -0.01169 154 ALA A N   
1205 C CA  . ALA A 154 ? 0.57098 0.41546 0.56679 0.03693  0.02453  -0.00312 154 ALA A CA  
1206 C C   . ALA A 154 ? 0.56840 0.40122 0.58010 0.03414  0.03145  0.00026  154 ALA A C   
1207 O O   . ALA A 154 ? 0.57727 0.40405 0.59652 0.03326  0.04034  0.00758  154 ALA A O   
1208 C CB  . ALA A 154 ? 0.53072 0.36733 0.50551 0.04651  0.02557  -0.00143 154 ALA A CB  
1209 N N   . ARG A 155 ? 0.48130 0.31058 0.49932 0.03285  0.02777  -0.00489 155 ARG A N   
1210 C CA  . ARG A 155 ? 0.44730 0.26506 0.48353 0.02940  0.03357  -0.00243 155 ARG A CA  
1211 C C   . ARG A 155 ? 0.64871 0.47490 0.70906 0.02023  0.03157  -0.00438 155 ARG A C   
1212 O O   . ARG A 155 ? 0.57742 0.39683 0.65479 0.01705  0.03989  0.00171  155 ARG A O   
1213 C CB  . ARG A 155 ? 0.56378 0.37470 0.59975 0.03086  0.02901  -0.00845 155 ARG A CB  
1214 C CG  . ARG A 155 ? 0.52100 0.32257 0.58075 0.02511  0.03132  -0.00915 155 ARG A CG  
1215 C CD  . ARG A 155 ? 0.68694 0.47294 0.75369 0.02656  0.04570  0.00218  155 ARG A CD  
1216 N NE  . ARG A 155 ? 0.99608 0.76475 1.05630 0.03218  0.05064  0.00455  155 ARG A NE  
1217 C CZ  . ARG A 155 ? 0.85604 0.61406 0.93461 0.02834  0.05157  0.00270  155 ARG A CZ  
1218 N NH1 . ARG A 155 ? 0.80762 0.57078 0.91339 0.01882  0.04711  -0.00221 155 ARG A NH1 
1219 N NH2 . ARG A 155 ? 0.89238 0.63386 0.96222 0.03451  0.05654  0.00545  155 ARG A NH2 
1220 N N   . MET A 156 ? 0.51051 0.35162 0.57307 0.01647  0.02088  -0.01252 156 MET A N   
1221 C CA  . MET A 156 ? 0.55016 0.39999 0.63445 0.00882  0.01738  -0.01535 156 MET A CA  
1222 C C   . MET A 156 ? 0.62098 0.47437 0.71012 0.00723  0.02476  -0.00745 156 MET A C   
1223 O O   . MET A 156 ? 0.64354 0.49859 0.75503 0.00160  0.02701  -0.00592 156 MET A O   
1224 C CB  . MET A 156 ? 0.47051 0.33485 0.55142 0.00736  0.00485  -0.02507 156 MET A CB  
1225 C CG  . MET A 156 ? 0.64641 0.50853 0.73567 0.00596  -0.00359 -0.03441 156 MET A CG  
1226 S SD  . MET A 156 ? 0.53784 0.41460 0.61339 0.00853  -0.01628 -0.04432 156 MET A SD  
1227 C CE  . MET A 156 ? 0.71229 0.59618 0.81028 0.00250  -0.02528 -0.05202 156 MET A CE  
1228 N N   . ARG A 157 ? 0.54994 0.40451 0.61924 0.01242  0.02819  -0.00272 157 ARG A N   
1229 C CA  . ARG A 157 ? 0.58495 0.44090 0.65617 0.01235  0.03572  0.00497  157 ARG A CA  
1230 C C   . ARG A 157 ? 0.63559 0.47715 0.71540 0.01401  0.04896  0.01453  157 ARG A C   
1231 O O   . ARG A 157 ? 0.63826 0.48129 0.73511 0.01049  0.05516  0.01964  157 ARG A O   
1232 C CB  . ARG A 157 ? 0.55042 0.40940 0.59759 0.01821  0.03510  0.00666  157 ARG A CB  
1233 C CG  . ARG A 157 ? 0.46665 0.34135 0.50990 0.01557  0.02480  -0.00010 157 ARG A CG  
1234 C CD  . ARG A 157 ? 0.48635 0.36358 0.51146 0.02004  0.02530  0.00257  157 ARG A CD  
1235 N NE  . ARG A 157 ? 0.61569 0.48495 0.62201 0.02730  0.02581  0.00307  157 ARG A NE  
1236 C CZ  . ARG A 157 ? 0.68436 0.55906 0.68117 0.02913  0.01828  -0.00273 157 ARG A CZ  
1237 N NH1 . ARG A 157 ? 0.51632 0.40357 0.51902 0.02475  0.01054  -0.00897 157 ARG A NH1 
1238 N NH2 . ARG A 157 ? 0.57088 0.43831 0.55179 0.03632  0.01877  -0.00204 157 ARG A NH2 
1239 N N   . ALA A 158 ? 0.63222 0.45977 0.70073 0.01992  0.05406  0.01757  158 ALA A N   
1240 C CA  . ALA A 158 ? 0.67066 0.48290 0.74690 0.02238  0.06792  0.02754  158 ALA A CA  
1241 C C   . ALA A 158 ? 0.78669 0.59767 0.89525 0.01394  0.06931  0.02661  158 ALA A C   
1242 O O   . ALA A 158 ? 0.81388 0.61862 0.93910 0.01267  0.08097  0.03539  158 ALA A O   
1243 C CB  . ALA A 158 ? 0.62024 0.41738 0.67630 0.03125  0.07209  0.03034  158 ALA A CB  
1244 N N   . ASP A 159 ? 0.71312 0.52969 0.83152 0.00860  0.05759  0.01602  159 ASP A N   
1245 C CA  . ASP A 159 ? 0.58189 0.39806 0.73248 0.00033  0.05616  0.01301  159 ASP A CA  
1246 C C   . ASP A 159 ? 0.67077 0.49967 0.84250 -0.00602 0.05571  0.01377  159 ASP A C   
1247 O O   . ASP A 159 ? 0.63700 0.46357 0.83800 -0.01158 0.06100  0.01696  159 ASP A O   
1248 C CB  . ASP A 159 ? 0.62536 0.44506 0.77791 -0.00244 0.04185  0.00008  159 ASP A CB  
1249 C CG  . ASP A 159 ? 0.70476 0.50933 0.84635 0.00239  0.04359  -0.00038 159 ASP A CG  
1250 O OD1 . ASP A 159 ? 0.70858 0.49960 0.84104 0.00800  0.05591  0.00949  159 ASP A OD1 
1251 O OD2 . ASP A 159 ? 0.64979 0.45556 0.79067 0.00149  0.03267  -0.01061 159 ASP A OD2 
1252 N N   A SER A 160 ? 0.65348 0.49603 0.81213 -0.00525 0.04947  0.01095  160 SER A N   
1253 N N   B SER A 160 ? 0.65387 0.49638 0.81257 -0.00524 0.04957  0.01104  160 SER A N   
1254 C CA  A SER A 160 ? 0.71261 0.56768 0.88908 -0.01032 0.04851  0.01151  160 SER A CA  
1255 C CA  B SER A 160 ? 0.71245 0.56745 0.88922 -0.01037 0.04857  0.01154  160 SER A CA  
1256 C C   A SER A 160 ? 0.75320 0.60338 0.93303 -0.00782 0.06381  0.02443  160 SER A C   
1257 C C   B SER A 160 ? 0.75310 0.60361 0.93250 -0.00777 0.06366  0.02437  160 SER A C   
1258 O O   A SER A 160 ? 0.81095 0.66704 1.01570 -0.01267 0.06729  0.02740  160 SER A O   
1259 O O   B SER A 160 ? 0.81068 0.66768 1.01402 -0.01250 0.06681  0.02721  160 SER A O   
1260 C CB  A SER A 160 ? 0.68013 0.55000 0.84049 -0.00965 0.03762  0.00492  160 SER A CB  
1261 C CB  B SER A 160 ? 0.68041 0.55042 0.84188 -0.00995 0.03723  0.00452  160 SER A CB  
1262 O OG  A SER A 160 ? 0.63429 0.51385 0.80348 -0.01169 0.04000  0.00862  160 SER A OG  
1263 O OG  B SER A 160 ? 0.64117 0.51683 0.80493 -0.01247 0.02367  -0.00716 160 SER A OG  
1264 N N   . LYS A 161 ? 0.77952 0.61906 0.93443 0.00052  0.07286  0.03205  161 LYS A N   
1265 C CA  . LYS A 161 ? 0.87371 0.70657 1.02755 0.00513  0.08812  0.04468  161 LYS A CA  
1266 C C   . LYS A 161 ? 0.93953 0.75998 1.11636 0.00389  0.10149  0.05334  161 LYS A C   
1267 O O   . LYS A 161 ? 1.10704 0.92490 1.28873 0.00692  0.11484  0.06407  161 LYS A O   
1268 C CB  . LYS A 161 ? 0.76547 0.58985 0.88332 0.01591  0.09226  0.04909  161 LYS A CB  
1269 N N   . ALA A 162 ? 0.76131 0.65004 0.90453 -0.09318 0.14595  -0.01142 162 ALA A N   
1270 C CA  . ALA A 162 ? 0.75526 0.64290 0.91697 -0.09949 0.15125  -0.01415 162 ALA A CA  
1271 C C   . ALA A 162 ? 0.86339 0.75540 1.04228 -0.11086 0.14426  -0.01680 162 ALA A C   
1272 O O   . ALA A 162 ? 0.80558 0.69946 0.97967 -0.11386 0.13524  -0.01657 162 ALA A O   
1273 N N   . ILE A 171 ? 1.02164 0.97788 1.21178 -0.10536 0.09170  0.00199  171 ILE A N   
1274 C CA  . ILE A 171 ? 1.01281 0.96843 1.19449 -0.10797 0.08278  0.00173  171 ILE A CA  
1275 C C   . ILE A 171 ? 1.06545 1.03407 1.26911 -0.11704 0.07446  -0.00196 171 ILE A C   
1276 O O   . ILE A 171 ? 1.07226 1.05120 1.28883 -0.11663 0.07615  -0.00062 171 ILE A O   
1277 C CB  . ILE A 171 ? 1.01288 0.96356 1.17222 -0.09850 0.08448  0.00697  171 ILE A CB  
1278 C CG1 . ILE A 171 ? 0.80475 0.74514 0.94378 -0.08962 0.09187  0.00842  171 ILE A CG1 
1279 C CG2 . ILE A 171 ? 0.87073 0.81914 1.02094 -0.10110 0.07535  0.00689  171 ILE A CG2 
1280 C CD1 . ILE A 171 ? 0.56215 0.49894 0.68241 -0.07957 0.09536  0.01189  171 ILE A CD1 
1281 N N   . MET A 172 ? 1.04303 1.01174 1.25119 -0.12508 0.06498  -0.00748 172 MET A N   
1282 C CA  . MET A 172 ? 0.96468 0.94815 1.19432 -0.13395 0.05507  -0.01359 172 MET A CA  
1283 C C   . MET A 172 ? 0.97105 0.96013 1.19468 -0.13101 0.05034  -0.01089 172 MET A C   
1284 O O   . MET A 172 ? 0.93739 0.91425 1.13842 -0.12516 0.05057  -0.00693 172 MET A O   
1285 C CB  . MET A 172 ? 0.90266 0.88340 1.13649 -0.14276 0.04492  -0.02203 172 MET A CB  
1286 C CG  . MET A 172 ? 0.97101 0.97066 1.23597 -0.15236 0.03612  -0.03260 172 MET A CG  
1287 S SD  . MET A 172 ? 1.21520 1.21312 1.49149 -0.16278 0.03200  -0.04082 172 MET A SD  
1288 C CE  . MET A 172 ? 0.85950 0.88613 1.17963 -0.17084 0.02609  -0.05265 172 MET A CE  
1289 N N   . ASP A 173 ? 0.98389 0.99193 1.23864 -0.13376 0.04997  -0.01597 173 ASP A N   
1290 C CA  . ASP A 173 ? 0.76706 0.78333 1.03633 -0.12922 0.05123  -0.01780 173 ASP A CA  
1291 C C   . ASP A 173 ? 0.71271 0.73306 1.00245 -0.13260 0.04104  -0.03193 173 ASP A C   
1292 O O   . ASP A 173 ? 0.80013 0.81680 1.09183 -0.13881 0.03295  -0.04080 173 ASP A O   
1293 C CB  . ASP A 173 ? 0.78486 0.82363 1.08376 -0.12948 0.05345  -0.01835 173 ASP A CB  
1294 C CG  . ASP A 173 ? 0.78407 0.82570 1.08198 -0.12074 0.06036  -0.01149 173 ASP A CG  
1295 O OD1 . ASP A 173 ? 0.53169 0.56013 0.81269 -0.11559 0.06243  -0.00883 173 ASP A OD1 
1296 O OD2 . ASP A 173 ? 0.86013 0.91597 1.17269 -0.11879 0.06441  -0.00813 173 ASP A OD2 
1297 N N   . VAL A 174 ? 0.55428 0.58300 0.85942 -0.12774 0.03991  -0.03495 174 VAL A N   
1298 C CA  . VAL A 174 ? 0.43520 0.46827 0.75709 -0.12836 0.02591  -0.05053 174 VAL A CA  
1299 C C   . VAL A 174 ? 0.47247 0.53960 0.83884 -0.13280 0.00830  -0.06912 174 VAL A C   
1300 O O   . VAL A 174 ? 0.38650 0.47586 0.77633 -0.13445 0.01003  -0.06809 174 VAL A O   
1301 C CB  . VAL A 174 ? 0.43607 0.46435 0.73412 -0.11136 0.02681  -0.04382 174 VAL A CB  
1302 C CG1 . VAL A 174 ? 0.45098 0.44772 0.71504 -0.11166 0.04637  -0.02673 174 VAL A CG1 
1303 C CG2 . VAL A 174 ? 0.46496 0.52207 0.78330 -0.10171 0.02591  -0.04162 174 VAL A CG2 
1304 N N   . ASN A 175 ? 0.47268 0.54127 0.83309 -0.12891 -0.01030 -0.08392 175 ASN A N   
1305 C CA  . ASN A 175 ? 0.39511 0.49601 0.78376 -0.12759 -0.03076 -0.10178 175 ASN A CA  
1306 C C   . ASN A 175 ? 0.49679 0.61792 0.87373 -0.10452 -0.04134 -0.10105 175 ASN A C   
1307 O O   . ASN A 175 ? 0.38818 0.49231 0.72331 -0.08748 -0.04461 -0.09632 175 ASN A O   
1308 C CB  . ASN A 175 ? 0.39931 0.49032 0.77810 -0.13157 -0.04596 -0.11689 175 ASN A CB  
1309 C CG  . ASN A 175 ? 0.57856 0.70355 0.99092 -0.13452 -0.06614 -0.13675 175 ASN A CG  
1310 O OD1 . ASN A 175 ? 0.47250 0.61169 0.87260 -0.11854 -0.08405 -0.14523 175 ASN A OD1 
1311 N ND2 . ASN A 175 ? 0.60448 0.73669 1.03799 -0.14854 -0.06050 -0.13771 175 ASN A ND2 
1312 N N   . PRO A 176 ? 0.45845 0.61557 0.87078 -0.10293 -0.04655 -0.10554 176 PRO A N   
1313 C CA  . PRO A 176 ? 0.41682 0.59312 0.81741 -0.07963 -0.05443 -0.10286 176 PRO A CA  
1314 C C   . PRO A 176 ? 0.38461 0.56310 0.75874 -0.06276 -0.07544 -0.11384 176 PRO A C   
1315 O O   . PRO A 176 ? 0.36217 0.53595 0.70384 -0.04117 -0.07710 -0.10670 176 PRO A O   
1316 C CB  . PRO A 176 ? 0.40024 0.61769 0.85075 -0.08500 -0.05809 -0.10901 176 PRO A CB  
1317 C CG  . PRO A 176 ? 0.47164 0.68288 0.95288 -0.10983 -0.04279 -0.10646 176 PRO A CG  
1318 C CD  . PRO A 176 ? 0.45898 0.63974 0.92271 -0.12189 -0.04300 -0.11134 176 PRO A CD  
1319 N N   . GLN A 177 ? 0.35451 0.53908 0.74065 -0.07192 -0.09112 -0.13112 177 GLN A N   
1320 C CA  . GLN A 177 ? 0.41247 0.59997 0.77398 -0.05603 -0.11182 -0.14237 177 GLN A CA  
1321 C C   . GLN A 177 ? 0.53572 0.68217 0.84567 -0.04791 -0.10754 -0.13482 177 GLN A C   
1322 O O   . GLN A 177 ? 0.48161 0.62489 0.75918 -0.02753 -0.11858 -0.13615 177 GLN A O   
1323 C CB  . GLN A 177 ? 0.45194 0.65881 0.84243 -0.06923 -0.12973 -0.16387 177 GLN A CB  
1324 C CG  . GLN A 177 ? 0.60920 0.82484 0.97889 -0.05296 -0.15295 -0.17730 177 GLN A CG  
1325 C CD  . GLN A 177 ? 0.74246 0.98510 1.10633 -0.02844 -0.16192 -0.17498 177 GLN A CD  
1326 O OE1 . GLN A 177 ? 0.69702 0.97289 1.09481 -0.02848 -0.16179 -0.17518 177 GLN A OE1 
1327 N NE2 . GLN A 177 ? 0.76793 0.99597 1.08808 -0.00681 -0.16919 -0.17238 177 GLN A NE2 
1328 N N   . ALA A 178 ? 0.40350 0.51884 0.70491 -0.06301 -0.09146 -0.12672 178 ALA A N   
1329 C CA  . ALA A 178 ? 0.56723 0.64424 0.82006 -0.05551 -0.08547 -0.11797 178 ALA A CA  
1330 C C   . ALA A 178 ? 0.35785 0.42580 0.57888 -0.03602 -0.07573 -0.10187 178 ALA A C   
1331 O O   . ALA A 178 ? 0.45036 0.49896 0.62943 -0.02015 -0.07944 -0.09887 178 ALA A O   
1332 C CB  . ALA A 178 ? 0.44590 0.49461 0.69880 -0.07564 -0.06881 -0.11144 178 ALA A CB  
1333 N N   . VAL A 179 ? 0.45337 0.53431 0.69340 -0.03705 -0.06267 -0.09147 179 VAL A N   
1334 C CA  . VAL A 179 ? 0.43745 0.51169 0.64962 -0.01866 -0.05295 -0.07678 179 VAL A CA  
1335 C C   . VAL A 179 ? 0.48039 0.57126 0.67670 0.00529  -0.07067 -0.08349 179 VAL A C   
1336 O O   . VAL A 179 ? 0.43306 0.50426 0.58660 0.02282  -0.06993 -0.07696 179 VAL A O   
1337 C CB  . VAL A 179 ? 0.46623 0.55506 0.70655 -0.02481 -0.03711 -0.06627 179 VAL A CB  
1338 C CG1 . VAL A 179 ? 0.33509 0.42083 0.54869 -0.00423 -0.02889 -0.05297 179 VAL A CG1 
1339 C CG2 . VAL A 179 ? 0.36852 0.43629 0.61660 -0.04601 -0.01752 -0.05717 179 VAL A CG2 
1340 N N   . VAL A 180 ? 0.40260 0.53051 0.63315 0.00647  -0.08667 -0.09672 180 VAL A N   
1341 C CA  . VAL A 180 ? 0.40224 0.54999 0.62056 0.02958  -0.10461 -0.10392 180 VAL A CA  
1342 C C   . VAL A 180 ? 0.48776 0.61522 0.66949 0.03834  -0.11777 -0.11155 180 VAL A C   
1343 O O   . VAL A 180 ? 0.45683 0.57603 0.60205 0.06067  -0.12207 -0.10778 180 VAL A O   
1344 C CB  . VAL A 180 ? 0.51824 0.71160 0.78345 0.02624  -0.12033 -0.11850 180 VAL A CB  
1345 C CG1 . VAL A 180 ? 0.45454 0.66976 0.70657 0.05033  -0.14055 -0.12718 180 VAL A CG1 
1346 C CG2 . VAL A 180 ? 0.36854 0.58217 0.66760 0.02030  -0.10680 -0.10972 180 VAL A CG2 
1347 N N   . ASP A 181 ? 0.40324 0.52102 0.59319 0.02117  -0.12356 -0.12205 181 ASP A N   
1348 C CA  . ASP A 181 ? 0.56840 0.66657 0.72481 0.02844  -0.13620 -0.12994 181 ASP A CA  
1349 C C   . ASP A 181 ? 0.47804 0.53751 0.58401 0.03964  -0.12318 -0.11489 181 ASP A C   
1350 O O   . ASP A 181 ? 0.54469 0.59405 0.61479 0.05851  -0.13262 -0.11649 181 ASP A O   
1351 C CB  . ASP A 181 ? 0.44532 0.53600 0.61927 0.00609  -0.14087 -0.14194 181 ASP A CB  
1352 C CG  . ASP A 181 ? 0.65881 0.78661 0.87486 -0.00213 -0.15906 -0.16109 181 ASP A CG  
1353 O OD1 . ASP A 181 ? 0.62736 0.78584 0.85132 0.01318  -0.17296 -0.16738 181 ASP A OD1 
1354 O OD2 . ASP A 181 ? 0.80849 0.93483 1.04926 -0.02387 -0.15923 -0.17000 181 ASP A OD2 
1355 N N   . ALA A 182 ? 0.46106 0.49908 0.56354 0.02827  -0.10128 -0.10028 182 ALA A N   
1356 C CA  . ALA A 182 ? 0.54573 0.54776 0.60173 0.03686  -0.08775 -0.08604 182 ALA A CA  
1357 C C   . ALA A 182 ? 0.60189 0.60623 0.63247 0.06076  -0.08502 -0.07677 182 ALA A C   
1358 O O   . ALA A 182 ? 0.56005 0.54273 0.54772 0.07666  -0.08602 -0.07289 182 ALA A O   
1359 C CB  . ALA A 182 ? 0.52258 0.50489 0.58374 0.01838  -0.06507 -0.07306 182 ALA A CB  
1360 N N   . MET A 183 ? 0.50096 0.53073 0.55686 0.06394  -0.08099 -0.07299 183 MET A N   
1361 C CA  . MET A 183 ? 0.45950 0.49124 0.49199 0.08683  -0.07689 -0.06360 183 MET A CA  
1362 C C   . MET A 183 ? 0.54086 0.58860 0.56007 0.10905  -0.09816 -0.07434 183 MET A C   
1363 O O   . MET A 183 ? 0.55996 0.59844 0.54506 0.13086  -0.09580 -0.06698 183 MET A O   
1364 C CB  . MET A 183 ? 0.45981 0.51449 0.52405 0.08391  -0.06624 -0.05645 183 MET A CB  
1365 C CG  . MET A 183 ? 0.41932 0.45886 0.49604 0.06310  -0.04439 -0.04501 183 MET A CG  
1366 S SD  . MET A 183 ? 0.37753 0.43841 0.48239 0.06318  -0.02938 -0.03396 183 MET A SD  
1367 C CE  . MET A 183 ? 0.39457 0.43443 0.44859 0.08891  -0.01830 -0.01930 183 MET A CE  
1368 N N   . GLU A 184 ? 0.51357 0.58479 0.55816 0.10412  -0.11844 -0.09165 184 GLU A N   
1369 C CA  . GLU A 184 ? 0.63190 0.71811 0.66270 0.12459  -0.13983 -0.10295 184 GLU A CA  
1370 C C   . GLU A 184 ? 0.57365 0.63087 0.56610 0.12918  -0.14744 -0.10758 184 GLU A C   
1371 O O   . GLU A 184 ? 0.68800 0.74348 0.65029 0.15144  -0.15830 -0.11015 184 GLU A O   
1372 C CB  . GLU A 184 ? 0.62341 0.75181 0.69990 0.11791  -0.15892 -0.12026 184 GLU A CB  
1373 C CG  . GLU A 184 ? 0.59087 0.75207 0.70507 0.11678  -0.15343 -0.11637 184 GLU A CG  
1374 C CD  . GLU A 184 ? 0.66011 0.86710 0.81268 0.11766  -0.17463 -0.13336 184 GLU A CD  
1375 O OE1 . GLU A 184 ? 0.65593 0.86917 0.81760 0.10918  -0.19116 -0.14949 184 GLU A OE1 
1376 O OE2 . GLU A 184 ? 0.54822 0.78530 0.72180 0.12670  -0.17447 -0.13064 184 GLU A OE2 
1377 N N   . ARG A 185 ? 0.61424 0.64824 0.60637 0.10933  -0.14145 -0.10824 185 ARG A N   
1378 C CA  . ARG A 185 ? 0.62101 0.62354 0.57366 0.11366  -0.14538 -0.11002 185 ARG A CA  
1379 C C   . ARG A 185 ? 0.76928 0.74321 0.67395 0.13168  -0.13249 -0.09475 185 ARG A C   
1380 O O   . ARG A 185 ? 0.78692 0.74543 0.65478 0.14795  -0.14089 -0.09711 185 ARG A O   
1381 C CB  . ARG A 185 ? 0.74383 0.72579 0.70515 0.08895  -0.13761 -0.11076 185 ARG A CB  
1382 C CG  . ARG A 185 ? 0.84207 0.83844 0.83011 0.07555  -0.15513 -0.12947 185 ARG A CG  
1383 C CD  . ARG A 185 ? 0.72626 0.69415 0.71005 0.05574  -0.14674 -0.12875 185 ARG A CD  
1384 N NE  . ARG A 185 ? 0.74326 0.70578 0.74775 0.03762  -0.12609 -0.11726 185 ARG A NE  
1385 C CZ  . ARG A 185 ? 0.67034 0.60359 0.65021 0.03501  -0.10671 -0.10157 185 ARG A CZ  
1386 N NH1 . ARG A 185 ? 0.58970 0.49592 0.52367 0.04887  -0.10435 -0.09497 185 ARG A NH1 
1387 N NH2 . ARG A 185 ? 0.59726 0.52894 0.59914 0.01804  -0.08917 -0.09240 185 ARG A NH2 
1388 N N   . HIS A 186 ? 0.44243 0.56080 0.64108 0.07038  -0.12803 -0.08942 186 HIS A N   
1389 C CA  . HIS A 186 ? 0.43225 0.54552 0.60602 0.07297  -0.12609 -0.08230 186 HIS A CA  
1390 C C   . HIS A 186 ? 0.54442 0.66057 0.71243 0.07885  -0.12612 -0.08352 186 HIS A C   
1391 O O   . HIS A 186 ? 0.50449 0.61600 0.65209 0.08192  -0.12437 -0.07861 186 HIS A O   
1392 C CB  . HIS A 186 ? 0.45825 0.56927 0.62989 0.06767  -0.12192 -0.07350 186 HIS A CB  
1393 C CG  . HIS A 186 ? 0.48427 0.59125 0.65687 0.06281  -0.12188 -0.07126 186 HIS A CG  
1394 N ND1 . HIS A 186 ? 0.36836 0.46829 0.52015 0.06254  -0.12122 -0.06691 186 HIS A ND1 
1395 C CD2 . HIS A 186 ? 0.51306 0.62181 0.70560 0.05821  -0.12211 -0.07306 186 HIS A CD2 
1396 C CE1 . HIS A 186 ? 0.53178 0.62966 0.68952 0.05826  -0.12149 -0.06595 186 HIS A CE1 
1397 N NE2 . HIS A 186 ? 0.53437 0.63723 0.71664 0.05576  -0.12215 -0.06948 186 HIS A NE2 
1398 N N   . HIS A 187 ? 0.54035 0.66382 0.72620 0.08059  -0.12784 -0.09037 187 HIS A N   
1399 C CA  . HIS A 187 ? 0.56432 0.69119 0.74609 0.08679  -0.12834 -0.09250 187 HIS A CA  
1400 C C   . HIS A 187 ? 0.47994 0.60558 0.65330 0.08626  -0.12365 -0.08404 187 HIS A C   
1401 O O   . HIS A 187 ? 0.55944 0.68141 0.71347 0.09167  -0.12297 -0.08124 187 HIS A O   
1402 C CB  . HIS A 187 ? 0.61047 0.73370 0.77312 0.09469  -0.13193 -0.09626 187 HIS A CB  
1403 C CG  . HIS A 187 ? 0.89600 1.02413 1.05939 0.10195  -0.13417 -0.10185 187 HIS A CG  
1404 N ND1 . HIS A 187 ? 0.91069 1.04690 1.09409 0.10317  -0.13762 -0.11153 187 HIS A ND1 
1405 C CD2 . HIS A 187 ? 0.81769 0.94366 0.96429 0.10866  -0.13336 -0.09953 187 HIS A CD2 
1406 C CE1 . HIS A 187 ? 0.82161 0.96087 1.00004 0.11041  -0.13925 -0.11490 187 HIS A CE1 
1407 N NE2 . HIS A 187 ? 0.76993 0.90282 0.92584 0.11402  -0.13664 -0.10744 187 HIS A NE2 
1408 N N   . VAL A 188 ? 0.47936 0.60787 0.66800 0.08000  -0.12005 -0.08022 188 VAL A N   
1409 C CA  . VAL A 188 ? 0.43278 0.56102 0.61638 0.07918  -0.11537 -0.07267 188 VAL A CA  
1410 C C   . VAL A 188 ? 0.52839 0.66482 0.73593 0.07735  -0.11270 -0.07483 188 VAL A C   
1411 O O   . VAL A 188 ? 0.34218 0.48372 0.57234 0.07453  -0.11353 -0.08119 188 VAL A O   
1412 C CB  . VAL A 188 ? 0.41103 0.53450 0.58860 0.07366  -0.11258 -0.06506 188 VAL A CB  
1413 C CG1 . VAL A 188 ? 0.43171 0.54681 0.58424 0.07550  -0.11403 -0.06278 188 VAL A CG1 
1414 C CG2 . VAL A 188 ? 0.31615 0.44206 0.51582 0.06713  -0.11235 -0.06661 188 VAL A CG2 
1415 N N   . GLN A 189 ? 0.36679 0.50418 0.56970 0.07896  -0.10881 -0.06985 189 GLN A N   
1416 C CA  . GLN A 189 ? 0.43648 0.58098 0.66138 0.07658  -0.10447 -0.07034 189 GLN A CA  
1417 C C   . GLN A 189 ? 0.31439 0.45831 0.54557 0.07095  -0.09850 -0.06256 189 GLN A C   
1418 O O   . GLN A 189 ? 0.29538 0.44446 0.54587 0.06815  -0.09311 -0.06188 189 GLN A O   
1419 C CB  . GLN A 189 ? 0.35963 0.50664 0.57741 0.08337  -0.10396 -0.07140 189 GLN A CB  
1420 C CG  . GLN A 189 ? 0.35164 0.49867 0.56025 0.09048  -0.10988 -0.07859 189 GLN A CG  
1421 C CD  . GLN A 189 ? 0.46051 0.61248 0.68899 0.08837  -0.11375 -0.08802 189 GLN A CD  
1422 O OE1 . GLN A 189 ? 0.45788 0.60704 0.67840 0.09058  -0.11870 -0.09226 189 GLN A OE1 
1423 N NE2 . GLN A 189 ? 0.38255 0.54166 0.63769 0.08405  -0.11087 -0.09181 189 GLN A NE2 
1424 N N   . TRP A 190 ? 0.32160 0.45932 0.53732 0.06926  -0.09892 -0.05689 190 TRP A N   
1425 C CA  . TRP A 190 ? 0.30523 0.43566 0.51471 0.06184  -0.08978 -0.04746 190 TRP A CA  
1426 C C   . TRP A 190 ? 0.31763 0.44386 0.52720 0.05737  -0.09145 -0.04574 190 TRP A C   
1427 O O   . TRP A 190 ? 0.35371 0.48079 0.55609 0.06138  -0.10011 -0.04929 190 TRP A O   
1428 C CB  . TRP A 190 ? 0.35156 0.47426 0.53162 0.06325  -0.08493 -0.04031 190 TRP A CB  
1429 C CG  . TRP A 190 ? 0.34647 0.47067 0.52604 0.06522  -0.07950 -0.03928 190 TRP A CG  
1430 C CD1 . TRP A 190 ? 0.31260 0.44089 0.48769 0.07388  -0.08403 -0.04378 190 TRP A CD1 
1431 C CD2 . TRP A 190 ? 0.28747 0.40881 0.47068 0.05898  -0.06836 -0.03334 190 TRP A CD2 
1432 N NE1 . TRP A 190 ? 0.29021 0.41855 0.46654 0.07312  -0.07651 -0.04111 190 TRP A NE1 
1433 C CE2 . TRP A 190 ? 0.37344 0.49779 0.55509 0.06376  -0.06684 -0.03482 190 TRP A CE2 
1434 C CE3 . TRP A 190 ? 0.36511 0.48123 0.55186 0.05049  -0.05935 -0.02679 190 TRP A CE3 
1435 C CZ2 . TRP A 190 ? 0.42598 0.54883 0.61052 0.05962  -0.05681 -0.03026 190 TRP A CZ2 
1436 C CZ3 . TRP A 190 ? 0.32039 0.43473 0.50912 0.04679  -0.04925 -0.02210 190 TRP A CZ3 
1437 C CH2 . TRP A 190 ? 0.35898 0.47695 0.54713 0.05100  -0.04813 -0.02399 190 TRP A CH2 
1438 N N   . LEU A 191 ? 0.33603 0.45720 0.55297 0.04954  -0.08281 -0.04010 191 LEU A N   
1439 C CA  . LEU A 191 ? 0.29001 0.40585 0.50648 0.04529  -0.08283 -0.03734 191 LEU A CA  
1440 C C   . LEU A 191 ? 0.30859 0.41470 0.51300 0.03919  -0.07132 -0.02683 191 LEU A C   
1441 O O   . LEU A 191 ? 0.23900 0.34389 0.45158 0.03578  -0.06234 -0.02353 191 LEU A O   
1442 C CB  . LEU A 191 ? 0.29646 0.41751 0.54296 0.04322  -0.08546 -0.04413 191 LEU A CB  
1443 C CG  . LEU A 191 ? 0.32617 0.44000 0.57812 0.03724  -0.08100 -0.03988 191 LEU A CG  
1444 C CD1 . LEU A 191 ? 0.23101 0.34130 0.46585 0.03903  -0.08804 -0.03891 191 LEU A CD1 
1445 C CD2 . LEU A 191 ? 0.23244 0.35162 0.51787 0.03473  -0.08102 -0.04732 191 LEU A CD2 
1446 N N   . ILE A 192 ? 0.27816 0.37778 0.46278 0.03837  -0.07172 -0.02203 192 ILE A N   
1447 C CA  . ILE A 192 ? 0.30366 0.39458 0.47517 0.03388  -0.06219 -0.01282 192 ILE A CA  
1448 C C   . ILE A 192 ? 0.34476 0.43107 0.51879 0.03173  -0.06354 -0.01130 192 ILE A C   
1449 O O   . ILE A 192 ? 0.30121 0.38905 0.47075 0.03422  -0.07236 -0.01517 192 ILE A O   
1450 C CB  . ILE A 192 ? 0.28789 0.37559 0.43136 0.03542  -0.06068 -0.00882 192 ILE A CB  
1451 C CG1 . ILE A 192 ? 0.29846 0.38992 0.43886 0.03814  -0.05933 -0.01049 192 ILE A CG1 
1452 C CG2 . ILE A 192 ? 0.24937 0.32962 0.38007 0.03164  -0.05137 -0.00040 192 ILE A CG2 
1453 C CD1 . ILE A 192 ? 0.30827 0.39692 0.42298 0.04016  -0.05856 -0.00852 192 ILE A CD1 
1454 N N   . HIS A 193 ? 0.19396 0.27399 0.37458 0.02752  -0.05443 -0.00553 193 HIS A N   
1455 C CA  . HIS A 193 ? 0.26099 0.33477 0.44214 0.02594  -0.05407 -0.00283 193 HIS A CA  
1456 C C   . HIS A 193 ? 0.22020 0.28447 0.39416 0.02303  -0.04182 0.00673  193 HIS A C   
1457 O O   . HIS A 193 ? 0.23185 0.29514 0.40193 0.02191  -0.03407 0.01063  193 HIS A O   
1458 C CB  . HIS A 193 ? 0.22505 0.30226 0.43362 0.02500  -0.05816 -0.00961 193 HIS A CB  
1459 C CG  . HIS A 193 ? 0.22133 0.29796 0.45415 0.02126  -0.04927 -0.00977 193 HIS A CG  
1460 N ND1 . HIS A 193 ? 0.28039 0.34706 0.51775 0.01751  -0.03815 -0.00287 193 HIS A ND1 
1461 C CD2 . HIS A 193 ? 0.25850 0.34322 0.51300 0.02100  -0.04961 -0.01654 193 HIS A CD2 
1462 C CE1 . HIS A 193 ? 0.24907 0.31723 0.51035 0.01441  -0.03127 -0.00528 193 HIS A CE1 
1463 N NE2 . HIS A 193 ? 0.26945 0.34925 0.54221 0.01634  -0.03841 -0.01399 193 HIS A NE2 
1464 N N   . GLY A 194 ? 0.27853 0.33544 0.44945 0.02248  -0.04013 0.01059  194 GLY A N   
1465 C CA  . GLY A 194 ? 0.27834 0.32496 0.44204 0.02105  -0.02855 0.01981  194 GLY A CA  
1466 C C   . GLY A 194 ? 0.33804 0.37764 0.51989 0.01898  -0.02386 0.02106  194 GLY A C   
1467 O O   . GLY A 194 ? 0.30203 0.34469 0.51009 0.01632  -0.02264 0.01598  194 GLY A O   
1468 N N   . HIS A 195 ? 0.39870 0.42890 0.56692 0.02051  -0.02091 0.02737  195 HIS A N   
1469 C CA  . HIS A 195 ? 0.37497 0.39617 0.55608 0.01941  -0.01612 0.02956  195 HIS A CA  
1470 C C   . HIS A 195 ? 0.34143 0.35401 0.53711 0.01627  -0.00135 0.03471  195 HIS A C   
1471 O O   . HIS A 195 ? 0.36133 0.36113 0.55101 0.01717  0.00793  0.04256  195 HIS A O   
1472 C CB  . HIS A 195 ? 0.28110 0.30890 0.48429 0.01823  -0.02561 0.01994  195 HIS A CB  
1473 C CG  . HIS A 195 ? 0.35009 0.36861 0.56790 0.01678  -0.02044 0.02143  195 HIS A CG  
1474 N ND1 . HIS A 195 ? 0.27420 0.28309 0.47584 0.01959  -0.01961 0.02742  195 HIS A ND1 
1475 C CD2 . HIS A 195 ? 0.38758 0.40465 0.63504 0.01295  -0.01518 0.01743  195 HIS A CD2 
1476 C CE1 . HIS A 195 ? 0.40675 0.40764 0.62656 0.01765  -0.01374 0.02775  195 HIS A CE1 
1477 N NE2 . HIS A 195 ? 0.35585 0.36156 0.60430 0.01326  -0.01068 0.02148  195 HIS A NE2 
1478 N N   . THR A 196 ? 0.30904 0.32795 0.52378 0.01300  0.00138  0.03032  196 THR A N   
1479 C CA  . THR A 196 ? 0.39276 0.40410 0.62561 0.00931  0.01562  0.03365  196 THR A CA  
1480 C C   . THR A 196 ? 0.48374 0.48630 0.69750 0.01028  0.02764  0.04417  196 THR A C   
1481 O O   . THR A 196 ? 0.34764 0.34045 0.57187 0.00793  0.04137  0.04906  196 THR A O   
1482 C CB  . THR A 196 ? 0.40404 0.42640 0.66560 0.00572  0.01400  0.02405  196 THR A CB  
1483 O OG1 . THR A 196 ? 0.46340 0.49483 0.71382 0.00707  0.00971  0.02271  196 THR A OG1 
1484 C CG2 . THR A 196 ? 0.41675 0.44834 0.69803 0.00553  0.00208  0.01288  196 THR A CG2 
1485 N N   . HIS A 197 ? 0.42913 0.43480 0.61585 0.01373  0.02336  0.04731  197 HIS A N   
1486 C CA  . HIS A 197 ? 0.38012 0.37878 0.54682 0.01544  0.03364  0.05655  197 HIS A CA  
1487 C C   . HIS A 197 ? 0.41146 0.41095 0.59369 0.01158  0.04354  0.05685  197 HIS A C   
1488 O O   . HIS A 197 ? 0.39834 0.38839 0.57272 0.01192  0.05619  0.06507  197 HIS A O   
1489 C CB  . HIS A 197 ? 0.34175 0.32494 0.49511 0.01857  0.04285  0.06619  197 HIS A CB  
1490 C CG  . HIS A 197 ? 0.44803 0.43010 0.58401 0.02306  0.03370  0.06640  197 HIS A CG  
1491 N ND1 . HIS A 197 ? 0.56787 0.53697 0.68757 0.02765  0.03973  0.07464  197 HIS A ND1 
1492 C CD2 . HIS A 197 ? 0.33867 0.33072 0.47051 0.02411  0.01924  0.05933  197 HIS A CD2 
1493 C CE1 . HIS A 197 ? 0.41151 0.38347 0.51880 0.03110  0.02890  0.07218  197 HIS A CE1 
1494 N NE2 . HIS A 197 ? 0.47604 0.46175 0.59067 0.02870  0.01661  0.06292  197 HIS A NE2 
1495 N N   . ARG A 198 ? 0.32953 0.34039 0.53361 0.00845  0.03788  0.04769  198 ARG A N   
1496 C CA  . ARG A 198 ? 0.34277 0.35664 0.56354 0.00492  0.04566  0.04621  198 ARG A CA  
1497 C C   . ARG A 198 ? 0.35049 0.37758 0.56591 0.00595  0.03649  0.04060  198 ARG A C   
1498 O O   . ARG A 198 ? 0.40955 0.44729 0.64401 0.00501  0.02861  0.03110  198 ARG A O   
1499 C CB  . ARG A 198 ? 0.33069 0.34593 0.58703 0.00048  0.04887  0.03932  198 ARG A CB  
1500 C CG  . ARG A 198 ? 0.46230 0.46277 0.72795 -0.00145 0.06160  0.04493  198 ARG A CG  
1501 C CD  . ARG A 198 ? 0.57594 0.58053 0.87914 -0.00602 0.06220  0.03513  198 ARG A CD  
1502 N NE  . ARG A 198 ? 0.71223 0.70195 1.02699 -0.00833 0.07531  0.03966  198 ARG A NE  
1503 C CZ  . ARG A 198 ? 0.88553 0.86904 1.20047 -0.00722 0.07278  0.03996  198 ARG A CZ  
1504 N NH1 . ARG A 198 ? 0.82260 0.81381 1.12689 -0.00399 0.05729  0.03588  198 ARG A NH1 
1505 N NH2 . ARG A 198 ? 0.87070 0.83926 1.19680 -0.00934 0.08674  0.04448  198 ARG A NH2 
1506 N N   . PRO A 199 ? 0.36830 0.39496 0.55819 0.00835  0.03757  0.04589  199 PRO A N   
1507 C CA  . PRO A 199 ? 0.32468 0.36244 0.50784 0.00959  0.02962  0.04089  199 PRO A CA  
1508 C C   . PRO A 199 ? 0.37351 0.41774 0.57847 0.00685  0.03291  0.03620  199 PRO A C   
1509 O O   . PRO A 199 ? 0.36443 0.40367 0.57636 0.00426  0.04481  0.04053  199 PRO A O   
1510 C CB  . PRO A 199 ? 0.36947 0.40347 0.52323 0.01197  0.03369  0.04817  199 PRO A CB  
1511 C CG  . PRO A 199 ? 0.39702 0.41862 0.54633 0.01173  0.04618  0.05717  199 PRO A CG  
1512 C CD  . PRO A 199 ? 0.41308 0.42910 0.57880 0.01063  0.04618  0.05620  199 PRO A CD  
1513 N N   . ALA A 200 ? 0.26290 0.31825 0.47821 0.00799  0.02228  0.02709  200 ALA A N   
1514 C CA  . ALA A 200 ? 0.39626 0.45950 0.63542 0.00639  0.02316  0.02050  200 ALA A CA  
1515 C C   . ALA A 200 ? 0.39111 0.46600 0.63110 0.01024  0.00968  0.01164  200 ALA A C   
1516 O O   . ALA A 200 ? 0.29310 0.36922 0.51907 0.01336  0.00021  0.01019  200 ALA A O   
1517 C CB  . ALA A 200 ? 0.30717 0.36901 0.57687 0.00272  0.02796  0.01664  200 ALA A CB  
1518 N N   . VAL A 201 ? 0.38662 0.46974 0.64291 0.01048  0.00926  0.00566  201 VAL A N   
1519 C CA  . VAL A 201 ? 0.37699 0.47137 0.63831 0.01517  -0.00283 -0.00369 201 VAL A CA  
1520 C C   . VAL A 201 ? 0.28584 0.38834 0.58133 0.01410  -0.00389 -0.01325 201 VAL A C   
1521 O O   . VAL A 201 ? 0.34188 0.44637 0.65192 0.01173  0.00376  -0.01406 201 VAL A O   
1522 C CB  . VAL A 201 ? 0.38955 0.48695 0.63476 0.01817  -0.00294 -0.00238 201 VAL A CB  
1523 C CG1 . VAL A 201 ? 0.35655 0.46465 0.60787 0.02415  -0.01454 -0.01200 201 VAL A CG1 
1524 C CG2 . VAL A 201 ? 0.32231 0.41277 0.53567 0.01903  -0.00197 0.00535  201 VAL A CG2 
1525 N N   . HIS A 202 ? 0.29416 0.40184 0.60339 0.01578  -0.01316 -0.02112 202 HIS A N   
1526 C CA  . HIS A 202 ? 0.40011 0.51680 0.74378 0.01491  -0.01506 -0.03204 202 HIS A CA  
1527 C C   . HIS A 202 ? 0.30713 0.43750 0.65592 0.02204  -0.02807 -0.04281 202 HIS A C   
1528 O O   . HIS A 202 ? 0.33383 0.46634 0.66750 0.02730  -0.03893 -0.04468 202 HIS A O   
1529 C CB  . HIS A 202 ? 0.24216 0.35615 0.60057 0.01224  -0.01636 -0.03488 202 HIS A CB  
1530 C CG  . HIS A 202 ? 0.40442 0.50375 0.75625 0.00663  -0.00384 -0.02413 202 HIS A CG  
1531 N ND1 . HIS A 202 ? 0.37568 0.46971 0.74813 0.00088  0.00946  -0.02268 202 HIS A ND1 
1532 C CD2 . HIS A 202 ? 0.34681 0.43538 0.67322 0.00662  -0.00237 -0.01450 202 HIS A CD2 
1533 C CE1 . HIS A 202 ? 0.43773 0.51746 0.79625 -0.00188 0.01877  -0.01191 202 HIS A CE1 
1534 N NE2 . HIS A 202 ? 0.39383 0.47064 0.72452 0.00172  0.01133  -0.00705 202 HIS A NE2 
1535 N N   . GLU A 203 ? 0.35596 0.49535 0.72566 0.02275  -0.02680 -0.05000 203 GLU A N   
1536 C CA  . GLU A 203 ? 0.30991 0.46319 0.68770 0.03063  -0.03917 -0.06152 203 GLU A CA  
1537 C C   . GLU A 203 ? 0.27273 0.43620 0.68262 0.03097  -0.04573 -0.07469 203 GLU A C   
1538 O O   . GLU A 203 ? 0.36463 0.52707 0.79989 0.02426  -0.03748 -0.07702 203 GLU A O   
1539 C CB  . GLU A 203 ? 0.27793 0.43692 0.66100 0.03245  -0.03544 -0.06343 203 GLU A CB  
1540 C CG  . GLU A 203 ? 0.41974 0.59196 0.80541 0.04250  -0.04826 -0.07409 203 GLU A CG  
1541 C CD  . GLU A 203 ? 0.57928 0.75653 0.96863 0.04480  -0.04441 -0.07548 203 GLU A CD  
1542 O OE1 . GLU A 203 ? 0.62792 0.80140 1.02784 0.03770  -0.03214 -0.07143 203 GLU A OE1 
1543 O OE2 . GLU A 203 ? 0.66849 0.85293 1.04952 0.05413  -0.05334 -0.08047 203 GLU A OE2 
1544 N N   . LEU A 204 ? 0.41317 0.58549 0.82062 0.03889  -0.05998 -0.08332 204 LEU A N   
1545 C CA  . LEU A 204 ? 0.27853 0.45237 0.69764 0.03874  -0.06570 -0.09453 204 LEU A CA  
1546 C C   . LEU A 204 ? 0.31304 0.49056 0.71335 0.04789  -0.07740 -0.10174 204 LEU A C   
1547 O O   . LEU A 204 ? 0.31165 0.49065 0.69433 0.05361  -0.07940 -0.09852 204 LEU A O   
1548 C CB  . LEU A 204 ? 0.24673 0.41478 0.66657 0.03523  -0.06691 -0.09233 204 LEU A CB  
1549 C CG  . LEU A 204 ? 0.28604 0.44993 0.67567 0.04021  -0.07546 -0.08689 204 LEU A CG  
1550 C CD1 . LEU A 204 ? 0.34544 0.50658 0.73435 0.04029  -0.08223 -0.09266 204 LEU A CD1 
1551 C CD2 . LEU A 204 ? 0.37734 0.53290 0.75287 0.03656  -0.06824 -0.07316 204 LEU A CD2 
1552 N N   . GLN A 205 ? 0.34742 0.52588 0.75160 0.04953  -0.08434 -0.11139 205 GLN A N   
1553 C CA  . GLN A 205 ? 0.41506 0.59587 0.80082 0.05838  -0.09479 -0.11791 205 GLN A CA  
1554 C C   . GLN A 205 ? 0.28592 0.46186 0.65864 0.05987  -0.10151 -0.11895 205 GLN A C   
1555 O O   . GLN A 205 ? 0.37613 0.55046 0.76529 0.05467  -0.10020 -0.12248 205 GLN A O   
1556 C CB  . GLN A 205 ? 0.49076 0.67901 0.89478 0.06035  -0.09691 -0.13102 205 GLN A CB  
1557 C CG  . GLN A 205 ? 0.45147 0.64401 0.87782 0.05575  -0.08800 -0.13169 205 GLN A CG  
1558 C CD  . GLN A 205 ? 0.71976 0.91596 1.13241 0.06199  -0.08887 -0.12915 205 GLN A CD  
1559 O OE1 . GLN A 205 ? 0.76677 0.96430 1.15934 0.07074  -0.09721 -0.13181 205 GLN A OE1 
1560 N NE2 . GLN A 205 ? 0.77433 0.97143 1.19752 0.05764  -0.07943 -0.12367 205 GLN A NE2 
1561 N N   . ALA A 206 ? 0.32260 0.49546 0.66601 0.06686  -0.10777 -0.11571 206 ALA A N   
1562 C CA  . ALA A 206 ? 0.37641 0.54413 0.70436 0.06897  -0.11381 -0.11654 206 ALA A CA  
1563 C C   . ALA A 206 ? 0.46971 0.63709 0.77360 0.07846  -0.12056 -0.11915 206 ALA A C   
1564 O O   . ALA A 206 ? 0.49804 0.66513 0.78691 0.08284  -0.11966 -0.11413 206 ALA A O   
1565 C CB  . ALA A 206 ? 0.30348 0.46382 0.61785 0.06533  -0.11131 -0.10541 206 ALA A CB  
1566 N N   . ASN A 207 ? 0.43633 0.60334 0.73720 0.08183  -0.12672 -0.12709 207 ASN A N   
1567 C CA  . ASN A 207 ? 0.59169 0.75824 0.87190 0.09125  -0.13285 -0.13093 207 ASN A CA  
1568 C C   . ASN A 207 ? 0.56063 0.73423 0.84610 0.09655  -0.13381 -0.13642 207 ASN A C   
1569 O O   . ASN A 207 ? 0.52360 0.69571 0.78842 0.10434  -0.13616 -0.13477 207 ASN A O   
1570 C CB  . ASN A 207 ? 0.53118 0.68927 0.78040 0.09448  -0.13257 -0.12064 207 ASN A CB  
1571 C CG  . ASN A 207 ? 0.54804 0.69944 0.79243 0.08838  -0.13050 -0.11377 207 ASN A CG  
1572 O OD1 . ASN A 207 ? 0.58345 0.73343 0.83254 0.08672  -0.13320 -0.11827 207 ASN A OD1 
1573 N ND2 . ASN A 207 ? 0.45140 0.59881 0.68649 0.08532  -0.12575 -0.10321 207 ASN A ND2 
1574 N N   . GLY A 208 ? 0.49139 0.67223 0.80474 0.09239  -0.13148 -0.14310 208 GLY A N   
1575 C CA  . GLY A 208 ? 0.59222 0.78040 0.91301 0.09688  -0.13226 -0.14922 208 GLY A CA  
1576 C C   . GLY A 208 ? 0.67508 0.86244 0.98476 0.09851  -0.12778 -0.13971 208 GLY A C   
1577 O O   . GLY A 208 ? 0.70784 0.89911 1.01238 0.10531  -0.12990 -0.14302 208 GLY A O   
1578 N N   . GLN A 209 ? 0.62580 0.80830 0.93194 0.09278  -0.12162 -0.12838 209 GLN A N   
1579 C CA  . GLN A 209 ? 0.56231 0.74344 0.85771 0.09413  -0.11676 -0.11906 209 GLN A CA  
1580 C C   . GLN A 209 ? 0.55840 0.73856 0.86842 0.08478  -0.10856 -0.11167 209 GLN A C   
1581 O O   . GLN A 209 ? 0.55827 0.73620 0.87855 0.07838  -0.10737 -0.11141 209 GLN A O   
1582 C CB  . GLN A 209 ? 0.61447 0.78760 0.87668 0.10051  -0.11897 -0.11146 209 GLN A CB  
1583 C CG  . GLN A 209 ? 0.75160 0.92503 0.99669 0.11121  -0.12413 -0.11583 209 GLN A CG  
1584 C CD  . GLN A 209 ? 0.82355 1.00454 1.08031 0.11440  -0.12306 -0.12022 209 GLN A CD  
1585 O OE1 . GLN A 209 ? 0.83244 1.02014 1.10127 0.11742  -0.12757 -0.13113 209 GLN A OE1 
1586 N NE2 . GLN A 209 ? 0.89701 1.07701 1.14995 0.11408  -0.11710 -0.11222 209 GLN A NE2 
1587 N N   . PRO A 210 ? 0.56229 0.74387 0.87406 0.08401  -0.10237 -0.10571 210 PRO A N   
1588 C CA  . PRO A 210 ? 0.47098 0.65115 0.79556 0.07556  -0.09376 -0.09814 210 PRO A CA  
1589 C C   . PRO A 210 ? 0.39627 0.56871 0.70293 0.07396  -0.09396 -0.08932 210 PRO A C   
1590 O O   . PRO A 210 ? 0.41301 0.58056 0.69302 0.07987  -0.09783 -0.08551 210 PRO A O   
1591 C CB  . PRO A 210 ? 0.46699 0.64974 0.79125 0.07729  -0.08790 -0.09374 210 PRO A CB  
1592 C CG  . PRO A 210 ? 0.38389 0.57164 0.70581 0.08484  -0.09307 -0.10188 210 PRO A CG  
1593 C CD  . PRO A 210 ? 0.49695 0.68166 0.80103 0.09086  -0.10236 -0.10613 210 PRO A CD  
1594 N N   . ALA A 211 ? 0.30959 0.48040 0.63139 0.06591  -0.08921 -0.08623 211 ALA A N   
1595 C CA  . ALA A 211 ? 0.27768 0.44174 0.58541 0.06372  -0.08922 -0.07826 211 ALA A CA  
1596 C C   . ALA A 211 ? 0.26407 0.42610 0.58524 0.05581  -0.07897 -0.07043 211 ALA A C   
1597 O O   . ALA A 211 ? 0.26455 0.42887 0.60769 0.05057  -0.07129 -0.07189 211 ALA A O   
1598 C CB  . ALA A 211 ? 0.34701 0.50799 0.65400 0.06241  -0.09493 -0.08258 211 ALA A CB  
1599 N N   . TRP A 212 ? 0.29645 0.44680 0.59192 0.05281  -0.07536 -0.06002 212 TRP A N   
1600 C CA  . TRP A 212 ? 0.27193 0.41155 0.56125 0.04416  -0.06245 -0.04921 212 TRP A CA  
1601 C C   . TRP A 212 ? 0.32290 0.45407 0.60141 0.04045  -0.06236 -0.04383 212 TRP A C   
1602 O O   . TRP A 212 ? 0.22959 0.35937 0.49009 0.04446  -0.07000 -0.04377 212 TRP A O   
1603 C CB  . TRP A 212 ? 0.33311 0.46686 0.59835 0.04465  -0.05580 -0.04085 212 TRP A CB  
1604 C CG  . TRP A 212 ? 0.32455 0.46537 0.60028 0.04767  -0.05423 -0.04499 212 TRP A CG  
1605 C CD1 . TRP A 212 ? 0.32438 0.46559 0.61529 0.04268  -0.04438 -0.04344 212 TRP A CD1 
1606 C CD2 . TRP A 212 ? 0.34981 0.49814 0.62139 0.05701  -0.06266 -0.05151 212 TRP A CD2 
1607 N NE1 . TRP A 212 ? 0.34811 0.49738 0.64542 0.04803  -0.04659 -0.04899 212 TRP A NE1 
1608 C CE2 . TRP A 212 ? 0.35831 0.51190 0.64345 0.05725  -0.05784 -0.05388 212 TRP A CE2 
1609 C CE3 . TRP A 212 ? 0.35131 0.50180 0.60819 0.06575  -0.07342 -0.05542 212 TRP A CE3 
1610 C CZ2 . TRP A 212 ? 0.52874 0.68988 0.81286 0.06636  -0.06390 -0.06002 212 TRP A CZ2 
1611 C CZ3 . TRP A 212 ? 0.40707 0.56417 0.66202 0.07507  -0.07889 -0.06108 212 TRP A CZ3 
1612 C CH2 . TRP A 212 ? 0.37943 0.54192 0.64780 0.07553  -0.07436 -0.06336 212 TRP A CH2 
1613 N N   . ARG A 213 ? 0.26592 0.39102 0.55546 0.03315  -0.05324 -0.03936 213 ARG A N   
1614 C CA  . ARG A 213 ? 0.26201 0.37789 0.54157 0.02954  -0.05127 -0.03318 213 ARG A CA  
1615 C C   . ARG A 213 ? 0.31302 0.41808 0.57379 0.02533  -0.03940 -0.02124 213 ARG A C   
1616 O O   . ARG A 213 ? 0.33832 0.44037 0.61029 0.02095  -0.02879 -0.01792 213 ARG A O   
1617 C CB  . ARG A 213 ? 0.26069 0.37717 0.56763 0.02554  -0.04994 -0.03776 213 ARG A CB  
1618 C CG  . ARG A 213 ? 0.23302 0.33924 0.53017 0.02239  -0.04752 -0.03122 213 ARG A CG  
1619 C CD  . ARG A 213 ? 0.24783 0.35561 0.57255 0.01966  -0.04835 -0.03769 213 ARG A CD  
1620 N NE  . ARG A 213 ? 0.32564 0.43269 0.67626 0.01452  -0.03739 -0.03892 213 ARG A NE  
1621 C CZ  . ARG A 213 ? 0.37641 0.47144 0.72777 0.00913  -0.02415 -0.03038 213 ARG A CZ  
1622 N NH1 . ARG A 213 ? 0.30334 0.38674 0.63068 0.00868  -0.02076 -0.02007 213 ARG A NH1 
1623 N NH2 . ARG A 213 ? 0.30980 0.40436 0.68653 0.00455  -0.01383 -0.03254 213 ARG A NH2 
1624 N N   . VAL A 214 ? 0.34188 0.44150 0.57454 0.02691  -0.04104 -0.01542 214 VAL A N   
1625 C CA  . VAL A 214 ? 0.26515 0.35588 0.47747 0.02411  -0.03128 -0.00520 214 VAL A CA  
1626 C C   . VAL A 214 ? 0.30613 0.38844 0.51113 0.02171  -0.02904 0.00018  214 VAL A C   
1627 O O   . VAL A 214 ? 0.25768 0.34028 0.45569 0.02385  -0.03737 -0.00216 214 VAL A O   
1628 C CB  . VAL A 214 ? 0.26341 0.35448 0.44997 0.02766  -0.03382 -0.00341 214 VAL A CB  
1629 C CG1 . VAL A 214 ? 0.25662 0.33999 0.42375 0.02490  -0.02397 0.00580  214 VAL A CG1 
1630 C CG2 . VAL A 214 ? 0.26053 0.35907 0.45361 0.03110  -0.03608 -0.00861 214 VAL A CG2 
1631 N N   . VAL A 215 ? 0.25541 0.32982 0.46120 0.01785  -0.01762 0.00749  215 VAL A N   
1632 C CA  . VAL A 215 ? 0.30407 0.36934 0.50450 0.01627  -0.01399 0.01310  215 VAL A CA  
1633 C C   . VAL A 215 ? 0.30346 0.36160 0.47678 0.01672  -0.00752 0.02212  215 VAL A C   
1634 O O   . VAL A 215 ? 0.26042 0.31709 0.42944 0.01555  0.00085  0.02630  215 VAL A O   
1635 C CB  . VAL A 215 ? 0.32068 0.38116 0.54532 0.01228  -0.00518 0.01396  215 VAL A CB  
1636 C CG1 . VAL A 215 ? 0.28849 0.33880 0.50727 0.01179  -0.00235 0.01932  215 VAL A CG1 
1637 C CG2 . VAL A 215 ? 0.26875 0.33867 0.52308 0.01176  -0.01116 0.00318  215 VAL A CG2 
1638 N N   . LEU A 216 ? 0.22486 0.27928 0.38046 0.01868  -0.01163 0.02443  216 LEU A N   
1639 C CA  . LEU A 216 ? 0.27188 0.32075 0.40195 0.01996  -0.00672 0.03156  216 LEU A CA  
1640 C C   . LEU A 216 ? 0.36581 0.40407 0.49564 0.01894  0.00407  0.03963  216 LEU A C   
1641 O O   . LEU A 216 ? 0.25734 0.29110 0.40466 0.01726  0.00672  0.03979  216 LEU A O   
1642 C CB  . LEU A 216 ? 0.24593 0.29600 0.35773 0.02295  -0.01580 0.02964  216 LEU A CB  
1643 C CG  . LEU A 216 ? 0.27665 0.33453 0.37915 0.02474  -0.02359 0.02385  216 LEU A CG  
1644 C CD1 . LEU A 216 ? 0.31091 0.37050 0.40581 0.02702  -0.03390 0.01958  216 LEU A CD1 
1645 C CD2 . LEU A 216 ? 0.26195 0.31954 0.34466 0.02518  -0.01794 0.02732  216 LEU A CD2 
1646 N N   . GLY A 217 ? 0.31066 0.34458 0.41998 0.02041  0.01073  0.04617  217 GLY A N   
1647 C CA  . GLY A 217 ? 0.29586 0.31874 0.39928 0.02116  0.02126  0.05471  217 GLY A CA  
1648 C C   . GLY A 217 ? 0.43048 0.44869 0.51361 0.02540  0.01784  0.05765  217 GLY A C   
1649 O O   . GLY A 217 ? 0.32858 0.35277 0.39737 0.02756  0.00901  0.05379  217 GLY A O   
1650 N N   . ALA A 218 ? 0.34722 0.35426 0.42953 0.02685  0.02542  0.06435  218 ALA A N   
1651 C CA  . ALA A 218 ? 0.35723 0.35867 0.41842 0.03210  0.02374  0.06825  218 ALA A CA  
1652 C C   . ALA A 218 ? 0.45257 0.45268 0.48901 0.03613  0.02918  0.07340  218 ALA A C   
1653 O O   . ALA A 218 ? 0.38409 0.38218 0.42114 0.03494  0.03852  0.07727  218 ALA A O   
1654 C CB  . ALA A 218 ? 0.33220 0.32084 0.40085 0.03310  0.03045  0.07384  218 ALA A CB  
1655 N N   . TRP A 219 ? 0.28659 0.28845 0.30160 0.04115  0.02312  0.07274  219 TRP A N   
1656 C CA  . TRP A 219 ? 0.40417 0.40656 0.39485 0.04597  0.02669  0.07588  219 TRP A CA  
1657 C C   . TRP A 219 ? 0.47149 0.46066 0.45082 0.05167  0.03606  0.08532  219 TRP A C   
1658 O O   . TRP A 219 ? 0.58872 0.57480 0.55153 0.05793  0.03287  0.08678  219 TRP A O   
1659 C CB  . TRP A 219 ? 0.31276 0.32442 0.28719 0.04887  0.01583  0.06924  219 TRP A CB  
1660 C CG  . TRP A 219 ? 0.31009 0.33319 0.29190 0.04423  0.00830  0.06067  219 TRP A CG  
1661 C CD1 . TRP A 219 ? 0.26875 0.29485 0.27150 0.03905  0.00479  0.05668  219 TRP A CD1 
1662 C CD2 . TRP A 219 ? 0.32563 0.35818 0.29347 0.04503  0.00389  0.05478  219 TRP A CD2 
1663 N NE1 . TRP A 219 ? 0.27277 0.30850 0.27364 0.03720  -0.00132 0.04960  219 TRP A NE1 
1664 C CE2 . TRP A 219 ? 0.26611 0.30552 0.24631 0.04030  -0.00143 0.04834  219 TRP A CE2 
1665 C CE3 . TRP A 219 ? 0.37286 0.40892 0.31931 0.04961  0.00418  0.05372  219 TRP A CE3 
1666 C CZ2 . TRP A 219 ? 0.27770 0.32561 0.24931 0.03965  -0.00528 0.04172  219 TRP A CZ2 
1667 C CZ3 . TRP A 219 ? 0.28649 0.33244 0.22640 0.04830  -0.00003 0.04605  219 TRP A CZ3 
1668 C CH2 . TRP A 219 ? 0.28854 0.33951 0.24087 0.04317  -0.00414 0.04053  219 TRP A CH2 
1669 N N   . HIS A 220 ? 0.56148 0.54223 0.54964 0.04988  0.04827  0.09180  220 HIS A N   
1670 C CA  . HIS A 220 ? 0.65524 0.62138 0.63214 0.05561  0.05949  0.10177  220 HIS A CA  
1671 C C   . HIS A 220 ? 0.58481 0.55113 0.53881 0.06097  0.06553  0.10591  220 HIS A C   
1672 O O   . HIS A 220 ? 0.72740 0.69071 0.65783 0.06942  0.06498  0.10890  220 HIS A O   
1673 C CB  . HIS A 220 ? 0.65444 0.60975 0.65420 0.05085  0.07091  0.10651  220 HIS A CB  
1674 C CG  . HIS A 220 ? 0.83349 0.78526 0.85293 0.04775  0.06716  0.10388  220 HIS A CG  
1675 N ND1 . HIS A 220 ? 0.95405 0.90522 1.00322 0.04036  0.07074  0.10113  220 HIS A ND1 
1676 C CD2 . HIS A 220 ? 1.02327 0.97245 1.03761 0.05119  0.06012  0.10294  220 HIS A CD2 
1677 C CE1 . HIS A 220 ? 0.99374 0.94230 1.05549 0.03928  0.06606  0.09839  220 HIS A CE1 
1678 N NE2 . HIS A 220 ? 1.14453 1.09142 1.18530 0.04568  0.05970  0.09981  220 HIS A NE2 
1679 N N   A SER A 221 ? 0.57866 0.54913 0.53949 0.05658  0.07094  0.10555  221 SER A N   
1680 N N   B SER A 221 ? 0.57991 0.55028 0.54058 0.05664  0.07106  0.10564  221 SER A N   
1681 C CA  A SER A 221 ? 0.61260 0.58444 0.55421 0.06079  0.07685  0.10862  221 SER A CA  
1682 C CA  B SER A 221 ? 0.61207 0.58406 0.55273 0.06110  0.07653  0.10854  221 SER A CA  
1683 C C   A SER A 221 ? 0.61821 0.60580 0.55601 0.05821  0.06897  0.10016  221 SER A C   
1684 C C   B SER A 221 ? 0.61679 0.60449 0.55439 0.05826  0.06885  0.10009  221 SER A C   
1685 O O   A SER A 221 ? 0.59464 0.58640 0.51246 0.06314  0.06982  0.09999  221 SER A O   
1686 O O   B SER A 221 ? 0.59403 0.58598 0.51179 0.06311  0.06972  0.09988  221 SER A O   
1687 C CB  A SER A 221 ? 0.63262 0.59523 0.58349 0.05828  0.09164  0.11582  221 SER A CB  
1688 C CB  B SER A 221 ? 0.63458 0.59671 0.58232 0.05937  0.09169  0.11630  221 SER A CB  
1689 O OG  A SER A 221 ? 0.63388 0.58000 0.58664 0.06114  0.10141  0.12430  221 SER A OG  
1690 O OG  B SER A 221 ? 0.63647 0.59752 0.56161 0.06565  0.09799  0.12061  221 SER A OG  
1691 N N   . GLU A 222 ? 0.44991 0.44604 0.40617 0.05110  0.06165  0.09288  222 GLU A N   
1692 C CA  . GLU A 222 ? 0.47466 0.48402 0.42884 0.04830  0.05542  0.08510  222 GLU A CA  
1693 C C   . GLU A 222 ? 0.40883 0.42525 0.37630 0.04409  0.04400  0.07716  222 GLU A C   
1694 O O   . GLU A 222 ? 0.38947 0.40139 0.37103 0.04239  0.04154  0.07754  222 GLU A O   
1695 C CB  . GLU A 222 ? 0.50761 0.51857 0.47099 0.04385  0.06353  0.08639  222 GLU A CB  
1696 N N   . GLY A 223 ? 0.36197 0.38921 0.32467 0.04265  0.03751  0.06972  223 GLY A N   
1697 C CA  . GLY A 223 ? 0.36914 0.40275 0.34181 0.03946  0.02721  0.06222  223 GLY A CA  
1698 C C   . GLY A 223 ? 0.39779 0.43309 0.39272 0.03373  0.02771  0.06040  223 GLY A C   
1699 O O   . GLY A 223 ? 0.34329 0.37720 0.34541 0.03147  0.03569  0.06351  223 GLY A O   
1700 N N   . SER A 224 ? 0.31310 0.35194 0.31887 0.03190  0.01868  0.05478  224 SER A N   
1701 C CA  . SER A 224 ? 0.28405 0.32581 0.31078 0.02782  0.01701  0.05153  224 SER A CA  
1702 C C   . SER A 224 ? 0.26659 0.31531 0.29369 0.02768  0.00610  0.04360  224 SER A C   
1703 O O   . SER A 224 ? 0.27924 0.32815 0.29913 0.02971  -0.00074 0.04129  224 SER A O   
1704 C CB  . SER A 224 ? 0.32031 0.35591 0.36691 0.02616  0.01943  0.05436  224 SER A CB  
1705 O OG  . SER A 224 ? 0.48147 0.52191 0.54905 0.02304  0.01578  0.04921  224 SER A OG  
1706 N N   . MET A 225 ? 0.25534 0.30929 0.29026 0.02578  0.00482  0.03955  225 MET A N   
1707 C CA  . MET A 225 ? 0.20573 0.26501 0.24065 0.02635  -0.00451 0.03246  225 MET A CA  
1708 C C   . MET A 225 ? 0.27034 0.33317 0.32129 0.02506  -0.00534 0.02939  225 MET A C   
1709 O O   . MET A 225 ? 0.27982 0.34239 0.33797 0.02345  0.00175  0.03206  225 MET A O   
1710 C CB  . MET A 225 ? 0.24428 0.30683 0.25921 0.02763  -0.00543 0.02939  225 MET A CB  
1711 C CG  . MET A 225 ? 0.28663 0.35162 0.29737 0.02650  0.00101  0.02926  225 MET A CG  
1712 S SD  . MET A 225 ? 0.34538 0.41426 0.33543 0.02745  0.00045  0.02395  225 MET A SD  
1713 C CE  . MET A 225 ? 0.43280 0.50360 0.42517 0.02588  0.00687  0.02314  225 MET A CE  
1714 N N   . VAL A 226 ? 0.23845 0.30476 0.29462 0.02638  -0.01425 0.02351  226 VAL A N   
1715 C CA  . VAL A 226 ? 0.18764 0.25830 0.25421 0.02710  -0.01676 0.01926  226 VAL A CA  
1716 C C   . VAL A 226 ? 0.27829 0.35089 0.32871 0.02919  -0.01945 0.01554  226 VAL A C   
1717 O O   . VAL A 226 ? 0.24795 0.32028 0.28783 0.03049  -0.02481 0.01292  226 VAL A O   
1718 C CB  . VAL A 226 ? 0.23397 0.30716 0.31956 0.02811  -0.02457 0.01484  226 VAL A CB  
1719 C CG1 . VAL A 226 ? 0.21150 0.28992 0.30285 0.03098  -0.02923 0.00923  226 VAL A CG1 
1720 C CG2 . VAL A 226 ? 0.19344 0.26475 0.29847 0.02541  -0.01968 0.01769  226 VAL A CG2 
1721 N N   . LYS A 227 ? 0.26630 0.34026 0.31469 0.02939  -0.01483 0.01535  227 LYS A N   
1722 C CA  . LYS A 227 ? 0.24268 0.31718 0.27699 0.03135  -0.01528 0.01201  227 LYS A CA  
1723 C C   . LYS A 227 ? 0.29765 0.37449 0.34115 0.03472  -0.01924 0.00829  227 LYS A C   
1724 O O   . LYS A 227 ? 0.30269 0.38129 0.35789 0.03457  -0.01598 0.00935  227 LYS A O   
1725 C CB  . LYS A 227 ? 0.30313 0.37667 0.32588 0.02945  -0.00582 0.01473  227 LYS A CB  
1726 C CG  . LYS A 227 ? 0.28706 0.36022 0.29635 0.03095  -0.00418 0.01119  227 LYS A CG  
1727 C CD  . LYS A 227 ? 0.40912 0.48187 0.40393 0.02863  0.00329  0.01210  227 LYS A CD  
1728 C CE  . LYS A 227 ? 0.48467 0.55710 0.47586 0.02837  0.01090  0.01207  227 LYS A CE  
1729 N NZ  . LYS A 227 ? 0.53263 0.60546 0.50940 0.02644  0.01742  0.01067  227 LYS A NZ  
1730 N N   . VAL A 228 ? 0.28234 0.35926 0.32048 0.03832  -0.02628 0.00372  228 VAL A N   
1731 C CA  . VAL A 228 ? 0.24736 0.32617 0.29096 0.04334  -0.03076 -0.00019 228 VAL A CA  
1732 C C   . VAL A 228 ? 0.39180 0.46716 0.41795 0.04577  -0.02678 -0.00123 228 VAL A C   
1733 O O   . VAL A 228 ? 0.27883 0.35116 0.29053 0.04554  -0.02685 -0.00258 228 VAL A O   
1734 C CB  . VAL A 228 ? 0.29722 0.37814 0.34771 0.04680  -0.04150 -0.00476 228 VAL A CB  
1735 C CG1 . VAL A 228 ? 0.24891 0.33219 0.30335 0.05353  -0.04637 -0.00917 228 VAL A CG1 
1736 C CG2 . VAL A 228 ? 0.22892 0.31258 0.29777 0.04390  -0.04432 -0.00407 228 VAL A CG2 
1737 N N   . THR A 229 ? 0.31983 0.27350 0.34548 0.03788  -0.00106 -0.01995 229 THR A N   
1738 C CA  . THR A 229 ? 0.36467 0.30907 0.38578 0.04098  0.00311  -0.02448 229 THR A CA  
1739 C C   . THR A 229 ? 0.41039 0.35339 0.43042 0.03971  0.00349  -0.01972 229 THR A C   
1740 O O   . THR A 229 ? 0.36676 0.31738 0.38982 0.03715  0.00064  -0.01285 229 THR A O   
1741 C CB  . THR A 229 ? 0.37058 0.31856 0.38955 0.04885  0.00651  -0.02462 229 THR A CB  
1742 O OG1 . THR A 229 ? 0.43644 0.39432 0.45615 0.05249  0.00672  -0.01606 229 THR A OG1 
1743 C CG2 . THR A 229 ? 0.40158 0.35404 0.42212 0.05040  0.00553  -0.02746 229 THR A CG2 
1744 N N   . PRO A 230 ? 0.37053 0.30398 0.38626 0.04134  0.00691  -0.02311 230 PRO A N   
1745 C CA  . PRO A 230 ? 0.57601 0.50904 0.59020 0.04129  0.00743  -0.01781 230 PRO A CA  
1746 C C   . PRO A 230 ? 0.37437 0.31916 0.38961 0.04649  0.00755  -0.00938 230 PRO A C   
1747 O O   . PRO A 230 ? 0.46433 0.41239 0.47993 0.04558  0.00653  -0.00350 230 PRO A O   
1748 C CB  . PRO A 230 ? 0.56248 0.48269 0.57125 0.04329  0.01170  -0.02365 230 PRO A CB  
1749 C CG  . PRO A 230 ? 0.52068 0.43657 0.52848 0.04557  0.01376  -0.03135 230 PRO A CG  
1750 C CD  . PRO A 230 ? 0.37627 0.29787 0.38844 0.04212  0.01011  -0.03231 230 PRO A CD  
1751 N N   . ASP A 231 ? 0.33791 0.28964 0.35379 0.05182  0.00864  -0.00868 231 ASP A N   
1752 C CA  . ASP A 231 ? 0.38482 0.34732 0.40130 0.05748  0.00937  -0.00149 231 ASP A CA  
1753 C C   . ASP A 231 ? 0.48222 0.45856 0.50367 0.05641  0.00605  0.00488  231 ASP A C   
1754 O O   . ASP A 231 ? 0.42402 0.40998 0.44681 0.05914  0.00578  0.01198  231 ASP A O   
1755 C CB  . ASP A 231 ? 0.43449 0.39613 0.44812 0.06488  0.01328  -0.00454 231 ASP A CB  
1756 C CG  . ASP A 231 ? 0.56047 0.50906 0.56899 0.06681  0.01707  -0.00993 231 ASP A CG  
1757 O OD1 . ASP A 231 ? 0.55145 0.49412 0.55819 0.06417  0.01704  -0.00871 231 ASP A OD1 
1758 O OD2 . ASP A 231 ? 0.73965 0.68393 0.74587 0.07098  0.02015  -0.01538 231 ASP A OD2 
1759 N N   . ASP A 232 ? 0.39083 0.36861 0.41501 0.05269  0.00358  0.00261  232 ASP A N   
1760 C CA  . ASP A 232 ? 0.38922 0.37992 0.41768 0.05223  0.00087  0.00861  232 ASP A CA  
1761 C C   . ASP A 232 ? 0.40169 0.39097 0.43300 0.04605  -0.00257 0.00601  232 ASP A C   
1762 O O   . ASP A 232 ? 0.34831 0.32710 0.37840 0.04244  -0.00283 -0.00068 232 ASP A O   
1763 C CB  . ASP A 232 ? 0.31625 0.31445 0.34414 0.05917  0.00303  0.00962  232 ASP A CB  
1764 C CG  . ASP A 232 ? 0.36706 0.35758 0.39212 0.06180  0.00535  0.00130  232 ASP A CG  
1765 O OD1 . ASP A 232 ? 0.35269 0.33613 0.37797 0.05745  0.00393  -0.00437 232 ASP A OD1 
1766 O OD2 . ASP A 232 ? 0.44880 0.44065 0.47156 0.06831  0.00857  0.00027  232 ASP A OD2 
1767 N N   . VAL A 233 ? 0.32807 0.32813 0.36321 0.04488  -0.00520 0.01142  233 VAL A N   
1768 C CA  . VAL A 233 ? 0.31084 0.31129 0.34879 0.04005  -0.00851 0.00983  233 VAL A CA  
1769 C C   . VAL A 233 ? 0.33194 0.34070 0.37044 0.04422  -0.00818 0.01133  233 VAL A C   
1770 O O   . VAL A 233 ? 0.28164 0.30098 0.32120 0.04774  -0.00752 0.01775  233 VAL A O   
1771 C CB  . VAL A 233 ? 0.35448 0.35978 0.39670 0.03374  -0.01234 0.01543  233 VAL A CB  
1772 C CG1 . VAL A 233 ? 0.28818 0.29328 0.33321 0.02886  -0.01581 0.01369  233 VAL A CG1 
1773 C CG2 . VAL A 233 ? 0.31950 0.31724 0.36091 0.03002  -0.01251 0.01421  233 VAL A CG2 
1774 N N   . GLU A 234 ? 0.28104 0.28524 0.31875 0.04396  -0.00859 0.00530  234 GLU A N   
1775 C CA  . GLU A 234 ? 0.25968 0.27018 0.29690 0.04861  -0.00780 0.00535  234 GLU A CA  
1776 C C   . GLU A 234 ? 0.34369 0.35609 0.38338 0.04458  -0.01142 0.00520  234 GLU A C   
1777 O O   . GLU A 234 ? 0.30703 0.31087 0.34672 0.04055  -0.01311 -0.00068 234 GLU A O   
1778 C CB  . GLU A 234 ? 0.26328 0.26668 0.29649 0.05362  -0.00432 -0.00239 234 GLU A CB  
1779 C CG  . GLU A 234 ? 0.26714 0.26488 0.29748 0.05649  -0.00087 -0.00390 234 GLU A CG  
1780 C CD  . GLU A 234 ? 0.40844 0.39862 0.43502 0.06107  0.00266  -0.01190 234 GLU A CD  
1781 O OE1 . GLU A 234 ? 0.36231 0.35270 0.38859 0.06246  0.00245  -0.01615 234 GLU A OE1 
1782 O OE2 . GLU A 234 ? 0.47543 0.45945 0.49928 0.06335  0.00567  -0.01395 234 GLU A OE2 
1783 N N   . LEU A 235 ? 0.25516 0.27868 0.29686 0.04569  -0.01257 0.01164  235 LEU A N   
1784 C CA  . LEU A 235 ? 0.30724 0.33337 0.35061 0.04318  -0.01558 0.01199  235 LEU A CA  
1785 C C   . LEU A 235 ? 0.28655 0.31521 0.32727 0.04917  -0.01365 0.00913  235 LEU A C   
1786 O O   . LEU A 235 ? 0.26323 0.30049 0.30327 0.05425  -0.01146 0.01329  235 LEU A O   
1787 C CB  . LEU A 235 ? 0.31469 0.35132 0.36189 0.04019  -0.01804 0.02109  235 LEU A CB  
1788 C CG  . LEU A 235 ? 0.39058 0.43079 0.43952 0.03758  -0.02116 0.02289  235 LEU A CG  
1789 C CD1 . LEU A 235 ? 0.38884 0.41886 0.43828 0.03240  -0.02407 0.01675  235 LEU A CD1 
1790 C CD2 . LEU A 235 ? 0.30603 0.35668 0.35881 0.03458  -0.02303 0.03221  235 LEU A CD2 
1791 N N   . ILE A 236 ? 0.28180 0.30331 0.32108 0.04868  -0.01448 0.00188  236 ILE A N   
1792 C CA  . ILE A 236 ? 0.25796 0.27950 0.29417 0.05459  -0.01223 -0.00298 236 ILE A CA  
1793 C C   . ILE A 236 ? 0.34610 0.36926 0.38267 0.05349  -0.01508 -0.00404 236 ILE A C   
1794 O O   . ILE A 236 ? 0.35044 0.36731 0.38822 0.04849  -0.01811 -0.00728 236 ILE A O   
1795 C CB  . ILE A 236 ? 0.31682 0.32714 0.35021 0.05617  -0.00971 -0.01232 236 ILE A CB  
1796 C CG1 . ILE A 236 ? 0.27487 0.28367 0.30734 0.05792  -0.00665 -0.01076 236 ILE A CG1 
1797 C CG2 . ILE A 236 ? 0.29177 0.30204 0.32231 0.06194  -0.00765 -0.01803 236 ILE A CG2 
1798 C CD1 . ILE A 236 ? 0.35995 0.35705 0.38962 0.05882  -0.00401 -0.01937 236 ILE A CD1 
1799 N N   . HIS A 237 ? 0.29004 0.32163 0.32545 0.05827  -0.01413 -0.00134 237 HIS A N   
1800 C CA  . HIS A 237 ? 0.36603 0.39927 0.40084 0.05851  -0.01636 -0.00265 237 HIS A CA  
1801 C C   . HIS A 237 ? 0.37512 0.40614 0.40641 0.06452  -0.01387 -0.00995 237 HIS A C   
1802 O O   . HIS A 237 ? 0.30910 0.34368 0.33867 0.06999  -0.01027 -0.00995 237 HIS A O   
1803 C CB  . HIS A 237 ? 0.31429 0.35939 0.35043 0.05885  -0.01752 0.00652  237 HIS A CB  
1804 C CG  . HIS A 237 ? 0.54881 0.59565 0.58867 0.05220  -0.02080 0.01283  237 HIS A CG  
1805 N ND1 . HIS A 237 ? 0.47874 0.52355 0.52093 0.04854  -0.02085 0.01502  237 HIS A ND1 
1806 C CD2 . HIS A 237 ? 0.51242 0.56240 0.55402 0.04847  -0.02420 0.01710  237 HIS A CD2 
1807 C CE1 . HIS A 237 ? 0.57686 0.62400 0.62234 0.04284  -0.02410 0.02032  237 HIS A CE1 
1808 N NE2 . HIS A 237 ? 0.55007 0.60014 0.59529 0.04262  -0.02615 0.02170  237 HIS A NE2 
1809 N N   . PHE A 238 ? 0.30831 0.33363 0.33866 0.06356  -0.01586 -0.01634 238 PHE A N   
1810 C CA  . PHE A 238 ? 0.36710 0.38904 0.39438 0.06858  -0.01382 -0.02464 238 PHE A CA  
1811 C C   . PHE A 238 ? 0.38063 0.40289 0.40719 0.06834  -0.01690 -0.02694 238 PHE A C   
1812 O O   . PHE A 238 ? 0.35371 0.37470 0.38223 0.06318  -0.02073 -0.02447 238 PHE A O   
1813 C CB  . PHE A 238 ? 0.31134 0.32167 0.33795 0.06741  -0.01229 -0.03356 238 PHE A CB  
1814 C CG  . PHE A 238 ? 0.37576 0.37782 0.40443 0.06045  -0.01566 -0.03635 238 PHE A CG  
1815 C CD1 . PHE A 238 ? 0.27824 0.27853 0.30932 0.05538  -0.01657 -0.03198 238 PHE A CD1 
1816 C CD2 . PHE A 238 ? 0.36991 0.36630 0.39816 0.05910  -0.01798 -0.04347 238 PHE A CD2 
1817 C CE1 . PHE A 238 ? 0.32781 0.32083 0.36090 0.04898  -0.01967 -0.03466 238 PHE A CE1 
1818 C CE2 . PHE A 238 ? 0.31615 0.30520 0.34646 0.05278  -0.02112 -0.04623 238 PHE A CE2 
1819 C CZ  . PHE A 238 ? 0.34688 0.33424 0.37964 0.04766  -0.02193 -0.04182 238 PHE A CZ  
1820 N N   . PRO A 239 ? 0.44223 0.46620 0.46599 0.07388  -0.01545 -0.03163 239 PRO A N   
1821 C CA  . PRO A 239 ? 0.38603 0.41027 0.40870 0.07413  -0.01845 -0.03407 239 PRO A CA  
1822 C C   . PRO A 239 ? 0.41976 0.43305 0.44269 0.07096  -0.02050 -0.04335 239 PRO A C   
1823 O O   . PRO A 239 ? 0.38770 0.39317 0.41079 0.07006  -0.01868 -0.04976 239 PRO A O   
1824 C CB  . PRO A 239 ? 0.47668 0.50676 0.49619 0.08161  -0.01567 -0.03634 239 PRO A CB  
1825 C CG  . PRO A 239 ? 0.56443 0.59165 0.58333 0.08461  -0.01133 -0.04034 239 PRO A CG  
1826 C CD  . PRO A 239 ? 0.45754 0.48408 0.47898 0.08049  -0.01100 -0.03443 239 PRO A CD  
1827 N N   . PHE A 240 ? 0.39817 0.41100 0.42107 0.06920  -0.02436 -0.04391 240 PHE A N   
1828 C CA  . PHE A 240 ? 0.43548 0.43878 0.45874 0.06637  -0.02678 -0.05276 240 PHE A CA  
1829 C C   . PHE A 240 ? 0.52384 0.52303 0.54474 0.07105  -0.02407 -0.06314 240 PHE A C   
1830 O O   . PHE A 240 ? 0.43552 0.42623 0.45702 0.06920  -0.02288 -0.07050 240 PHE A O   
1831 C CB  . PHE A 240 ? 0.36198 0.36657 0.38522 0.06475  -0.03137 -0.05110 240 PHE A CB  
1832 C CG  . PHE A 240 ? 0.47380 0.47978 0.49991 0.05883  -0.03457 -0.04278 240 PHE A CG  
1833 C CD1 . PHE A 240 ? 0.45082 0.45368 0.47986 0.05396  -0.03420 -0.04037 240 PHE A CD1 
1834 C CD2 . PHE A 240 ? 0.43055 0.44086 0.45638 0.05813  -0.03794 -0.03743 240 PHE A CD2 
1835 C CE1 . PHE A 240 ? 0.47867 0.48308 0.51062 0.04845  -0.03714 -0.03300 240 PHE A CE1 
1836 C CE2 . PHE A 240 ? 0.45278 0.46421 0.48144 0.05254  -0.04079 -0.02993 240 PHE A CE2 
1837 C CZ  . PHE A 240 ? 0.43477 0.44344 0.46667 0.04767  -0.04040 -0.02783 240 PHE A CZ  
1838 N N   . LEU A 241 ? 0.56955 0.57476 0.58773 0.07705  -0.02299 -0.06393 241 LEU A N   
1839 C CA  . LEU A 241 ? 0.61146 0.61376 0.62741 0.08178  -0.02084 -0.07394 241 LEU A CA  
1840 C C   . LEU A 241 ? 0.72808 0.73483 0.74252 0.08724  -0.01585 -0.07345 241 LEU A C   
1841 O O   . LEU A 241 ? 0.60782 0.62146 0.62254 0.08820  -0.01437 -0.06491 241 LEU A O   
1842 C CB  . LEU A 241 ? 0.66769 0.67334 0.68152 0.08492  -0.02345 -0.07627 241 LEU A CB  
1843 C CG  . LEU A 241 ? 0.67960 0.67933 0.69438 0.08082  -0.02825 -0.08018 241 LEU A CG  
1844 C CD1 . LEU A 241 ? 0.63265 0.62166 0.64955 0.07641  -0.02822 -0.08830 241 LEU A CD1 
1845 C CD2 . LEU A 241 ? 0.71304 0.71604 0.72922 0.07661  -0.03208 -0.07045 241 LEU A CD2 
1846 N N   . GLU A 242 ? 0.86214 0.86491 0.87508 0.09088  -0.01324 -0.08303 242 GLU A N   
1847 C CA  . GLU A 242 ? 0.95820 0.96418 0.96964 0.09641  -0.00840 -0.08413 242 GLU A CA  
1848 C C   . GLU A 242 ? 0.97363 0.99066 0.98292 0.10219  -0.00803 -0.07975 242 GLU A C   
1849 O O   . GLU A 242 ? 0.94992 0.96852 0.95731 0.10581  -0.00866 -0.08518 242 GLU A O   
1850 C CB  . GLU A 242 ? 0.84103 0.83917 0.85164 0.09825  -0.00587 -0.09613 242 GLU A CB  
1851 N N   . GLU A 243 ? 1.08927 1.11433 1.09887 0.10308  -0.00700 -0.06993 243 GLU A N   
1852 C CA  . GLU A 243 ? 1.14903 1.18524 1.15663 0.10838  -0.00631 -0.06505 243 GLU A CA  
1853 C C   . GLU A 243 ? 1.26213 1.30037 1.26780 0.11514  -0.00201 -0.07097 243 GLU A C   
1854 O O   . GLU A 243 ? 1.15864 1.20009 1.16454 0.11758  0.00145  -0.06796 243 GLU A O   
1855 C CB  . GLU A 243 ? 1.13617 1.18044 1.14500 0.10714  -0.00619 -0.05321 243 GLU A CB  
1856 C CG  . GLU A 243 ? 1.07890 1.12088 1.09020 0.10006  -0.01000 -0.04713 243 GLU A CG  
1857 C CD  . GLU A 243 ? 1.14450 1.19012 1.15492 0.09894  -0.01399 -0.04388 243 GLU A CD  
1858 O OE1 . GLU A 243 ? 1.24701 1.30143 1.25522 0.10338  -0.01346 -0.04059 243 GLU A OE1 
1859 O OE2 . GLU A 243 ? 1.06112 1.10072 1.07296 0.09364  -0.01766 -0.04459 243 GLU A OE2 
1860 N N   . ASN A 244 ? 1.31254 1.34894 1.31639 0.11825  -0.00226 -0.07959 244 ASN A N   
1861 C CA  . ASN A 244 ? 1.20194 1.24025 1.20408 0.12469  0.00170  -0.08602 244 ASN A CA  
1862 C C   . ASN A 244 ? 1.15050 1.20101 1.15122 0.12989  0.00354  -0.07892 244 ASN A C   
1863 O O   . ASN A 244 ? 1.12168 1.17969 1.12090 0.13129  0.00132  -0.07455 244 ASN A O   
1864 C CB  . ASN A 244 ? 1.18802 1.22335 1.18858 0.12693  0.00052  -0.09611 244 ASN A CB  
1865 C CG  . ASN A 244 ? 1.28086 1.30424 1.28269 0.12395  0.00104  -0.10618 244 ASN A CG  
1866 O OD1 . ASN A 244 ? 1.24798 1.26513 1.25148 0.12074  0.00281  -0.10594 244 ASN A OD1 
1867 N ND2 . ASN A 244 ? 1.25986 1.28012 1.26081 0.12503  -0.00045 -0.11520 244 ASN A ND2 
1868 N N   . LEU A 245 ? 1.06927 1.12167 1.07035 0.13275  0.00761  -0.07776 245 LEU A N   
1869 C CA  . LEU A 245 ? 0.86386 0.92800 0.86396 0.13760  0.00962  -0.07104 245 LEU A CA  
1870 C C   . LEU A 245 ? 0.70744 0.77722 0.70489 0.14407  0.01074  -0.07647 245 LEU A C   
1871 O O   . LEU A 245 ? 0.68609 0.75048 0.68288 0.14653  0.01239  -0.08647 245 LEU A O   
1872 C CB  . LEU A 245 ? 0.79100 0.85506 0.79228 0.13915  0.01361  -0.06908 245 LEU A CB  
1873 C CG  . LEU A 245 ? 0.69826 0.76976 0.69818 0.14654  0.01766  -0.07032 245 LEU A CG  
1874 N N   . TYR A 246 ? 0.71536 0.79607 0.71128 0.14667  0.00980  -0.06993 246 TYR A N   
1875 C CA  . TYR A 246 ? 0.61183 0.70015 0.60509 0.15337  0.01125  -0.07332 246 TYR A CA  
1876 C C   . TYR A 246 ? 0.65184 0.75215 0.64475 0.15690  0.01345  -0.06480 246 TYR A C   
1877 O O   . TYR A 246 ? 0.83358 0.93657 0.82822 0.15379  0.01320  -0.05605 246 TYR A O   
1878 C CB  . TYR A 246 ? 0.64864 0.73852 0.63963 0.15331  0.00744  -0.07479 246 TYR A CB  
1879 C CG  . TYR A 246 ? 0.72281 0.81858 0.71339 0.15012  0.00416  -0.06416 246 TYR A CG  
1880 C CD1 . TYR A 246 ? 0.78347 0.87291 0.77590 0.14323  0.00076  -0.06057 246 TYR A CD1 
1881 C CD2 . TYR A 246 ? 0.76757 0.87524 0.75592 0.15392  0.00456  -0.05782 246 TYR A CD2 
1882 C CE1 . TYR A 246 ? 0.92018 1.01472 0.91236 0.14017  -0.00213 -0.05096 246 TYR A CE1 
1883 C CE2 . TYR A 246 ? 0.86939 0.98221 0.85728 0.15081  0.00178  -0.04808 246 TYR A CE2 
1884 C CZ  . TYR A 246 ? 0.94904 1.05512 0.93890 0.14392  -0.00155 -0.04470 246 TYR A CZ  
1885 O OH  . TYR A 246 ? 0.99625 1.10719 0.98579 0.14069  -0.00421 -0.03511 246 TYR A OH  
1886 N N   . PHE A 247 ? 0.48007 0.58799 0.47086 0.16345  0.01565  -0.06760 247 PHE A N   
1887 C CA  . PHE A 247 ? 0.50723 0.62707 0.49761 0.16750  0.01808  -0.06066 247 PHE A CA  
1888 C C   . PHE A 247 ? 0.70804 0.83814 0.69550 0.17003  0.01634  -0.05668 247 PHE A C   
1889 O O   . PHE A 247 ? 0.57468 0.70399 0.55976 0.17221  0.01498  -0.06280 247 PHE A O   
1890 C CB  . PHE A 247 ? 0.44629 0.56740 0.43674 0.17352  0.02269  -0.06674 247 PHE A CB  
1891 C CG  . PHE A 247 ? 0.58757 0.69798 0.58031 0.17157  0.02475  -0.07133 247 PHE A CG  
1892 C CD1 . PHE A 247 ? 0.49385 0.60201 0.48894 0.16749  0.02482  -0.06458 247 PHE A CD1 
1893 C CD2 . PHE A 247 ? 0.53720 0.63993 0.52966 0.17386  0.02671  -0.08243 247 PHE A CD2 
1894 C CE1 . PHE A 247 ? 0.42882 0.52697 0.42557 0.16580  0.02674  -0.06857 247 PHE A CE1 
1895 C CE2 . PHE A 247 ? 0.40493 0.49746 0.39918 0.17197  0.02880  -0.08650 247 PHE A CE2 
1896 C CZ  . PHE A 247 ? 0.38149 0.47161 0.37770 0.16798  0.02879  -0.07944 247 PHE A CZ  
1897 N N   . GLN A 248 ? 0.67802 0.81780 0.66561 0.16968  0.01640  -0.04641 248 GLN A N   
1898 C CA  . GLN A 248 ? 0.72814 0.87919 0.71279 0.17261  0.01563  -0.04156 248 GLN A CA  
1899 C C   . GLN A 248 ? 0.68344 0.84554 0.66810 0.17807  0.01961  -0.03867 248 GLN A C   
1900 O O   . GLN A 248 ? 0.77958 0.94354 0.76688 0.17695  0.02143  -0.03369 248 GLN A O   
1901 C CB  . GLN A 248 ? 0.87808 1.03149 0.86278 0.16711  0.01219  -0.03162 248 GLN A CB  
1902 N N   . SER A 249 ? 0.67237 0.84193 0.65412 0.18408  0.02089  -0.04198 249 SER A N   
1903 C CA  . SER A 249 ? 0.81973 0.99945 0.80152 0.18991  0.02487  -0.04094 249 SER A CA  
1904 C C   . SER A 249 ? 0.95858 1.14978 0.94061 0.18901  0.02508  -0.02937 249 SER A C   
1905 O O   . SER A 249 ? 1.08417 1.28599 1.06350 0.19234  0.02538  -0.02629 249 SER A O   
1906 C CB  . SER A 249 ? 0.70275 0.88753 0.68134 0.19653  0.02606  -0.04801 249 SER A CB  
1907 N N   . HIS A 250 ? 0.95778 1.14720 0.94302 0.18450  0.02499  -0.02304 250 HIS A N   
1908 C CA  . HIS A 250 ? 0.92571 1.12645 0.91187 0.18396  0.02582  -0.01270 250 HIS A CA  
1909 C C   . HIS A 250 ? 0.87178 1.08285 0.85783 0.19088  0.02994  -0.01364 250 HIS A C   
1910 O O   . HIS A 250 ? 0.82189 1.02959 0.80823 0.19523  0.03241  -0.02167 250 HIS A O   
1911 C CB  . HIS A 250 ? 0.85550 1.05197 0.84552 0.17827  0.02519  -0.00698 250 HIS A CB  
1912 C CG  . HIS A 250 ? 0.99085 1.17989 0.98125 0.17109  0.02106  -0.00380 250 HIS A CG  
1913 N ND1 . HIS A 250 ? 0.98589 1.16785 0.97961 0.16545  0.01991  -0.00103 250 HIS A ND1 
1914 C CD2 . HIS A 250 ? 1.07333 1.26093 1.06118 0.16875  0.01777  -0.00299 250 HIS A CD2 
1915 C CE1 . HIS A 250 ? 0.97483 1.15142 0.96827 0.15984  0.01612  0.00121  250 HIS A CE1 
1916 N NE2 . HIS A 250 ? 1.20840 1.38808 1.19829 0.16174  0.01473  0.00012  250 HIS A NE2 
1917 N N   . HIS A 251 ? 0.93021 1.15404 0.91591 0.19181  0.03075  -0.00540 251 HIS A N   
1918 C CA  . HIS A 251 ? 1.00120 1.23650 0.98650 0.19847  0.03442  -0.00577 251 HIS A CA  
1919 C C   . HIS A 251 ? 1.06534 1.30885 1.05376 0.19760  0.03613  0.00249  251 HIS A C   
1920 O O   . HIS A 251 ? 0.98706 1.23303 0.97656 0.19238  0.03427  0.01092  251 HIS A O   
1921 C CB  . HIS A 251 ? 1.06680 1.31195 1.04793 0.20184  0.03416  -0.00478 251 HIS A CB  
1922 C CG  . HIS A 251 ? 1.12972 1.36933 1.10776 0.20498  0.03341  -0.01432 251 HIS A CG  
1923 N ND1 . HIS A 251 ? 1.16634 1.40669 1.14402 0.21136  0.03628  -0.02297 251 HIS A ND1 
1924 C CD2 . HIS A 251 ? 1.03257 1.26597 1.00787 0.20269  0.03008  -0.01677 251 HIS A CD2 
1925 C CE1 . HIS A 251 ? 1.10441 1.33951 1.07935 0.21278  0.03479  -0.03043 251 HIS A CE1 
1926 N NE2 . HIS A 251 ? 1.05857 1.28942 1.03197 0.20770  0.03097  -0.02685 251 HIS A NE2 
1927 N N   . HIS A 252 ? 1.11014 1.35795 1.10012 0.20280  0.03968  -0.00017 252 HIS A N   
1928 C CA  . HIS A 252 ? 1.09619 1.35273 1.08920 0.20308  0.04159  0.00680  252 HIS A CA  
1929 C C   . HIS A 252 ? 1.05660 1.32884 1.04818 0.20483  0.04234  0.01372  252 HIS A C   
1930 O O   . HIS A 252 ? 1.08267 1.36420 1.07333 0.21102  0.04514  0.01160  252 HIS A O   
1931 C CB  . HIS A 252 ? 1.08588 1.34168 1.08082 0.20854  0.04510  0.00129  252 HIS A CB  
1932 C CG  . HIS A 252 ? 1.14289 1.38500 1.14017 0.20585  0.04479  -0.00229 252 HIS A CG  
1933 N ND1 . HIS A 252 ? 1.08187 1.31477 1.07890 0.20921  0.04646  -0.01183 252 HIS A ND1 
1934 C CD2 . HIS A 252 ? 1.13568 1.37182 1.13550 0.20006  0.04309  0.00238  252 HIS A CD2 
1935 C CE1 . HIS A 252 ? 1.00701 1.22865 1.00609 0.20557  0.04586  -0.01272 252 HIS A CE1 
1936 N NE2 . HIS A 252 ? 1.04473 1.26822 1.04552 0.20007  0.04375  -0.00422 252 HIS A NE2 
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