data_9F9J
# 
_entry.id   9F9J 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.401 
_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   9F9J         pdb_00009f9j 10.2210/pdb9f9j/pdb 
WWPDB D_1292138402 ?            ?                   
# 
_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       2025-01-22 
# 
_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                        9F9J 
_pdbx_database_status.recvd_initial_deposition_date   2024-05-07 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBE 
_pdbx_database_status.process_site                    PDBE 
_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           Y 
# 
_pdbx_contact_author.id                 3 
_pdbx_contact_author.email              joerg.standfuss@psi.ch 
_pdbx_contact_author.name_first         Joerg 
_pdbx_contact_author.name_last          Standfuss 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0001-8825-386X 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Bertrand, Q.'  1 0000-0003-3476-1775 
'Weinert, T.'   2 0000-0002-0339-3722 
'Standfuss, J.' 3 0000-0001-8825-386X 
# 
_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                   UK 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'Nat Commun' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           2041-1723 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            15 
_citation.language                  ? 
_citation.page_first                10278 
_citation.page_last                 10278 
_citation.title                     
'Structural effects of high laser power densities on an early bacteriorhodopsin photocycle intermediate.' 
_citation.year                      2024 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1038/s41467-024-54422-8 
_citation.pdbx_database_id_PubMed   39604356 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Bertrand, Q.'    1  0000-0003-3476-1775 
primary 'Nogly, P.'       2  0000-0002-8040-7753 
primary 'Nango, E.'       3  0000-0001-9851-7355 
primary 'Kekilli, D.'     4  ?                   
primary 'Khusainov, G.'   5  ?                   
primary 'Furrer, A.'      6  0000-0001-9894-6985 
primary 'James, D.'       7  ?                   
primary 'Dworkowski, F.'  8  0000-0001-5004-8684 
primary 'Skopintsev, P.'  9  ?                   
primary 'Mous, S.'        10 ?                   
primary 'Martiel, I.'     11 ?                   
primary 'Borjesson, P.'   12 0000-0002-7193-640X 
primary 'Ortolani, G.'    13 0000-0001-6373-9919 
primary 'Huang, C.Y.'     14 0000-0002-7676-0239 
primary 'Kepa, M.'        15 0000-0002-4045-3990 
primary 'Ozerov, D.'      16 0000-0002-3274-1124 
primary 'Brunle, S.'      17 ?                   
primary 'Panneels, V.'    18 0000-0001-8899-3366 
primary 'Tanaka, T.'      19 ?                   
primary 'Tanaka, R.'      20 ?                   
primary 'Tono, K.'        21 0000-0003-1218-3759 
primary 'Owada, S.'       22 ?                   
primary 'Johnson, P.J.M.' 23 0000-0002-7251-4815 
primary 'Nass, K.'        24 ?                   
primary 'Knopp, G.'       25 0000-0002-0786-3402 
primary 'Cirelli, C.'     26 0000-0003-4576-3805 
primary 'Milne, C.'       27 0000-0003-4714-9139 
primary 'Schertler, G.'   28 0000-0002-5846-6810 
primary 'Iwata, S.'       29 0000-0003-1735-2937 
primary 'Neutze, R.'      30 0000-0003-0986-6153 
primary 'Weinert, T.'     31 0000-0002-0339-3722 
primary 'Standfuss, J.'   32 0000-0001-8825-386X 
# 
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 Bacteriorhodopsin                                                                        25261.807 1  ? ? ? ? 
2 non-polymer syn '1-[2,6,10.14-TETRAMETHYL-HEXADECAN-16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-16-YL]GLYCEROL' 639.130   11 ? ? ? ? 
3 non-polymer syn '(2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate'                                         356.540   5  ? ? ? ? 
4 non-polymer man RETINAL                                                                                  284.436   1  ? ? ? ? 
5 water       nat water                                                                                    18.015    28 ? ? ? ? 
# 
loop_
_entity_name_com.entity_id 
_entity_name_com.name 
1 BR,Bacterioopsin,BO 
4 BR,Bacterioopsin,BO 
# 
_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       
;ATGRPEWIWLALGTALMGLGTLYFLVKGMGVSDPDAKKFYAITTLVPAIAFTMYLSMLLGYGLTMVPFGGEQNPIYWARY
ADWLFTTPLLLLDLALLVDADQGTILALVGADGIMIGTGLVGALTKVYSYRFVWWAISTAAMLYILYVLFFGFTSKAESM
RPEVASTFKVLRNVTVVLWSAYPVVWLIGSEGAGIVPLNIETLLFMVLDVSAKVGFGLILLRSRAIFGEAE
;
_entity_poly.pdbx_seq_one_letter_code_can   
;ATGRPEWIWLALGTALMGLGTLYFLVKGMGVSDPDAKKFYAITTLVPAIAFTMYLSMLLGYGLTMVPFGGEQNPIYWARY
ADWLFTTPLLLLDLALLVDADQGTILALVGADGIMIGTGLVGALTKVYSYRFVWWAISTAAMLYILYVLFFGFTSKAESM
RPEVASTFKVLRNVTVVLWSAYPVVWLIGSEGAGIVPLNIETLLFMVLDVSAKVGFGLILLRSRAIFGEAE
;
_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-[2,6,10.14-TETRAMETHYL-HEXADECAN-16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-16-YL]GLYCEROL' LI1 
3 '(2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate'                                         OLC 
4 RETINAL                                                                                  RET 
5 water                                                                                    HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   ALA n 
1 2   THR n 
1 3   GLY n 
1 4   ARG n 
1 5   PRO n 
1 6   GLU n 
1 7   TRP n 
1 8   ILE n 
1 9   TRP n 
1 10  LEU n 
1 11  ALA n 
1 12  LEU n 
1 13  GLY n 
1 14  THR n 
1 15  ALA n 
1 16  LEU n 
1 17  MET n 
1 18  GLY n 
1 19  LEU n 
1 20  GLY n 
1 21  THR n 
1 22  LEU n 
1 23  TYR n 
1 24  PHE n 
1 25  LEU n 
1 26  VAL n 
1 27  LYS n 
1 28  GLY n 
1 29  MET n 
1 30  GLY n 
1 31  VAL n 
1 32  SER n 
1 33  ASP n 
1 34  PRO n 
1 35  ASP n 
1 36  ALA n 
1 37  LYS n 
1 38  LYS n 
1 39  PHE n 
1 40  TYR n 
1 41  ALA n 
1 42  ILE n 
1 43  THR n 
1 44  THR n 
1 45  LEU n 
1 46  VAL n 
1 47  PRO n 
1 48  ALA n 
1 49  ILE n 
1 50  ALA n 
1 51  PHE n 
1 52  THR n 
1 53  MET n 
1 54  TYR n 
1 55  LEU n 
1 56  SER n 
1 57  MET n 
1 58  LEU n 
1 59  LEU n 
1 60  GLY n 
1 61  TYR n 
1 62  GLY n 
1 63  LEU n 
1 64  THR n 
1 65  MET n 
1 66  VAL n 
1 67  PRO n 
1 68  PHE n 
1 69  GLY n 
1 70  GLY n 
1 71  GLU n 
1 72  GLN n 
1 73  ASN n 
1 74  PRO n 
1 75  ILE n 
1 76  TYR n 
1 77  TRP n 
1 78  ALA n 
1 79  ARG n 
1 80  TYR n 
1 81  ALA n 
1 82  ASP n 
1 83  TRP n 
1 84  LEU n 
1 85  PHE n 
1 86  THR n 
1 87  THR n 
1 88  PRO n 
1 89  LEU n 
1 90  LEU n 
1 91  LEU n 
1 92  LEU n 
1 93  ASP n 
1 94  LEU n 
1 95  ALA n 
1 96  LEU n 
1 97  LEU n 
1 98  VAL n 
1 99  ASP n 
1 100 ALA n 
1 101 ASP n 
1 102 GLN n 
1 103 GLY n 
1 104 THR n 
1 105 ILE n 
1 106 LEU n 
1 107 ALA n 
1 108 LEU n 
1 109 VAL n 
1 110 GLY n 
1 111 ALA n 
1 112 ASP n 
1 113 GLY n 
1 114 ILE n 
1 115 MET n 
1 116 ILE n 
1 117 GLY n 
1 118 THR n 
1 119 GLY n 
1 120 LEU n 
1 121 VAL n 
1 122 GLY n 
1 123 ALA n 
1 124 LEU n 
1 125 THR n 
1 126 LYS n 
1 127 VAL n 
1 128 TYR n 
1 129 SER n 
1 130 TYR n 
1 131 ARG n 
1 132 PHE n 
1 133 VAL n 
1 134 TRP n 
1 135 TRP n 
1 136 ALA n 
1 137 ILE n 
1 138 SER n 
1 139 THR n 
1 140 ALA n 
1 141 ALA n 
1 142 MET n 
1 143 LEU n 
1 144 TYR n 
1 145 ILE n 
1 146 LEU n 
1 147 TYR n 
1 148 VAL n 
1 149 LEU n 
1 150 PHE n 
1 151 PHE n 
1 152 GLY n 
1 153 PHE n 
1 154 THR n 
1 155 SER n 
1 156 LYS n 
1 157 ALA n 
1 158 GLU n 
1 159 SER n 
1 160 MET n 
1 161 ARG n 
1 162 PRO n 
1 163 GLU n 
1 164 VAL n 
1 165 ALA n 
1 166 SER n 
1 167 THR n 
1 168 PHE n 
1 169 LYS n 
1 170 VAL n 
1 171 LEU n 
1 172 ARG n 
1 173 ASN n 
1 174 VAL n 
1 175 THR n 
1 176 VAL n 
1 177 VAL n 
1 178 LEU n 
1 179 TRP n 
1 180 SER n 
1 181 ALA n 
1 182 TYR n 
1 183 PRO n 
1 184 VAL n 
1 185 VAL n 
1 186 TRP n 
1 187 LEU n 
1 188 ILE n 
1 189 GLY n 
1 190 SER n 
1 191 GLU n 
1 192 GLY n 
1 193 ALA n 
1 194 GLY n 
1 195 ILE n 
1 196 VAL n 
1 197 PRO n 
1 198 LEU n 
1 199 ASN n 
1 200 ILE n 
1 201 GLU n 
1 202 THR n 
1 203 LEU n 
1 204 LEU n 
1 205 PHE n 
1 206 MET n 
1 207 VAL n 
1 208 LEU n 
1 209 ASP n 
1 210 VAL n 
1 211 SER n 
1 212 ALA n 
1 213 LYS n 
1 214 VAL n 
1 215 GLY n 
1 216 PHE n 
1 217 GLY n 
1 218 LEU n 
1 219 ILE n 
1 220 LEU n 
1 221 LEU n 
1 222 ARG n 
1 223 SER n 
1 224 ARG n 
1 225 ALA n 
1 226 ILE n 
1 227 PHE n 
1 228 GLY n 
1 229 GLU n 
1 230 ALA n 
1 231 GLU n 
# 
loop_
_entity_src_gen.entity_id 
_entity_src_gen.pdbx_src_id 
_entity_src_gen.pdbx_alt_source_flag 
_entity_src_gen.pdbx_seq_type 
_entity_src_gen.pdbx_beg_seq_num 
_entity_src_gen.pdbx_end_seq_num 
_entity_src_gen.gene_src_common_name 
_entity_src_gen.gene_src_genus 
_entity_src_gen.pdbx_gene_src_gene 
_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 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 
_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 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 
_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 
1 1 sample 'Biological sequence' 1 231 ? ? 'bop, VNG_1467G' ? ? ? ? ? ? 'Halobacterium salinarum' 2242 ? ? 700922 ? ? ? ? ? 
'Escherichia coli' 562 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 
4 1 sample 'Biological sequence' 1 231 ? ? 'bop, VNG_1467G' ? ? ? ? ? ? 'Halobacterium salinarum' 2242 ? ? 700922 ? ? ? ? ? 
'Escherichia coli' 562 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 
# 
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 
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 
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  
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 
LI1 non-polymer         . '1-[2,6,10.14-TETRAMETHYL-HEXADECAN-16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-16-YL]GLYCEROL' 
'LIPID FRAGMENT'    'C42 H86 O3'     639.130 
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 
OLC non-polymer         . '(2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate'                                         
1-Oleoyl-R-glycerol 'C21 H40 O4'     356.540 
PHE 'L-peptide linking' y PHENYLALANINE                                                                            ? 'C9 H11 N O2' 
165.189 
PRO 'L-peptide linking' y PROLINE                                                                                  ? 'C5 H9 N O2' 
115.130 
RET non-polymer         . RETINAL                                                                                  ? 'C20 H28 O' 
284.436 
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   ALA 1   4   4   ALA ALA A . n 
A 1 2   THR 2   5   5   THR THR A . n 
A 1 3   GLY 3   6   6   GLY GLY A . n 
A 1 4   ARG 4   7   7   ARG ARG A . n 
A 1 5   PRO 5   8   8   PRO PRO A . n 
A 1 6   GLU 6   9   9   GLU GLU A . n 
A 1 7   TRP 7   10  10  TRP TRP A . n 
A 1 8   ILE 8   11  11  ILE ILE A . n 
A 1 9   TRP 9   12  12  TRP TRP A . n 
A 1 10  LEU 10  13  13  LEU LEU A . n 
A 1 11  ALA 11  14  14  ALA ALA A . n 
A 1 12  LEU 12  15  15  LEU LEU A . n 
A 1 13  GLY 13  16  16  GLY GLY A . n 
A 1 14  THR 14  17  17  THR THR A . n 
A 1 15  ALA 15  18  18  ALA ALA A . n 
A 1 16  LEU 16  19  19  LEU LEU A . n 
A 1 17  MET 17  20  20  MET MET A . n 
A 1 18  GLY 18  21  21  GLY GLY A . n 
A 1 19  LEU 19  22  22  LEU LEU A . n 
A 1 20  GLY 20  23  23  GLY GLY A . n 
A 1 21  THR 21  24  24  THR THR A . n 
A 1 22  LEU 22  25  25  LEU LEU A . n 
A 1 23  TYR 23  26  26  TYR TYR A . n 
A 1 24  PHE 24  27  27  PHE PHE A . n 
A 1 25  LEU 25  28  28  LEU LEU A . n 
A 1 26  VAL 26  29  29  VAL VAL A . n 
A 1 27  LYS 27  30  30  LYS LYS A . n 
A 1 28  GLY 28  31  31  GLY GLY A . n 
A 1 29  MET 29  32  32  MET MET A . n 
A 1 30  GLY 30  33  33  GLY GLY A . n 
A 1 31  VAL 31  34  34  VAL VAL A . n 
A 1 32  SER 32  35  35  SER SER A . n 
A 1 33  ASP 33  36  36  ASP ASP A . n 
A 1 34  PRO 34  37  37  PRO PRO A . n 
A 1 35  ASP 35  38  38  ASP ASP A . n 
A 1 36  ALA 36  39  39  ALA ALA A . n 
A 1 37  LYS 37  40  40  LYS LYS A . n 
A 1 38  LYS 38  41  41  LYS LYS A . n 
A 1 39  PHE 39  42  42  PHE PHE A . n 
A 1 40  TYR 40  43  43  TYR TYR A . n 
A 1 41  ALA 41  44  44  ALA ALA A . n 
A 1 42  ILE 42  45  45  ILE ILE A . n 
A 1 43  THR 43  46  46  THR THR A . n 
A 1 44  THR 44  47  47  THR THR A . n 
A 1 45  LEU 45  48  48  LEU LEU A . n 
A 1 46  VAL 46  49  49  VAL VAL A . n 
A 1 47  PRO 47  50  50  PRO PRO A . n 
A 1 48  ALA 48  51  51  ALA ALA A . n 
A 1 49  ILE 49  52  52  ILE ILE A . n 
A 1 50  ALA 50  53  53  ALA ALA A . n 
A 1 51  PHE 51  54  54  PHE PHE A . n 
A 1 52  THR 52  55  55  THR THR A . n 
A 1 53  MET 53  56  56  MET MET A . n 
A 1 54  TYR 54  57  57  TYR TYR A . n 
A 1 55  LEU 55  58  58  LEU LEU A . n 
A 1 56  SER 56  59  59  SER SER A . n 
A 1 57  MET 57  60  60  MET MET A . n 
A 1 58  LEU 58  61  61  LEU LEU A . n 
A 1 59  LEU 59  62  62  LEU LEU A . n 
A 1 60  GLY 60  63  63  GLY GLY A . n 
A 1 61  TYR 61  64  64  TYR TYR A . n 
A 1 62  GLY 62  65  65  GLY GLY A . n 
A 1 63  LEU 63  66  66  LEU LEU A . n 
A 1 64  THR 64  67  67  THR THR A . n 
A 1 65  MET 65  68  68  MET MET A . n 
A 1 66  VAL 66  69  69  VAL VAL A . n 
A 1 67  PRO 67  70  70  PRO PRO A . n 
A 1 68  PHE 68  71  71  PHE PHE A . n 
A 1 69  GLY 69  72  72  GLY GLY A . n 
A 1 70  GLY 70  73  73  GLY GLY A . n 
A 1 71  GLU 71  74  74  GLU GLU A . n 
A 1 72  GLN 72  75  75  GLN GLN A . n 
A 1 73  ASN 73  76  76  ASN ASN A . n 
A 1 74  PRO 74  77  77  PRO PRO A . n 
A 1 75  ILE 75  78  78  ILE ILE A . n 
A 1 76  TYR 76  79  79  TYR TYR A . n 
A 1 77  TRP 77  80  80  TRP TRP A . n 
A 1 78  ALA 78  81  81  ALA ALA A . n 
A 1 79  ARG 79  82  82  ARG ARG A . n 
A 1 80  TYR 80  83  83  TYR TYR A . n 
A 1 81  ALA 81  84  84  ALA ALA A . n 
A 1 82  ASP 82  85  85  ASP ASP A . n 
A 1 83  TRP 83  86  86  TRP TRP A . n 
A 1 84  LEU 84  87  87  LEU LEU A . n 
A 1 85  PHE 85  88  88  PHE PHE A . n 
A 1 86  THR 86  89  89  THR THR A . n 
A 1 87  THR 87  90  90  THR THR A . n 
A 1 88  PRO 88  91  91  PRO PRO A . n 
A 1 89  LEU 89  92  92  LEU LEU A . n 
A 1 90  LEU 90  93  93  LEU LEU A . n 
A 1 91  LEU 91  94  94  LEU LEU A . n 
A 1 92  LEU 92  95  95  LEU LEU A . n 
A 1 93  ASP 93  96  96  ASP ASP A . n 
A 1 94  LEU 94  97  97  LEU LEU A . n 
A 1 95  ALA 95  98  98  ALA ALA A . n 
A 1 96  LEU 96  99  99  LEU LEU A . n 
A 1 97  LEU 97  100 100 LEU LEU A . n 
A 1 98  VAL 98  101 101 VAL VAL A . n 
A 1 99  ASP 99  102 102 ASP ASP A . n 
A 1 100 ALA 100 103 103 ALA ALA A . n 
A 1 101 ASP 101 104 104 ASP ASP A . n 
A 1 102 GLN 102 105 105 GLN GLN A . n 
A 1 103 GLY 103 106 106 GLY GLY A . n 
A 1 104 THR 104 107 107 THR THR A . n 
A 1 105 ILE 105 108 108 ILE ILE A . n 
A 1 106 LEU 106 109 109 LEU LEU A . n 
A 1 107 ALA 107 110 110 ALA ALA A . n 
A 1 108 LEU 108 111 111 LEU LEU A . n 
A 1 109 VAL 109 112 112 VAL VAL A . n 
A 1 110 GLY 110 113 113 GLY GLY A . n 
A 1 111 ALA 111 114 114 ALA ALA A . n 
A 1 112 ASP 112 115 115 ASP ASP A . n 
A 1 113 GLY 113 116 116 GLY GLY A . n 
A 1 114 ILE 114 117 117 ILE ILE A . n 
A 1 115 MET 115 118 118 MET MET A . n 
A 1 116 ILE 116 119 119 ILE ILE A . n 
A 1 117 GLY 117 120 120 GLY GLY A . n 
A 1 118 THR 118 121 121 THR THR A . n 
A 1 119 GLY 119 122 122 GLY GLY A . n 
A 1 120 LEU 120 123 123 LEU LEU A . n 
A 1 121 VAL 121 124 124 VAL VAL A . n 
A 1 122 GLY 122 125 125 GLY GLY A . n 
A 1 123 ALA 123 126 126 ALA ALA A . n 
A 1 124 LEU 124 127 127 LEU LEU A . n 
A 1 125 THR 125 128 128 THR THR A . n 
A 1 126 LYS 126 129 129 LYS LYS A . n 
A 1 127 VAL 127 130 130 VAL VAL A . n 
A 1 128 TYR 128 131 131 TYR TYR A . n 
A 1 129 SER 129 132 132 SER SER A . n 
A 1 130 TYR 130 133 133 TYR TYR A . n 
A 1 131 ARG 131 134 134 ARG ARG A . n 
A 1 132 PHE 132 135 135 PHE PHE A . n 
A 1 133 VAL 133 136 136 VAL VAL A . n 
A 1 134 TRP 134 137 137 TRP TRP A . n 
A 1 135 TRP 135 138 138 TRP TRP A . n 
A 1 136 ALA 136 139 139 ALA ALA A . n 
A 1 137 ILE 137 140 140 ILE ILE A . n 
A 1 138 SER 138 141 141 SER SER A . n 
A 1 139 THR 139 142 142 THR THR A . n 
A 1 140 ALA 140 143 143 ALA ALA A . n 
A 1 141 ALA 141 144 144 ALA ALA A . n 
A 1 142 MET 142 145 145 MET MET A . n 
A 1 143 LEU 143 146 146 LEU LEU A . n 
A 1 144 TYR 144 147 147 TYR TYR A . n 
A 1 145 ILE 145 148 148 ILE ILE A . n 
A 1 146 LEU 146 149 149 LEU LEU A . n 
A 1 147 TYR 147 150 150 TYR TYR A . n 
A 1 148 VAL 148 151 151 VAL VAL A . n 
A 1 149 LEU 149 152 152 LEU LEU A . n 
A 1 150 PHE 150 153 153 PHE PHE A . n 
A 1 151 PHE 151 154 154 PHE PHE A . n 
A 1 152 GLY 152 155 155 GLY GLY A . n 
A 1 153 PHE 153 156 156 PHE PHE A . n 
A 1 154 THR 154 157 157 THR THR A . n 
A 1 155 SER 155 158 158 SER SER A . n 
A 1 156 LYS 156 159 159 LYS LYS A . n 
A 1 157 ALA 157 160 160 ALA ALA A . n 
A 1 158 GLU 158 161 161 GLU GLU A . n 
A 1 159 SER 159 162 162 SER SER A . n 
A 1 160 MET 160 163 163 MET MET A . n 
A 1 161 ARG 161 164 164 ARG ARG A . n 
A 1 162 PRO 162 165 165 PRO PRO A . n 
A 1 163 GLU 163 166 166 GLU GLU A . n 
A 1 164 VAL 164 167 167 VAL VAL A . n 
A 1 165 ALA 165 168 168 ALA ALA A . n 
A 1 166 SER 166 169 169 SER SER A . n 
A 1 167 THR 167 170 170 THR THR A . n 
A 1 168 PHE 168 171 171 PHE PHE A . n 
A 1 169 LYS 169 172 172 LYS LYS A . n 
A 1 170 VAL 170 173 173 VAL VAL A . n 
A 1 171 LEU 171 174 174 LEU LEU A . n 
A 1 172 ARG 172 175 175 ARG ARG A . n 
A 1 173 ASN 173 176 176 ASN ASN A . n 
A 1 174 VAL 174 177 177 VAL VAL A . n 
A 1 175 THR 175 178 178 THR THR A . n 
A 1 176 VAL 176 179 179 VAL VAL A . n 
A 1 177 VAL 177 180 180 VAL VAL A . n 
A 1 178 LEU 178 181 181 LEU LEU A . n 
A 1 179 TRP 179 182 182 TRP TRP A . n 
A 1 180 SER 180 183 183 SER SER A . n 
A 1 181 ALA 181 184 184 ALA ALA A . n 
A 1 182 TYR 182 185 185 TYR TYR A . n 
A 1 183 PRO 183 186 186 PRO PRO A . n 
A 1 184 VAL 184 187 187 VAL VAL A . n 
A 1 185 VAL 185 188 188 VAL VAL A . n 
A 1 186 TRP 186 189 189 TRP TRP A . n 
A 1 187 LEU 187 190 190 LEU LEU A . n 
A 1 188 ILE 188 191 191 ILE ILE A . n 
A 1 189 GLY 189 192 192 GLY GLY A . n 
A 1 190 SER 190 193 193 SER SER A . n 
A 1 191 GLU 191 194 194 GLU GLU A . n 
A 1 192 GLY 192 195 195 GLY GLY A . n 
A 1 193 ALA 193 196 196 ALA ALA A . n 
A 1 194 GLY 194 197 197 GLY GLY A . n 
A 1 195 ILE 195 198 198 ILE ILE A . n 
A 1 196 VAL 196 199 199 VAL VAL A . n 
A 1 197 PRO 197 200 200 PRO PRO A . n 
A 1 198 LEU 198 201 201 LEU LEU A . n 
A 1 199 ASN 199 202 202 ASN ASN A . n 
A 1 200 ILE 200 203 203 ILE ILE A . n 
A 1 201 GLU 201 204 204 GLU GLU A . n 
A 1 202 THR 202 205 205 THR THR A . n 
A 1 203 LEU 203 206 206 LEU LEU A . n 
A 1 204 LEU 204 207 207 LEU LEU A . n 
A 1 205 PHE 205 208 208 PHE PHE A . n 
A 1 206 MET 206 209 209 MET MET A . n 
A 1 207 VAL 207 210 210 VAL VAL A . n 
A 1 208 LEU 208 211 211 LEU LEU A . n 
A 1 209 ASP 209 212 212 ASP ASP A . n 
A 1 210 VAL 210 213 213 VAL VAL A . n 
A 1 211 SER 211 214 214 SER SER A . n 
A 1 212 ALA 212 215 215 ALA ALA A . n 
A 1 213 LYS 213 216 216 LYS LYR A . n 
A 1 214 VAL 214 217 217 VAL VAL A . n 
A 1 215 GLY 215 218 218 GLY GLY A . n 
A 1 216 PHE 216 219 219 PHE PHE A . n 
A 1 217 GLY 217 220 220 GLY GLY A . n 
A 1 218 LEU 218 221 221 LEU LEU A . n 
A 1 219 ILE 219 222 222 ILE ILE A . n 
A 1 220 LEU 220 223 223 LEU LEU A . n 
A 1 221 LEU 221 224 224 LEU LEU A . n 
A 1 222 ARG 222 225 225 ARG ARG A . n 
A 1 223 SER 223 226 226 SER SER A . n 
A 1 224 ARG 224 227 227 ARG ARG A . n 
A 1 225 ALA 225 228 228 ALA ALA A . n 
A 1 226 ILE 226 229 229 ILE ILE A . n 
A 1 227 PHE 227 230 230 PHE PHE A . n 
A 1 228 GLY 228 231 231 GLY GLY A . n 
A 1 229 GLU 229 232 232 GLU GLU A . n 
A 1 230 ALA 230 233 233 ALA ALA A . n 
A 1 231 GLU 231 234 234 GLU GLU A . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        RET 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   RET 
_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 LI1 1  301 303 LI1 LI1 A . 
C 2 LI1 1  302 305 LI1 LI1 A . 
D 2 LI1 1  303 306 LI1 LI1 A . 
E 2 LI1 1  304 307 LI1 LI1 A . 
F 2 LI1 1  305 308 LI1 LI1 A . 
G 3 OLC 1  306 309 OLC OLC A . 
H 3 OLC 1  307 310 OLC OLC A . 
I 3 OLC 1  308 312 OLC OLC A . 
J 3 OLC 1  309 313 OLC OLC A . 
K 3 OLC 1  310 314 OLC OLC A . 
L 2 LI1 1  311 316 LI1 LI1 A . 
M 2 LI1 1  312 317 LI1 LI1 A . 
N 2 LI1 1  313 319 LI1 LI1 A . 
O 2 LI1 1  314 320 LI1 LI1 A . 
P 2 LI1 1  315 321 LI1 LI1 A . 
Q 2 LI1 1  316 322 LI1 LI1 A . 
R 4 RET 1  317 216 RET LYR A . 
S 5 HOH 1  401 488 HOH HOH A . 
S 5 HOH 2  402 481 HOH HOH A . 
S 5 HOH 3  403 402 HOH HOH A . 
S 5 HOH 4  404 497 HOH HOH A . 
S 5 HOH 5  405 479 HOH HOH A . 
S 5 HOH 6  406 425 HOH HOH A . 
S 5 HOH 7  407 420 HOH HOH A . 
S 5 HOH 8  408 403 HOH HOH A . 
S 5 HOH 9  409 455 HOH HOH A . 
S 5 HOH 10 410 499 HOH HOH A . 
S 5 HOH 11 411 477 HOH HOH A . 
S 5 HOH 12 412 414 HOH HOH A . 
S 5 HOH 13 413 400 HOH HOH A . 
S 5 HOH 14 414 496 HOH HOH A . 
S 5 HOH 15 415 476 HOH HOH A . 
S 5 HOH 16 416 416 HOH HOH A . 
S 5 HOH 17 417 421 HOH HOH A . 
S 5 HOH 18 418 478 HOH HOH A . 
S 5 HOH 19 419 417 HOH HOH A . 
S 5 HOH 20 420 415 HOH HOH A . 
S 5 HOH 21 421 406 HOH HOH A . 
S 5 HOH 22 422 408 HOH HOH A . 
S 5 HOH 23 423 418 HOH HOH A . 
S 5 HOH 24 424 422 HOH HOH A . 
S 5 HOH 25 425 401 HOH HOH A . 
S 5 HOH 26 426 498 HOH HOH A . 
S 5 HOH 27 427 500 HOH HOH A . 
S 5 HOH 28 428 475 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 N 1 A LI1 301 ? C1  ? B LI1 1 C1  
2   1 N 1 A LI1 301 ? C2  ? B LI1 1 C2  
3   1 N 1 A LI1 301 ? C3  ? B LI1 1 C3  
4   1 N 1 A LI1 301 ? O1  ? B LI1 1 O1  
5   1 N 1 A LI1 301 ? O2  ? B LI1 1 O2  
6   1 N 1 A LI1 301 ? O3  ? B LI1 1 O3  
7   1 N 1 A LI1 301 ? C41 ? B LI1 1 C41 
8   1 N 1 A LI1 301 ? C42 ? B LI1 1 C42 
9   1 N 1 A LI1 301 ? C43 ? B LI1 1 C43 
10  1 N 1 A LI1 301 ? C44 ? B LI1 1 C44 
11  1 N 1 A LI1 301 ? C45 ? B LI1 1 C45 
12  1 N 1 A LI1 301 ? C11 ? B LI1 1 C11 
13  1 N 1 A LI1 301 ? C12 ? B LI1 1 C12 
14  1 N 1 A LI1 301 ? C13 ? B LI1 1 C13 
15  1 N 1 A LI1 301 ? C14 ? B LI1 1 C14 
16  1 N 1 A LI1 301 ? C15 ? B LI1 1 C15 
17  1 N 1 A LI1 301 ? C16 ? B LI1 1 C16 
18  1 N 1 A LI1 301 ? C17 ? B LI1 1 C17 
19  1 N 1 A LI1 301 ? C18 ? B LI1 1 C18 
20  1 N 1 A LI1 301 ? C19 ? B LI1 1 C19 
21  1 N 1 A LI1 301 ? C20 ? B LI1 1 C20 
22  1 N 1 A LI1 301 ? C21 ? B LI1 1 C21 
23  1 N 1 A LI1 301 ? C22 ? B LI1 1 C22 
24  1 N 1 A LI1 301 ? C23 ? B LI1 1 C23 
25  1 N 1 A LI1 301 ? C24 ? B LI1 1 C24 
26  1 N 1 A LI1 301 ? C25 ? B LI1 1 C25 
27  1 N 1 A LI1 301 ? C26 ? B LI1 1 C26 
28  1 N 1 A LI1 301 ? C27 ? B LI1 1 C27 
29  1 N 1 A LI1 301 ? C28 ? B LI1 1 C28 
30  1 N 1 A LI1 301 ? C29 ? B LI1 1 C29 
31  1 N 1 A LI1 301 ? C30 ? B LI1 1 C30 
32  1 N 1 A LI1 302 ? C1  ? C LI1 1 C1  
33  1 N 1 A LI1 302 ? C2  ? C LI1 1 C2  
34  1 N 1 A LI1 302 ? C3  ? C LI1 1 C3  
35  1 N 1 A LI1 302 ? O1  ? C LI1 1 O1  
36  1 N 1 A LI1 302 ? O2  ? C LI1 1 O2  
37  1 N 1 A LI1 302 ? O3  ? C LI1 1 O3  
38  1 N 1 A LI1 302 ? C41 ? C LI1 1 C41 
39  1 N 1 A LI1 302 ? C42 ? C LI1 1 C42 
40  1 N 1 A LI1 302 ? C43 ? C LI1 1 C43 
41  1 N 1 A LI1 302 ? C44 ? C LI1 1 C44 
42  1 N 1 A LI1 302 ? C45 ? C LI1 1 C45 
43  1 N 1 A LI1 302 ? C46 ? C LI1 1 C46 
44  1 N 1 A LI1 302 ? C47 ? C LI1 1 C47 
45  1 N 1 A LI1 302 ? C48 ? C LI1 1 C48 
46  1 N 1 A LI1 302 ? C49 ? C LI1 1 C49 
47  1 N 1 A LI1 302 ? C59 ? C LI1 1 C59 
48  1 N 1 A LI1 302 ? C60 ? C LI1 1 C60 
49  1 N 1 A LI1 302 ? C11 ? C LI1 1 C11 
50  1 N 1 A LI1 302 ? C12 ? C LI1 1 C12 
51  1 N 1 A LI1 302 ? C13 ? C LI1 1 C13 
52  1 N 1 A LI1 302 ? C14 ? C LI1 1 C14 
53  1 N 1 A LI1 302 ? C15 ? C LI1 1 C15 
54  1 N 1 A LI1 302 ? C16 ? C LI1 1 C16 
55  1 N 1 A LI1 302 ? C17 ? C LI1 1 C17 
56  1 N 1 A LI1 302 ? C18 ? C LI1 1 C18 
57  1 N 1 A LI1 302 ? C19 ? C LI1 1 C19 
58  1 N 1 A LI1 302 ? C20 ? C LI1 1 C20 
59  1 N 1 A LI1 302 ? C21 ? C LI1 1 C21 
60  1 N 1 A LI1 302 ? C22 ? C LI1 1 C22 
61  1 N 1 A LI1 302 ? C23 ? C LI1 1 C23 
62  1 N 1 A LI1 302 ? C24 ? C LI1 1 C24 
63  1 N 1 A LI1 302 ? C25 ? C LI1 1 C25 
64  1 N 1 A LI1 302 ? C26 ? C LI1 1 C26 
65  1 N 1 A LI1 302 ? C27 ? C LI1 1 C27 
66  1 N 1 A LI1 302 ? C28 ? C LI1 1 C28 
67  1 N 1 A LI1 302 ? C29 ? C LI1 1 C29 
68  1 N 1 A LI1 302 ? C30 ? C LI1 1 C30 
69  1 N 1 A LI1 303 ? C1  ? D LI1 1 C1  
70  1 N 1 A LI1 303 ? C2  ? D LI1 1 C2  
71  1 N 1 A LI1 303 ? C3  ? D LI1 1 C3  
72  1 N 1 A LI1 303 ? O1  ? D LI1 1 O1  
73  1 N 1 A LI1 303 ? O2  ? D LI1 1 O2  
74  1 N 1 A LI1 303 ? O3  ? D LI1 1 O3  
75  1 N 1 A LI1 303 ? C41 ? D LI1 1 C41 
76  1 N 1 A LI1 303 ? C42 ? D LI1 1 C42 
77  1 N 1 A LI1 303 ? C43 ? D LI1 1 C43 
78  1 N 1 A LI1 303 ? C44 ? D LI1 1 C44 
79  1 N 1 A LI1 303 ? C49 ? D LI1 1 C49 
80  1 N 1 A LI1 303 ? C59 ? D LI1 1 C59 
81  1 N 1 A LI1 303 ? C60 ? D LI1 1 C60 
82  1 N 1 A LI1 303 ? C11 ? D LI1 1 C11 
83  1 N 1 A LI1 303 ? C12 ? D LI1 1 C12 
84  1 N 1 A LI1 303 ? C13 ? D LI1 1 C13 
85  1 N 1 A LI1 303 ? C14 ? D LI1 1 C14 
86  1 N 1 A LI1 303 ? C15 ? D LI1 1 C15 
87  1 N 1 A LI1 303 ? C16 ? D LI1 1 C16 
88  1 N 1 A LI1 303 ? C17 ? D LI1 1 C17 
89  1 N 1 A LI1 303 ? C18 ? D LI1 1 C18 
90  1 N 1 A LI1 303 ? C19 ? D LI1 1 C19 
91  1 N 1 A LI1 303 ? C20 ? D LI1 1 C20 
92  1 N 1 A LI1 303 ? C21 ? D LI1 1 C21 
93  1 N 1 A LI1 303 ? C22 ? D LI1 1 C22 
94  1 N 1 A LI1 303 ? C23 ? D LI1 1 C23 
95  1 N 1 A LI1 303 ? C24 ? D LI1 1 C24 
96  1 N 1 A LI1 303 ? C25 ? D LI1 1 C25 
97  1 N 1 A LI1 303 ? C26 ? D LI1 1 C26 
98  1 N 1 A LI1 303 ? C27 ? D LI1 1 C27 
99  1 N 1 A LI1 303 ? C28 ? D LI1 1 C28 
100 1 N 1 A LI1 303 ? C29 ? D LI1 1 C29 
101 1 N 1 A LI1 303 ? C30 ? D LI1 1 C30 
102 1 N 1 A LI1 304 ? C1  ? E LI1 1 C1  
103 1 N 1 A LI1 304 ? C2  ? E LI1 1 C2  
104 1 N 1 A LI1 304 ? C3  ? E LI1 1 C3  
105 1 N 1 A LI1 304 ? O1  ? E LI1 1 O1  
106 1 N 1 A LI1 304 ? O2  ? E LI1 1 O2  
107 1 N 1 A LI1 304 ? O3  ? E LI1 1 O3  
108 1 N 1 A LI1 304 ? C41 ? E LI1 1 C41 
109 1 N 1 A LI1 304 ? C42 ? E LI1 1 C42 
110 1 N 1 A LI1 304 ? C43 ? E LI1 1 C43 
111 1 N 1 A LI1 304 ? C44 ? E LI1 1 C44 
112 1 N 1 A LI1 304 ? C49 ? E LI1 1 C49 
113 1 N 1 A LI1 304 ? C60 ? E LI1 1 C60 
114 1 N 1 A LI1 304 ? C11 ? E LI1 1 C11 
115 1 N 1 A LI1 304 ? C12 ? E LI1 1 C12 
116 1 N 1 A LI1 304 ? C13 ? E LI1 1 C13 
117 1 N 1 A LI1 304 ? C14 ? E LI1 1 C14 
118 1 N 1 A LI1 304 ? C15 ? E LI1 1 C15 
119 1 N 1 A LI1 304 ? C16 ? E LI1 1 C16 
120 1 N 1 A LI1 304 ? C17 ? E LI1 1 C17 
121 1 N 1 A LI1 304 ? C18 ? E LI1 1 C18 
122 1 N 1 A LI1 304 ? C19 ? E LI1 1 C19 
123 1 N 1 A LI1 304 ? C20 ? E LI1 1 C20 
124 1 N 1 A LI1 304 ? C21 ? E LI1 1 C21 
125 1 N 1 A LI1 304 ? C22 ? E LI1 1 C22 
126 1 N 1 A LI1 304 ? C23 ? E LI1 1 C23 
127 1 N 1 A LI1 304 ? C24 ? E LI1 1 C24 
128 1 N 1 A LI1 304 ? C25 ? E LI1 1 C25 
129 1 N 1 A LI1 304 ? C26 ? E LI1 1 C26 
130 1 N 1 A LI1 304 ? C27 ? E LI1 1 C27 
131 1 N 1 A LI1 304 ? C28 ? E LI1 1 C28 
132 1 N 1 A LI1 304 ? C29 ? E LI1 1 C29 
133 1 N 1 A LI1 304 ? C30 ? E LI1 1 C30 
134 1 N 1 A LI1 305 ? C1  ? F LI1 1 C1  
135 1 N 1 A LI1 305 ? C2  ? F LI1 1 C2  
136 1 N 1 A LI1 305 ? C3  ? F LI1 1 C3  
137 1 N 1 A LI1 305 ? O1  ? F LI1 1 O1  
138 1 N 1 A LI1 305 ? O2  ? F LI1 1 O2  
139 1 N 1 A LI1 305 ? O3  ? F LI1 1 O3  
140 1 N 1 A LI1 305 ? C41 ? F LI1 1 C41 
141 1 N 1 A LI1 305 ? C42 ? F LI1 1 C42 
142 1 N 1 A LI1 305 ? C43 ? F LI1 1 C43 
143 1 N 1 A LI1 305 ? C44 ? F LI1 1 C44 
144 1 N 1 A LI1 305 ? C45 ? F LI1 1 C45 
145 1 N 1 A LI1 305 ? C49 ? F LI1 1 C49 
146 1 N 1 A LI1 305 ? C11 ? F LI1 1 C11 
147 1 N 1 A LI1 305 ? C12 ? F LI1 1 C12 
148 1 N 1 A LI1 305 ? C13 ? F LI1 1 C13 
149 1 N 1 A LI1 305 ? C14 ? F LI1 1 C14 
150 1 N 1 A LI1 305 ? C15 ? F LI1 1 C15 
151 1 N 1 A LI1 305 ? C16 ? F LI1 1 C16 
152 1 N 1 A LI1 305 ? C17 ? F LI1 1 C17 
153 1 N 1 A LI1 305 ? C18 ? F LI1 1 C18 
154 1 N 1 A LI1 305 ? C19 ? F LI1 1 C19 
155 1 N 1 A LI1 305 ? C20 ? F LI1 1 C20 
156 1 N 1 A LI1 305 ? C21 ? F LI1 1 C21 
157 1 N 1 A LI1 305 ? C22 ? F LI1 1 C22 
158 1 N 1 A LI1 305 ? C23 ? F LI1 1 C23 
159 1 N 1 A LI1 305 ? C24 ? F LI1 1 C24 
160 1 N 1 A LI1 305 ? C25 ? F LI1 1 C25 
161 1 N 1 A LI1 305 ? C26 ? F LI1 1 C26 
162 1 N 1 A LI1 305 ? C27 ? F LI1 1 C27 
163 1 N 1 A LI1 305 ? C28 ? F LI1 1 C28 
164 1 N 1 A LI1 305 ? C29 ? F LI1 1 C29 
165 1 N 1 A LI1 305 ? C30 ? F LI1 1 C30 
166 1 N 1 A LI1 311 ? C1  ? L LI1 1 C1  
167 1 N 1 A LI1 311 ? C2  ? L LI1 1 C2  
168 1 N 1 A LI1 311 ? C3  ? L LI1 1 C3  
169 1 N 1 A LI1 311 ? O1  ? L LI1 1 O1  
170 1 N 1 A LI1 311 ? O2  ? L LI1 1 O2  
171 1 N 1 A LI1 311 ? O3  ? L LI1 1 O3  
172 1 N 1 A LI1 311 ? C41 ? L LI1 1 C41 
173 1 N 1 A LI1 311 ? C42 ? L LI1 1 C42 
174 1 N 1 A LI1 311 ? C43 ? L LI1 1 C43 
175 1 N 1 A LI1 311 ? C44 ? L LI1 1 C44 
176 1 N 1 A LI1 311 ? C49 ? L LI1 1 C49 
177 1 N 1 A LI1 311 ? C57 ? L LI1 1 C57 
178 1 N 1 A LI1 311 ? C58 ? L LI1 1 C58 
179 1 N 1 A LI1 311 ? C59 ? L LI1 1 C59 
180 1 N 1 A LI1 311 ? C60 ? L LI1 1 C60 
181 1 N 1 A LI1 311 ? C11 ? L LI1 1 C11 
182 1 N 1 A LI1 311 ? C12 ? L LI1 1 C12 
183 1 N 1 A LI1 311 ? C13 ? L LI1 1 C13 
184 1 N 1 A LI1 311 ? C14 ? L LI1 1 C14 
185 1 N 1 A LI1 311 ? C15 ? L LI1 1 C15 
186 1 N 1 A LI1 311 ? C16 ? L LI1 1 C16 
187 1 N 1 A LI1 311 ? C17 ? L LI1 1 C17 
188 1 N 1 A LI1 311 ? C18 ? L LI1 1 C18 
189 1 N 1 A LI1 311 ? C19 ? L LI1 1 C19 
190 1 N 1 A LI1 311 ? C20 ? L LI1 1 C20 
191 1 N 1 A LI1 311 ? C21 ? L LI1 1 C21 
192 1 N 1 A LI1 311 ? C22 ? L LI1 1 C22 
193 1 N 1 A LI1 311 ? C23 ? L LI1 1 C23 
194 1 N 1 A LI1 311 ? C24 ? L LI1 1 C24 
195 1 N 1 A LI1 311 ? C25 ? L LI1 1 C25 
196 1 N 1 A LI1 311 ? C26 ? L LI1 1 C26 
197 1 N 1 A LI1 311 ? C27 ? L LI1 1 C27 
198 1 N 1 A LI1 311 ? C28 ? L LI1 1 C28 
199 1 N 1 A LI1 311 ? C29 ? L LI1 1 C29 
200 1 N 1 A LI1 311 ? C30 ? L LI1 1 C30 
201 1 N 1 A LI1 312 ? C1  ? M LI1 1 C1  
202 1 N 1 A LI1 312 ? C2  ? M LI1 1 C2  
203 1 N 1 A LI1 312 ? C3  ? M LI1 1 C3  
204 1 N 1 A LI1 312 ? O1  ? M LI1 1 O1  
205 1 N 1 A LI1 312 ? O2  ? M LI1 1 O2  
206 1 N 1 A LI1 312 ? O3  ? M LI1 1 O3  
207 1 N 1 A LI1 312 ? C41 ? M LI1 1 C41 
208 1 N 1 A LI1 312 ? C42 ? M LI1 1 C42 
209 1 N 1 A LI1 312 ? C43 ? M LI1 1 C43 
210 1 N 1 A LI1 312 ? C44 ? M LI1 1 C44 
211 1 N 1 A LI1 312 ? C49 ? M LI1 1 C49 
212 1 N 1 A LI1 312 ? C60 ? M LI1 1 C60 
213 1 N 1 A LI1 312 ? C11 ? M LI1 1 C11 
214 1 N 1 A LI1 312 ? C12 ? M LI1 1 C12 
215 1 N 1 A LI1 312 ? C13 ? M LI1 1 C13 
216 1 N 1 A LI1 312 ? C14 ? M LI1 1 C14 
217 1 N 1 A LI1 312 ? C15 ? M LI1 1 C15 
218 1 N 1 A LI1 312 ? C16 ? M LI1 1 C16 
219 1 N 1 A LI1 312 ? C17 ? M LI1 1 C17 
220 1 N 1 A LI1 312 ? C18 ? M LI1 1 C18 
221 1 N 1 A LI1 312 ? C19 ? M LI1 1 C19 
222 1 N 1 A LI1 312 ? C20 ? M LI1 1 C20 
223 1 N 1 A LI1 312 ? C21 ? M LI1 1 C21 
224 1 N 1 A LI1 312 ? C22 ? M LI1 1 C22 
225 1 N 1 A LI1 312 ? C23 ? M LI1 1 C23 
226 1 N 1 A LI1 312 ? C24 ? M LI1 1 C24 
227 1 N 1 A LI1 312 ? C25 ? M LI1 1 C25 
228 1 N 1 A LI1 312 ? C26 ? M LI1 1 C26 
229 1 N 1 A LI1 312 ? C27 ? M LI1 1 C27 
230 1 N 1 A LI1 312 ? C28 ? M LI1 1 C28 
231 1 N 1 A LI1 312 ? C29 ? M LI1 1 C29 
232 1 N 1 A LI1 312 ? C30 ? M LI1 1 C30 
233 1 N 1 A LI1 313 ? C1  ? N LI1 1 C1  
234 1 N 1 A LI1 313 ? C2  ? N LI1 1 C2  
235 1 N 1 A LI1 313 ? C3  ? N LI1 1 C3  
236 1 N 1 A LI1 313 ? O1  ? N LI1 1 O1  
237 1 N 1 A LI1 313 ? O2  ? N LI1 1 O2  
238 1 N 1 A LI1 313 ? O3  ? N LI1 1 O3  
239 1 N 1 A LI1 313 ? C41 ? N LI1 1 C41 
240 1 N 1 A LI1 313 ? C42 ? N LI1 1 C42 
241 1 N 1 A LI1 313 ? C43 ? N LI1 1 C43 
242 1 N 1 A LI1 313 ? C44 ? N LI1 1 C44 
243 1 N 1 A LI1 313 ? C45 ? N LI1 1 C45 
244 1 N 1 A LI1 313 ? C49 ? N LI1 1 C49 
245 1 N 1 A LI1 313 ? C11 ? N LI1 1 C11 
246 1 N 1 A LI1 313 ? C12 ? N LI1 1 C12 
247 1 N 1 A LI1 313 ? C13 ? N LI1 1 C13 
248 1 N 1 A LI1 313 ? C14 ? N LI1 1 C14 
249 1 N 1 A LI1 313 ? C15 ? N LI1 1 C15 
250 1 N 1 A LI1 313 ? C16 ? N LI1 1 C16 
251 1 N 1 A LI1 313 ? C17 ? N LI1 1 C17 
252 1 N 1 A LI1 313 ? C18 ? N LI1 1 C18 
253 1 N 1 A LI1 313 ? C19 ? N LI1 1 C19 
254 1 N 1 A LI1 313 ? C20 ? N LI1 1 C20 
255 1 N 1 A LI1 313 ? C21 ? N LI1 1 C21 
256 1 N 1 A LI1 313 ? C22 ? N LI1 1 C22 
257 1 N 1 A LI1 313 ? C23 ? N LI1 1 C23 
258 1 N 1 A LI1 313 ? C24 ? N LI1 1 C24 
259 1 N 1 A LI1 313 ? C25 ? N LI1 1 C25 
260 1 N 1 A LI1 313 ? C26 ? N LI1 1 C26 
261 1 N 1 A LI1 313 ? C27 ? N LI1 1 C27 
262 1 N 1 A LI1 313 ? C28 ? N LI1 1 C28 
263 1 N 1 A LI1 313 ? C29 ? N LI1 1 C29 
264 1 N 1 A LI1 313 ? C30 ? N LI1 1 C30 
265 1 N 1 A LI1 314 ? C1  ? O LI1 1 C1  
266 1 N 1 A LI1 314 ? C2  ? O LI1 1 C2  
267 1 N 1 A LI1 314 ? C3  ? O LI1 1 C3  
268 1 N 1 A LI1 314 ? O1  ? O LI1 1 O1  
269 1 N 1 A LI1 314 ? O2  ? O LI1 1 O2  
270 1 N 1 A LI1 314 ? O3  ? O LI1 1 O3  
271 1 N 1 A LI1 314 ? C41 ? O LI1 1 C41 
272 1 N 1 A LI1 314 ? C42 ? O LI1 1 C42 
273 1 N 1 A LI1 314 ? C43 ? O LI1 1 C43 
274 1 N 1 A LI1 314 ? C44 ? O LI1 1 C44 
275 1 N 1 A LI1 314 ? C49 ? O LI1 1 C49 
276 1 N 1 A LI1 314 ? C60 ? O LI1 1 C60 
277 1 N 1 A LI1 314 ? C11 ? O LI1 1 C11 
278 1 N 1 A LI1 314 ? C12 ? O LI1 1 C12 
279 1 N 1 A LI1 314 ? C13 ? O LI1 1 C13 
280 1 N 1 A LI1 314 ? C14 ? O LI1 1 C14 
281 1 N 1 A LI1 314 ? C15 ? O LI1 1 C15 
282 1 N 1 A LI1 314 ? C16 ? O LI1 1 C16 
283 1 N 1 A LI1 314 ? C17 ? O LI1 1 C17 
284 1 N 1 A LI1 314 ? C18 ? O LI1 1 C18 
285 1 N 1 A LI1 314 ? C19 ? O LI1 1 C19 
286 1 N 1 A LI1 314 ? C20 ? O LI1 1 C20 
287 1 N 1 A LI1 314 ? C21 ? O LI1 1 C21 
288 1 N 1 A LI1 314 ? C22 ? O LI1 1 C22 
289 1 N 1 A LI1 314 ? C23 ? O LI1 1 C23 
290 1 N 1 A LI1 314 ? C24 ? O LI1 1 C24 
291 1 N 1 A LI1 314 ? C25 ? O LI1 1 C25 
292 1 N 1 A LI1 314 ? C26 ? O LI1 1 C26 
293 1 N 1 A LI1 314 ? C27 ? O LI1 1 C27 
294 1 N 1 A LI1 314 ? C28 ? O LI1 1 C28 
295 1 N 1 A LI1 314 ? C29 ? O LI1 1 C29 
296 1 N 1 A LI1 314 ? C30 ? O LI1 1 C30 
297 1 N 1 A LI1 315 ? C1  ? P LI1 1 C1  
298 1 N 1 A LI1 315 ? C2  ? P LI1 1 C2  
299 1 N 1 A LI1 315 ? C3  ? P LI1 1 C3  
300 1 N 1 A LI1 315 ? O1  ? P LI1 1 O1  
301 1 N 1 A LI1 315 ? O2  ? P LI1 1 O2  
302 1 N 1 A LI1 315 ? O3  ? P LI1 1 O3  
303 1 N 1 A LI1 315 ? C41 ? P LI1 1 C41 
304 1 N 1 A LI1 315 ? C42 ? P LI1 1 C42 
305 1 N 1 A LI1 315 ? C43 ? P LI1 1 C43 
306 1 N 1 A LI1 315 ? C44 ? P LI1 1 C44 
307 1 N 1 A LI1 315 ? C45 ? P LI1 1 C45 
308 1 N 1 A LI1 315 ? C46 ? P LI1 1 C46 
309 1 N 1 A LI1 315 ? C47 ? P LI1 1 C47 
310 1 N 1 A LI1 315 ? C48 ? P LI1 1 C48 
311 1 N 1 A LI1 315 ? C49 ? P LI1 1 C49 
312 1 N 1 A LI1 315 ? C50 ? P LI1 1 C50 
313 1 N 1 A LI1 315 ? C51 ? P LI1 1 C51 
314 1 N 1 A LI1 315 ? C59 ? P LI1 1 C59 
315 1 N 1 A LI1 315 ? C60 ? P LI1 1 C60 
316 1 N 1 A LI1 315 ? C11 ? P LI1 1 C11 
317 1 N 1 A LI1 315 ? C12 ? P LI1 1 C12 
318 1 N 1 A LI1 315 ? C13 ? P LI1 1 C13 
319 1 N 1 A LI1 315 ? C14 ? P LI1 1 C14 
320 1 N 1 A LI1 315 ? C15 ? P LI1 1 C15 
321 1 N 1 A LI1 315 ? C16 ? P LI1 1 C16 
322 1 N 1 A LI1 315 ? C17 ? P LI1 1 C17 
323 1 N 1 A LI1 315 ? C18 ? P LI1 1 C18 
324 1 N 1 A LI1 315 ? C19 ? P LI1 1 C19 
325 1 N 1 A LI1 315 ? C20 ? P LI1 1 C20 
326 1 N 1 A LI1 315 ? C21 ? P LI1 1 C21 
327 1 N 1 A LI1 315 ? C22 ? P LI1 1 C22 
328 1 N 1 A LI1 315 ? C23 ? P LI1 1 C23 
329 1 N 1 A LI1 315 ? C24 ? P LI1 1 C24 
330 1 N 1 A LI1 315 ? C25 ? P LI1 1 C25 
331 1 N 1 A LI1 315 ? C26 ? P LI1 1 C26 
332 1 N 1 A LI1 315 ? C27 ? P LI1 1 C27 
333 1 N 1 A LI1 315 ? C28 ? P LI1 1 C28 
334 1 N 1 A LI1 315 ? C29 ? P LI1 1 C29 
335 1 N 1 A LI1 315 ? C30 ? P LI1 1 C30 
336 1 N 1 A LI1 316 ? C1  ? Q LI1 1 C1  
337 1 N 1 A LI1 316 ? C2  ? Q LI1 1 C2  
338 1 N 1 A LI1 316 ? C3  ? Q LI1 1 C3  
339 1 N 1 A LI1 316 ? O1  ? Q LI1 1 O1  
340 1 N 1 A LI1 316 ? O2  ? Q LI1 1 O2  
341 1 N 1 A LI1 316 ? O3  ? Q LI1 1 O3  
342 1 N 1 A LI1 316 ? C41 ? Q LI1 1 C41 
343 1 N 1 A LI1 316 ? C42 ? Q LI1 1 C42 
344 1 N 1 A LI1 316 ? C43 ? Q LI1 1 C43 
345 1 N 1 A LI1 316 ? C44 ? Q LI1 1 C44 
346 1 N 1 A LI1 316 ? C45 ? Q LI1 1 C45 
347 1 N 1 A LI1 316 ? C49 ? Q LI1 1 C49 
348 1 N 1 A LI1 316 ? C11 ? Q LI1 1 C11 
349 1 N 1 A LI1 316 ? C12 ? Q LI1 1 C12 
350 1 N 1 A LI1 316 ? C13 ? Q LI1 1 C13 
351 1 N 1 A LI1 316 ? C14 ? Q LI1 1 C14 
352 1 N 1 A LI1 316 ? C15 ? Q LI1 1 C15 
353 1 N 1 A LI1 316 ? C16 ? Q LI1 1 C16 
354 1 N 1 A LI1 316 ? C17 ? Q LI1 1 C17 
355 1 N 1 A LI1 316 ? C18 ? Q LI1 1 C18 
356 1 N 1 A LI1 316 ? C19 ? Q LI1 1 C19 
357 1 N 1 A LI1 316 ? C20 ? Q LI1 1 C20 
358 1 N 1 A LI1 316 ? C21 ? Q LI1 1 C21 
359 1 N 1 A LI1 316 ? C22 ? Q LI1 1 C22 
360 1 N 1 A LI1 316 ? C23 ? Q LI1 1 C23 
361 1 N 1 A LI1 316 ? C24 ? Q LI1 1 C24 
362 1 N 1 A LI1 316 ? C25 ? Q LI1 1 C25 
363 1 N 1 A LI1 316 ? C26 ? Q LI1 1 C26 
364 1 N 1 A LI1 316 ? C27 ? Q LI1 1 C27 
365 1 N 1 A LI1 316 ? C28 ? Q LI1 1 C28 
366 1 N 1 A LI1 316 ? C29 ? Q LI1 1 C29 
367 1 N 1 A LI1 316 ? C30 ? Q LI1 1 C30 
# 
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   ? ? ? '(1.20_4459: ???)' 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? CrystFEL ? ? ? 0.9.1              2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? CrystFEL ? ? ? 0.9.1              3 
# 
_cell.angle_alpha                  90.00 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.00 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  120.00 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9F9J 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     62.950 
_cell.length_a_esd                 ? 
_cell.length_b                     62.950 
_cell.length_b_esd                 ? 
_cell.length_c                     111.700 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_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                         9F9J 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                173 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 63' 
_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                   9F9J 
_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             2.50 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          50.85 
_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          'LIPIDIC CUBIC PHASE' 
_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    '0.1M Na/K phosphate pH5.4, 30% PEG 2000' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            293 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     293 
_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                     CCD 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         MPCCD 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2017-07-30 
_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   1.227 
_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                      'FREE ELECTRON LASER' 
_diffrn_source.target                      ? 
_diffrn_source.type                        'SACLA BEAMLINE BL3' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        1.227 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   BL3 
_diffrn_source.pdbx_synchrotron_site       SACLA 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       9F9J 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.65 
_reflns.d_resolution_low                               31.16 
_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                                     29412 
_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                           100 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                425 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          8.2 
_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                                   ? 
_reflns.pdbx_CC_star                                   0.998 
_reflns.pdbx_R_split                                   0.0892 
_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                                    1.65 
_reflns_shell.d_res_low                                     1.70 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           1.14 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             2913 
_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                                  ? 
_reflns_shell.pdbx_CC_star                                  0.633 
_reflns_shell.pdbx_R_split                                  0.907 
_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                               ? 
_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                                 9F9J 
_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                            1.76 
_refine.ls_d_res_low                             16.02 
_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                     22437 
_refine.ls_number_reflns_R_free                  2024 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    90.30 
_refine.ls_percent_reflns_R_free                 9.02 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.2432 
_refine.ls_R_factor_R_free                       0.2820 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.2393 
_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                          0.00 
_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       ML 
_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             1.10 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             0.90 
_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                 42.38 
_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                            0.40 
_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.pdbx_number_atoms_protein        1804 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         253 
_refine_hist.number_atoms_solvent             28 
_refine_hist.number_atoms_total               2085 
_refine_hist.d_res_high                       1.76 
_refine_hist.d_res_low                        16.02 
# 
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' ? 0.003  ? 2148 ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 0.886  ? 2852 ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 16.249 ? 833  ? f_dihedral_angle_d ? ? 
'X-RAY DIFFRACTION' ? 0.042  ? 309  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.019  ? 335  ? f_plane_restr      ? ? 
# 
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' 1.76 1.80  . . 107 1100 69.00 . . . . 0.5890 . . . . . . . . . . . 0.5904 
'X-RAY DIFFRACTION' 1.80 1.85  . . 128 1255 77.00 . . . . 0.5533 . . . . . . . . . . . 0.6050 
'X-RAY DIFFRACTION' 1.85 1.91  . . 123 1286 80.00 . . . . 0.5810 . . . . . . . . . . . 0.6569 
'X-RAY DIFFRACTION' 1.91 1.97  . . 134 1348 84.00 . . . . 0.4819 . . . . . . . . . . . 0.5951 
'X-RAY DIFFRACTION' 1.97 2.04  . . 138 1397 87.00 . . . . 0.4095 . . . . . . . . . . . 0.4525 
'X-RAY DIFFRACTION' 2.04 2.12  . . 144 1456 91.00 . . . . 0.3804 . . . . . . . . . . . 0.4379 
'X-RAY DIFFRACTION' 2.12 2.22  . . 145 1510 93.00 . . . . 0.3347 . . . . . . . . . . . 0.3778 
'X-RAY DIFFRACTION' 2.22 2.33  . . 149 1545 94.00 . . . . 0.3075 . . . . . . . . . . . 0.4059 
'X-RAY DIFFRACTION' 2.33 2.48  . . 157 1526 96.00 . . . . 0.2693 . . . . . . . . . . . 0.3506 
'X-RAY DIFFRACTION' 2.48 2.67  . . 164 1569 97.00 . . . . 0.2541 . . . . . . . . . . . 0.3185 
'X-RAY DIFFRACTION' 2.67 2.93  . . 154 1576 98.00 . . . . 0.2227 . . . . . . . . . . . 0.2533 
'X-RAY DIFFRACTION' 2.94 3.36  . . 156 1601 98.00 . . . . 0.2096 . . . . . . . . . . . 0.2641 
'X-RAY DIFFRACTION' 3.36 4.22  . . 160 1626 99.00 . . . . 0.1927 . . . . . . . . . . . 0.2311 
'X-RAY DIFFRACTION' 4.22 16.02 . . 165 1618 99.00 . . . . 0.2000 . . . . . . . . . . . 0.2252 
# 
_struct.entry_id                     9F9J 
_struct.title                        
'Laser excitation effects on BR: Extrapolated 10ps Light dataset recorded at 1281 GW/cm2 at SACLA (+100ps, 1ns, 10ns)' 
_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        9F9J 
_struct_keywords.text            
'Bacteriorhodospin, Proton transport, Membrane, RETINAL, TIME-RESOLVED CRYSTALLOGRAPHY, SERIAL CRYSTALLOGRAPHY, Laser excitation' 
_struct_keywords.pdbx_keywords   'PROTON TRANSPORT' 
# 
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 2 ? 
D N N 2 ? 
E N N 2 ? 
F N N 2 ? 
G N N 3 ? 
H N N 3 ? 
I N N 3 ? 
J N N 3 ? 
K N N 3 ? 
L N N 2 ? 
M N N 2 ? 
N N N 2 ? 
O N N 2 ? 
P N N 2 ? 
Q N N 2 ? 
R N N 4 ? 
S N N 5 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    BACR_HALSA 
_struct_ref.pdbx_db_accession          P02945 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;TGRPEWIWLALGTALMGLGTLYFLVKGMGVSDPDAKKFYAITTLVPAIAFTMYLSMLLGYGLTMVPFGGEQNPIYWARYA
DWLFTTPLLLLDLALLVDADQGTILALVGADGIMIGTGLVGALTKVYSYRFVWWAISTAAMLYILYVLFFGFTSKAESMR
PEVASTFKVLRNVTVVLWSAYPVVWLIGSEGAGIVPLNIETLLFMVLDVSAKVGFGLILLRSRAIFGEAE
;
_struct_ref.pdbx_align_begin           18 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              9F9J 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 2 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 231 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             P02945 
_struct_ref_seq.db_align_beg                  18 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  247 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       5 
_struct_ref_seq.pdbx_auth_seq_align_end       234 
# 
_struct_ref_seq_dif.align_id                     1 
_struct_ref_seq_dif.pdbx_pdb_id_code             9F9J 
_struct_ref_seq_dif.mon_id                       ALA 
_struct_ref_seq_dif.pdbx_pdb_strand_id           A 
_struct_ref_seq_dif.seq_num                      1 
_struct_ref_seq_dif.pdbx_pdb_ins_code            ? 
_struct_ref_seq_dif.pdbx_seq_db_name             UNP 
_struct_ref_seq_dif.pdbx_seq_db_accession_code   P02945 
_struct_ref_seq_dif.db_mon_id                    ? 
_struct_ref_seq_dif.pdbx_seq_db_seq_num          ? 
_struct_ref_seq_dif.details                      'expression tag' 
_struct_ref_seq_dif.pdbx_auth_seq_num            4 
_struct_ref_seq_dif.pdbx_ordinal                 1 
# 
_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 
# 
loop_
_pdbx_struct_assembly_prop.biol_id 
_pdbx_struct_assembly_prop.type 
_pdbx_struct_assembly_prop.value 
_pdbx_struct_assembly_prop.details 
1 'ABSA (A^2)' 3250  ? 
1 MORE         -47   ? 
1 'SSA (A^2)'  13080 ? 
# 
_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,H,I,J,K,L,M,N,O,P,Q,R,S 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'gel filtration' 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_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 6   ? GLY A 28  ? GLU A 9   GLY A 31  1 ? 23 
HELX_P HELX_P2  AA2 ASP A 33  ? LEU A 59  ? ASP A 36  LEU A 62  1 ? 27 
HELX_P HELX_P3  AA3 TRP A 77  ? ASP A 99  ? TRP A 80  ASP A 102 1 ? 23 
HELX_P HELX_P4  AA4 ASP A 101 ? THR A 125 ? ASP A 104 THR A 128 1 ? 25 
HELX_P HELX_P5  AA5 VAL A 127 ? GLY A 152 ? VAL A 130 GLY A 155 1 ? 26 
HELX_P HELX_P6  AA6 PHE A 153 ? GLU A 158 ? PHE A 156 GLU A 161 1 ? 6  
HELX_P HELX_P7  AA7 ARG A 161 ? SER A 180 ? ARG A 164 SER A 183 1 ? 20 
HELX_P HELX_P8  AA8 ALA A 181 ? GLY A 189 ? ALA A 184 GLY A 192 1 ? 9  
HELX_P HELX_P9  AA9 PRO A 197 ? ARG A 222 ? PRO A 200 ARG A 225 1 ? 26 
HELX_P HELX_P10 AB1 SER A 223 ? PHE A 227 ? SER A 226 PHE A 230 5 ? 5  
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
_struct_conn.id                            covale1 
_struct_conn.conn_type_id                  covale 
_struct_conn.pdbx_leaving_atom_flag        one 
_struct_conn.pdbx_PDB_id                   ? 
_struct_conn.ptnr1_label_asym_id           A 
_struct_conn.ptnr1_label_comp_id           LYS 
_struct_conn.ptnr1_label_seq_id            213 
_struct_conn.ptnr1_label_atom_id           NZ 
_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                1_555 
_struct_conn.ptnr2_label_asym_id           R 
_struct_conn.ptnr2_label_comp_id           RET 
_struct_conn.ptnr2_label_seq_id            . 
_struct_conn.ptnr2_label_atom_id           C15 
_struct_conn.pdbx_ptnr2_label_alt_id       ? 
_struct_conn.pdbx_ptnr2_PDB_ins_code       ? 
_struct_conn.ptnr1_auth_asym_id            A 
_struct_conn.ptnr1_auth_comp_id            LYS 
_struct_conn.ptnr1_auth_seq_id             216 
_struct_conn.ptnr2_auth_asym_id            A 
_struct_conn.ptnr2_auth_comp_id            RET 
_struct_conn.ptnr2_auth_seq_id             317 
_struct_conn.ptnr2_symmetry                1_555 
_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               1.340 
_struct_conn.pdbx_value_order              ? 
_struct_conn.pdbx_role                     ? 
# 
_struct_conn_type.id          covale 
_struct_conn_type.criteria    ? 
_struct_conn_type.reference   ? 
# 
_pdbx_modification_feature.ordinal                            1 
_pdbx_modification_feature.label_comp_id                      RET 
_pdbx_modification_feature.label_asym_id                      R 
_pdbx_modification_feature.label_seq_id                       . 
_pdbx_modification_feature.label_alt_id                       ? 
_pdbx_modification_feature.modified_residue_label_comp_id     LYS 
_pdbx_modification_feature.modified_residue_label_asym_id     A 
_pdbx_modification_feature.modified_residue_label_seq_id      213 
_pdbx_modification_feature.modified_residue_label_alt_id      ? 
_pdbx_modification_feature.auth_comp_id                       RET 
_pdbx_modification_feature.auth_asym_id                       A 
_pdbx_modification_feature.auth_seq_id                        317 
_pdbx_modification_feature.PDB_ins_code                       ? 
_pdbx_modification_feature.symmetry                           1_555 
_pdbx_modification_feature.modified_residue_auth_comp_id      LYS 
_pdbx_modification_feature.modified_residue_auth_asym_id      A 
_pdbx_modification_feature.modified_residue_auth_seq_id       216 
_pdbx_modification_feature.modified_residue_PDB_ins_code      ? 
_pdbx_modification_feature.modified_residue_symmetry          1_555 
_pdbx_modification_feature.comp_id_linking_atom               C15 
_pdbx_modification_feature.modified_residue_id_linking_atom   NZ 
_pdbx_modification_feature.modified_residue_id                LYS 
_pdbx_modification_feature.ref_pcm_id                         1 
_pdbx_modification_feature.ref_comp_id                        RET 
_pdbx_modification_feature.type                               Retinoylation 
_pdbx_modification_feature.category                           Lipid/lipid-like 
# 
_struct_sheet.id               AA1 
_struct_sheet.type             ? 
_struct_sheet.number_strands   2 
_struct_sheet.details          ? 
# 
_struct_sheet_order.sheet_id     AA1 
_struct_sheet_order.range_id_1   1 
_struct_sheet_order.range_id_2   2 
_struct_sheet_order.offset       ? 
_struct_sheet_order.sense        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 THR A 64 ? PHE A 68 ? THR A 67 PHE A 71 
AA1 2 GLU A 71 ? ILE A 75 ? GLU A 74 ILE A 78 
# 
_pdbx_struct_sheet_hbond.sheet_id                AA1 
_pdbx_struct_sheet_hbond.range_id_1              1 
_pdbx_struct_sheet_hbond.range_id_2              2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id   N 
_pdbx_struct_sheet_hbond.range_1_label_comp_id   THR 
_pdbx_struct_sheet_hbond.range_1_label_asym_id   A 
_pdbx_struct_sheet_hbond.range_1_label_seq_id    64 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code    ? 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id    N 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id    THR 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id    A 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id     67 
_pdbx_struct_sheet_hbond.range_2_label_atom_id   O 
_pdbx_struct_sheet_hbond.range_2_label_comp_id   ILE 
_pdbx_struct_sheet_hbond.range_2_label_asym_id   A 
_pdbx_struct_sheet_hbond.range_2_label_seq_id    75 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code    ? 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id    O 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id    ILE 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id    A 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id     78 
# 
_pdbx_entry_details.entry_id                   9F9J 
_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   Y 
# 
_pdbx_validate_torsion.id              1 
_pdbx_validate_torsion.PDB_model_num   1 
_pdbx_validate_torsion.auth_comp_id    MET 
_pdbx_validate_torsion.auth_asym_id    A 
_pdbx_validate_torsion.auth_seq_id     163 
_pdbx_validate_torsion.PDB_ins_code    ? 
_pdbx_validate_torsion.label_alt_id    ? 
_pdbx_validate_torsion.phi             -124.00 
_pdbx_validate_torsion.psi             -169.51 
# 
_pdbx_validate_planes.id              1 
_pdbx_validate_planes.PDB_model_num   1 
_pdbx_validate_planes.auth_comp_id    ARG 
_pdbx_validate_planes.auth_asym_id    A 
_pdbx_validate_planes.auth_seq_id     7 
_pdbx_validate_planes.PDB_ins_code    ? 
_pdbx_validate_planes.label_alt_id    ? 
_pdbx_validate_planes.rmsd            0.126 
_pdbx_validate_planes.type            'SIDE CHAIN' 
# 
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 23.8812 27.3452 29.7122 0.3072 ? 0.0374  ? -0.0095 ? 0.3147 ? -0.0250 ? 0.3983 ? 3.1479 ? 1.7981  
? -2.8559 ? 6.3980  ? -5.3944 ? 6.4960 ? -0.1875 ? 0.1821  ? -0.1092 ? -0.6151 ? 0.1225  ? -0.4178 ? 1.1149  ? 0.2829  ? 0.0083  ? 
2 'X-RAY DIFFRACTION' ? refined 15.1916 28.0547 41.6512 0.3647 ? 0.0238  ? -0.0542 ? 0.2812 ? 0.0307  ? 0.4014 ? 2.0512 ? -0.3924 
? -0.6410 ? 0.8768  ? 1.4103  ? 2.5456 ? 0.1698  ? -0.1455 ? -0.0371 ? 0.1578  ? 0.2925  ? -0.0502 ? 0.5072  ? -0.1544 ? -0.5449 ? 
3 'X-RAY DIFFRACTION' ? refined 12.9154 39.1383 27.9078 0.3064 ? -0.0026 ? 0.0104  ? 0.3304 ? -0.0031 ? 0.3327 ? 1.3633 ? 0.3481  
? -0.0544 ? 1.7798  ? 1.3805  ? 4.4698 ? 0.0179  ? 0.2501  ? 0.0122  ? -0.3121 ? 0.0788  ? -0.0380 ? 0.0606  ? -0.1696 ? -0.1168 ? 
4 'X-RAY DIFFRACTION' ? refined 7.7694  46.3503 37.0339 0.3336 ? 0.0310  ? -0.0526 ? 0.3545 ? -0.0040 ? 0.3659 ? 0.6756 ? -0.6879 
? -0.8181 ? 2.3243  ? -1.2416 ? 2.2893 ? 0.2209  ? -0.0029 ? 0.0240  ? 0.0995  ? 0.3265  ? -0.0213 ? 0.1321  ? -0.4865 ? -0.5230 ? 
5 'X-RAY DIFFRACTION' ? refined 13.5980 53.5485 33.6096 0.3384 ? -0.0798 ? 0.0011  ? 0.2689 ? -0.0117 ? 0.3732 ? 3.2782 ? -0.8918 
? 0.4233  ? 1.8095  ? -2.6463 ? 3.6829 ? 0.0737  ? 0.0467  ? 0.1729  ? 0.2657  ? 0.0513  ? -0.0026 ? -1.4973 ? 1.0445  ? -0.0725 ? 
6 'X-RAY DIFFRACTION' ? refined 17.7566 46.9259 57.9332 1.7056 ? -0.0530 ? 0.0449  ? 1.1692 ? -0.1488 ? 0.7552 ? 5.6009 ? -3.7205 
? 2.6930  ? 6.1482  ? -5.4857 ? 5.2680 ? -0.6266 ? -1.1289 ? 0.3426  ? 2.4293  ? 0.1890  ? 0.3196  ? -2.8851 ? -2.3533 ? 0.9141  ? 
7 'X-RAY DIFFRACTION' ? refined 23.0602 42.4500 35.7776 0.3765 ? -0.0695 ? -0.0477 ? 0.3490 ? -0.0178 ? 0.4172 ? 0.6079 ? -0.3158 
? -0.9951 ? -0.0352 ? -1.4280 ? 5.5475 ? -0.0102 ? 0.0820  ? -0.0527 ? 0.1042  ? 0.0604  ? -0.1903 ? -0.3200 ? 0.2903  ? -0.0358 ? 
8 'X-RAY DIFFRACTION' ? refined 23.9292 31.7537 55.3892 0.5075 ? -0.0573 ? -0.0752 ? 0.5204 ? 0.2415  ? 0.5629 ? 3.5178 ? -2.0254 
? -0.8471 ? 5.4705  ? 3.9339  ? 3.0120 ? -0.6474 ? -0.4286 ? 0.0656  ? 1.4202  ? -0.9325 ? -0.8730 ? -0.1498 ? 0.5549  ? 1.0487  ? 
9 'X-RAY DIFFRACTION' ? refined 19.2507 30.2882 64.8345 0.7288 ? -0.1231 ? -0.1207 ? 0.4830 ? 0.0223  ? 0.3718 ? 4.0361 ? 0.1236  
? 1.7309  ? 1.3875  ? -1.5347 ? 2.5667 ? 1.1945  ? -0.0854 ? -0.4490 ? 1.3052  ? -0.0390 ? -0.2625 ? -0.6323 ? 1.7779  ? -1.3699 ? 
# 
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 ? ? ? ? ? ? ? ? ? ? ? 
;chain 'A' and (resid 4 through 30 )
;
2 'X-RAY DIFFRACTION' 2 ? ? ? ? ? ? ? ? ? ? ? 
;chain 'A' and (resid 31 through 62 )
;
3 'X-RAY DIFFRACTION' 3 ? ? ? ? ? ? ? ? ? ? ? 
;chain 'A' and (resid 63 through 100 )
;
4 'X-RAY DIFFRACTION' 4 ? ? ? ? ? ? ? ? ? ? ? 
;chain 'A' and (resid 101 through 130 )
;
5 'X-RAY DIFFRACTION' 5 ? ? ? ? ? ? ? ? ? ? ? 
;chain 'A' and (resid 131 through 154 )
;
6 'X-RAY DIFFRACTION' 6 ? ? ? ? ? ? ? ? ? ? ? 
;chain 'A' and (resid 155 through 164 )
;
7 'X-RAY DIFFRACTION' 7 ? ? ? ? ? ? ? ? ? ? ? 
;chain 'A' and (resid 165 through 224 )
;
8 'X-RAY DIFFRACTION' 8 ? ? ? ? ? ? ? ? ? ? ? 
;chain 'A' and (resid 225 through 229 )
;
9 'X-RAY DIFFRACTION' 9 ? ? ? ? ? ? ? ? ? ? ? 
;chain 'A' and (resid 230 through 234 )
;
# 
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 
ALA N    N N N 1   
ALA CA   C N S 2   
ALA C    C N N 3   
ALA O    O N N 4   
ALA CB   C N N 5   
ALA OXT  O N N 6   
ALA H    H N N 7   
ALA H2   H N N 8   
ALA HA   H N N 9   
ALA HB1  H N N 10  
ALA HB2  H N N 11  
ALA HB3  H N N 12  
ALA HXT  H N N 13  
ARG N    N N N 14  
ARG CA   C N S 15  
ARG C    C N N 16  
ARG O    O N N 17  
ARG CB   C N N 18  
ARG CG   C N N 19  
ARG CD   C N N 20  
ARG NE   N N N 21  
ARG CZ   C N N 22  
ARG NH1  N N N 23  
ARG NH2  N N N 24  
ARG OXT  O N N 25  
ARG H    H N N 26  
ARG H2   H N N 27  
ARG HA   H N N 28  
ARG HB2  H N N 29  
ARG HB3  H N N 30  
ARG HG2  H N N 31  
ARG HG3  H N N 32  
ARG HD2  H N N 33  
ARG HD3  H N N 34  
ARG HE   H N N 35  
ARG HH11 H N N 36  
ARG HH12 H N N 37  
ARG HH21 H N N 38  
ARG HH22 H N N 39  
ARG HXT  H N N 40  
ASN N    N N N 41  
ASN CA   C N S 42  
ASN C    C N N 43  
ASN O    O N N 44  
ASN CB   C N N 45  
ASN CG   C N N 46  
ASN OD1  O N N 47  
ASN ND2  N N N 48  
ASN OXT  O N N 49  
ASN H    H N N 50  
ASN H2   H N N 51  
ASN HA   H N N 52  
ASN HB2  H N N 53  
ASN HB3  H N N 54  
ASN HD21 H N N 55  
ASN HD22 H N N 56  
ASN HXT  H N N 57  
ASP N    N N N 58  
ASP CA   C N S 59  
ASP C    C N N 60  
ASP O    O N N 61  
ASP CB   C N N 62  
ASP CG   C N N 63  
ASP OD1  O N N 64  
ASP OD2  O N N 65  
ASP OXT  O N N 66  
ASP H    H N N 67  
ASP H2   H N N 68  
ASP HA   H N N 69  
ASP HB2  H N N 70  
ASP HB3  H N N 71  
ASP HD2  H N N 72  
ASP HXT  H N N 73  
GLN N    N N N 74  
GLN CA   C N S 75  
GLN C    C N N 76  
GLN O    O N N 77  
GLN CB   C N N 78  
GLN CG   C N N 79  
GLN CD   C N N 80  
GLN OE1  O N N 81  
GLN NE2  N N N 82  
GLN OXT  O N N 83  
GLN H    H N N 84  
GLN H2   H N N 85  
GLN HA   H N N 86  
GLN HB2  H N N 87  
GLN HB3  H N N 88  
GLN HG2  H N N 89  
GLN HG3  H N N 90  
GLN HE21 H N N 91  
GLN HE22 H N N 92  
GLN HXT  H N N 93  
GLU N    N N N 94  
GLU CA   C N S 95  
GLU C    C N N 96  
GLU O    O N N 97  
GLU CB   C N N 98  
GLU CG   C N N 99  
GLU CD   C N N 100 
GLU OE1  O N N 101 
GLU OE2  O N N 102 
GLU OXT  O N N 103 
GLU H    H N N 104 
GLU H2   H N N 105 
GLU HA   H N N 106 
GLU HB2  H N N 107 
GLU HB3  H N N 108 
GLU HG2  H N N 109 
GLU HG3  H N N 110 
GLU HE2  H N N 111 
GLU HXT  H N N 112 
GLY N    N N N 113 
GLY CA   C N N 114 
GLY C    C N N 115 
GLY O    O N N 116 
GLY OXT  O N N 117 
GLY H    H N N 118 
GLY H2   H N N 119 
GLY HA2  H N N 120 
GLY HA3  H N N 121 
GLY HXT  H N N 122 
HOH O    O N N 123 
HOH H1   H N N 124 
HOH H2   H N N 125 
ILE N    N N N 126 
ILE CA   C N S 127 
ILE C    C N N 128 
ILE O    O N N 129 
ILE CB   C N S 130 
ILE CG1  C N N 131 
ILE CG2  C N N 132 
ILE CD1  C N N 133 
ILE OXT  O N N 134 
ILE H    H N N 135 
ILE H2   H N N 136 
ILE HA   H N N 137 
ILE HB   H N N 138 
ILE HG12 H N N 139 
ILE HG13 H N N 140 
ILE HG21 H N N 141 
ILE HG22 H N N 142 
ILE HG23 H N N 143 
ILE HD11 H N N 144 
ILE HD12 H N N 145 
ILE HD13 H N N 146 
ILE HXT  H N N 147 
LEU N    N N N 148 
LEU CA   C N S 149 
LEU C    C N N 150 
LEU O    O N N 151 
LEU CB   C N N 152 
LEU CG   C N N 153 
LEU CD1  C N N 154 
LEU CD2  C N N 155 
LEU OXT  O N N 156 
LEU H    H N N 157 
LEU H2   H N N 158 
LEU HA   H N N 159 
LEU HB2  H N N 160 
LEU HB3  H N N 161 
LEU HG   H N N 162 
LEU HD11 H N N 163 
LEU HD12 H N N 164 
LEU HD13 H N N 165 
LEU HD21 H N N 166 
LEU HD22 H N N 167 
LEU HD23 H N N 168 
LEU HXT  H N N 169 
LI1 C1   C N N 170 
LI1 C2   C N R 171 
LI1 C3   C N N 172 
LI1 O1   O N N 173 
LI1 O2   O N N 174 
LI1 O3   O N N 175 
LI1 C41  C N N 176 
LI1 C42  C N N 177 
LI1 C43  C N R 178 
LI1 C44  C N N 179 
LI1 C45  C N N 180 
LI1 C46  C N N 181 
LI1 C47  C N N 182 
LI1 C48  C N R 183 
LI1 C49  C N N 184 
LI1 C50  C N N 185 
LI1 C51  C N N 186 
LI1 C52  C N N 187 
LI1 C53  C N N 188 
LI1 C55  C N N 189 
LI1 C56  C N N 190 
LI1 C57  C N N 191 
LI1 C58  C N N 192 
LI1 C59  C N N 193 
LI1 C60  C N N 194 
LI1 C11  C N N 195 
LI1 C12  C N N 196 
LI1 C13  C N S 197 
LI1 C14  C N N 198 
LI1 C15  C N N 199 
LI1 C16  C N N 200 
LI1 C17  C N N 201 
LI1 C18  C N R 202 
LI1 C19  C N N 203 
LI1 C20  C N N 204 
LI1 C21  C N N 205 
LI1 C22  C N N 206 
LI1 C23  C N S 207 
LI1 C24  C N N 208 
LI1 C25  C N N 209 
LI1 C26  C N N 210 
LI1 C27  C N N 211 
LI1 C28  C N N 212 
LI1 C29  C N N 213 
LI1 C30  C N N 214 
LI1 H11  H N N 215 
LI1 H12  H N N 216 
LI1 H2   H N N 217 
LI1 H31  H N N 218 
LI1 H32  H N N 219 
LI1 HO3  H N N 220 
LI1 H411 H N N 221 
LI1 H412 H N N 222 
LI1 H421 H N N 223 
LI1 H422 H N N 224 
LI1 H43  H N N 225 
LI1 H441 H N N 226 
LI1 H442 H N N 227 
LI1 H443 H N N 228 
LI1 H451 H N N 229 
LI1 H452 H N N 230 
LI1 H461 H N N 231 
LI1 H462 H N N 232 
LI1 H471 H N N 233 
LI1 H472 H N N 234 
LI1 H48  H N N 235 
LI1 H491 H N N 236 
LI1 H492 H N N 237 
LI1 H493 H N N 238 
LI1 H501 H N N 239 
LI1 H502 H N N 240 
LI1 H511 H N N 241 
LI1 H512 H N N 242 
LI1 H521 H N N 243 
LI1 H522 H N N 244 
LI1 H531 H N N 245 
LI1 H532 H N N 246 
LI1 H551 H N N 247 
LI1 H552 H N N 248 
LI1 H561 H N N 249 
LI1 H562 H N N 250 
LI1 H571 H N N 251 
LI1 H572 H N N 252 
LI1 H58  H N N 253 
LI1 H591 H N N 254 
LI1 H592 H N N 255 
LI1 H593 H N N 256 
LI1 H601 H N N 257 
LI1 H602 H N N 258 
LI1 H603 H N N 259 
LI1 H111 H N N 260 
LI1 H112 H N N 261 
LI1 H121 H N N 262 
LI1 H122 H N N 263 
LI1 H13  H N N 264 
LI1 H141 H N N 265 
LI1 H142 H N N 266 
LI1 H143 H N N 267 
LI1 H151 H N N 268 
LI1 H152 H N N 269 
LI1 H161 H N N 270 
LI1 H162 H N N 271 
LI1 H171 H N N 272 
LI1 H172 H N N 273 
LI1 H18  H N N 274 
LI1 H191 H N N 275 
LI1 H192 H N N 276 
LI1 H193 H N N 277 
LI1 H201 H N N 278 
LI1 H202 H N N 279 
LI1 H211 H N N 280 
LI1 H212 H N N 281 
LI1 H221 H N N 282 
LI1 H222 H N N 283 
LI1 H23  H N N 284 
LI1 H241 H N N 285 
LI1 H242 H N N 286 
LI1 H243 H N N 287 
LI1 H251 H N N 288 
LI1 H252 H N N 289 
LI1 H261 H N N 290 
LI1 H262 H N N 291 
LI1 H271 H N N 292 
LI1 H272 H N N 293 
LI1 H28  H N N 294 
LI1 H291 H N N 295 
LI1 H292 H N N 296 
LI1 H293 H N N 297 
LI1 H301 H N N 298 
LI1 H302 H N N 299 
LI1 H303 H N N 300 
LYS N    N N N 301 
LYS CA   C N S 302 
LYS C    C N N 303 
LYS O    O N N 304 
LYS CB   C N N 305 
LYS CG   C N N 306 
LYS CD   C N N 307 
LYS CE   C N N 308 
LYS NZ   N N N 309 
LYS OXT  O N N 310 
LYS H    H N N 311 
LYS H2   H N N 312 
LYS HA   H N N 313 
LYS HB2  H N N 314 
LYS HB3  H N N 315 
LYS HG2  H N N 316 
LYS HG3  H N N 317 
LYS HD2  H N N 318 
LYS HD3  H N N 319 
LYS HE2  H N N 320 
LYS HE3  H N N 321 
LYS HZ1  H N N 322 
LYS HZ2  H N N 323 
LYS HZ3  H N N 324 
LYS HXT  H N N 325 
MET N    N N N 326 
MET CA   C N S 327 
MET C    C N N 328 
MET O    O N N 329 
MET CB   C N N 330 
MET CG   C N N 331 
MET SD   S N N 332 
MET CE   C N N 333 
MET OXT  O N N 334 
MET H    H N N 335 
MET H2   H N N 336 
MET HA   H N N 337 
MET HB2  H N N 338 
MET HB3  H N N 339 
MET HG2  H N N 340 
MET HG3  H N N 341 
MET HE1  H N N 342 
MET HE2  H N N 343 
MET HE3  H N N 344 
MET HXT  H N N 345 
OLC C18  C N N 346 
OLC C10  C N N 347 
OLC C9   C N N 348 
OLC C17  C N N 349 
OLC C11  C N N 350 
OLC C8   C N N 351 
OLC C24  C N N 352 
OLC C16  C N N 353 
OLC C12  C N N 354 
OLC C7   C N N 355 
OLC C15  C N N 356 
OLC C13  C N N 357 
OLC C6   C N N 358 
OLC C14  C N N 359 
OLC C5   C N N 360 
OLC C4   C N N 361 
OLC C3   C N N 362 
OLC C2   C N N 363 
OLC C21  C N N 364 
OLC C1   C N N 365 
OLC C22  C N R 366 
OLC O19  O N N 367 
OLC O25  O N N 368 
OLC O23  O N N 369 
OLC O20  O N N 370 
OLC H18  H N N 371 
OLC H18A H N N 372 
OLC H18B H N N 373 
OLC H10  H N N 374 
OLC H9   H N N 375 
OLC H17  H N N 376 
OLC H17A H N N 377 
OLC H11  H N N 378 
OLC H11A H N N 379 
OLC H8   H N N 380 
OLC H8A  H N N 381 
OLC H24  H N N 382 
OLC H24A H N N 383 
OLC H16  H N N 384 
OLC H16A H N N 385 
OLC H12  H N N 386 
OLC H12A H N N 387 
OLC H7   H N N 388 
OLC H7A  H N N 389 
OLC H15  H N N 390 
OLC H15A H N N 391 
OLC H13  H N N 392 
OLC H13A H N N 393 
OLC H6   H N N 394 
OLC H6A  H N N 395 
OLC H14  H N N 396 
OLC H14A H N N 397 
OLC H5   H N N 398 
OLC H5A  H N N 399 
OLC H4   H N N 400 
OLC H4A  H N N 401 
OLC H3   H N N 402 
OLC H3A  H N N 403 
OLC H2   H N N 404 
OLC H2A  H N N 405 
OLC H21  H N N 406 
OLC H21A H N N 407 
OLC H22  H N N 408 
OLC HO25 H N N 409 
OLC HO23 H N N 410 
PHE N    N N N 411 
PHE CA   C N S 412 
PHE C    C N N 413 
PHE O    O N N 414 
PHE CB   C N N 415 
PHE CG   C Y N 416 
PHE CD1  C Y N 417 
PHE CD2  C Y N 418 
PHE CE1  C Y N 419 
PHE CE2  C Y N 420 
PHE CZ   C Y N 421 
PHE OXT  O N N 422 
PHE H    H N N 423 
PHE H2   H N N 424 
PHE HA   H N N 425 
PHE HB2  H N N 426 
PHE HB3  H N N 427 
PHE HD1  H N N 428 
PHE HD2  H N N 429 
PHE HE1  H N N 430 
PHE HE2  H N N 431 
PHE HZ   H N N 432 
PHE HXT  H N N 433 
PRO N    N N N 434 
PRO CA   C N S 435 
PRO C    C N N 436 
PRO O    O N N 437 
PRO CB   C N N 438 
PRO CG   C N N 439 
PRO CD   C N N 440 
PRO OXT  O N N 441 
PRO H    H N N 442 
PRO HA   H N N 443 
PRO HB2  H N N 444 
PRO HB3  H N N 445 
PRO HG2  H N N 446 
PRO HG3  H N N 447 
PRO HD2  H N N 448 
PRO HD3  H N N 449 
PRO HXT  H N N 450 
RET C1   C N N 451 
RET C2   C N N 452 
RET C3   C N N 453 
RET C4   C N N 454 
RET C5   C N N 455 
RET C6   C N N 456 
RET C7   C N N 457 
RET C8   C N N 458 
RET C9   C N N 459 
RET C10  C N N 460 
RET C11  C N N 461 
RET C12  C N N 462 
RET C13  C N N 463 
RET C14  C N N 464 
RET C15  C N N 465 
RET O1   O N N 466 
RET C16  C N N 467 
RET C17  C N N 468 
RET C18  C N N 469 
RET C19  C N N 470 
RET C20  C N N 471 
RET H21  H N N 472 
RET H22  H N N 473 
RET H31  H N N 474 
RET H32  H N N 475 
RET H41  H N N 476 
RET H42  H N N 477 
RET H7   H N N 478 
RET H8   H N N 479 
RET H10  H N N 480 
RET H11  H N N 481 
RET H12  H N N 482 
RET H14  H N N 483 
RET H15  H N N 484 
RET H161 H N N 485 
RET H162 H N N 486 
RET H163 H N N 487 
RET H171 H N N 488 
RET H172 H N N 489 
RET H173 H N N 490 
RET H181 H N N 491 
RET H182 H N N 492 
RET H183 H N N 493 
RET H191 H N N 494 
RET H192 H N N 495 
RET H193 H N N 496 
RET H201 H N N 497 
RET H202 H N N 498 
RET H203 H N N 499 
SER N    N N N 500 
SER CA   C N S 501 
SER C    C N N 502 
SER O    O N N 503 
SER CB   C N N 504 
SER OG   O N N 505 
SER OXT  O N N 506 
SER H    H N N 507 
SER H2   H N N 508 
SER HA   H N N 509 
SER HB2  H N N 510 
SER HB3  H N N 511 
SER HG   H N N 512 
SER HXT  H N N 513 
THR N    N N N 514 
THR CA   C N S 515 
THR C    C N N 516 
THR O    O N N 517 
THR CB   C N R 518 
THR OG1  O N N 519 
THR CG2  C N N 520 
THR OXT  O N N 521 
THR H    H N N 522 
THR H2   H N N 523 
THR HA   H N N 524 
THR HB   H N N 525 
THR HG1  H N N 526 
THR HG21 H N N 527 
THR HG22 H N N 528 
THR HG23 H N N 529 
THR HXT  H N N 530 
TRP N    N N N 531 
TRP CA   C N S 532 
TRP C    C N N 533 
TRP O    O N N 534 
TRP CB   C N N 535 
TRP CG   C Y N 536 
TRP CD1  C Y N 537 
TRP CD2  C Y N 538 
TRP NE1  N Y N 539 
TRP CE2  C Y N 540 
TRP CE3  C Y N 541 
TRP CZ2  C Y N 542 
TRP CZ3  C Y N 543 
TRP CH2  C Y N 544 
TRP OXT  O N N 545 
TRP H    H N N 546 
TRP H2   H N N 547 
TRP HA   H N N 548 
TRP HB2  H N N 549 
TRP HB3  H N N 550 
TRP HD1  H N N 551 
TRP HE1  H N N 552 
TRP HE3  H N N 553 
TRP HZ2  H N N 554 
TRP HZ3  H N N 555 
TRP HH2  H N N 556 
TRP HXT  H N N 557 
TYR N    N N N 558 
TYR CA   C N S 559 
TYR C    C N N 560 
TYR O    O N N 561 
TYR CB   C N N 562 
TYR CG   C Y N 563 
TYR CD1  C Y N 564 
TYR CD2  C Y N 565 
TYR CE1  C Y N 566 
TYR CE2  C Y N 567 
TYR CZ   C Y N 568 
TYR OH   O N N 569 
TYR OXT  O N N 570 
TYR H    H N N 571 
TYR H2   H N N 572 
TYR HA   H N N 573 
TYR HB2  H N N 574 
TYR HB3  H N N 575 
TYR HD1  H N N 576 
TYR HD2  H N N 577 
TYR HE1  H N N 578 
TYR HE2  H N N 579 
TYR HH   H N N 580 
TYR HXT  H N N 581 
VAL N    N N N 582 
VAL CA   C N S 583 
VAL C    C N N 584 
VAL O    O N N 585 
VAL CB   C N N 586 
VAL CG1  C N N 587 
VAL CG2  C N N 588 
VAL OXT  O N N 589 
VAL H    H N N 590 
VAL H2   H N N 591 
VAL HA   H N N 592 
VAL HB   H N N 593 
VAL HG11 H N N 594 
VAL HG12 H N N 595 
VAL HG13 H N N 596 
VAL HG21 H N N 597 
VAL HG22 H N N 598 
VAL HG23 H N N 599 
VAL HXT  H N N 600 
# 
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 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ARG N   CA   sing N N 13  
ARG N   H    sing N N 14  
ARG N   H2   sing N N 15  
ARG CA  C    sing N N 16  
ARG CA  CB   sing N N 17  
ARG CA  HA   sing N N 18  
ARG C   O    doub N N 19  
ARG C   OXT  sing N N 20  
ARG CB  CG   sing N N 21  
ARG CB  HB2  sing N N 22  
ARG CB  HB3  sing N N 23  
ARG CG  CD   sing N N 24  
ARG CG  HG2  sing N N 25  
ARG CG  HG3  sing N N 26  
ARG CD  NE   sing N N 27  
ARG CD  HD2  sing N N 28  
ARG CD  HD3  sing N N 29  
ARG NE  CZ   sing N N 30  
ARG NE  HE   sing N N 31  
ARG CZ  NH1  sing N N 32  
ARG CZ  NH2  doub N N 33  
ARG NH1 HH11 sing N N 34  
ARG NH1 HH12 sing N N 35  
ARG NH2 HH21 sing N N 36  
ARG NH2 HH22 sing N N 37  
ARG OXT HXT  sing N N 38  
ASN N   CA   sing N N 39  
ASN N   H    sing N N 40  
ASN N   H2   sing N N 41  
ASN CA  C    sing N N 42  
ASN CA  CB   sing N N 43  
ASN CA  HA   sing N N 44  
ASN C   O    doub N N 45  
ASN C   OXT  sing N N 46  
ASN CB  CG   sing N N 47  
ASN CB  HB2  sing N N 48  
ASN CB  HB3  sing N N 49  
ASN CG  OD1  doub N N 50  
ASN CG  ND2  sing N N 51  
ASN ND2 HD21 sing N N 52  
ASN ND2 HD22 sing N N 53  
ASN OXT HXT  sing N N 54  
ASP N   CA   sing N N 55  
ASP N   H    sing N N 56  
ASP N   H2   sing N N 57  
ASP CA  C    sing N N 58  
ASP CA  CB   sing N N 59  
ASP CA  HA   sing N N 60  
ASP C   O    doub N N 61  
ASP C   OXT  sing N N 62  
ASP CB  CG   sing N N 63  
ASP CB  HB2  sing N N 64  
ASP CB  HB3  sing N N 65  
ASP CG  OD1  doub N N 66  
ASP CG  OD2  sing N N 67  
ASP OD2 HD2  sing N N 68  
ASP OXT HXT  sing N N 69  
GLN N   CA   sing N N 70  
GLN N   H    sing N N 71  
GLN N   H2   sing N N 72  
GLN CA  C    sing N N 73  
GLN CA  CB   sing N N 74  
GLN CA  HA   sing N N 75  
GLN C   O    doub N N 76  
GLN C   OXT  sing N N 77  
GLN CB  CG   sing N N 78  
GLN CB  HB2  sing N N 79  
GLN CB  HB3  sing N N 80  
GLN CG  CD   sing N N 81  
GLN CG  HG2  sing N N 82  
GLN CG  HG3  sing N N 83  
GLN CD  OE1  doub N N 84  
GLN CD  NE2  sing N N 85  
GLN NE2 HE21 sing N N 86  
GLN NE2 HE22 sing N N 87  
GLN OXT HXT  sing N N 88  
GLU N   CA   sing N N 89  
GLU N   H    sing N N 90  
GLU N   H2   sing N N 91  
GLU CA  C    sing N N 92  
GLU CA  CB   sing N N 93  
GLU CA  HA   sing N N 94  
GLU C   O    doub N N 95  
GLU C   OXT  sing N N 96  
GLU CB  CG   sing N N 97  
GLU CB  HB2  sing N N 98  
GLU CB  HB3  sing N N 99  
GLU CG  CD   sing N N 100 
GLU CG  HG2  sing N N 101 
GLU CG  HG3  sing N N 102 
GLU CD  OE1  doub N N 103 
GLU CD  OE2  sing N N 104 
GLU OE2 HE2  sing N N 105 
GLU OXT HXT  sing N N 106 
GLY N   CA   sing N N 107 
GLY N   H    sing N N 108 
GLY N   H2   sing N N 109 
GLY CA  C    sing N N 110 
GLY CA  HA2  sing N N 111 
GLY CA  HA3  sing N N 112 
GLY C   O    doub N N 113 
GLY C   OXT  sing N N 114 
GLY OXT HXT  sing N N 115 
HOH O   H1   sing N N 116 
HOH O   H2   sing N N 117 
ILE N   CA   sing N N 118 
ILE N   H    sing N N 119 
ILE N   H2   sing N N 120 
ILE CA  C    sing N N 121 
ILE CA  CB   sing N N 122 
ILE CA  HA   sing N N 123 
ILE C   O    doub N N 124 
ILE C   OXT  sing N N 125 
ILE CB  CG1  sing N N 126 
ILE CB  CG2  sing N N 127 
ILE CB  HB   sing N N 128 
ILE CG1 CD1  sing N N 129 
ILE CG1 HG12 sing N N 130 
ILE CG1 HG13 sing N N 131 
ILE CG2 HG21 sing N N 132 
ILE CG2 HG22 sing N N 133 
ILE CG2 HG23 sing N N 134 
ILE CD1 HD11 sing N N 135 
ILE CD1 HD12 sing N N 136 
ILE CD1 HD13 sing N N 137 
ILE OXT HXT  sing N N 138 
LEU N   CA   sing N N 139 
LEU N   H    sing N N 140 
LEU N   H2   sing N N 141 
LEU CA  C    sing N N 142 
LEU CA  CB   sing N N 143 
LEU CA  HA   sing N N 144 
LEU C   O    doub N N 145 
LEU C   OXT  sing N N 146 
LEU CB  CG   sing N N 147 
LEU CB  HB2  sing N N 148 
LEU CB  HB3  sing N N 149 
LEU CG  CD1  sing N N 150 
LEU CG  CD2  sing N N 151 
LEU CG  HG   sing N N 152 
LEU CD1 HD11 sing N N 153 
LEU CD1 HD12 sing N N 154 
LEU CD1 HD13 sing N N 155 
LEU CD2 HD21 sing N N 156 
LEU CD2 HD22 sing N N 157 
LEU CD2 HD23 sing N N 158 
LEU OXT HXT  sing N N 159 
LI1 C1  C2   sing N N 160 
LI1 C1  O1   sing N N 161 
LI1 C1  H11  sing N N 162 
LI1 C1  H12  sing N N 163 
LI1 C2  C3   sing N N 164 
LI1 C2  O2   sing N N 165 
LI1 C2  H2   sing N N 166 
LI1 C3  O3   sing N N 167 
LI1 C3  H31  sing N N 168 
LI1 C3  H32  sing N N 169 
LI1 O1  C11  sing N N 170 
LI1 O2  C41  sing N N 171 
LI1 O3  HO3  sing N N 172 
LI1 C41 C42  sing N N 173 
LI1 C41 H411 sing N N 174 
LI1 C41 H412 sing N N 175 
LI1 C42 C43  sing N N 176 
LI1 C42 H421 sing N N 177 
LI1 C42 H422 sing N N 178 
LI1 C43 C44  sing N N 179 
LI1 C43 C45  sing N N 180 
LI1 C43 H43  sing N N 181 
LI1 C44 H441 sing N N 182 
LI1 C44 H442 sing N N 183 
LI1 C44 H443 sing N N 184 
LI1 C45 C46  sing N N 185 
LI1 C45 H451 sing N N 186 
LI1 C45 H452 sing N N 187 
LI1 C46 C47  sing N N 188 
LI1 C46 H461 sing N N 189 
LI1 C46 H462 sing N N 190 
LI1 C47 C48  sing N N 191 
LI1 C47 H471 sing N N 192 
LI1 C47 H472 sing N N 193 
LI1 C48 C49  sing N N 194 
LI1 C48 C50  sing N N 195 
LI1 C48 H48  sing N N 196 
LI1 C49 H491 sing N N 197 
LI1 C49 H492 sing N N 198 
LI1 C49 H493 sing N N 199 
LI1 C50 C51  sing N N 200 
LI1 C50 H501 sing N N 201 
LI1 C50 H502 sing N N 202 
LI1 C51 C52  sing N N 203 
LI1 C51 H511 sing N N 204 
LI1 C51 H512 sing N N 205 
LI1 C52 C53  sing N N 206 
LI1 C52 H521 sing N N 207 
LI1 C52 H522 sing N N 208 
LI1 C53 C55  sing N N 209 
LI1 C53 H531 sing N N 210 
LI1 C53 H532 sing N N 211 
LI1 C55 C56  sing N N 212 
LI1 C55 H551 sing N N 213 
LI1 C55 H552 sing N N 214 
LI1 C56 C57  sing N N 215 
LI1 C56 H561 sing N N 216 
LI1 C56 H562 sing N N 217 
LI1 C57 C58  sing N N 218 
LI1 C57 H571 sing N N 219 
LI1 C57 H572 sing N N 220 
LI1 C58 C59  sing N N 221 
LI1 C58 C60  sing N N 222 
LI1 C58 H58  sing N N 223 
LI1 C59 H591 sing N N 224 
LI1 C59 H592 sing N N 225 
LI1 C59 H593 sing N N 226 
LI1 C60 H601 sing N N 227 
LI1 C60 H602 sing N N 228 
LI1 C60 H603 sing N N 229 
LI1 C11 C12  sing N N 230 
LI1 C11 H111 sing N N 231 
LI1 C11 H112 sing N N 232 
LI1 C12 C13  sing N N 233 
LI1 C12 H121 sing N N 234 
LI1 C12 H122 sing N N 235 
LI1 C13 C14  sing N N 236 
LI1 C13 C15  sing N N 237 
LI1 C13 H13  sing N N 238 
LI1 C14 H141 sing N N 239 
LI1 C14 H142 sing N N 240 
LI1 C14 H143 sing N N 241 
LI1 C15 C16  sing N N 242 
LI1 C15 H151 sing N N 243 
LI1 C15 H152 sing N N 244 
LI1 C16 C17  sing N N 245 
LI1 C16 H161 sing N N 246 
LI1 C16 H162 sing N N 247 
LI1 C17 C18  sing N N 248 
LI1 C17 H171 sing N N 249 
LI1 C17 H172 sing N N 250 
LI1 C18 C19  sing N N 251 
LI1 C18 C20  sing N N 252 
LI1 C18 H18  sing N N 253 
LI1 C19 H191 sing N N 254 
LI1 C19 H192 sing N N 255 
LI1 C19 H193 sing N N 256 
LI1 C20 C21  sing N N 257 
LI1 C20 H201 sing N N 258 
LI1 C20 H202 sing N N 259 
LI1 C21 C22  sing N N 260 
LI1 C21 H211 sing N N 261 
LI1 C21 H212 sing N N 262 
LI1 C22 C23  sing N N 263 
LI1 C22 H221 sing N N 264 
LI1 C22 H222 sing N N 265 
LI1 C23 C24  sing N N 266 
LI1 C23 C25  sing N N 267 
LI1 C23 H23  sing N N 268 
LI1 C24 H241 sing N N 269 
LI1 C24 H242 sing N N 270 
LI1 C24 H243 sing N N 271 
LI1 C25 C26  sing N N 272 
LI1 C25 H251 sing N N 273 
LI1 C25 H252 sing N N 274 
LI1 C26 C27  sing N N 275 
LI1 C26 H261 sing N N 276 
LI1 C26 H262 sing N N 277 
LI1 C27 C28  sing N N 278 
LI1 C27 H271 sing N N 279 
LI1 C27 H272 sing N N 280 
LI1 C28 C29  sing N N 281 
LI1 C28 C30  sing N N 282 
LI1 C28 H28  sing N N 283 
LI1 C29 H291 sing N N 284 
LI1 C29 H292 sing N N 285 
LI1 C29 H293 sing N N 286 
LI1 C30 H301 sing N N 287 
LI1 C30 H302 sing N N 288 
LI1 C30 H303 sing N N 289 
LYS N   CA   sing N N 290 
LYS N   H    sing N N 291 
LYS N   H2   sing N N 292 
LYS CA  C    sing N N 293 
LYS CA  CB   sing N N 294 
LYS CA  HA   sing N N 295 
LYS C   O    doub N N 296 
LYS C   OXT  sing N N 297 
LYS CB  CG   sing N N 298 
LYS CB  HB2  sing N N 299 
LYS CB  HB3  sing N N 300 
LYS CG  CD   sing N N 301 
LYS CG  HG2  sing N N 302 
LYS CG  HG3  sing N N 303 
LYS CD  CE   sing N N 304 
LYS CD  HD2  sing N N 305 
LYS CD  HD3  sing N N 306 
LYS CE  NZ   sing N N 307 
LYS CE  HE2  sing N N 308 
LYS CE  HE3  sing N N 309 
LYS NZ  HZ1  sing N N 310 
LYS NZ  HZ2  sing N N 311 
LYS NZ  HZ3  sing N N 312 
LYS OXT HXT  sing N N 313 
MET N   CA   sing N N 314 
MET N   H    sing N N 315 
MET N   H2   sing N N 316 
MET CA  C    sing N N 317 
MET CA  CB   sing N N 318 
MET CA  HA   sing N N 319 
MET C   O    doub N N 320 
MET C   OXT  sing N N 321 
MET CB  CG   sing N N 322 
MET CB  HB2  sing N N 323 
MET CB  HB3  sing N N 324 
MET CG  SD   sing N N 325 
MET CG  HG2  sing N N 326 
MET CG  HG3  sing N N 327 
MET SD  CE   sing N N 328 
MET CE  HE1  sing N N 329 
MET CE  HE2  sing N N 330 
MET CE  HE3  sing N N 331 
MET OXT HXT  sing N N 332 
OLC C18 C17  sing N N 333 
OLC C10 C9   doub N N 334 
OLC C10 C11  sing N N 335 
OLC C9  C8   sing N N 336 
OLC C17 C16  sing N Z 337 
OLC C11 C12  sing N N 338 
OLC C8  C7   sing N N 339 
OLC C24 C22  sing N N 340 
OLC C24 O25  sing N N 341 
OLC C16 C15  sing N N 342 
OLC C12 C13  sing N N 343 
OLC C7  C6   sing N N 344 
OLC C15 C14  sing N N 345 
OLC C13 C14  sing N N 346 
OLC C6  C5   sing N N 347 
OLC C5  C4   sing N N 348 
OLC C4  C3   sing N N 349 
OLC C3  C2   sing N N 350 
OLC C2  C1   sing N N 351 
OLC C21 C22  sing N N 352 
OLC C21 O20  sing N N 353 
OLC C1  O19  doub N N 354 
OLC C1  O20  sing N N 355 
OLC C22 O23  sing N N 356 
OLC C18 H18  sing N N 357 
OLC C18 H18A sing N N 358 
OLC C18 H18B sing N N 359 
OLC C10 H10  sing N N 360 
OLC C9  H9   sing N N 361 
OLC C17 H17  sing N N 362 
OLC C17 H17A sing N N 363 
OLC C11 H11  sing N N 364 
OLC C11 H11A sing N N 365 
OLC C8  H8   sing N N 366 
OLC C8  H8A  sing N N 367 
OLC C24 H24  sing N N 368 
OLC C24 H24A sing N N 369 
OLC C16 H16  sing N N 370 
OLC C16 H16A sing N N 371 
OLC C12 H12  sing N N 372 
OLC C12 H12A sing N N 373 
OLC C7  H7   sing N N 374 
OLC C7  H7A  sing N N 375 
OLC C15 H15  sing N N 376 
OLC C15 H15A sing N N 377 
OLC C13 H13  sing N N 378 
OLC C13 H13A sing N N 379 
OLC C6  H6   sing N N 380 
OLC C6  H6A  sing N N 381 
OLC C14 H14  sing N N 382 
OLC C14 H14A sing N N 383 
OLC C5  H5   sing N N 384 
OLC C5  H5A  sing N N 385 
OLC C4  H4   sing N N 386 
OLC C4  H4A  sing N N 387 
OLC C3  H3   sing N N 388 
OLC C3  H3A  sing N N 389 
OLC C2  H2   sing N N 390 
OLC C2  H2A  sing N N 391 
OLC C21 H21  sing N N 392 
OLC C21 H21A sing N N 393 
OLC C22 H22  sing N N 394 
OLC O25 HO25 sing N N 395 
OLC O23 HO23 sing N N 396 
PHE N   CA   sing N N 397 
PHE N   H    sing N N 398 
PHE N   H2   sing N N 399 
PHE CA  C    sing N N 400 
PHE CA  CB   sing N N 401 
PHE CA  HA   sing N N 402 
PHE C   O    doub N N 403 
PHE C   OXT  sing N N 404 
PHE CB  CG   sing N N 405 
PHE CB  HB2  sing N N 406 
PHE CB  HB3  sing N N 407 
PHE CG  CD1  doub Y N 408 
PHE CG  CD2  sing Y N 409 
PHE CD1 CE1  sing Y N 410 
PHE CD1 HD1  sing N N 411 
PHE CD2 CE2  doub Y N 412 
PHE CD2 HD2  sing N N 413 
PHE CE1 CZ   doub Y N 414 
PHE CE1 HE1  sing N N 415 
PHE CE2 CZ   sing Y N 416 
PHE CE2 HE2  sing N N 417 
PHE CZ  HZ   sing N N 418 
PHE OXT HXT  sing N N 419 
PRO N   CA   sing N N 420 
PRO N   CD   sing N N 421 
PRO N   H    sing N N 422 
PRO CA  C    sing N N 423 
PRO CA  CB   sing N N 424 
PRO CA  HA   sing N N 425 
PRO C   O    doub N N 426 
PRO C   OXT  sing N N 427 
PRO CB  CG   sing N N 428 
PRO CB  HB2  sing N N 429 
PRO CB  HB3  sing N N 430 
PRO CG  CD   sing N N 431 
PRO CG  HG2  sing N N 432 
PRO CG  HG3  sing N N 433 
PRO CD  HD2  sing N N 434 
PRO CD  HD3  sing N N 435 
PRO OXT HXT  sing N N 436 
RET C1  C2   sing N N 437 
RET C1  C6   sing N N 438 
RET C1  C16  sing N N 439 
RET C1  C17  sing N N 440 
RET C2  C3   sing N N 441 
RET C2  H21  sing N N 442 
RET C2  H22  sing N N 443 
RET C3  C4   sing N N 444 
RET C3  H31  sing N N 445 
RET C3  H32  sing N N 446 
RET C4  C5   sing N N 447 
RET C4  H41  sing N N 448 
RET C4  H42  sing N N 449 
RET C5  C6   doub N N 450 
RET C5  C18  sing N N 451 
RET C6  C7   sing N N 452 
RET C7  C8   doub N E 453 
RET C7  H7   sing N N 454 
RET C8  C9   sing N N 455 
RET C8  H8   sing N N 456 
RET C9  C10  doub N E 457 
RET C9  C19  sing N N 458 
RET C10 C11  sing N N 459 
RET C10 H10  sing N N 460 
RET C11 C12  doub N E 461 
RET C11 H11  sing N N 462 
RET C12 C13  sing N N 463 
RET C12 H12  sing N N 464 
RET C13 C14  doub N E 465 
RET C13 C20  sing N N 466 
RET C14 C15  sing N N 467 
RET C14 H14  sing N N 468 
RET C15 O1   doub N N 469 
RET C15 H15  sing N N 470 
RET C16 H161 sing N N 471 
RET C16 H162 sing N N 472 
RET C16 H163 sing N N 473 
RET C17 H171 sing N N 474 
RET C17 H172 sing N N 475 
RET C17 H173 sing N N 476 
RET C18 H181 sing N N 477 
RET C18 H182 sing N N 478 
RET C18 H183 sing N N 479 
RET C19 H191 sing N N 480 
RET C19 H192 sing N N 481 
RET C19 H193 sing N N 482 
RET C20 H201 sing N N 483 
RET C20 H202 sing N N 484 
RET C20 H203 sing N N 485 
SER N   CA   sing N N 486 
SER N   H    sing N N 487 
SER N   H2   sing N N 488 
SER CA  C    sing N N 489 
SER CA  CB   sing N N 490 
SER CA  HA   sing N N 491 
SER C   O    doub N N 492 
SER C   OXT  sing N N 493 
SER CB  OG   sing N N 494 
SER CB  HB2  sing N N 495 
SER CB  HB3  sing N N 496 
SER OG  HG   sing N N 497 
SER OXT HXT  sing N N 498 
THR N   CA   sing N N 499 
THR N   H    sing N N 500 
THR N   H2   sing N N 501 
THR CA  C    sing N N 502 
THR CA  CB   sing N N 503 
THR CA  HA   sing N N 504 
THR C   O    doub N N 505 
THR C   OXT  sing N N 506 
THR CB  OG1  sing N N 507 
THR CB  CG2  sing N N 508 
THR CB  HB   sing N N 509 
THR OG1 HG1  sing N N 510 
THR CG2 HG21 sing N N 511 
THR CG2 HG22 sing N N 512 
THR CG2 HG23 sing N N 513 
THR OXT HXT  sing N N 514 
TRP N   CA   sing N N 515 
TRP N   H    sing N N 516 
TRP N   H2   sing N N 517 
TRP CA  C    sing N N 518 
TRP CA  CB   sing N N 519 
TRP CA  HA   sing N N 520 
TRP C   O    doub N N 521 
TRP C   OXT  sing N N 522 
TRP CB  CG   sing N N 523 
TRP CB  HB2  sing N N 524 
TRP CB  HB3  sing N N 525 
TRP CG  CD1  doub Y N 526 
TRP CG  CD2  sing Y N 527 
TRP CD1 NE1  sing Y N 528 
TRP CD1 HD1  sing N N 529 
TRP CD2 CE2  doub Y N 530 
TRP CD2 CE3  sing Y N 531 
TRP NE1 CE2  sing Y N 532 
TRP NE1 HE1  sing N N 533 
TRP CE2 CZ2  sing Y N 534 
TRP CE3 CZ3  doub Y N 535 
TRP CE3 HE3  sing N N 536 
TRP CZ2 CH2  doub Y N 537 
TRP CZ2 HZ2  sing N N 538 
TRP CZ3 CH2  sing Y N 539 
TRP CZ3 HZ3  sing N N 540 
TRP CH2 HH2  sing N N 541 
TRP OXT HXT  sing N N 542 
TYR N   CA   sing N N 543 
TYR N   H    sing N N 544 
TYR N   H2   sing N N 545 
TYR CA  C    sing N N 546 
TYR CA  CB   sing N N 547 
TYR CA  HA   sing N N 548 
TYR C   O    doub N N 549 
TYR C   OXT  sing N N 550 
TYR CB  CG   sing N N 551 
TYR CB  HB2  sing N N 552 
TYR CB  HB3  sing N N 553 
TYR CG  CD1  doub Y N 554 
TYR CG  CD2  sing Y N 555 
TYR CD1 CE1  sing Y N 556 
TYR CD1 HD1  sing N N 557 
TYR CD2 CE2  doub Y N 558 
TYR CD2 HD2  sing N N 559 
TYR CE1 CZ   doub Y N 560 
TYR CE1 HE1  sing N N 561 
TYR CE2 CZ   sing Y N 562 
TYR CE2 HE2  sing N N 563 
TYR CZ  OH   sing N N 564 
TYR OH  HH   sing N N 565 
TYR OXT HXT  sing N N 566 
VAL N   CA   sing N N 567 
VAL N   H    sing N N 568 
VAL N   H2   sing N N 569 
VAL CA  C    sing N N 570 
VAL CA  CB   sing N N 571 
VAL CA  HA   sing N N 572 
VAL C   O    doub N N 573 
VAL C   OXT  sing N N 574 
VAL CB  CG1  sing N N 575 
VAL CB  CG2  sing N N 576 
VAL CB  HB   sing N N 577 
VAL CG1 HG11 sing N N 578 
VAL CG1 HG12 sing N N 579 
VAL CG1 HG13 sing N N 580 
VAL CG2 HG21 sing N N 581 
VAL CG2 HG22 sing N N 582 
VAL CG2 HG23 sing N N 583 
VAL OXT HXT  sing N N 584 
# 
_pdbx_audit_support.funding_organization   Innosuisse 
_pdbx_audit_support.country                'European Union' 
_pdbx_audit_support.grant_number           '42711.1 IP-LS' 
_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   6g7h 
_pdbx_initial_refinement_model.details          ? 
# 
_atom_sites.entry_id                    9F9J 
_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]   0.015886 
_atom_sites.fract_transf_matrix[1][2]   0.009172 
_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]   0.018343 
_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]   0.008953 
_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 
C 
H 
N 
O 
S 
# 
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 1   ? 25.855 22.524 11.834 1.00 201.44 ? 4   ALA A N    1 
ATOM   2    C CA   . ALA A 1 1   ? 26.239 23.898 12.241 1.00 182.77 ? 4   ALA A CA   1 
ATOM   3    C C    . ALA A 1 1   ? 25.001 24.788 12.366 1.00 154.09 ? 4   ALA A C    1 
ATOM   4    O O    . ALA A 1 1   ? 24.224 24.834 11.398 1.00 184.47 ? 4   ALA A O    1 
ATOM   5    C CB   . ALA A 1 1   ? 27.207 24.470 11.236 1.00 176.16 ? 4   ALA A CB   1 
ATOM   6    N N    . THR A 1 2   ? 24.824 25.459 13.509 1.00 122.82 ? 5   THR A N    1 
ATOM   7    C CA   . THR A 1 2   ? 23.701 26.427 13.636 1.00 97.06  ? 5   THR A CA   1 
ATOM   8    C C    . THR A 1 2   ? 24.111 27.686 12.878 1.00 94.45  ? 5   THR A C    1 
ATOM   9    O O    . THR A 1 2   ? 25.287 28.062 12.981 1.00 96.13  ? 5   THR A O    1 
ATOM   10   C CB   . THR A 1 2   ? 23.349 26.693 15.102 1.00 92.28  ? 5   THR A CB   1 
ATOM   11   O OG1  . THR A 1 2   ? 22.352 25.747 15.485 1.00 101.70 ? 5   THR A OG1  1 
ATOM   12   C CG2  . THR A 1 2   ? 22.842 28.094 15.355 1.00 74.64  ? 5   THR A CG2  1 
ATOM   13   H HA   . THR A 1 2   ? 22.913 26.040 13.192 0.00 116.52 ? 5   THR A HA   1 
ATOM   14   H HB   . THR A 1 2   ? 24.159 26.545 15.646 0.00 110.78 ? 5   THR A HB   1 
ATOM   15   H HG1  . THR A 1 2   ? 22.511 25.005 15.109 0.00 122.09 ? 5   THR A HG1  1 
ATOM   16   H HG21 . THR A 1 2   ? 23.576 28.729 15.265 0.00 89.62  ? 5   THR A HG21 1 
ATOM   17   H HG22 . THR A 1 2   ? 22.145 28.308 14.710 0.00 89.62  ? 5   THR A HG22 1 
ATOM   18   H HG23 . THR A 1 2   ? 22.478 28.149 16.256 0.00 89.62  ? 5   THR A HG23 1 
ATOM   19   N N    . GLY A 1 3   ? 23.194 28.307 12.144 1.00 83.33  ? 6   GLY A N    1 
ATOM   20   C CA   . GLY A 1 3   ? 23.520 29.472 11.303 1.00 68.22  ? 6   GLY A CA   1 
ATOM   21   C C    . GLY A 1 3   ? 23.623 30.759 12.095 1.00 65.02  ? 6   GLY A C    1 
ATOM   22   O O    . GLY A 1 3   ? 24.138 31.735 11.539 1.00 73.17  ? 6   GLY A O    1 
ATOM   23   H H    . GLY A 1 3   ? 22.320 28.056 12.136 0.00 100.05 ? 6   GLY A H    1 
ATOM   24   H HA2  . GLY A 1 3   ? 24.380 29.304 10.843 0.00 81.92  ? 6   GLY A HA2  1 
ATOM   25   H HA3  . GLY A 1 3   ? 22.820 29.573 10.612 0.00 81.92  ? 6   GLY A HA3  1 
ATOM   26   N N    . ARG A 1 4   ? 23.153 30.771 13.337 1.00 63.16  ? 7   ARG A N    1 
ATOM   27   C CA   . ARG A 1 4   ? 23.150 31.994 14.177 1.00 65.90  ? 7   ARG A CA   1 
ATOM   28   C C    . ARG A 1 4   ? 24.498 32.109 14.888 1.00 57.54  ? 7   ARG A C    1 
ATOM   29   O O    . ARG A 1 4   ? 24.821 31.217 15.656 1.00 53.17  ? 7   ARG A O    1 
ATOM   30   C CB   . ARG A 1 4   ? 21.984 31.951 15.161 1.00 58.40  ? 7   ARG A CB   1 
ATOM   31   C CG   . ARG A 1 4   ? 20.654 32.378 14.565 1.00 65.80  ? 7   ARG A CG   1 
ATOM   32   C CD   . ARG A 1 4   ? 19.545 32.223 15.579 1.00 69.08  ? 7   ARG A CD   1 
ATOM   33   N NE   . ARG A 1 4   ? 19.360 30.831 15.957 1.00 74.38  ? 7   ARG A NE   1 
ATOM   34   C CZ   . ARG A 1 4   ? 18.788 30.423 17.083 1.00 62.95  ? 7   ARG A CZ   1 
ATOM   35   N NH1  . ARG A 1 4   ? 18.808 31.187 18.159 1.00 51.02  ? 7   ARG A NH1  1 
ATOM   36   N NH2  . ARG A 1 4   ? 18.200 29.242 17.134 1.00 76.58  ? 7   ARG A NH2  1 
ATOM   37   H H    . ARG A 1 4   ? 22.779 30.049 13.728 0.00 75.85  ? 7   ARG A H    1 
ATOM   38   H HA   . ARG A 1 4   ? 23.029 32.767 13.588 0.00 79.13  ? 7   ARG A HA   1 
ATOM   39   H HB2  . ARG A 1 4   ? 21.899 31.037 15.503 0.00 70.14  ? 7   ARG A HB2  1 
ATOM   40   H HB3  . ARG A 1 4   ? 22.194 32.537 15.917 0.00 70.14  ? 7   ARG A HB3  1 
ATOM   41   H HG2  . ARG A 1 4   ? 20.707 33.315 14.281 0.00 79.02  ? 7   ARG A HG2  1 
ATOM   42   H HG3  . ARG A 1 4   ? 20.456 31.827 13.779 0.00 79.02  ? 7   ARG A HG3  1 
ATOM   43   H HD2  . ARG A 1 4   ? 19.765 32.749 16.375 0.00 82.95  ? 7   ARG A HD2  1 
ATOM   44   H HD3  . ARG A 1 4   ? 18.708 32.573 15.205 0.00 82.95  ? 7   ARG A HD3  1 
ATOM   45   H HE   . ARG A 1 4   ? 19.649 30.220 15.408 0.00 89.30  ? 7   ARG A HE   1 
ATOM   46   H HH11 . ARG A 1 4   ? 18.499 32.012 18.118 0.00 61.27  ? 7   ARG A HH11 1 
ATOM   47   H HH12 . ARG A 1 4   ? 19.124 30.869 18.918 0.00 61.27  ? 7   ARG A HH12 1 
ATOM   48   H HH21 . ARG A 1 4   ? 18.105 28.769 16.400 0.00 91.95  ? 7   ARG A HH21 1 
ATOM   49   H HH22 . ARG A 1 4   ? 17.902 28.935 17.903 0.00 91.95  ? 7   ARG A HH22 1 
ATOM   50   N N    . PRO A 1 5   ? 25.280 33.183 14.666 1.00 57.07  ? 8   PRO A N    1 
ATOM   51   C CA   . PRO A 1 5   ? 26.608 33.319 15.262 1.00 60.75  ? 8   PRO A CA   1 
ATOM   52   C C    . PRO A 1 5   ? 26.564 33.404 16.786 1.00 50.47  ? 8   PRO A C    1 
ATOM   53   O O    . PRO A 1 5   ? 27.555 33.080 17.392 1.00 57.02  ? 8   PRO A O    1 
ATOM   54   C CB   . PRO A 1 5   ? 27.108 34.645 14.682 1.00 66.91  ? 8   PRO A CB   1 
ATOM   55   C CG   . PRO A 1 5   ? 25.857 35.411 14.411 1.00 64.51  ? 8   PRO A CG   1 
ATOM   56   C CD   . PRO A 1 5   ? 24.917 34.357 13.877 1.00 63.56  ? 8   PRO A CD   1 
ATOM   57   H HA   . PRO A 1 5   ? 27.191 32.576 14.967 0.00 72.96  ? 8   PRO A HA   1 
ATOM   58   H HB2  . PRO A 1 5   ? 27.675 35.119 15.326 0.00 80.34  ? 8   PRO A HB2  1 
ATOM   59   H HB3  . PRO A 1 5   ? 27.614 34.500 13.856 0.00 80.34  ? 8   PRO A HB3  1 
ATOM   60   H HG2  . PRO A 1 5   ? 25.508 35.808 15.235 0.00 77.46  ? 8   PRO A HG2  1 
ATOM   61   H HG3  . PRO A 1 5   ? 26.009 36.117 13.751 0.00 77.46  ? 8   PRO A HG3  1 
ATOM   62   H HD2  . PRO A 1 5   ? 23.987 34.608 14.025 0.00 76.32  ? 8   PRO A HD2  1 
ATOM   63   H HD3  . PRO A 1 5   ? 25.062 34.201 12.926 0.00 76.32  ? 8   PRO A HD3  1 
ATOM   64   N N    . GLU A 1 6   ? 25.435 33.813 17.356 1.00 44.34  ? 9   GLU A N    1 
ATOM   65   C CA   . GLU A 1 6   ? 25.258 33.955 18.796 1.00 43.57  ? 9   GLU A CA   1 
ATOM   66   C C    . GLU A 1 6   ? 24.914 32.641 19.487 1.00 52.27  ? 9   GLU A C    1 
ATOM   67   O O    . GLU A 1 6   ? 24.696 32.643 20.703 1.00 42.43  ? 9   GLU A O    1 
ATOM   68   C CB   . GLU A 1 6   ? 24.168 34.992 19.096 1.00 51.34  ? 9   GLU A CB   1 
ATOM   69   C CG   . GLU A 1 6   ? 22.749 34.584 18.700 1.00 35.92  ? 9   GLU A CG   1 
ATOM   70   C CD   . GLU A 1 6   ? 22.408 34.949 17.270 1.00 58.15  ? 9   GLU A CD   1 
ATOM   71   O OE1  . GLU A 1 6   ? 23.341 35.182 16.472 1.00 54.45  ? 9   GLU A OE1  1 
ATOM   72   O OE2  . GLU A 1 6   ? 21.204 35.003 16.942 1.00 56.94  ? 9   GLU A OE2  1 
ATOM   73   H H    . GLU A 1 6   ? 24.734 33.997 16.894 0.00 53.26  ? 9   GLU A H    1 
ATOM   74   H HA   . GLU A 1 6   ? 26.091 34.279 19.174 0.00 52.34  ? 9   GLU A HA   1 
ATOM   75   H HB2  . GLU A 1 6   ? 24.164 35.163 20.050 0.00 61.66  ? 9   GLU A HB2  1 
ATOM   76   H HB3  . GLU A 1 6   ? 24.380 35.806 18.613 0.00 61.66  ? 9   GLU A HB3  1 
ATOM   77   H HG2  . GLU A 1 6   ? 22.660 33.623 18.793 0.00 43.16  ? 9   GLU A HG2  1 
ATOM   78   H HG3  . GLU A 1 6   ? 22.117 35.034 19.283 0.00 43.16  ? 9   GLU A HG3  1 
ATOM   79   N N    . TRP A 1 7   ? 24.867 31.527 18.753 1.00 49.70  ? 10  TRP A N    1 
ATOM   80   C CA   . TRP A 1 7   ? 24.417 30.272 19.346 1.00 39.97  ? 10  TRP A CA   1 
ATOM   81   C C    . TRP A 1 7   ? 25.364 29.786 20.436 1.00 37.64  ? 10  TRP A C    1 
ATOM   82   O O    . TRP A 1 7   ? 24.920 29.161 21.405 1.00 40.00  ? 10  TRP A O    1 
ATOM   83   C CB   . TRP A 1 7   ? 24.265 29.204 18.260 1.00 42.23  ? 10  TRP A CB   1 
ATOM   84   C CG   . TRP A 1 7   ? 25.548 28.516 17.877 1.00 54.72  ? 10  TRP A CG   1 
ATOM   85   C CD1  . TRP A 1 7   ? 26.344 28.802 16.806 1.00 74.40  ? 10  TRP A CD1  1 
ATOM   86   C CD2  . TRP A 1 7   ? 26.171 27.416 18.555 1.00 52.91  ? 10  TRP A CD2  1 
ATOM   87   N NE1  . TRP A 1 7   ? 27.425 27.955 16.779 1.00 75.94  ? 10  TRP A NE1  1 
ATOM   88   C CE2  . TRP A 1 7   ? 27.343 27.095 17.842 1.00 70.41  ? 10  TRP A CE2  1 
ATOM   89   C CE3  . TRP A 1 7   ? 25.854 26.676 19.699 1.00 62.65  ? 10  TRP A CE3  1 
ATOM   90   C CZ2  . TRP A 1 7   ? 28.197 26.066 18.234 1.00 84.47  ? 10  TRP A CZ2  1 
ATOM   91   C CZ3  . TRP A 1 7   ? 26.704 25.656 20.087 1.00 65.07  ? 10  TRP A CZ3  1 
ATOM   92   C CH2  . TRP A 1 7   ? 27.861 25.360 19.356 1.00 71.65  ? 10  TRP A CH2  1 
ATOM   93   H H    . TRP A 1 7   ? 25.087 31.473 17.924 0.00 59.69  ? 10  TRP A H    1 
ATOM   94   H HA   . TRP A 1 7   ? 23.548 30.416 19.752 0.00 48.02  ? 10  TRP A HA   1 
ATOM   95   H HB2  . TRP A 1 7   ? 23.652 28.524 18.580 0.00 50.73  ? 10  TRP A HB2  1 
ATOM   96   H HB3  . TRP A 1 7   ? 23.908 29.624 17.462 0.00 50.73  ? 10  TRP A HB3  1 
ATOM   97   H HD1  . TRP A 1 7   ? 26.178 29.473 16.184 0.00 89.33  ? 10  TRP A HD1  1 
ATOM   98   H HE1  . TRP A 1 7   ? 28.052 27.963 16.190 0.00 91.18  ? 10  TRP A HE1  1 
ATOM   99   H HE3  . TRP A 1 7   ? 25.087 26.866 20.189 0.00 75.23  ? 10  TRP A HE3  1 
ATOM   100  H HZ2  . TRP A 1 7   ? 28.967 25.868 17.751 0.00 101.42 ? 10  TRP A HZ2  1 
ATOM   101  H HZ3  . TRP A 1 7   ? 26.503 25.157 20.846 0.00 78.14  ? 10  TRP A HZ3  1 
ATOM   102  H HH2  . TRP A 1 7   ? 28.414 24.669 19.640 0.00 86.03  ? 10  TRP A HH2  1 
ATOM   103  N N    . ILE A 1 8   ? 26.665 30.051 20.295 1.00 42.66  ? 11  ILE A N    1 
ATOM   104  C CA   . ILE A 1 8   ? 27.626 29.564 21.281 1.00 41.43  ? 11  ILE A CA   1 
ATOM   105  C C    . ILE A 1 8   ? 27.341 30.171 22.650 1.00 39.21  ? 11  ILE A C    1 
ATOM   106  O O    . ILE A 1 8   ? 27.498 29.511 23.684 1.00 44.85  ? 11  ILE A O    1 
ATOM   107  C CB   . ILE A 1 8   ? 29.068 29.856 20.815 1.00 42.95  ? 11  ILE A CB   1 
ATOM   108  C CG1  . ILE A 1 8   ? 30.093 29.357 21.842 1.00 74.65  ? 11  ILE A CG1  1 
ATOM   109  C CG2  . ILE A 1 8   ? 29.270 31.344 20.559 1.00 45.69  ? 11  ILE A CG2  1 
ATOM   110  C CD1  . ILE A 1 8   ? 29.854 27.948 22.350 1.00 69.62  ? 11  ILE A CD1  1 
ATOM   111  H H    . ILE A 1 8   ? 27.009 30.503 19.649 0.00 51.24  ? 11  ILE A H    1 
ATOM   112  H HA   . ILE A 1 8   ? 27.528 28.602 21.357 0.00 49.77  ? 11  ILE A HA   1 
ATOM   113  H HB   . ILE A 1 8   ? 29.203 29.374 19.984 0.00 51.59  ? 11  ILE A HB   1 
ATOM   114  H HG12 . ILE A 1 8   ? 30.972 29.373 21.431 0.00 89.63  ? 11  ILE A HG12 1 
ATOM   115  H HG13 . ILE A 1 8   ? 30.075 29.951 22.609 0.00 89.63  ? 11  ILE A HG13 1 
ATOM   116  H HG21 . ILE A 1 8   ? 30.183 31.493 20.268 0.00 54.88  ? 11  ILE A HG21 1 
ATOM   117  H HG22 . ILE A 1 8   ? 28.652 31.633 19.869 0.00 54.88  ? 11  ILE A HG22 1 
ATOM   118  H HG23 . ILE A 1 8   ? 29.100 31.832 21.379 0.00 54.88  ? 11  ILE A HG23 1 
ATOM   119  H HD11 . ILE A 1 8   ? 30.629 27.660 22.858 0.00 83.59  ? 11  ILE A HD11 1 
ATOM   120  H HD12 . ILE A 1 8   ? 29.067 27.946 22.917 0.00 83.59  ? 11  ILE A HD12 1 
ATOM   121  H HD13 . ILE A 1 8   ? 29.718 27.358 21.593 0.00 83.59  ? 11  ILE A HD13 1 
ATOM   122  N N    . TRP A 1 9   ? 26.906 31.432 22.681 1.00 42.40  ? 12  TRP A N    1 
ATOM   123  C CA   . TRP A 1 9   ? 26.614 32.071 23.959 1.00 41.67  ? 12  TRP A CA   1 
ATOM   124  C C    . TRP A 1 9   ? 25.269 31.630 24.522 1.00 43.90  ? 12  TRP A C    1 
ATOM   125  O O    . TRP A 1 9   ? 25.103 31.585 25.746 1.00 44.06  ? 12  TRP A O    1 
ATOM   126  C CB   . TRP A 1 9   ? 26.656 33.592 23.809 1.00 38.81  ? 12  TRP A CB   1 
ATOM   127  C CG   . TRP A 1 9   ? 27.861 34.070 23.057 1.00 50.70  ? 12  TRP A CG   1 
ATOM   128  C CD1  . TRP A 1 9   ? 27.875 34.841 21.932 1.00 42.99  ? 12  TRP A CD1  1 
ATOM   129  C CD2  . TRP A 1 9   ? 29.231 33.779 23.361 1.00 52.07  ? 12  TRP A CD2  1 
ATOM   130  N NE1  . TRP A 1 9   ? 29.169 35.062 21.526 1.00 38.83  ? 12  TRP A NE1  1 
ATOM   131  C CE2  . TRP A 1 9   ? 30.020 34.418 22.386 1.00 44.63  ? 12  TRP A CE2  1 
ATOM   132  C CE3  . TRP A 1 9   ? 29.866 33.043 24.367 1.00 52.49  ? 12  TRP A CE3  1 
ATOM   133  C CZ2  . TRP A 1 9   ? 31.411 34.347 22.386 1.00 49.56  ? 12  TRP A CZ2  1 
ATOM   134  C CZ3  . TRP A 1 9   ? 31.247 32.974 24.366 1.00 65.59  ? 12  TRP A CZ3  1 
ATOM   135  C CH2  . TRP A 1 9   ? 32.004 33.621 23.382 1.00 57.78  ? 12  TRP A CH2  1 
ATOM   136  H H    . TRP A 1 9   ? 26.776 31.927 21.991 0.00 50.94  ? 12  TRP A H    1 
ATOM   137  H HA   . TRP A 1 9   ? 27.298 31.820 24.599 0.00 50.06  ? 12  TRP A HA   1 
ATOM   138  H HB2  . TRP A 1 9   ? 25.867 33.884 23.326 0.00 46.63  ? 12  TRP A HB2  1 
ATOM   139  H HB3  . TRP A 1 9   ? 26.674 33.996 24.691 0.00 46.63  ? 12  TRP A HB3  1 
ATOM   140  H HD1  . TRP A 1 9   ? 27.118 35.170 21.503 0.00 51.64  ? 12  TRP A HD1  1 
ATOM   141  H HE1  . TRP A 1 9   ? 29.406 35.528 20.844 0.00 46.64  ? 12  TRP A HE1  1 
ATOM   142  H HE3  . TRP A 1 9   ? 29.369 32.609 25.023 0.00 63.03  ? 12  TRP A HE3  1 
ATOM   143  H HZ2  . TRP A 1 9   ? 31.917 34.776 21.734 0.00 59.52  ? 12  TRP A HZ2  1 
ATOM   144  H HZ3  . TRP A 1 9   ? 31.680 32.489 25.030 0.00 78.76  ? 12  TRP A HZ3  1 
ATOM   145  H HH2  . TRP A 1 9   ? 32.932 33.557 23.407 0.00 69.38  ? 12  TRP A HH2  1 
ATOM   146  N N    . LEU A 1 10  ? 24.304 31.300 23.660 1.00 37.63  ? 13  LEU A N    1 
ATOM   147  C CA   . LEU A 1 10  ? 23.044 30.748 24.148 1.00 39.75  ? 13  LEU A CA   1 
ATOM   148  C C    . LEU A 1 10  ? 23.241 29.341 24.700 1.00 41.63  ? 13  LEU A C    1 
ATOM   149  O O    . LEU A 1 10  ? 22.623 28.970 25.705 1.00 42.45  ? 13  LEU A O    1 
ATOM   150  C CB   . LEU A 1 10  ? 21.998 30.743 23.033 1.00 34.82  ? 13  LEU A CB   1 
ATOM   151  C CG   . LEU A 1 10  ? 21.719 32.082 22.347 1.00 47.46  ? 13  LEU A CG   1 
ATOM   152  C CD1  . LEU A 1 10  ? 20.633 31.925 21.295 1.00 44.69  ? 13  LEU A CD1  1 
ATOM   153  C CD2  . LEU A 1 10  ? 21.316 33.135 23.367 1.00 52.68  ? 13  LEU A CD2  1 
ATOM   154  H H    . LEU A 1 10  ? 24.354 31.386 22.806 0.00 45.21  ? 13  LEU A H    1 
ATOM   155  H HA   . LEU A 1 10  ? 22.713 31.312 24.864 0.00 47.75  ? 13  LEU A HA   1 
ATOM   156  H HB2  . LEU A 1 10  ? 22.297 30.128 22.344 0.00 41.84  ? 13  LEU A HB2  1 
ATOM   157  H HB3  . LEU A 1 10  ? 21.159 30.437 23.410 0.00 41.84  ? 13  LEU A HB3  1 
ATOM   158  H HG   . LEU A 1 10  ? 22.529 32.383 21.907 0.00 57.01  ? 13  LEU A HG   1 
ATOM   159  H HD11 . LEU A 1 10  ? 20.488 32.780 20.860 0.00 53.68  ? 13  LEU A HD11 1 
ATOM   160  H HD12 . LEU A 1 10  ? 20.918 31.266 20.643 0.00 53.68  ? 13  LEU A HD12 1 
ATOM   161  H HD13 . LEU A 1 10  ? 19.815 31.631 21.727 0.00 53.68  ? 13  LEU A HD13 1 
ATOM   162  H HD21 . LEU A 1 10  ? 21.063 33.947 22.901 0.00 63.27  ? 13  LEU A HD21 1 
ATOM   163  H HD22 . LEU A 1 10  ? 20.565 32.803 23.884 0.00 63.27  ? 13  LEU A HD22 1 
ATOM   164  H HD23 . LEU A 1 10  ? 22.069 33.312 23.953 0.00 63.27  ? 13  LEU A HD23 1 
ATOM   165  N N    . ALA A 1 11  ? 24.097 28.543 24.057 1.00 38.91  ? 14  ALA A N    1 
ATOM   166  C CA   . ALA A 1 11  ? 24.373 27.202 24.561 1.00 38.79  ? 14  ALA A CA   1 
ATOM   167  C C    . ALA A 1 11  ? 25.074 27.256 25.912 1.00 44.06  ? 14  ALA A C    1 
ATOM   168  O O    . ALA A 1 11  ? 24.715 26.516 26.835 1.00 39.57  ? 14  ALA A O    1 
ATOM   169  C CB   . ALA A 1 11  ? 25.218 26.426 23.551 1.00 38.94  ? 14  ALA A CB   1 
ATOM   170  H H    . ALA A 1 11  ? 24.523 28.752 23.340 0.00 46.75  ? 14  ALA A H    1 
ATOM   171  H HA   . ALA A 1 11  ? 23.531 26.732 24.674 0.00 46.60  ? 14  ALA A HA   1 
ATOM   172  H HB1  . ALA A 1 11  ? 25.389 25.537 23.899 0.00 46.78  ? 14  ALA A HB1  1 
ATOM   173  H HB2  . ALA A 1 11  ? 24.733 26.366 22.713 0.00 46.78  ? 14  ALA A HB2  1 
ATOM   174  H HB3  . ALA A 1 11  ? 26.056 26.895 23.415 0.00 46.78  ? 14  ALA A HB3  1 
ATOM   175  N N    A LEU A 1 12  ? 26.078 28.126 26.047 0.36 45.34  ? 15  LEU A N    1 
ATOM   176  N N    B LEU A 1 12  ? 26.081 28.122 26.047 0.64 45.46  ? 15  LEU A N    1 
ATOM   177  C CA   A LEU A 1 12  ? 26.786 28.248 27.317 0.36 42.03  ? 15  LEU A CA   1 
ATOM   178  C CA   B LEU A 1 12  ? 26.782 28.242 27.320 0.64 41.94  ? 15  LEU A CA   1 
ATOM   179  C C    A LEU A 1 12  ? 25.862 28.764 28.414 0.36 45.95  ? 15  LEU A C    1 
ATOM   180  C C    B LEU A 1 12  ? 25.852 28.753 28.412 0.64 46.03  ? 15  LEU A C    1 
ATOM   181  O O    A LEU A 1 12  ? 25.931 28.307 29.561 0.36 39.37  ? 15  LEU A O    1 
ATOM   182  O O    B LEU A 1 12  ? 25.905 28.283 29.555 0.64 39.29  ? 15  LEU A O    1 
ATOM   183  C CB   A LEU A 1 12  ? 27.995 29.170 27.148 0.36 45.40  ? 15  LEU A CB   1 
ATOM   184  C CB   B LEU A 1 12  ? 27.990 29.166 27.168 0.64 45.37  ? 15  LEU A CB   1 
ATOM   185  C CG   A LEU A 1 12  ? 28.958 29.322 28.330 0.36 42.77  ? 15  LEU A CG   1 
ATOM   186  C CG   B LEU A 1 12  ? 29.145 28.592 26.345 0.64 46.95  ? 15  LEU A CG   1 
ATOM   187  C CD1  A LEU A 1 12  ? 29.384 27.972 28.882 0.36 48.09  ? 15  LEU A CD1  1 
ATOM   188  C CD1  B LEU A 1 12  ? 30.067 29.700 25.862 0.64 50.68  ? 15  LEU A CD1  1 
ATOM   189  C CD2  A LEU A 1 12  ? 30.176 30.128 27.903 0.36 57.23  ? 15  LEU A CD2  1 
ATOM   190  C CD2  B LEU A 1 12  ? 29.923 27.559 27.148 0.64 50.32  ? 15  LEU A CD2  1 
ATOM   191  H H    A LEU A 1 12  ? 26.363 28.649 25.427 0.36 54.46  ? 15  LEU A H    1 
ATOM   192  H H    B LEU A 1 12  ? 26.371 28.642 25.426 0.64 54.61  ? 15  LEU A H    1 
ATOM   193  H HA   A LEU A 1 12  ? 27.109 27.374 27.587 0.36 50.49  ? 15  LEU A HA   1 
ATOM   194  H HA   B LEU A 1 12  ? 27.106 27.366 27.585 0.64 50.37  ? 15  LEU A HA   1 
ATOM   195  H HB2  A LEU A 1 12  ? 28.520 28.833 26.404 0.36 54.53  ? 15  LEU A HB2  1 
ATOM   196  H HB2  B LEU A 1 12  ? 27.698 29.981 26.731 0.64 54.49  ? 15  LEU A HB2  1 
ATOM   197  H HB3  A LEU A 1 12  ? 27.662 30.057 26.944 0.36 54.53  ? 15  LEU A HB3  1 
ATOM   198  H HB3  B LEU A 1 12  ? 28.334 29.368 28.052 0.64 54.49  ? 15  LEU A HB3  1 
ATOM   199  H HG   A LEU A 1 12  ? 28.500 29.794 29.044 0.36 51.37  ? 15  LEU A HG   1 
ATOM   200  H HG   B LEU A 1 12  ? 28.778 28.148 25.565 0.64 56.39  ? 15  LEU A HG   1 
ATOM   201  H HD11 A LEU A 1 12  ? 30.080 28.107 29.543 0.36 57.76  ? 15  LEU A HD11 1 
ATOM   202  H HD11 B LEU A 1 12  ? 30.765 29.312 25.312 0.64 60.87  ? 15  LEU A HD11 1 
ATOM   203  H HD12 A LEU A 1 12  ? 28.617 27.542 29.291 0.36 57.76  ? 15  LEU A HD12 1 
ATOM   204  H HD12 B LEU A 1 12  ? 29.552 30.336 25.343 0.64 60.87  ? 15  LEU A HD12 1 
ATOM   205  H HD13 A LEU A 1 12  ? 29.720 27.426 28.154 0.36 57.76  ? 15  LEU A HD13 1 
ATOM   206  H HD13 B LEU A 1 12  ? 30.460 30.141 26.632 0.64 60.87  ? 15  LEU A HD13 1 
ATOM   207  H HD21 A LEU A 1 12  ? 30.693 30.360 28.691 0.36 68.73  ? 15  LEU A HD21 1 
ATOM   208  H HD21 B LEU A 1 12  ? 30.656 27.225 26.608 0.64 60.43  ? 15  LEU A HD21 1 
ATOM   209  H HD22 A LEU A 1 12  ? 30.714 29.591 27.301 0.36 68.73  ? 15  LEU A HD22 1 
ATOM   210  H HD22 B LEU A 1 12  ? 30.269 27.979 27.951 0.64 60.43  ? 15  LEU A HD22 1 
ATOM   211  H HD23 A LEU A 1 12  ? 29.880 30.934 27.453 0.36 68.73  ? 15  LEU A HD23 1 
ATOM   212  H HD23 B LEU A 1 12  ? 29.328 26.830 27.386 0.64 60.43  ? 15  LEU A HD23 1 
ATOM   213  N N    . GLY A 1 13  ? 24.989 29.715 28.080 1.00 37.58  ? 16  GLY A N    1 
ATOM   214  C CA   . GLY A 1 13  ? 24.046 30.215 29.066 1.00 45.24  ? 16  GLY A CA   1 
ATOM   215  C C    . GLY A 1 13  ? 23.066 29.152 29.523 1.00 39.50  ? 16  GLY A C    1 
ATOM   216  O O    . GLY A 1 13  ? 22.722 29.078 30.705 1.00 48.83  ? 16  GLY A O    1 
ATOM   217  H H    . GLY A 1 13  ? 24.936 30.082 27.304 0.00 45.15  ? 16  GLY A H    1 
ATOM   218  H HA2  . GLY A 1 13  ? 24.532 30.536 29.841 0.00 54.34  ? 16  GLY A HA2  1 
ATOM   219  H HA3  . GLY A 1 13  ? 23.542 30.951 28.683 0.00 54.34  ? 16  GLY A HA3  1 
ATOM   220  N N    . THR A 1 14  ? 22.601 28.314 28.592 1.00 40.40  ? 17  THR A N    1 
ATOM   221  C CA   . THR A 1 14  ? 21.701 27.227 28.961 1.00 47.09  ? 17  THR A CA   1 
ATOM   222  C C    . THR A 1 14  ? 22.378 26.260 29.925 1.00 44.44  ? 17  THR A C    1 
ATOM   223  O O    . THR A 1 14  ? 21.755 25.788 30.883 1.00 38.64  ? 17  THR A O    1 
ATOM   224  C CB   . THR A 1 14  ? 21.233 26.487 27.706 1.00 41.15  ? 17  THR A CB   1 
ATOM   225  O OG1  . THR A 1 14  ? 20.518 27.389 26.853 1.00 42.26  ? 17  THR A OG1  1 
ATOM   226  C CG2  . THR A 1 14  ? 20.325 25.321 28.073 1.00 44.06  ? 17  THR A CG2  1 
ATOM   227  H H    . THR A 1 14  ? 22.790 28.354 27.754 0.00 48.54  ? 17  THR A H    1 
ATOM   228  H HA   . THR A 1 14  ? 20.921 27.600 29.401 0.00 56.57  ? 17  THR A HA   1 
ATOM   229  H HB   . THR A 1 14  ? 22.006 26.137 27.236 0.00 49.43  ? 17  THR A HB   1 
ATOM   230  H HG1  . THR A 1 14  ? 20.255 26.986 26.164 0.00 50.76  ? 17  THR A HG1  1 
ATOM   231  H HG21 . THR A 1 14  ? 19.903 24.965 27.276 0.00 52.92  ? 17  THR A HG21 1 
ATOM   232  H HG22 . THR A 1 14  ? 20.842 24.618 28.497 0.00 52.92  ? 17  THR A HG22 1 
ATOM   233  H HG23 . THR A 1 14  ? 19.635 25.618 28.688 0.00 52.92  ? 17  THR A HG23 1 
ATOM   234  N N    . ALA A 1 15  ? 23.657 25.959 29.690 1.00 38.39  ? 18  ALA A N    1 
ATOM   235  C CA   . ALA A 1 15  ? 24.352 24.978 30.518 1.00 61.33  ? 18  ALA A CA   1 
ATOM   236  C C    . ALA A 1 15  ? 24.634 25.521 31.913 1.00 43.70  ? 18  ALA A C    1 
ATOM   237  O O    . ALA A 1 15  ? 24.497 24.797 32.906 1.00 45.05  ? 18  ALA A O    1 
ATOM   238  C CB   . ALA A 1 15  ? 25.651 24.550 29.836 1.00 54.11  ? 18  ALA A CB   1 
ATOM   239  H H    . ALA A 1 15  ? 24.137 26.304 29.066 0.00 46.12  ? 18  ALA A H    1 
ATOM   240  H HA   . ALA A 1 15  ? 23.786 24.196 30.613 0.00 73.65  ? 18  ALA A HA   1 
ATOM   241  H HB1  . ALA A 1 15  ? 26.104 23.903 30.399 0.00 64.98  ? 18  ALA A HB1  1 
ATOM   242  H HB2  . ALA A 1 15  ? 25.441 24.151 28.977 0.00 64.98  ? 18  ALA A HB2  1 
ATOM   243  H HB3  . ALA A 1 15  ? 26.213 25.330 29.710 0.00 64.98  ? 18  ALA A HB3  1 
ATOM   244  N N    . LEU A 1 16  ? 25.036 26.790 32.013 1.00 42.80  ? 19  LEU A N    1 
ATOM   245  C CA   . LEU A 1 16  ? 25.335 27.359 33.323 1.00 41.71  ? 19  LEU A CA   1 
ATOM   246  C C    . LEU A 1 16  ? 24.069 27.519 34.156 1.00 41.95  ? 19  LEU A C    1 
ATOM   247  O O    . LEU A 1 16  ? 24.084 27.283 35.369 1.00 41.30  ? 19  LEU A O    1 
ATOM   248  C CB   . LEU A 1 16  ? 26.049 28.700 33.163 1.00 41.35  ? 19  LEU A CB   1 
ATOM   249  C CG   . LEU A 1 16  ? 27.436 28.627 32.523 1.00 56.21  ? 19  LEU A CG   1 
ATOM   250  C CD1  . LEU A 1 16  ? 27.957 30.021 32.212 1.00 39.44  ? 19  LEU A CD1  1 
ATOM   251  C CD2  . LEU A 1 16  ? 28.407 27.883 33.427 1.00 52.04  ? 19  LEU A CD2  1 
ATOM   252  H H    . LEU A 1 16  ? 25.142 27.329 31.351 0.00 51.41  ? 19  LEU A H    1 
ATOM   253  H HA   . LEU A 1 16  ? 25.931 26.758 33.796 0.00 50.10  ? 19  LEU A HA   1 
ATOM   254  H HB2  . LEU A 1 16  ? 25.501 29.274 32.605 0.00 49.67  ? 19  LEU A HB2  1 
ATOM   255  H HB3  . LEU A 1 16  ? 26.155 29.096 34.042 0.00 49.67  ? 19  LEU A HB3  1 
ATOM   256  H HG   . LEU A 1 16  ? 27.370 28.139 31.687 0.00 67.50  ? 19  LEU A HG   1 
ATOM   257  H HD11 . LEU A 1 16  ? 28.844 29.948 31.827 0.00 47.38  ? 19  LEU A HD11 1 
ATOM   258  H HD12 . LEU A 1 16  ? 27.357 30.448 31.581 0.00 47.38  ? 19  LEU A HD12 1 
ATOM   259  H HD13 . LEU A 1 16  ? 27.994 30.534 33.034 0.00 47.38  ? 19  LEU A HD13 1 
ATOM   260  H HD21 . LEU A 1 16  ? 29.302 27.960 33.061 0.00 62.50  ? 19  LEU A HD21 1 
ATOM   261  H HD22 . LEU A 1 16  ? 28.377 28.275 34.314 0.00 62.50  ? 19  LEU A HD22 1 
ATOM   262  H HD23 . LEU A 1 16  ? 28.146 26.949 33.470 0.00 62.50  ? 19  LEU A HD23 1 
ATOM   263  N N    . MET A 1 17  ? 22.964 27.922 33.525 1.00 38.30  ? 20  MET A N    1 
ATOM   264  C CA   . MET A 1 17  ? 21.703 28.014 34.251 1.00 48.61  ? 20  MET A CA   1 
ATOM   265  C C    . MET A 1 17  ? 21.246 26.635 34.711 1.00 47.35  ? 20  MET A C    1 
ATOM   266  O O    . MET A 1 17  ? 20.715 26.483 35.818 1.00 41.71  ? 20  MET A O    1 
ATOM   267  C CB   . MET A 1 17  ? 20.636 28.666 33.369 1.00 44.30  ? 20  MET A CB   1 
ATOM   268  C CG   . MET A 1 17  ? 20.864 30.151 33.089 1.00 41.47  ? 20  MET A CG   1 
ATOM   269  S SD   . MET A 1 17  ? 20.930 31.197 34.559 1.00 43.26  ? 20  MET A SD   1 
ATOM   270  C CE   . MET A 1 17  ? 21.326 32.783 33.828 1.00 52.30  ? 20  MET A CE   1 
ATOM   271  H H    . MET A 1 17  ? 22.921 28.142 32.695 0.00 46.01  ? 20  MET A H    1 
ATOM   272  H HA   . MET A 1 17  ? 21.828 28.581 35.027 0.00 58.38  ? 20  MET A HA   1 
ATOM   273  H HB2  . MET A 1 17  ? 20.618 28.206 32.515 0.00 53.21  ? 20  MET A HB2  1 
ATOM   274  H HB3  . MET A 1 17  ? 19.776 28.580 33.810 0.00 53.21  ? 20  MET A HB3  1 
ATOM   275  H HG2  . MET A 1 17  ? 21.709 30.251 32.623 0.00 49.82  ? 20  MET A HG2  1 
ATOM   276  H HG3  . MET A 1 17  ? 20.138 30.475 32.534 0.00 49.82  ? 20  MET A HG3  1 
ATOM   277  H HE1  . MET A 1 17  ? 21.390 33.448 34.532 0.00 62.82  ? 20  MET A HE1  1 
ATOM   278  H HE2  . MET A 1 17  ? 22.173 32.713 33.361 0.00 62.82  ? 20  MET A HE2  1 
ATOM   279  H HE3  . MET A 1 17  ? 20.624 33.028 33.205 0.00 62.82  ? 20  MET A HE3  1 
ATOM   280  N N    . GLY A 1 18  ? 21.450 25.616 33.875 1.00 38.64  ? 21  GLY A N    1 
ATOM   281  C CA   . GLY A 1 18  ? 21.060 24.269 34.261 1.00 41.84  ? 21  GLY A CA   1 
ATOM   282  C C    . GLY A 1 18  ? 21.901 23.732 35.403 1.00 45.88  ? 21  GLY A C    1 
ATOM   283  O O    . GLY A 1 18  ? 21.375 23.185 36.375 1.00 51.48  ? 21  GLY A O    1 
ATOM   284  H H    . GLY A 1 18  ? 21.805 25.679 33.094 0.00 46.42  ? 21  GLY A H    1 
ATOM   285  H HA2  . GLY A 1 18  ? 20.131 24.271 34.539 0.00 50.26  ? 21  GLY A HA2  1 
ATOM   286  H HA3  . GLY A 1 18  ? 21.161 23.675 33.501 0.00 50.26  ? 21  GLY A HA3  1 
ATOM   287  N N    . LEU A 1 19  ? 23.223 23.885 35.304 1.00 46.71  ? 22  LEU A N    1 
ATOM   288  C CA   . LEU A 1 19  ? 24.095 23.440 36.386 1.00 47.19  ? 22  LEU A CA   1 
ATOM   289  C C    . LEU A 1 19  ? 23.811 24.212 37.668 1.00 52.00  ? 22  LEU A C    1 
ATOM   290  O O    . LEU A 1 19  ? 23.898 23.657 38.770 1.00 44.11  ? 22  LEU A O    1 
ATOM   291  C CB   . LEU A 1 19  ? 25.559 23.596 35.975 1.00 48.56  ? 22  LEU A CB   1 
ATOM   292  C CG   . LEU A 1 19  ? 26.043 22.626 34.893 1.00 61.71  ? 22  LEU A CG   1 
ATOM   293  C CD1  . LEU A 1 19  ? 27.432 23.017 34.414 1.00 63.47  ? 22  LEU A CD1  1 
ATOM   294  C CD2  . LEU A 1 19  ? 26.029 21.184 35.388 1.00 70.22  ? 22  LEU A CD2  1 
ATOM   295  H H    . LEU A 1 19  ? 23.631 24.237 34.634 1.00 56.10  ? 22  LEU A H    1 
ATOM   296  H HA   . LEU A 1 19  ? 23.931 22.499 36.558 1.00 56.68  ? 22  LEU A HA   1 
ATOM   297  H HB2  . LEU A 1 19  ? 25.686 24.495 35.635 1.00 58.32  ? 22  LEU A HB2  1 
ATOM   298  H HB3  . LEU A 1 19  ? 26.112 23.455 36.759 1.00 58.32  ? 22  LEU A HB3  1 
ATOM   299  H HG   . LEU A 1 19  ? 25.433 22.677 34.140 1.00 74.10  ? 22  LEU A HG   1 
ATOM   300  H HD11 . LEU A 1 19  ? 27.727 22.379 33.747 1.00 76.22  ? 22  LEU A HD11 1 
ATOM   301  H HD12 . LEU A 1 19  ? 27.394 23.906 34.028 1.00 76.22  ? 22  LEU A HD12 1 
ATOM   302  H HD13 . LEU A 1 19  ? 28.040 23.011 35.170 1.00 76.22  ? 22  LEU A HD13 1 
ATOM   303  H HD21 . LEU A 1 19  ? 26.431 20.615 34.713 1.00 84.31  ? 22  LEU A HD21 1 
ATOM   304  H HD22 . LEU A 1 19  ? 26.537 21.129 36.213 1.00 84.31  ? 22  LEU A HD22 1 
ATOM   305  H HD23 . LEU A 1 19  ? 25.111 20.913 35.546 1.00 84.31  ? 22  LEU A HD23 1 
ATOM   306  N N    . GLY A 1 20  ? 23.471 25.496 37.544 1.00 50.66  ? 23  GLY A N    1 
ATOM   307  C CA   . GLY A 1 20  ? 23.115 26.271 38.720 1.00 45.73  ? 23  GLY A CA   1 
ATOM   308  C C    . GLY A 1 20  ? 21.836 25.780 39.369 1.00 51.73  ? 23  GLY A C    1 
ATOM   309  O O    . GLY A 1 20  ? 21.718 25.764 40.598 1.00 46.95  ? 23  GLY A O    1 
ATOM   310  H H    . GLY A 1 20  ? 23.440 25.930 36.802 0.00 60.84  ? 23  GLY A H    1 
ATOM   311  H HA2  . GLY A 1 20  ? 23.831 26.212 39.372 0.00 54.92  ? 23  GLY A HA2  1 
ATOM   312  H HA3  . GLY A 1 20  ? 22.993 27.200 38.468 0.00 54.92  ? 23  GLY A HA3  1 
ATOM   313  N N    . THR A 1 21  ? 20.859 25.374 38.556 1.00 46.51  ? 24  THR A N    1 
ATOM   314  C CA   . THR A 1 21  ? 19.626 24.820 39.102 1.00 46.35  ? 24  THR A CA   1 
ATOM   315  C C    . THR A 1 21  ? 19.905 23.542 39.884 1.00 43.35  ? 24  THR A C    1 
ATOM   316  O O    . THR A 1 21  ? 19.406 23.361 41.001 1.00 41.57  ? 24  THR A O    1 
ATOM   317  C CB   . THR A 1 21  ? 18.630 24.547 37.974 1.00 37.18  ? 24  THR A CB   1 
ATOM   318  O OG1  . THR A 1 21  ? 18.372 25.761 37.258 1.00 42.97  ? 24  THR A OG1  1 
ATOM   319  C CG2  . THR A 1 21  ? 17.319 24.007 38.535 1.00 36.94  ? 24  THR A CG2  1 
ATOM   320  H H    . THR A 1 21  ? 20.887 25.409 37.697 0.00 55.86  ? 24  THR A H    1 
ATOM   321  H HA   . THR A 1 21  ? 19.231 25.468 39.705 0.00 55.67  ? 24  THR A HA   1 
ATOM   322  H HB   . THR A 1 21  ? 19.000 23.885 37.369 0.00 44.66  ? 24  THR A HB   1 
ATOM   323  H HG1  . THR A 1 21  ? 19.082 26.047 36.913 0.00 51.61  ? 24  THR A HG1  1 
ATOM   324  H HG21 . THR A 1 21  ? 16.635 24.017 37.848 0.00 44.38  ? 24  THR A HG21 1 
ATOM   325  H HG22 . THR A 1 21  ? 17.441 23.096 38.845 0.00 44.38  ? 24  THR A HG22 1 
ATOM   326  H HG23 . THR A 1 21  ? 17.026 24.556 39.279 0.00 44.38  ? 24  THR A HG23 1 
ATOM   327  N N    . LEU A 1 22  ? 20.707 22.642 39.308 1.00 42.53  ? 25  LEU A N    1 
ATOM   328  C CA   . LEU A 1 22  ? 20.970 21.361 39.955 1.00 49.08  ? 25  LEU A CA   1 
ATOM   329  C C    . LEU A 1 22  ? 21.798 21.529 41.222 1.00 50.01  ? 25  LEU A C    1 
ATOM   330  O O    . LEU A 1 22  ? 21.581 20.812 42.205 1.00 47.95  ? 25  LEU A O    1 
ATOM   331  C CB   . LEU A 1 22  ? 21.668 20.414 38.978 1.00 42.58  ? 25  LEU A CB   1 
ATOM   332  C CG   . LEU A 1 22  ? 20.764 19.665 37.992 1.00 63.35  ? 25  LEU A CG   1 
ATOM   333  C CD1  . LEU A 1 22  ? 19.699 20.566 37.383 1.00 59.33  ? 25  LEU A CD1  1 
ATOM   334  C CD2  . LEU A 1 22  ? 21.601 19.022 36.895 1.00 72.25  ? 25  LEU A CD2  1 
ATOM   335  H H    . LEU A 1 22  ? 21.105 22.750 38.553 0.00 51.09  ? 25  LEU A H    1 
ATOM   336  H HA   . LEU A 1 22  ? 20.122 20.964 40.208 0.00 58.95  ? 25  LEU A HA   1 
ATOM   337  H HB2  . LEU A 1 22  ? 22.295 20.934 38.452 0.00 51.15  ? 25  LEU A HB2  1 
ATOM   338  H HB3  . LEU A 1 22  ? 22.143 19.745 39.495 0.00 51.15  ? 25  LEU A HB3  1 
ATOM   339  H HG   . LEU A 1 22  ? 20.298 18.971 38.484 0.00 76.07  ? 25  LEU A HG   1 
ATOM   340  H HD11 . LEU A 1 22  ? 19.176 20.052 36.748 0.00 71.24  ? 25  LEU A HD11 1 
ATOM   341  H HD12 . LEU A 1 22  ? 19.126 20.900 38.090 0.00 71.24  ? 25  LEU A HD12 1 
ATOM   342  H HD13 . LEU A 1 22  ? 20.133 21.306 36.931 0.00 71.24  ? 25  LEU A HD13 1 
ATOM   343  H HD21 . LEU A 1 22  ? 21.011 18.578 36.266 0.00 86.75  ? 25  LEU A HD21 1 
ATOM   344  H HD22 . LEU A 1 22  ? 22.110 19.712 36.441 0.00 86.75  ? 25  LEU A HD22 1 
ATOM   345  H HD23 . LEU A 1 22  ? 22.204 18.376 37.296 0.00 86.75  ? 25  LEU A HD23 1 
ATOM   346  N N    . TYR A 1 23  ? 22.755 22.459 41.224 1.00 42.42  ? 26  TYR A N    1 
ATOM   347  C CA   . TYR A 1 23  ? 23.531 22.697 42.437 1.00 46.12  ? 26  TYR A CA   1 
ATOM   348  C C    . TYR A 1 23  ? 22.633 23.196 43.563 1.00 52.10  ? 26  TYR A C    1 
ATOM   349  O O    . TYR A 1 23  ? 22.680 22.683 44.687 1.00 41.18  ? 26  TYR A O    1 
ATOM   350  C CB   . TYR A 1 23  ? 24.653 23.700 42.166 1.00 42.72  ? 26  TYR A CB   1 
ATOM   351  C CG   . TYR A 1 23  ? 25.534 23.944 43.371 1.00 48.26  ? 26  TYR A CG   1 
ATOM   352  C CD1  . TYR A 1 23  ? 26.238 22.902 43.961 1.00 56.87  ? 26  TYR A CD1  1 
ATOM   353  C CD2  . TYR A 1 23  ? 25.656 25.212 43.923 1.00 51.53  ? 26  TYR A CD2  1 
ATOM   354  C CE1  . TYR A 1 23  ? 27.042 23.117 45.065 1.00 63.34  ? 26  TYR A CE1  1 
ATOM   355  C CE2  . TYR A 1 23  ? 26.458 25.436 45.028 1.00 48.78  ? 26  TYR A CE2  1 
ATOM   356  C CZ   . TYR A 1 23  ? 27.148 24.385 45.594 1.00 63.47  ? 26  TYR A CZ   1 
ATOM   357  O OH   . TYR A 1 23  ? 27.947 24.604 46.693 1.00 66.66  ? 26  TYR A OH   1 
ATOM   358  H H    . TYR A 1 23  ? 22.969 22.952 40.553 0.00 50.96  ? 26  TYR A H    1 
ATOM   359  H HA   . TYR A 1 23  ? 23.939 21.862 42.714 0.00 55.39  ? 26  TYR A HA   1 
ATOM   360  H HB2  . TYR A 1 23  ? 25.212 23.359 41.450 0.00 51.31  ? 26  TYR A HB2  1 
ATOM   361  H HB3  . TYR A 1 23  ? 24.261 24.548 41.905 0.00 51.31  ? 26  TYR A HB3  1 
ATOM   362  H HD1  . TYR A 1 23  ? 26.168 22.045 43.608 0.00 68.29  ? 26  TYR A HD1  1 
ATOM   363  H HD2  . TYR A 1 23  ? 25.191 25.922 43.544 0.00 61.89  ? 26  TYR A HD2  1 
ATOM   364  H HE1  . TYR A 1 23  ? 27.508 22.410 45.449 0.00 76.06  ? 26  TYR A HE1  1 
ATOM   365  H HE2  . TYR A 1 23  ? 26.531 26.291 45.386 0.00 58.58  ? 26  TYR A HE2  1 
ATOM   366  H HH   . TYR A 1 23  ? 28.299 23.883 46.940 0.00 80.04  ? 26  TYR A HH   1 
ATOM   367  N N    . PHE A 1 24  ? 21.801 24.199 43.274 1.00 51.89  ? 27  PHE A N    1 
ATOM   368  C CA   . PHE A 1 24  ? 20.924 24.752 44.300 1.00 45.51  ? 27  PHE A CA   1 
ATOM   369  C C    . PHE A 1 24  ? 19.914 23.714 44.774 1.00 51.20  ? 27  PHE A C    1 
ATOM   370  O O    . PHE A 1 24  ? 19.565 23.671 45.960 1.00 43.64  ? 27  PHE A O    1 
ATOM   371  C CB   . PHE A 1 24  ? 20.201 25.986 43.755 1.00 52.14  ? 27  PHE A CB   1 
ATOM   372  C CG   . PHE A 1 24  ? 21.084 27.198 43.597 1.00 36.37  ? 27  PHE A CG   1 
ATOM   373  C CD1  . PHE A 1 24  ? 22.172 27.411 44.430 1.00 48.23  ? 27  PHE A CD1  1 
ATOM   374  C CD2  . PHE A 1 24  ? 20.820 28.126 42.604 1.00 41.07  ? 27  PHE A CD2  1 
ATOM   375  C CE1  . PHE A 1 24  ? 22.974 28.525 44.274 1.00 57.90  ? 27  PHE A CE1  1 
ATOM   376  C CE2  . PHE A 1 24  ? 21.619 29.240 42.444 1.00 40.68  ? 27  PHE A CE2  1 
ATOM   377  C CZ   . PHE A 1 24  ? 22.697 29.440 43.279 1.00 63.61  ? 27  PHE A CZ   1 
ATOM   378  H H    . PHE A 1 24  ? 21.728 24.572 42.502 0.00 62.32  ? 27  PHE A H    1 
ATOM   379  H HA   . PHE A 1 24  ? 21.460 25.022 45.062 0.00 54.66  ? 27  PHE A HA   1 
ATOM   380  H HB2  . PHE A 1 24  ? 19.837 25.772 42.882 0.00 62.62  ? 27  PHE A HB2  1 
ATOM   381  H HB3  . PHE A 1 24  ? 19.485 26.221 44.365 0.00 62.62  ? 27  PHE A HB3  1 
ATOM   382  H HD1  . PHE A 1 24  ? 22.364 26.796 45.101 0.00 57.93  ? 27  PHE A HD1  1 
ATOM   383  H HD2  . PHE A 1 24  ? 20.095 27.996 42.036 0.00 49.34  ? 27  PHE A HD2  1 
ATOM   384  H HE1  . PHE A 1 24  ? 23.701 28.658 44.839 0.00 69.53  ? 27  PHE A HE1  1 
ATOM   385  H HE2  . PHE A 1 24  ? 21.430 29.855 41.773 0.00 48.87  ? 27  PHE A HE2  1 
ATOM   386  H HZ   . PHE A 1 24  ? 23.236 30.191 43.173 0.00 76.39  ? 27  PHE A HZ   1 
ATOM   387  N N    . LEU A 1 25  ? 19.431 22.870 43.860 1.00 39.94  ? 28  LEU A N    1 
ATOM   388  C CA   . LEU A 1 25  ? 18.436 21.869 44.228 1.00 57.27  ? 28  LEU A CA   1 
ATOM   389  C C    . LEU A 1 25  ? 19.028 20.819 45.162 1.00 54.43  ? 28  LEU A C    1 
ATOM   390  O O    . LEU A 1 25  ? 18.361 20.369 46.101 1.00 50.68  ? 28  LEU A O    1 
ATOM   391  C CB   . LEU A 1 25  ? 17.871 21.217 42.966 1.00 51.16  ? 28  LEU A CB   1 
ATOM   392  C CG   . LEU A 1 25  ? 16.798 20.142 43.146 1.00 71.24  ? 28  LEU A CG   1 
ATOM   393  C CD1  . LEU A 1 25  ? 15.506 20.752 43.658 1.00 49.77  ? 28  LEU A CD1  1 
ATOM   394  C CD2  . LEU A 1 25  ? 16.561 19.416 41.832 1.00 75.63  ? 28  LEU A CD2  1 
ATOM   395  H H    . LEU A 1 25  ? 19.660 22.858 43.031 0.00 47.98  ? 28  LEU A H    1 
ATOM   396  H HA   . LEU A 1 25  ? 17.706 22.303 44.697 0.00 68.78  ? 28  LEU A HA   1 
ATOM   397  H HB2  . LEU A 1 25  ? 17.478 21.916 42.421 0.00 61.45  ? 28  LEU A HB2  1 
ATOM   398  H HB3  . LEU A 1 25  ? 18.608 20.801 42.492 0.00 61.45  ? 28  LEU A HB3  1 
ATOM   399  H HG   . LEU A 1 25  ? 17.101 19.497 43.804 0.00 85.54  ? 28  LEU A HG   1 
ATOM   400  H HD11 . LEU A 1 25  ? 14.844 20.050 43.759 0.00 59.78  ? 28  LEU A HD11 1 
ATOM   401  H HD12 . LEU A 1 25  ? 15.673 21.174 44.515 0.00 59.78  ? 28  LEU A HD12 1 
ATOM   402  H HD13 . LEU A 1 25  ? 15.194 21.412 43.020 0.00 59.78  ? 28  LEU A HD13 1 
ATOM   403  H HD21 . LEU A 1 25  ? 15.887 18.732 41.966 0.00 90.80  ? 28  LEU A HD21 1 
ATOM   404  H HD22 . LEU A 1 25  ? 16.258 20.055 41.168 0.00 90.80  ? 28  LEU A HD22 1 
ATOM   405  H HD23 . LEU A 1 25  ? 17.393 19.008 41.542 0.00 90.80  ? 28  LEU A HD23 1 
ATOM   406  N N    . VAL A 1 26  ? 20.276 20.415 44.920 1.00 51.68  ? 29  VAL A N    1 
ATOM   407  C CA   . VAL A 1 26  ? 20.915 19.429 45.787 1.00 43.97  ? 29  VAL A CA   1 
ATOM   408  C C    . VAL A 1 26  ? 21.326 20.065 47.109 1.00 49.55  ? 29  VAL A C    1 
ATOM   409  O O    . VAL A 1 26  ? 21.206 19.445 48.173 1.00 62.58  ? 29  VAL A O    1 
ATOM   410  C CB   . VAL A 1 26  ? 22.116 18.788 45.068 1.00 39.82  ? 29  VAL A CB   1 
ATOM   411  C CG1  . VAL A 1 26  ? 22.878 17.871 46.014 1.00 59.63  ? 29  VAL A CG1  1 
ATOM   412  C CG2  . VAL A 1 26  ? 21.644 18.017 43.846 1.00 49.86  ? 29  VAL A CG2  1 
ATOM   413  H H    . VAL A 1 26  ? 20.767 20.693 44.271 0.00 62.07  ? 29  VAL A H    1 
ATOM   414  H HA   . VAL A 1 26  ? 20.273 18.729 45.981 0.00 52.81  ? 29  VAL A HA   1 
ATOM   415  H HB   . VAL A 1 26  ? 22.720 19.489 44.776 0.00 47.83  ? 29  VAL A HB   1 
ATOM   416  H HG11 . VAL A 1 26  ? 23.480 17.313 45.497 0.00 71.61  ? 29  VAL A HG11 1 
ATOM   417  H HG12 . VAL A 1 26  ? 23.384 18.412 46.640 0.00 71.61  ? 29  VAL A HG12 1 
ATOM   418  H HG13 . VAL A 1 26  ? 22.244 17.316 46.494 0.00 71.61  ? 29  VAL A HG13 1 
ATOM   419  H HG21 . VAL A 1 26  ? 22.413 17.623 43.405 0.00 59.88  ? 29  VAL A HG21 1 
ATOM   420  H HG22 . VAL A 1 26  ? 21.033 17.319 44.130 0.00 59.88  ? 29  VAL A HG22 1 
ATOM   421  H HG23 . VAL A 1 26  ? 21.193 18.627 43.242 0.00 59.88  ? 29  VAL A HG23 1 
ATOM   422  N N    . LYS A 1 27  ? 21.821 21.304 47.069 1.00 47.58  ? 30  LYS A N    1 
ATOM   423  C CA   . LYS A 1 27  ? 22.201 21.980 48.305 1.00 49.20  ? 30  LYS A CA   1 
ATOM   424  C C    . LYS A 1 27  ? 21.000 22.148 49.228 1.00 61.82  ? 30  LYS A C    1 
ATOM   425  O O    . LYS A 1 27  ? 21.129 22.043 50.453 1.00 60.50  ? 30  LYS A O    1 
ATOM   426  C CB   . LYS A 1 27  ? 22.833 23.337 47.995 1.00 53.91  ? 30  LYS A CB   1 
ATOM   427  C CG   . LYS A 1 27  ? 23.766 23.844 49.088 1.00 68.32  ? 30  LYS A CG   1 
ATOM   428  C CD   . LYS A 1 27  ? 24.666 24.971 48.599 1.00 66.24  ? 30  LYS A CD   1 
ATOM   429  C CE   . LYS A 1 27  ? 25.392 25.638 49.760 1.00 77.13  ? 30  LYS A CE   1 
ATOM   430  N NZ   . LYS A 1 27  ? 26.744 26.136 49.377 1.00 85.66  ? 30  LYS A NZ   1 
ATOM   431  H H    . LYS A 1 27  ? 21.943 21.765 46.353 0.00 57.15  ? 30  LYS A H    1 
ATOM   432  H HA   . LYS A 1 27  ? 22.864 21.441 48.765 0.00 59.09  ? 30  LYS A HA   1 
ATOM   433  H HB2  . LYS A 1 27  ? 23.348 23.262 47.176 0.00 64.75  ? 30  LYS A HB2  1 
ATOM   434  H HB3  . LYS A 1 27  ? 22.126 23.992 47.882 0.00 64.75  ? 30  LYS A HB3  1 
ATOM   435  H HG2  . LYS A 1 27  ? 23.237 24.180 49.828 0.00 82.03  ? 30  LYS A HG2  1 
ATOM   436  H HG3  . LYS A 1 27  ? 24.331 23.115 49.387 0.00 82.03  ? 30  LYS A HG3  1 
ATOM   437  H HD2  . LYS A 1 27  ? 25.329 24.612 47.989 0.00 79.53  ? 30  LYS A HD2  1 
ATOM   438  H HD3  . LYS A 1 27  ? 24.128 25.640 48.149 0.00 79.53  ? 30  LYS A HD3  1 
ATOM   439  H HE2  . LYS A 1 27  ? 24.869 26.395 50.068 0.00 92.61  ? 30  LYS A HE2  1 
ATOM   440  H HE3  . LYS A 1 27  ? 25.500 24.995 50.478 0.00 92.61  ? 30  LYS A HE3  1 
ATOM   441  H HZ1  . LYS A 1 27  ? 27.134 26.526 50.076 0.00 102.84 ? 30  LYS A HZ1  1 
ATOM   442  H HZ2  . LYS A 1 27  ? 27.252 25.458 49.104 0.00 102.84 ? 30  LYS A HZ2  1 
ATOM   443  H HZ3  . LYS A 1 27  ? 26.674 26.729 48.717 0.00 102.84 ? 30  LYS A HZ3  1 
ATOM   444  N N    . GLY A 1 28  ? 19.821 22.396 48.657 1.00 56.92  ? 31  GLY A N    1 
ATOM   445  C CA   . GLY A 1 28  ? 18.621 22.589 49.452 1.00 57.03  ? 31  GLY A CA   1 
ATOM   446  C C    . GLY A 1 28  ? 18.034 21.317 50.031 1.00 77.93  ? 31  GLY A C    1 
ATOM   447  O O    . GLY A 1 28  ? 17.178 21.404 50.919 1.00 59.26  ? 31  GLY A O    1 
ATOM   448  H H    . GLY A 1 28  ? 19.694 22.457 47.809 0.00 68.36  ? 31  GLY A H    1 
ATOM   449  H HA2  . GLY A 1 28  ? 18.829 23.183 50.191 0.00 68.49  ? 31  GLY A HA2  1 
ATOM   450  H HA3  . GLY A 1 28  ? 17.943 23.003 48.896 0.00 68.49  ? 31  GLY A HA3  1 
ATOM   451  N N    . MET A 1 29  ? 18.465 20.151 49.555 1.00 84.07  ? 32  MET A N    1 
ATOM   452  C CA   . MET A 1 29  ? 17.937 18.895 50.074 1.00 90.49  ? 32  MET A CA   1 
ATOM   453  C C    . MET A 1 29  ? 18.290 18.742 51.548 1.00 90.62  ? 32  MET A C    1 
ATOM   454  O O    . MET A 1 29  ? 19.461 18.814 51.931 1.00 84.56  ? 32  MET A O    1 
ATOM   455  C CB   . MET A 1 29  ? 18.491 17.716 49.277 1.00 87.59  ? 32  MET A CB   1 
ATOM   456  C CG   . MET A 1 29  ? 17.667 17.359 48.047 1.00 103.68 ? 32  MET A CG   1 
ATOM   457  S SD   . MET A 1 29  ? 18.208 15.855 47.205 1.00 155.92 ? 32  MET A SD   1 
ATOM   458  C CE   . MET A 1 29  ? 18.307 14.693 48.566 1.00 135.80 ? 32  MET A CE   1 
ATOM   459  H H    . MET A 1 29  ? 19.056 20.061 48.938 0.00 100.93 ? 32  MET A H    1 
ATOM   460  H HA   . MET A 1 29  ? 16.972 18.896 49.974 0.00 108.64 ? 32  MET A HA   1 
ATOM   461  H HB2  . MET A 1 29  ? 19.387 17.936 48.978 0.00 105.16 ? 32  MET A HB2  1 
ATOM   462  H HB3  . MET A 1 29  ? 18.515 16.935 49.852 0.00 105.16 ? 32  MET A HB3  1 
ATOM   463  H HG2  . MET A 1 29  ? 16.745 17.230 48.317 0.00 124.47 ? 32  MET A HG2  1 
ATOM   464  H HG3  . MET A 1 29  ? 17.727 18.090 47.411 0.00 124.47 ? 32  MET A HG3  1 
ATOM   465  H HE1  . MET A 1 29  ? 18.271 13.790 48.214 0.00 163.01 ? 32  MET A HE1  1 
ATOM   466  H HE2  . MET A 1 29  ? 19.143 14.831 49.039 0.00 163.01 ? 32  MET A HE2  1 
ATOM   467  H HE3  . MET A 1 29  ? 17.560 14.845 49.166 0.00 163.01 ? 32  MET A HE3  1 
ATOM   468  N N    . GLY A 1 30  ? 17.268 18.528 52.377 1.00 80.81  ? 33  GLY A N    1 
ATOM   469  C CA   . GLY A 1 30  ? 17.448 18.343 53.797 1.00 92.24  ? 33  GLY A CA   1 
ATOM   470  C C    . GLY A 1 30  ? 17.296 19.600 54.627 1.00 89.73  ? 33  GLY A C    1 
ATOM   471  O O    . GLY A 1 30  ? 17.115 19.501 55.846 1.00 94.70  ? 33  GLY A O    1 
ATOM   472  H H    . GLY A 1 30  ? 16.447 18.485 52.125 0.00 97.02  ? 33  GLY A H    1 
ATOM   473  H HA2  . GLY A 1 30  ? 16.794 17.700 54.112 0.00 110.74 ? 33  GLY A HA2  1 
ATOM   474  H HA3  . GLY A 1 30  ? 18.338 17.991 53.955 0.00 110.74 ? 33  GLY A HA3  1 
ATOM   475  N N    . VAL A 1 31  ? 17.369 20.779 54.008 1.00 61.72  ? 34  VAL A N    1 
ATOM   476  C CA   . VAL A 1 31  ? 17.168 22.019 54.748 1.00 70.14  ? 34  VAL A CA   1 
ATOM   477  C C    . VAL A 1 31  ? 15.761 22.012 55.326 1.00 52.91  ? 34  VAL A C    1 
ATOM   478  O O    . VAL A 1 31  ? 14.770 21.975 54.587 1.00 83.68  ? 34  VAL A O    1 
ATOM   479  C CB   . VAL A 1 31  ? 17.404 23.234 53.843 1.00 73.86  ? 34  VAL A CB   1 
ATOM   480  C CG1  . VAL A 1 31  ? 17.029 24.523 54.566 1.00 69.76  ? 34  VAL A CG1  1 
ATOM   481  C CG2  . VAL A 1 31  ? 18.853 23.276 53.382 1.00 63.72  ? 34  VAL A CG2  1 
ATOM   482  H H    . VAL A 1 31  ? 17.532 20.885 53.170 0.00 74.11  ? 34  VAL A H    1 
ATOM   483  H HA   . VAL A 1 31  ? 17.803 22.065 55.479 0.00 84.22  ? 34  VAL A HA   1 
ATOM   484  H HB   . VAL A 1 31  ? 16.839 23.157 53.059 0.00 88.69  ? 34  VAL A HB   1 
ATOM   485  H HG11 . VAL A 1 31  ? 17.383 25.277 54.070 0.00 83.77  ? 34  VAL A HG11 1 
ATOM   486  H HG12 . VAL A 1 31  ? 16.062 24.585 54.619 0.00 83.77  ? 34  VAL A HG12 1 
ATOM   487  H HG13 . VAL A 1 31  ? 17.409 24.506 55.459 0.00 83.77  ? 34  VAL A HG13 1 
ATOM   488  H HG21 . VAL A 1 31  ? 18.991 24.074 52.848 0.00 76.52  ? 34  VAL A HG21 1 
ATOM   489  H HG22 . VAL A 1 31  ? 19.432 23.294 54.160 0.00 76.52  ? 34  VAL A HG22 1 
ATOM   490  H HG23 . VAL A 1 31  ? 19.038 22.486 52.850 0.00 76.52  ? 34  VAL A HG23 1 
ATOM   491  N N    . SER A 1 32  ? 15.668 22.046 56.658 1.00 69.14  ? 35  SER A N    1 
ATOM   492  C CA   . SER A 1 32  ? 14.391 21.938 57.349 1.00 69.40  ? 35  SER A CA   1 
ATOM   493  C C    . SER A 1 32  ? 13.930 23.235 57.996 1.00 63.48  ? 35  SER A C    1 
ATOM   494  O O    . SER A 1 32  ? 12.740 23.362 58.300 1.00 77.35  ? 35  SER A O    1 
ATOM   495  C CB   . SER A 1 32  ? 14.464 20.847 58.428 1.00 68.29  ? 35  SER A CB   1 
ATOM   496  O OG   . SER A 1 32  ? 15.751 20.799 59.019 1.00 87.43  ? 35  SER A OG   1 
ATOM   497  H H    . SER A 1 32  ? 16.341 22.132 57.186 0.00 83.02  ? 35  SER A H    1 
ATOM   498  H HA   . SER A 1 32  ? 13.713 21.677 56.706 0.00 83.33  ? 35  SER A HA   1 
ATOM   499  H HB2  . SER A 1 32  ? 13.809 21.041 59.116 0.00 82.00  ? 35  SER A HB2  1 
ATOM   500  H HB3  . SER A 1 32  ? 14.273 19.988 58.020 0.00 82.00  ? 35  SER A HB3  1 
ATOM   501  H HG   . SER A 1 32  ? 15.796 20.155 59.556 0.00 104.97 ? 35  SER A HG   1 
ATOM   502  N N    . ASP A 1 33  ? 14.828 24.185 58.220 1.00 66.62  ? 36  ASP A N    1 
ATOM   503  C CA   . ASP A 1 33  ? 14.445 25.481 58.761 1.00 63.99  ? 36  ASP A CA   1 
ATOM   504  C C    . ASP A 1 33  ? 13.437 26.152 57.832 1.00 58.55  ? 36  ASP A C    1 
ATOM   505  O O    . ASP A 1 33  ? 13.754 26.380 56.654 1.00 53.38  ? 36  ASP A O    1 
ATOM   506  C CB   . ASP A 1 33  ? 15.677 26.365 58.931 1.00 69.89  ? 36  ASP A CB   1 
ATOM   507  C CG   . ASP A 1 33  ? 15.337 27.751 59.445 1.00 70.83  ? 36  ASP A CG   1 
ATOM   508  O OD1  . ASP A 1 33  ? 14.936 27.871 60.622 1.00 75.41  ? 36  ASP A OD1  1 
ATOM   509  O OD2  . ASP A 1 33  ? 15.472 28.722 58.671 1.00 54.75  ? 36  ASP A OD2  1 
ATOM   510  H H    . ASP A 1 33  ? 15.670 24.105 58.065 0.00 79.99  ? 36  ASP A H    1 
ATOM   511  H HA   . ASP A 1 33  ? 14.035 25.363 59.632 0.00 76.83  ? 36  ASP A HA   1 
ATOM   512  H HB2  . ASP A 1 33  ? 16.280 25.949 59.566 0.00 83.91  ? 36  ASP A HB2  1 
ATOM   513  H HB3  . ASP A 1 33  ? 16.117 26.464 58.072 0.00 83.91  ? 36  ASP A HB3  1 
ATOM   514  N N    . PRO A 1 34  ? 12.230 26.488 58.303 1.00 61.47  ? 37  PRO A N    1 
ATOM   515  C CA   . PRO A 1 34  ? 11.231 27.049 57.375 1.00 65.76  ? 37  PRO A CA   1 
ATOM   516  C C    . PRO A 1 34  ? 11.681 28.341 56.715 1.00 57.90  ? 37  PRO A C    1 
ATOM   517  O O    . PRO A 1 34  ? 11.369 28.570 55.540 1.00 53.74  ? 37  PRO A O    1 
ATOM   518  C CB   . PRO A 1 34  ? 9.990  27.265 58.255 1.00 53.51  ? 37  PRO A CB   1 
ATOM   519  C CG   . PRO A 1 34  ? 10.417 27.079 59.658 1.00 60.38  ? 37  PRO A CG   1 
ATOM   520  C CD   . PRO A 1 34  ? 11.741 26.396 59.690 1.00 48.15  ? 37  PRO A CD   1 
ATOM   521  H HA   . PRO A 1 34  ? 11.024 26.391 56.693 0.00 78.96  ? 37  PRO A HA   1 
ATOM   522  H HB2  . PRO A 1 34  ? 9.652  28.164 58.120 0.00 64.26  ? 37  PRO A HB2  1 
ATOM   523  H HB3  . PRO A 1 34  ? 9.310  26.615 58.018 0.00 64.26  ? 37  PRO A HB3  1 
ATOM   524  H HG2  . PRO A 1 34  ? 10.485 27.949 60.082 0.00 72.51  ? 37  PRO A HG2  1 
ATOM   525  H HG3  . PRO A 1 34  ? 9.756  26.537 60.117 0.00 72.51  ? 37  PRO A HG3  1 
ATOM   526  H HD2  . PRO A 1 34  ? 12.346 26.852 60.296 0.00 57.83  ? 37  PRO A HD2  1 
ATOM   527  H HD3  . PRO A 1 34  ? 11.641 25.469 59.956 0.00 57.83  ? 37  PRO A HD3  1 
ATOM   528  N N    . ASP A 1 35  ? 12.404 29.199 57.438 1.00 56.14  ? 38  ASP A N    1 
ATOM   529  C CA   . ASP A 1 35  ? 12.896 30.434 56.837 1.00 51.93  ? 38  ASP A CA   1 
ATOM   530  C C    . ASP A 1 35  ? 13.862 30.135 55.696 1.00 49.08  ? 38  ASP A C    1 
ATOM   531  O O    . ASP A 1 35  ? 13.747 30.702 54.603 1.00 56.98  ? 38  ASP A O    1 
ATOM   532  C CB   . ASP A 1 35  ? 13.570 31.303 57.900 1.00 74.12  ? 38  ASP A CB   1 
ATOM   533  C CG   . ASP A 1 35  ? 12.575 31.938 58.853 1.00 63.01  ? 38  ASP A CG   1 
ATOM   534  O OD1  . ASP A 1 35  ? 11.422 32.185 58.439 1.00 76.99  ? 38  ASP A OD1  1 
ATOM   535  O OD2  . ASP A 1 35  ? 12.946 32.191 60.019 1.00 75.27  ? 38  ASP A OD2  1 
ATOM   536  H H    . ASP A 1 35  ? 12.618 29.090 58.264 0.00 67.42  ? 38  ASP A H    1 
ATOM   537  H HA   . ASP A 1 35  ? 12.144 30.930 56.476 0.00 62.37  ? 38  ASP A HA   1 
ATOM   538  H HB2  . ASP A 1 35  ? 14.176 30.753 58.421 0.00 89.00  ? 38  ASP A HB2  1 
ATOM   539  H HB3  . ASP A 1 35  ? 14.062 32.015 57.461 0.00 89.00  ? 38  ASP A HB3  1 
ATOM   540  N N    . ALA A 1 36  ? 14.826 29.242 55.934 1.00 46.27  ? 39  ALA A N    1 
ATOM   541  C CA   . ALA A 1 36  ? 15.761 28.872 54.878 1.00 44.46  ? 39  ALA A CA   1 
ATOM   542  C C    . ALA A 1 36  ? 15.043 28.227 53.701 1.00 42.37  ? 39  ALA A C    1 
ATOM   543  O O    . ALA A 1 36  ? 15.466 28.391 52.551 1.00 48.53  ? 39  ALA A O    1 
ATOM   544  C CB   . ALA A 1 36  ? 16.831 27.931 55.433 1.00 49.89  ? 39  ALA A CB   1 
ATOM   545  H H    . ALA A 1 36  ? 14.956 28.845 56.685 0.00 55.58  ? 39  ALA A H    1 
ATOM   546  H HA   . ALA A 1 36  ? 16.206 29.672 54.557 0.00 53.40  ? 39  ALA A HA   1 
ATOM   547  H HB1  . ALA A 1 36  ? 17.448 27.700 54.722 0.00 59.92  ? 39  ALA A HB1  1 
ATOM   548  H HB2  . ALA A 1 36  ? 17.305 28.380 56.150 0.00 59.92  ? 39  ALA A HB2  1 
ATOM   549  H HB3  . ALA A 1 36  ? 16.401 27.130 55.772 0.00 59.92  ? 39  ALA A HB3  1 
ATOM   550  N N    . LYS A 1 37  ? 13.957 27.495 53.964 1.00 42.50  ? 40  LYS A N    1 
ATOM   551  C CA   . LYS A 1 37  ? 13.184 26.909 52.873 1.00 53.39  ? 40  LYS A CA   1 
ATOM   552  C C    . LYS A 1 37  ? 12.650 27.987 51.938 1.00 48.02  ? 40  LYS A C    1 
ATOM   553  O O    . LYS A 1 37  ? 12.607 27.795 50.717 1.00 46.67  ? 40  LYS A O    1 
ATOM   554  C CB   . LYS A 1 37  ? 12.033 26.068 53.429 1.00 48.11  ? 40  LYS A CB   1 
ATOM   555  C CG   . LYS A 1 37  ? 12.471 24.943 54.362 1.00 46.12  ? 40  LYS A CG   1 
ATOM   556  C CD   . LYS A 1 37  ? 11.714 23.643 54.101 1.00 68.29  ? 40  LYS A CD   1 
ATOM   557  C CE   . LYS A 1 37  ? 10.557 23.468 55.074 1.00 77.76  ? 40  LYS A CE   1 
ATOM   558  N NZ   . LYS A 1 37  ? 10.003 22.087 55.044 1.00 78.73  ? 40  LYS A NZ   1 
ATOM   559  H H    . LYS A 1 37  ? 13.653 27.327 54.751 0.00 51.05  ? 40  LYS A H    1 
ATOM   560  H HA   . LYS A 1 37  ? 13.764 26.323 52.362 0.00 64.12  ? 40  LYS A HA   1 
ATOM   561  H HB2  . LYS A 1 37  ? 11.438 26.649 53.928 0.00 57.79  ? 40  LYS A HB2  1 
ATOM   562  H HB3  . LYS A 1 37  ? 11.558 25.664 52.686 0.00 57.79  ? 40  LYS A HB3  1 
ATOM   563  H HG2  . LYS A 1 37  ? 13.417 24.772 54.232 0.00 55.40  ? 40  LYS A HG2  1 
ATOM   564  H HG3  . LYS A 1 37  ? 12.305 25.210 55.280 0.00 55.40  ? 40  LYS A HG3  1 
ATOM   565  H HD2  . LYS A 1 37  ? 11.356 23.654 53.200 0.00 81.99  ? 40  LYS A HD2  1 
ATOM   566  H HD3  . LYS A 1 37  ? 12.319 22.892 54.209 0.00 81.99  ? 40  LYS A HD3  1 
ATOM   567  H HE2  . LYS A 1 37  ? 10.867 23.650 55.975 0.00 93.37  ? 40  LYS A HE2  1 
ATOM   568  H HE3  . LYS A 1 37  ? 9.846  24.084 54.838 0.00 93.37  ? 40  LYS A HE3  1 
ATOM   569  H HZ1  . LYS A 1 37  ? 9.330  22.016 55.622 0.00 94.53  ? 40  LYS A HZ1  1 
ATOM   570  H HZ2  . LYS A 1 37  ? 9.704  21.897 54.227 0.00 94.53  ? 40  LYS A HZ2  1 
ATOM   571  H HZ3  . LYS A 1 37  ? 10.636 21.501 55.264 0.00 94.53  ? 40  LYS A HZ3  1 
ATOM   572  N N    A LYS A 1 38  ? 12.241 29.130 52.491 0.28 47.58  ? 41  LYS A N    1 
ATOM   573  N N    B LYS A 1 38  ? 12.229 29.127 52.492 0.72 47.66  ? 41  LYS A N    1 
ATOM   574  C CA   A LYS A 1 38  ? 11.726 30.212 51.657 0.28 44.12  ? 41  LYS A CA   1 
ATOM   575  C CA   B LYS A 1 38  ? 11.728 30.212 51.653 0.72 43.97  ? 41  LYS A CA   1 
ATOM   576  C C    A LYS A 1 38  ? 12.793 30.713 50.691 0.28 43.18  ? 41  LYS A C    1 
ATOM   577  C C    B LYS A 1 38  ? 12.800 30.694 50.684 0.72 43.11  ? 41  LYS A C    1 
ATOM   578  O O    A LYS A 1 38  ? 12.525 30.917 49.501 0.28 45.44  ? 41  LYS A O    1 
ATOM   579  O O    B LYS A 1 38  ? 12.542 30.866 49.487 0.72 45.60  ? 41  LYS A O    1 
ATOM   580  C CB   A LYS A 1 38  ? 11.220 31.357 52.536 0.28 47.60  ? 41  LYS A CB   1 
ATOM   581  C CB   B LYS A 1 38  ? 11.241 31.374 52.522 0.72 47.53  ? 41  LYS A CB   1 
ATOM   582  C CG   A LYS A 1 38  ? 9.735  31.283 52.864 0.28 49.68  ? 41  LYS A CG   1 
ATOM   583  C CG   B LYS A 1 38  ? 10.197 31.002 53.561 0.72 54.85  ? 41  LYS A CG   1 
ATOM   584  C CD   A LYS A 1 38  ? 9.448  31.747 54.292 0.28 57.96  ? 41  LYS A CD   1 
ATOM   585  C CD   B LYS A 1 38  ? 9.633  32.248 54.226 0.72 61.59  ? 41  LYS A CD   1 
ATOM   586  C CE   A LYS A 1 38  ? 9.419  33.270 54.422 0.28 58.28  ? 41  LYS A CE   1 
ATOM   587  C CE   B LYS A 1 38  ? 9.126  31.958 55.627 0.72 65.05  ? 41  LYS A CE   1 
ATOM   588  N NZ   A LYS A 1 38  ? 8.662  33.955 53.334 0.28 62.61  ? 41  LYS A NZ   1 
ATOM   589  N NZ   B LYS A 1 38  ? 8.062  30.919 55.635 0.72 55.51  ? 41  LYS A NZ   1 
ATOM   590  H H    A LYS A 1 38  ? 12.251 29.301 53.334 0.28 57.15  ? 41  LYS A H    1 
ATOM   591  H H    B LYS A 1 38  ? 12.224 29.293 53.335 0.72 57.24  ? 41  LYS A H    1 
ATOM   592  H HA   A LYS A 1 38  ? 10.980 29.876 51.137 0.28 52.99  ? 41  LYS A HA   1 
ATOM   593  H HA   B LYS A 1 38  ? 10.974 29.881 51.140 0.72 52.82  ? 41  LYS A HA   1 
ATOM   594  H HB2  A LYS A 1 38  ? 11.707 31.342 53.375 0.28 57.17  ? 41  LYS A HB2  1 
ATOM   595  H HB2  B LYS A 1 38  ? 12.003 31.744 52.995 0.72 57.09  ? 41  LYS A HB2  1 
ATOM   596  H HB3  A LYS A 1 38  ? 11.378 32.195 52.075 0.28 57.17  ? 41  LYS A HB3  1 
ATOM   597  H HB3  B LYS A 1 38  ? 10.850 32.047 51.944 0.72 57.09  ? 41  LYS A HB3  1 
ATOM   598  H HG2  A LYS A 1 38  ? 9.243  31.855 52.254 0.28 59.67  ? 41  LYS A HG2  1 
ATOM   599  H HG2  B LYS A 1 38  ? 9.469  30.526 53.132 0.72 65.87  ? 41  LYS A HG2  1 
ATOM   600  H HG3  A LYS A 1 38  ? 9.432  30.366 52.776 0.28 59.67  ? 41  LYS A HG3  1 
ATOM   601  H HG3  B LYS A 1 38  ? 10.602 30.445 54.243 0.72 65.87  ? 41  LYS A HG3  1 
ATOM   602  H HD2  A LYS A 1 38  ? 8.582  31.406 54.568 0.28 69.61  ? 41  LYS A HD2  1 
ATOM   603  H HD2  B LYS A 1 38  ? 10.330 32.921 54.288 0.72 73.96  ? 41  LYS A HD2  1 
ATOM   604  H HD3  A LYS A 1 38  ? 10.141 31.409 54.881 0.28 69.61  ? 41  LYS A HD3  1 
ATOM   605  H HD3  B LYS A 1 38  ? 8.892  32.586 53.699 0.72 73.96  ? 41  LYS A HD3  1 
ATOM   606  H HE2  A LYS A 1 38  ? 9.000  33.503 55.265 0.28 69.99  ? 41  LYS A HE2  1 
ATOM   607  H HE2  B LYS A 1 38  ? 9.863  31.641 56.173 0.72 78.11  ? 41  LYS A HE2  1 
ATOM   608  H HE3  A LYS A 1 38  ? 10.330 33.602 54.401 0.28 69.99  ? 41  LYS A HE3  1 
ATOM   609  H HE3  B LYS A 1 38  ? 8.758  32.771 56.008 0.72 78.11  ? 41  LYS A HE3  1 
ATOM   610  H HZ1  A LYS A 1 38  ? 8.589  34.824 53.515 0.28 75.18  ? 41  LYS A HZ1  1 
ATOM   611  H HZ1  B LYS A 1 38  ? 7.773  30.784 56.466 0.72 66.66  ? 41  LYS A HZ1  1 
ATOM   612  H HZ2  A LYS A 1 38  ? 9.087  33.857 52.559 0.28 75.18  ? 41  LYS A HZ2  1 
ATOM   613  H HZ2  B LYS A 1 38  ? 7.378  31.180 55.130 0.72 66.66  ? 41  LYS A HZ2  1 
ATOM   614  H HZ3  A LYS A 1 38  ? 7.847  33.605 53.263 0.28 75.18  ? 41  LYS A HZ3  1 
ATOM   615  H HZ3  B LYS A 1 38  ? 8.382  30.153 55.313 0.72 66.66  ? 41  LYS A HZ3  1 
ATOM   616  N N    . PHE A 1 39  ? 14.017 30.917 51.186 1.00 36.61  ? 42  PHE A N    1 
ATOM   617  C CA   . PHE A 1 39  ? 15.072 31.467 50.342 1.00 51.08  ? 42  PHE A CA   1 
ATOM   618  C C    . PHE A 1 39  ? 15.585 30.444 49.338 1.00 53.92  ? 42  PHE A C    1 
ATOM   619  O O    . PHE A 1 39  ? 15.970 30.815 48.223 1.00 40.96  ? 42  PHE A O    1 
ATOM   620  C CB   . PHE A 1 39  ? 16.215 31.987 51.214 1.00 49.99  ? 42  PHE A CB   1 
ATOM   621  C CG   . PHE A 1 39  ? 15.862 33.222 51.994 1.00 46.50  ? 42  PHE A CG   1 
ATOM   622  C CD1  . PHE A 1 39  ? 15.765 34.449 51.360 1.00 50.40  ? 42  PHE A CD1  1 
ATOM   623  C CD2  . PHE A 1 39  ? 15.626 33.156 53.357 1.00 49.94  ? 42  PHE A CD2  1 
ATOM   624  C CE1  . PHE A 1 39  ? 15.439 35.587 52.070 1.00 54.24  ? 42  PHE A CE1  1 
ATOM   625  C CE2  . PHE A 1 39  ? 15.299 34.292 54.074 1.00 43.38  ? 42  PHE A CE2  1 
ATOM   626  C CZ   . PHE A 1 39  ? 15.206 35.509 53.429 1.00 49.91  ? 42  PHE A CZ   1 
ATOM   627  H H    . PHE A 1 39  ? 14.248 30.760 52.000 0.00 43.98  ? 42  PHE A H    1 
ATOM   628  H HA   . PHE A 1 39  ? 14.713 32.216 49.840 0.00 61.34  ? 42  PHE A HA   1 
ATOM   629  H HB2  . PHE A 1 39  ? 16.463 31.296 51.848 0.00 60.04  ? 42  PHE A HB2  1 
ATOM   630  H HB3  . PHE A 1 39  ? 16.970 32.201 50.644 0.00 60.04  ? 42  PHE A HB3  1 
ATOM   631  H HD1  . PHE A 1 39  ? 15.922 34.507 50.445 0.00 60.53  ? 42  PHE A HD1  1 
ATOM   632  H HD2  . PHE A 1 39  ? 15.687 32.338 53.796 0.00 59.98  ? 42  PHE A HD2  1 
ATOM   633  H HE1  . PHE A 1 39  ? 15.376 36.406 51.633 0.00 65.14  ? 42  PHE A HE1  1 
ATOM   634  H HE2  . PHE A 1 39  ? 15.143 34.237 54.989 0.00 52.10  ? 42  PHE A HE2  1 
ATOM   635  H HZ   . PHE A 1 39  ? 14.986 36.275 53.908 0.00 59.95  ? 42  PHE A HZ   1 
ATOM   636  N N    . TYR A 1 40  ? 15.600 29.161 49.705 1.00 36.44  ? 43  TYR A N    1 
ATOM   637  C CA   . TYR A 1 40  ? 16.010 28.131 48.755 1.00 36.34  ? 43  TYR A CA   1 
ATOM   638  C C    . TYR A 1 40  ? 15.000 27.996 47.624 1.00 44.02  ? 43  TYR A C    1 
ATOM   639  O O    . TYR A 1 40  ? 15.382 27.843 46.458 1.00 50.61  ? 43  TYR A O    1 
ATOM   640  C CB   . TYR A 1 40  ? 16.188 26.790 49.469 1.00 42.11  ? 43  TYR A CB   1 
ATOM   641  C CG   . TYR A 1 40  ? 17.596 26.545 49.956 1.00 40.28  ? 43  TYR A CG   1 
ATOM   642  C CD1  . TYR A 1 40  ? 18.563 26.020 49.108 1.00 34.96  ? 43  TYR A CD1  1 
ATOM   643  C CD2  . TYR A 1 40  ? 17.959 26.838 51.263 1.00 43.35  ? 43  TYR A CD2  1 
ATOM   644  C CE1  . TYR A 1 40  ? 19.852 25.795 49.550 1.00 52.70  ? 43  TYR A CE1  1 
ATOM   645  C CE2  . TYR A 1 40  ? 19.245 26.617 51.713 1.00 39.00  ? 43  TYR A CE2  1 
ATOM   646  C CZ   . TYR A 1 40  ? 20.187 26.095 50.854 1.00 56.90  ? 43  TYR A CZ   1 
ATOM   647  O OH   . TYR A 1 40  ? 21.469 25.874 51.302 1.00 68.97  ? 43  TYR A OH   1 
ATOM   648  H H    . TYR A 1 40  ? 15.382 28.867 50.484 0.00 43.78  ? 43  TYR A H    1 
ATOM   649  H HA   . TYR A 1 40  ? 16.866 28.384 48.374 0.00 43.66  ? 43  TYR A HA   1 
ATOM   650  H HB2  . TYR A 1 40  ? 15.600 26.767 50.239 0.00 50.58  ? 43  TYR A HB2  1 
ATOM   651  H HB3  . TYR A 1 40  ? 15.959 26.076 48.854 0.00 50.58  ? 43  TYR A HB3  1 
ATOM   652  H HD1  . TYR A 1 40  ? 18.338 25.817 48.228 0.00 42.01  ? 43  TYR A HD1  1 
ATOM   653  H HD2  . TYR A 1 40  ? 17.325 27.190 51.845 0.00 52.08  ? 43  TYR A HD2  1 
ATOM   654  H HE1  . TYR A 1 40  ? 20.490 25.443 48.972 0.00 63.29  ? 43  TYR A HE1  1 
ATOM   655  H HE2  . TYR A 1 40  ? 19.473 26.819 52.592 0.00 46.86  ? 43  TYR A HE2  1 
ATOM   656  H HH   . TYR A 1 40  ? 21.548 26.150 52.092 0.00 82.81  ? 43  TYR A HH   1 
ATOM   657  N N    . ALA A 1 41  ? 13.707 28.057 47.947 1.00 37.70  ? 44  ALA A N    1 
ATOM   658  C CA   . ALA A 1 41  ? 12.679 27.905 46.922 1.00 39.36  ? 44  ALA A CA   1 
ATOM   659  C C    . ALA A 1 41  ? 12.689 29.082 45.955 1.00 43.25  ? 44  ALA A C    1 
ATOM   660  O O    . ALA A 1 41  ? 12.617 28.895 44.735 1.00 51.71  ? 44  ALA A O    1 
ATOM   661  C CB   . ALA A 1 41  ? 11.306 27.754 47.578 1.00 39.47  ? 44  ALA A CB   1 
ATOM   662  H H    . ALA A 1 41  ? 13.404 28.183 48.742 0.00 45.30  ? 44  ALA A H    1 
ATOM   663  H HA   . ALA A 1 41  ? 12.860 27.098 46.415 0.00 47.28  ? 44  ALA A HA   1 
ATOM   664  H HB1  . ALA A 1 41  ? 10.635 27.650 46.885 0.00 47.41  ? 44  ALA A HB1  1 
ATOM   665  H HB2  . ALA A 1 41  ? 11.314 26.972 48.151 0.00 47.41  ? 44  ALA A HB2  1 
ATOM   666  H HB3  . ALA A 1 41  ? 11.119 28.548 48.104 0.00 47.41  ? 44  ALA A HB3  1 
ATOM   667  N N    . ILE A 1 42  ? 12.777 30.306 46.480 1.00 43.55  ? 45  ILE A N    1 
ATOM   668  C CA   . ILE A 1 42  ? 12.811 31.479 45.610 1.00 38.62  ? 45  ILE A CA   1 
ATOM   669  C C    . ILE A 1 42  ? 14.070 31.463 44.755 1.00 46.75  ? 45  ILE A C    1 
ATOM   670  O O    . ILE A 1 42  ? 14.026 31.750 43.553 1.00 46.27  ? 45  ILE A O    1 
ATOM   671  C CB   . ILE A 1 42  ? 12.724 32.775 46.438 1.00 38.15  ? 45  ILE A CB   1 
ATOM   672  C CG1  . ILE A 1 42  ? 11.376 32.885 47.152 1.00 38.19  ? 45  ILE A CG1  1 
ATOM   673  C CG2  . ILE A 1 42  ? 12.923 33.985 45.534 1.00 32.99  ? 45  ILE A CG2  1 
ATOM   674  C CD1  . ILE A 1 42  ? 11.381 33.908 48.271 1.00 40.11  ? 45  ILE A CD1  1 
ATOM   675  H H    . ILE A 1 42  ? 12.817 30.481 47.321 0.00 52.31  ? 45  ILE A H    1 
ATOM   676  H HA   . ILE A 1 42  ? 12.038 31.443 45.025 0.00 46.40  ? 45  ILE A HA   1 
ATOM   677  H HB   . ILE A 1 42  ? 13.425 32.747 47.108 0.00 45.84  ? 45  ILE A HB   1 
ATOM   678  H HG12 . ILE A 1 42  ? 10.700 33.148 46.508 0.00 45.87  ? 45  ILE A HG12 1 
ATOM   679  H HG13 . ILE A 1 42  ? 11.152 32.023 47.536 0.00 45.87  ? 45  ILE A HG13 1 
ATOM   680  H HG21 . ILE A 1 42  ? 12.627 34.781 46.002 0.00 39.63  ? 45  ILE A HG21 1 
ATOM   681  H HG22 . ILE A 1 42  ? 13.864 34.062 45.312 0.00 39.63  ? 45  ILE A HG22 1 
ATOM   682  H HG23 . ILE A 1 42  ? 12.401 33.863 44.725 0.00 39.63  ? 45  ILE A HG23 1 
ATOM   683  H HD11 . ILE A 1 42  ? 10.546 33.844 48.760 0.00 48.18  ? 45  ILE A HD11 1 
ATOM   684  H HD12 . ILE A 1 42  ? 12.127 33.726 48.863 0.00 48.18  ? 45  ILE A HD12 1 
ATOM   685  H HD13 . ILE A 1 42  ? 11.472 34.795 47.887 0.00 48.18  ? 45  ILE A HD13 1 
ATOM   686  N N    . THR A 1 43  ? 15.212 31.125 45.359 1.00 37.05  ? 46  THR A N    1 
ATOM   687  C CA   . THR A 1 43  ? 16.488 31.250 44.665 1.00 36.57  ? 46  THR A CA   1 
ATOM   688  C C    . THR A 1 43  ? 16.730 30.107 43.688 1.00 44.62  ? 46  THR A C    1 
ATOM   689  O O    . THR A 1 43  ? 17.462 30.286 42.710 1.00 42.00  ? 46  THR A O    1 
ATOM   690  C CB   . THR A 1 43  ? 17.635 31.321 45.676 1.00 34.39  ? 46  THR A CB   1 
ATOM   691  O OG1  . THR A 1 43  ? 17.364 32.349 46.637 1.00 39.47  ? 46  THR A OG1  1 
ATOM   692  C CG2  . THR A 1 43  ? 18.946 31.632 44.968 1.00 50.98  ? 46  THR A CG2  1 
ATOM   693  H H    . THR A 1 43  ? 15.271 30.824 46.163 0.00 44.51  ? 46  THR A H    1 
ATOM   694  H HA   . THR A 1 43  ? 16.481 32.077 44.159 0.00 43.94  ? 46  THR A HA   1 
ATOM   695  H HB   . THR A 1 43  ? 17.722 30.467 46.129 0.00 41.32  ? 46  THR A HB   1 
ATOM   696  H HG1  . THR A 1 43  ? 16.643 32.185 47.037 0.00 47.42  ? 46  THR A HG1  1 
ATOM   697  H HG21 . THR A 1 43  ? 19.641 31.812 45.621 0.00 61.23  ? 46  THR A HG21 1 
ATOM   698  H HG22 . THR A 1 43  ? 19.215 30.878 44.421 0.00 61.23  ? 46  THR A HG22 1 
ATOM   699  H HG23 . THR A 1 43  ? 18.839 32.411 44.399 0.00 61.23  ? 46  THR A HG23 1 
ATOM   700  N N    . THR A 1 44  ? 16.141 28.935 43.930 1.00 37.95  ? 47  THR A N    1 
ATOM   701  C CA   . THR A 1 44  ? 16.297 27.833 42.988 1.00 43.24  ? 47  THR A CA   1 
ATOM   702  C C    . THR A 1 44  ? 15.368 27.982 41.789 1.00 44.13  ? 47  THR A C    1 
ATOM   703  O O    . THR A 1 44  ? 15.685 27.489 40.701 1.00 38.99  ? 47  THR A O    1 
ATOM   704  C CB   . THR A 1 44  ? 16.043 26.494 43.685 1.00 51.64  ? 47  THR A CB   1 
ATOM   705  O OG1  . THR A 1 44  ? 16.939 26.351 44.794 1.00 43.77  ? 47  THR A OG1  1 
ATOM   706  C CG2  . THR A 1 44  ? 16.267 25.335 42.716 1.00 45.69  ? 47  THR A CG2  1 
ATOM   707  H H    . THR A 1 44  ? 15.656 28.758 44.618 0.00 45.59  ? 47  THR A H    1 
ATOM   708  H HA   . THR A 1 44  ? 17.212 27.827 42.666 0.00 51.94  ? 47  THR A HA   1 
ATOM   709  H HB   . THR A 1 44  ? 15.126 26.464 43.998 0.00 62.02  ? 47  THR A HB   1 
ATOM   710  H HG1  . THR A 1 44  ? 16.840 26.992 45.328 0.00 52.57  ? 47  THR A HG1  1 
ATOM   711  H HG21 . THR A 1 44  ? 16.231 24.492 43.194 0.00 54.88  ? 47  THR A HG21 1 
ATOM   712  H HG22 . THR A 1 44  ? 15.581 25.338 42.031 0.00 54.88  ? 47  THR A HG22 1 
ATOM   713  H HG23 . THR A 1 44  ? 17.135 25.420 42.292 0.00 54.88  ? 47  THR A HG23 1 
ATOM   714  N N    . LEU A 1 45  ? 14.228 28.658 41.963 1.00 40.60  ? 48  LEU A N    1 
ATOM   715  C CA   . LEU A 1 45  ? 13.312 28.863 40.845 1.00 46.42  ? 48  LEU A CA   1 
ATOM   716  C C    . LEU A 1 45  ? 13.874 29.839 39.820 1.00 34.73  ? 48  LEU A C    1 
ATOM   717  O O    . LEU A 1 45  ? 13.499 29.780 38.643 1.00 46.55  ? 48  LEU A O    1 
ATOM   718  C CB   . LEU A 1 45  ? 11.961 29.379 41.348 1.00 45.98  ? 48  LEU A CB   1 
ATOM   719  C CG   . LEU A 1 45  ? 10.923 28.370 41.844 1.00 56.19  ? 48  LEU A CG   1 
ATOM   720  C CD1  . LEU A 1 45  ? 9.774  29.111 42.512 1.00 48.42  ? 48  LEU A CD1  1 
ATOM   721  C CD2  . LEU A 1 45  ? 10.408 27.497 40.709 1.00 51.22  ? 48  LEU A CD2  1 
ATOM   722  H H    . LEU A 1 45  ? 13.968 29.002 42.707 0.00 48.77  ? 48  LEU A H    1 
ATOM   723  H HA   . LEU A 1 45  ? 13.173 28.006 40.412 0.00 55.76  ? 48  LEU A HA   1 
ATOM   724  H HB2  . LEU A 1 45  ? 12.137 29.979 42.089 0.00 55.23  ? 48  LEU A HB2  1 
ATOM   725  H HB3  . LEU A 1 45  ? 11.546 29.865 40.619 0.00 55.23  ? 48  LEU A HB3  1 
ATOM   726  H HG   . LEU A 1 45  ? 11.339 27.779 42.491 0.00 67.48  ? 48  LEU A HG   1 
ATOM   727  H HD11 . LEU A 1 45  ? 9.127  28.464 42.836 0.00 58.15  ? 48  LEU A HD11 1 
ATOM   728  H HD12 . LEU A 1 45  ? 10.122 29.631 43.253 0.00 58.15  ? 48  LEU A HD12 1 
ATOM   729  H HD13 . LEU A 1 45  ? 9.357  29.698 41.863 0.00 58.15  ? 48  LEU A HD13 1 
ATOM   730  H HD21 . LEU A 1 45  ? 9.713  26.913 41.050 0.00 61.52  ? 48  LEU A HD21 1 
ATOM   731  H HD22 . LEU A 1 45  ? 10.049 28.066 40.011 0.00 61.52  ? 48  LEU A HD22 1 
ATOM   732  H HD23 . LEU A 1 45  ? 11.143 26.968 40.360 0.00 61.52  ? 48  LEU A HD23 1 
ATOM   733  N N    . VAL A 1 46  ? 14.757 30.740 40.239 1.00 36.27  ? 49  VAL A N    1 
ATOM   734  C CA   . VAL A 1 46  ? 15.263 31.795 39.364 1.00 35.92  ? 49  VAL A CA   1 
ATOM   735  C C    . VAL A 1 46  ? 16.061 31.169 38.224 1.00 36.91  ? 49  VAL A C    1 
ATOM   736  O O    . VAL A 1 46  ? 15.755 31.428 37.051 1.00 37.47  ? 49  VAL A O    1 
ATOM   737  C CB   . VAL A 1 46  ? 16.099 32.817 40.153 1.00 30.48  ? 49  VAL A CB   1 
ATOM   738  C CG1  . VAL A 1 46  ? 16.914 33.690 39.212 1.00 31.10  ? 49  VAL A CG1  1 
ATOM   739  C CG2  . VAL A 1 46  ? 15.192 33.678 41.020 1.00 32.57  ? 49  VAL A CG2  1 
ATOM   740  H H    . VAL A 1 46  ? 15.084 30.762 41.034 0.00 43.58  ? 49  VAL A H    1 
ATOM   741  H HA   . VAL A 1 46  ? 14.511 32.263 38.968 0.00 43.15  ? 49  VAL A HA   1 
ATOM   742  H HB   . VAL A 1 46  ? 16.716 32.338 40.728 0.00 36.63  ? 49  VAL A HB   1 
ATOM   743  H HG11 . VAL A 1 46  ? 17.221 34.474 39.694 0.00 37.37  ? 49  VAL A HG11 1 
ATOM   744  H HG12 . VAL A 1 46  ? 17.674 33.182 38.888 0.00 37.37  ? 49  VAL A HG12 1 
ATOM   745  H HG13 . VAL A 1 46  ? 16.355 33.959 38.467 0.00 37.37  ? 49  VAL A HG13 1 
ATOM   746  H HG21 . VAL A 1 46  ? 15.737 34.298 41.529 0.00 39.14  ? 49  VAL A HG21 1 
ATOM   747  H HG22 . VAL A 1 46  ? 14.580 34.167 40.448 0.00 39.14  ? 49  VAL A HG22 1 
ATOM   748  H HG23 . VAL A 1 46  ? 14.693 33.104 41.623 0.00 39.14  ? 49  VAL A HG23 1 
ATOM   749  N N    . PRO A 1 47  ? 17.082 30.350 38.498 1.00 39.33  ? 50  PRO A N    1 
ATOM   750  C CA   . PRO A 1 47  ? 17.813 29.714 37.391 1.00 35.90  ? 50  PRO A CA   1 
ATOM   751  C C    . PRO A 1 47  ? 17.017 28.642 36.666 1.00 37.33  ? 50  PRO A C    1 
ATOM   752  O O    . PRO A 1 47  ? 17.304 28.375 35.492 1.00 40.21  ? 50  PRO A O    1 
ATOM   753  C CB   . PRO A 1 47  ? 19.050 29.123 38.079 1.00 42.17  ? 50  PRO A CB   1 
ATOM   754  C CG   . PRO A 1 47  ? 18.628 28.898 39.479 1.00 40.64  ? 50  PRO A CG   1 
ATOM   755  C CD   . PRO A 1 47  ? 17.675 30.014 39.806 1.00 34.88  ? 50  PRO A CD   1 
ATOM   756  H HA   . PRO A 1 47  ? 18.095 30.387 36.751 0.00 43.13  ? 50  PRO A HA   1 
ATOM   757  H HB2  . PRO A 1 47  ? 19.299 28.288 37.652 0.00 50.65  ? 50  PRO A HB2  1 
ATOM   758  H HB3  . PRO A 1 47  ? 19.787 29.751 38.033 0.00 50.65  ? 50  PRO A HB3  1 
ATOM   759  H HG2  . PRO A 1 47  ? 18.188 28.037 39.554 0.00 48.82  ? 50  PRO A HG2  1 
ATOM   760  H HG3  . PRO A 1 47  ? 19.403 28.927 40.062 0.00 48.82  ? 50  PRO A HG3  1 
ATOM   761  H HD2  . PRO A 1 47  ? 16.993 29.714 40.427 0.00 41.91  ? 50  PRO A HD2  1 
ATOM   762  H HD3  . PRO A 1 47  ? 18.149 30.775 40.176 0.00 41.91  ? 50  PRO A HD3  1 
ATOM   763  N N    . ALA A 1 48  ? 16.034 28.016 37.317 1.00 34.27  ? 51  ALA A N    1 
ATOM   764  C CA   . ALA A 1 48  ? 15.237 27.002 36.632 1.00 35.26  ? 51  ALA A CA   1 
ATOM   765  C C    . ALA A 1 48  ? 14.362 27.632 35.555 1.00 38.98  ? 51  ALA A C    1 
ATOM   766  O O    . ALA A 1 48  ? 14.222 27.078 34.458 1.00 40.23  ? 51  ALA A O    1 
ATOM   767  C CB   . ALA A 1 48  ? 14.382 26.232 37.638 1.00 42.07  ? 51  ALA A CB   1 
ATOM   768  H H    . ALA A 1 48  ? 15.814 28.157 38.136 0.00 41.17  ? 51  ALA A H    1 
ATOM   769  H HA   . ALA A 1 48  ? 15.835 26.369 36.206 0.00 42.36  ? 51  ALA A HA   1 
ATOM   770  H HB1  . ALA A 1 48  ? 13.862 25.564 37.165 0.00 50.53  ? 51  ALA A HB1  1 
ATOM   771  H HB2  . ALA A 1 48  ? 14.964 25.801 38.284 0.00 50.53  ? 51  ALA A HB2  1 
ATOM   772  H HB3  . ALA A 1 48  ? 13.789 26.853 38.090 0.00 50.53  ? 51  ALA A HB3  1 
ATOM   773  N N    . ILE A 1 49  ? 13.766 28.788 35.849 1.00 34.99  ? 52  ILE A N    1 
ATOM   774  C CA   . ILE A 1 49  ? 12.995 29.507 34.838 1.00 40.04  ? 52  ILE A CA   1 
ATOM   775  C C    . ILE A 1 49  ? 13.908 29.954 33.704 1.00 47.69  ? 52  ILE A C    1 
ATOM   776  O O    . ILE A 1 49  ? 13.614 29.742 32.521 1.00 38.17  ? 52  ILE A O    1 
ATOM   777  C CB   . ILE A 1 49  ? 12.262 30.702 35.476 1.00 39.94  ? 52  ILE A CB   1 
ATOM   778  C CG1  . ILE A 1 49  ? 11.169 30.211 36.428 1.00 47.80  ? 52  ILE A CG1  1 
ATOM   779  C CG2  . ILE A 1 49  ? 11.664 31.597 34.397 1.00 37.98  ? 52  ILE A CG2  1 
ATOM   780  C CD1  . ILE A 1 49  ? 10.647 31.272 37.372 1.00 49.45  ? 52  ILE A CD1  1 
ATOM   781  H H    . ILE A 1 49  ? 13.792 29.172 36.618 0.00 42.04  ? 52  ILE A H    1 
ATOM   782  H HA   . ILE A 1 49  ? 12.328 28.908 34.470 0.00 48.10  ? 52  ILE A HA   1 
ATOM   783  H HB   . ILE A 1 49  ? 12.906 31.219 35.985 0.00 47.98  ? 52  ILE A HB   1 
ATOM   784  H HG12 . ILE A 1 49  ? 10.419 29.891 35.902 0.00 57.42  ? 52  ILE A HG12 1 
ATOM   785  H HG13 . ILE A 1 49  ? 11.528 29.488 36.966 0.00 57.42  ? 52  ILE A HG13 1 
ATOM   786  H HG21 . ILE A 1 49  ? 11.006 32.183 34.802 0.00 45.63  ? 52  ILE A HG21 1 
ATOM   787  H HG22 . ILE A 1 49  ? 12.372 32.123 33.995 0.00 45.63  ? 52  ILE A HG22 1 
ATOM   788  H HG23 . ILE A 1 49  ? 11.241 31.041 33.724 0.00 45.63  ? 52  ILE A HG23 1 
ATOM   789  H HD11 . ILE A 1 49  ? 10.039 30.859 38.006 0.00 59.39  ? 52  ILE A HD11 1 
ATOM   790  H HD12 . ILE A 1 49  ? 11.395 31.671 37.843 0.00 59.39  ? 52  ILE A HD12 1 
ATOM   791  H HD13 . ILE A 1 49  ? 10.180 31.949 36.859 0.00 59.39  ? 52  ILE A HD13 1 
ATOM   792  N N    . ALA A 1 50  ? 15.038 30.578 34.051 1.00 36.16  ? 53  ALA A N    1 
ATOM   793  C CA   . ALA A 1 50  ? 15.960 31.070 33.035 1.00 47.85  ? 53  ALA A CA   1 
ATOM   794  C C    . ALA A 1 50  ? 16.505 29.940 32.171 1.00 34.83  ? 53  ALA A C    1 
ATOM   795  O O    . ALA A 1 50  ? 16.825 30.158 30.997 1.00 40.73  ? 53  ALA A O    1 
ATOM   796  C CB   . ALA A 1 50  ? 17.107 31.833 33.699 1.00 43.63  ? 53  ALA A CB   1 
ATOM   797  H H    . ALA A 1 50  ? 15.288 30.726 34.861 0.00 43.44  ? 53  ALA A H    1 
ATOM   798  H HA   . ALA A 1 50  ? 15.485 31.684 32.453 0.00 57.47  ? 53  ALA A HA   1 
ATOM   799  H HB1  . ALA A 1 50  ? 17.708 32.160 33.012 0.00 52.40  ? 53  ALA A HB1  1 
ATOM   800  H HB2  . ALA A 1 50  ? 16.741 32.578 34.201 0.00 52.40  ? 53  ALA A HB2  1 
ATOM   801  H HB3  . ALA A 1 50  ? 17.581 31.233 34.296 0.00 52.40  ? 53  ALA A HB3  1 
ATOM   802  N N    . PHE A 1 51  ? 16.621 28.731 32.727 1.00 33.64  ? 54  PHE A N    1 
ATOM   803  C CA   . PHE A 1 51  ? 17.106 27.602 31.938 1.00 36.88  ? 54  PHE A CA   1 
ATOM   804  C C    . PHE A 1 51  ? 16.159 27.281 30.789 1.00 38.45  ? 54  PHE A C    1 
ATOM   805  O O    . PHE A 1 51  ? 16.602 27.031 29.661 1.00 38.20  ? 54  PHE A O    1 
ATOM   806  C CB   . PHE A 1 51  ? 17.291 26.376 32.832 1.00 32.68  ? 54  PHE A CB   1 
ATOM   807  C CG   . PHE A 1 51  ? 17.399 25.085 32.072 1.00 40.30  ? 54  PHE A CG   1 
ATOM   808  C CD1  . PHE A 1 51  ? 18.578 24.729 31.438 1.00 46.73  ? 54  PHE A CD1  1 
ATOM   809  C CD2  . PHE A 1 51  ? 16.313 24.230 31.983 1.00 42.99  ? 54  PHE A CD2  1 
ATOM   810  C CE1  . PHE A 1 51  ? 18.672 23.540 30.737 1.00 58.10  ? 54  PHE A CE1  1 
ATOM   811  C CE2  . PHE A 1 51  ? 16.401 23.044 31.283 1.00 59.46  ? 54  PHE A CE2  1 
ATOM   812  C CZ   . PHE A 1 51  ? 17.582 22.698 30.660 1.00 45.02  ? 54  PHE A CZ   1 
ATOM   813  H H    . PHE A 1 51  ? 16.429 28.543 33.544 0.00 40.42  ? 54  PHE A H    1 
ATOM   814  H HA   . PHE A 1 51  ? 17.970 27.837 31.562 0.00 44.30  ? 54  PHE A HA   1 
ATOM   815  H HB2  . PHE A 1 51  ? 18.105 26.485 33.347 0.00 39.26  ? 54  PHE A HB2  1 
ATOM   816  H HB3  . PHE A 1 51  ? 16.528 26.306 33.427 0.00 39.26  ? 54  PHE A HB3  1 
ATOM   817  H HD1  . PHE A 1 51  ? 19.314 25.295 31.483 0.00 56.12  ? 54  PHE A HD1  1 
ATOM   818  H HD2  . PHE A 1 51  ? 15.514 24.458 32.400 0.00 51.64  ? 54  PHE A HD2  1 
ATOM   819  H HE1  . PHE A 1 51  ? 19.469 23.309 30.318 0.00 69.77  ? 54  PHE A HE1  1 
ATOM   820  H HE2  . PHE A 1 51  ? 15.665 22.479 31.231 0.00 71.40  ? 54  PHE A HE2  1 
ATOM   821  H HZ   . PHE A 1 51  ? 17.643 21.899 30.189 0.00 54.08  ? 54  PHE A HZ   1 
ATOM   822  N N    . THR A 1 52  ? 14.849 27.276 31.053 1.00 36.35  ? 55  THR A N    1 
ATOM   823  C CA   . THR A 1 52  ? 13.895 26.925 30.007 1.00 44.43  ? 55  THR A CA   1 
ATOM   824  C C    . THR A 1 52  ? 13.817 27.998 28.930 1.00 38.85  ? 55  THR A C    1 
ATOM   825  O O    . THR A 1 52  ? 13.525 27.688 27.770 1.00 38.05  ? 55  THR A O    1 
ATOM   826  C CB   . THR A 1 52  ? 12.506 26.692 30.604 1.00 46.16  ? 55  THR A CB   1 
ATOM   827  O OG1  . THR A 1 52  ? 11.988 27.926 31.115 1.00 47.15  ? 55  THR A OG1  1 
ATOM   828  C CG2  . THR A 1 52  ? 12.560 25.660 31.720 1.00 48.18  ? 55  THR A CG2  1 
ATOM   829  H H    . THR A 1 52  ? 14.498 27.468 31.814 0.00 43.67  ? 55  THR A H    1 
ATOM   830  H HA   . THR A 1 52  ? 14.189 26.097 29.595 0.00 53.37  ? 55  THR A HA   1 
ATOM   831  H HB   . THR A 1 52  ? 11.913 26.356 29.914 0.00 55.44  ? 55  THR A HB   1 
ATOM   832  H HG1  . THR A 1 52  ? 11.216 27.807 31.426 0.00 56.63  ? 55  THR A HG1  1 
ATOM   833  H HG21 . THR A 1 52  ? 11.661 25.431 32.004 0.00 57.86  ? 55  THR A HG21 1 
ATOM   834  H HG22 . THR A 1 52  ? 13.005 24.857 31.408 0.00 57.86  ? 55  THR A HG22 1 
ATOM   835  H HG23 . THR A 1 52  ? 13.049 26.016 32.478 0.00 57.86  ? 55  THR A HG23 1 
ATOM   836  N N    . MET A 1 53  ? 14.065 29.259 29.288 1.00 34.26  ? 56  MET A N    1 
ATOM   837  C CA   . MET A 1 53  ? 13.983 30.326 28.298 1.00 38.32  ? 56  MET A CA   1 
ATOM   838  C C    . MET A 1 53  ? 15.262 30.431 27.480 1.00 45.18  ? 56  MET A C    1 
ATOM   839  O O    . MET A 1 53  ? 15.203 30.698 26.275 1.00 40.02  ? 56  MET A O    1 
ATOM   840  C CB   . MET A 1 53  ? 13.662 31.656 28.982 1.00 39.67  ? 56  MET A CB   1 
ATOM   841  C CG   . MET A 1 53  ? 12.294 31.694 29.665 1.00 47.91  ? 56  MET A CG   1 
ATOM   842  S SD   . MET A 1 53  ? 10.895 31.945 28.543 1.00 52.80  ? 56  MET A SD   1 
ATOM   843  C CE   . MET A 1 53  ? 10.739 30.353 27.736 1.00 54.17  ? 56  MET A CE   1 
ATOM   844  H H    . MET A 1 53  ? 14.278 29.515 30.081 0.00 41.17  ? 56  MET A H    1 
ATOM   845  H HA   . MET A 1 53  ? 13.250 30.130 27.693 0.00 46.03  ? 56  MET A HA   1 
ATOM   846  H HB2  . MET A 1 53  ? 14.335 31.827 29.660 0.00 47.65  ? 56  MET A HB2  1 
ATOM   847  H HB3  . MET A 1 53  ? 13.677 32.360 28.315 0.00 47.65  ? 56  MET A HB3  1 
ATOM   848  H HG2  . MET A 1 53  ? 12.154 30.849 30.122 0.00 57.54  ? 56  MET A HG2  1 
ATOM   849  H HG3  . MET A 1 53  ? 12.289 32.422 30.306 0.00 57.54  ? 56  MET A HG3  1 
ATOM   850  H HE1  . MET A 1 53  ? 9.804  30.190 27.536 0.00 65.06  ? 56  MET A HE1  1 
ATOM   851  H HE2  . MET A 1 53  ? 11.256 30.362 26.915 0.00 65.06  ? 56  MET A HE2  1 
ATOM   852  H HE3  . MET A 1 53  ? 11.075 29.663 28.330 0.00 65.06  ? 56  MET A HE3  1 
ATOM   853  N N    . TYR A 1 54  ? 16.425 30.218 28.101 1.00 35.69  ? 57  TYR A N    1 
ATOM   854  C CA   . TYR A 1 54  ? 17.649 30.125 27.314 1.00 31.68  ? 57  TYR A CA   1 
ATOM   855  C C    . TYR A 1 54  ? 17.577 28.958 26.338 1.00 35.66  ? 57  TYR A C    1 
ATOM   856  O O    . TYR A 1 54  ? 18.035 29.066 25.195 1.00 35.81  ? 57  TYR A O    1 
ATOM   857  C CB   . TYR A 1 54  ? 18.866 29.986 28.228 1.00 36.74  ? 57  TYR A CB   1 
ATOM   858  C CG   . TYR A 1 54  ? 19.587 31.293 28.461 1.00 38.82  ? 57  TYR A CG   1 
ATOM   859  C CD1  . TYR A 1 54  ? 19.210 32.145 29.490 1.00 43.89  ? 57  TYR A CD1  1 
ATOM   860  C CD2  . TYR A 1 54  ? 20.628 31.686 27.633 1.00 39.05  ? 57  TYR A CD2  1 
ATOM   861  C CE1  . TYR A 1 54  ? 19.864 33.343 29.700 1.00 32.36  ? 57  TYR A CE1  1 
ATOM   862  C CE2  . TYR A 1 54  ? 21.286 32.883 27.832 1.00 35.97  ? 57  TYR A CE2  1 
ATOM   863  C CZ   . TYR A 1 54  ? 20.899 33.707 28.867 1.00 39.96  ? 57  TYR A CZ   1 
ATOM   864  O OH   . TYR A 1 54  ? 21.551 34.901 29.071 1.00 42.33  ? 57  TYR A OH   1 
ATOM   865  H H    . TYR A 1 54  ? 16.527 30.127 28.950 0.00 42.88  ? 57  TYR A H    1 
ATOM   866  H HA   . TYR A 1 54  ? 17.757 30.945 26.807 0.00 38.07  ? 57  TYR A HA   1 
ATOM   867  H HB2  . TYR A 1 54  ? 18.575 29.648 29.089 0.00 44.13  ? 57  TYR A HB2  1 
ATOM   868  H HB3  . TYR A 1 54  ? 19.494 29.367 27.823 0.00 44.13  ? 57  TYR A HB3  1 
ATOM   869  H HD1  . TYR A 1 54  ? 18.506 31.905 30.048 0.00 52.72  ? 57  TYR A HD1  1 
ATOM   870  H HD2  . TYR A 1 54  ? 20.887 31.134 26.931 0.00 46.91  ? 57  TYR A HD2  1 
ATOM   871  H HE1  . TYR A 1 54  ? 19.607 33.900 30.399 0.00 38.88  ? 57  TYR A HE1  1 
ATOM   872  H HE2  . TYR A 1 54  ? 21.986 33.131 27.273 0.00 43.22  ? 57  TYR A HE2  1 
ATOM   873  H HH   . TYR A 1 54  ? 21.231 35.292 29.741 0.00 50.84  ? 57  TYR A HH   1 
ATOM   874  N N    . LEU A 1 55  ? 16.999 27.834 26.770 1.00 38.87  ? 58  LEU A N    1 
ATOM   875  C CA   . LEU A 1 55  ? 16.826 26.701 25.866 1.00 34.59  ? 58  LEU A CA   1 
ATOM   876  C C    . LEU A 1 55  ? 15.903 27.058 24.707 1.00 36.78  ? 58  LEU A C    1 
ATOM   877  O O    . LEU A 1 55  ? 16.109 26.600 23.578 1.00 42.67  ? 58  LEU A O    1 
ATOM   878  C CB   . LEU A 1 55  ? 16.281 25.495 26.632 1.00 38.86  ? 58  LEU A CB   1 
ATOM   879  C CG   . LEU A 1 55  ? 16.078 24.219 25.808 1.00 48.46  ? 58  LEU A CG   1 
ATOM   880  C CD1  . LEU A 1 55  ? 17.398 23.723 25.233 1.00 46.84  ? 58  LEU A CD1  1 
ATOM   881  C CD2  . LEU A 1 55  ? 15.408 23.135 26.641 1.00 39.65  ? 58  LEU A CD2  1 
ATOM   882  H H    . LEU A 1 55  ? 16.704 27.706 27.567 0.00 46.70  ? 58  LEU A H    1 
ATOM   883  H HA   . LEU A 1 55  ? 17.691 26.459 25.500 0.00 41.56  ? 58  LEU A HA   1 
ATOM   884  H HB2  . LEU A 1 55  ? 16.903 25.282 27.345 0.00 46.68  ? 58  LEU A HB2  1 
ATOM   885  H HB3  . LEU A 1 55  ? 15.419 25.737 27.006 0.00 46.68  ? 58  LEU A HB3  1 
ATOM   886  H HG   . LEU A 1 55  ? 15.492 24.425 25.062 0.00 58.20  ? 58  LEU A HG   1 
ATOM   887  H HD11 . LEU A 1 55  ? 17.252 22.867 24.799 0.00 56.26  ? 58  LEU A HD11 1 
ATOM   888  H HD12 . LEU A 1 55  ? 17.725 24.369 24.587 0.00 56.26  ? 58  LEU A HD12 1 
ATOM   889  H HD13 . LEU A 1 55  ? 18.039 23.623 25.954 0.00 56.26  ? 58  LEU A HD13 1 
ATOM   890  H HD21 . LEU A 1 55  ? 15.292 22.342 26.094 0.00 47.63  ? 58  LEU A HD21 1 
ATOM   891  H HD22 . LEU A 1 55  ? 15.970 22.931 27.405 0.00 47.63  ? 58  LEU A HD22 1 
ATOM   892  H HD23 . LEU A 1 55  ? 14.544 23.457 26.943 0.00 47.63  ? 58  LEU A HD23 1 
ATOM   893  N N    . SER A 1 56  ? 14.878 27.875 24.965 1.00 37.20  ? 59  SER A N    1 
ATOM   894  C CA   . SER A 1 56  ? 13.957 28.249 23.896 1.00 39.07  ? 59  SER A CA   1 
ATOM   895  C C    . SER A 1 56  ? 14.623 29.187 22.897 1.00 34.97  ? 59  SER A C    1 
ATOM   896  O O    . SER A 1 56  ? 14.325 29.131 21.698 1.00 40.18  ? 59  SER A O    1 
ATOM   897  C CB   . SER A 1 56  ? 12.700 28.897 24.479 1.00 46.49  ? 59  SER A CB   1 
ATOM   898  O OG   . SER A 1 56  ? 12.930 30.254 24.816 1.00 54.17  ? 59  SER A OG   1 
ATOM   899  H H    . SER A 1 56  ? 14.699 28.218 25.734 0.00 44.69  ? 59  SER A H    1 
ATOM   900  H HA   . SER A 1 56  ? 13.683 27.447 23.423 0.00 46.93  ? 59  SER A HA   1 
ATOM   901  H HB2  . SER A 1 56  ? 11.990 28.853 23.820 0.00 55.84  ? 59  SER A HB2  1 
ATOM   902  H HB3  . SER A 1 56  ? 12.441 28.414 25.279 0.00 55.84  ? 59  SER A HB3  1 
ATOM   903  H HG   . SER A 1 56  ? 13.533 30.307 25.399 0.00 65.05  ? 59  SER A HG   1 
ATOM   904  N N    . MET A 1 57  ? 15.518 30.054 23.374 1.00 37.39  ? 60  MET A N    1 
ATOM   905  C CA   . MET A 1 57  ? 16.308 30.881 22.469 1.00 32.87  ? 60  MET A CA   1 
ATOM   906  C C    . MET A 1 57  ? 17.274 30.030 21.655 1.00 32.87  ? 60  MET A C    1 
ATOM   907  O O    . MET A 1 57  ? 17.415 30.225 20.442 1.00 37.61  ? 60  MET A O    1 
ATOM   908  C CB   . MET A 1 57  ? 17.068 31.936 23.272 1.00 31.20  ? 60  MET A CB   1 
ATOM   909  C CG   . MET A 1 57  ? 16.172 32.836 24.110 1.00 36.33  ? 60  MET A CG   1 
ATOM   910  S SD   . MET A 1 57  ? 16.876 34.465 24.434 1.00 48.66  ? 60  MET A SD   1 
ATOM   911  C CE   . MET A 1 57  ? 17.892 34.100 25.864 1.00 52.06  ? 60  MET A CE   1 
ATOM   912  H H    . MET A 1 57  ? 15.684 30.180 24.208 0.00 44.92  ? 60  MET A H    1 
ATOM   913  H HA   . MET A 1 57  ? 15.710 31.342 21.859 0.00 39.49  ? 60  MET A HA   1 
ATOM   914  H HB2  . MET A 1 57  ? 17.682 31.487 23.874 0.00 37.49  ? 60  MET A HB2  1 
ATOM   915  H HB3  . MET A 1 57  ? 17.562 32.501 22.656 0.00 37.49  ? 60  MET A HB3  1 
ATOM   916  H HG2  . MET A 1 57  ? 15.333 32.965 23.641 0.00 43.65  ? 60  MET A HG2  1 
ATOM   917  H HG3  . MET A 1 57  ? 16.012 32.407 24.965 0.00 43.65  ? 60  MET A HG3  1 
ATOM   918  H HE1  . MET A 1 57  ? 18.321 34.918 26.163 0.00 62.52  ? 60  MET A HE1  1 
ATOM   919  H HE2  . MET A 1 57  ? 17.330 33.745 26.570 0.00 62.52  ? 60  MET A HE2  1 
ATOM   920  H HE3  . MET A 1 57  ? 18.564 33.446 25.616 0.00 62.52  ? 60  MET A HE3  1 
ATOM   921  N N    . LEU A 1 58  ? 17.946 29.078 22.308 1.00 38.66  ? 61  LEU A N    1 
ATOM   922  C CA   . LEU A 1 58  ? 18.901 28.226 21.607 1.00 43.36  ? 61  LEU A CA   1 
ATOM   923  C C    . LEU A 1 58  ? 18.223 27.446 20.489 1.00 43.25  ? 61  LEU A C    1 
ATOM   924  O O    . LEU A 1 58  ? 18.786 27.294 19.398 1.00 33.58  ? 61  LEU A O    1 
ATOM   925  C CB   . LEU A 1 58  ? 19.566 27.269 22.597 1.00 35.07  ? 61  LEU A CB   1 
ATOM   926  C CG   . LEU A 1 58  ? 20.531 26.240 22.005 1.00 38.65  ? 61  LEU A CG   1 
ATOM   927  C CD1  . LEU A 1 58  ? 21.746 26.932 21.410 1.00 43.12  ? 61  LEU A CD1  1 
ATOM   928  C CD2  . LEU A 1 58  ? 20.946 25.219 23.053 1.00 46.95  ? 61  LEU A CD2  1 
ATOM   929  H H    . LEU A 1 58  ? 17.866 28.908 23.147 0.00 46.45  ? 61  LEU A H    1 
ATOM   930  H HA   . LEU A 1 58  ? 19.589 28.784 21.212 0.00 52.08  ? 61  LEU A HA   1 
ATOM   931  H HB2  . LEU A 1 58  ? 20.069 27.799 23.235 0.00 42.14  ? 61  LEU A HB2  1 
ATOM   932  H HB3  . LEU A 1 58  ? 18.867 26.775 23.054 0.00 42.14  ? 61  LEU A HB3  1 
ATOM   933  H HG   . LEU A 1 58  ? 20.080 25.760 21.293 0.00 46.43  ? 61  LEU A HG   1 
ATOM   934  H HD11 . LEU A 1 58  ? 22.367 26.259 21.089 0.00 51.79  ? 61  LEU A HD11 1 
ATOM   935  H HD12 . LEU A 1 58  ? 21.459 27.495 20.674 0.00 51.79  ? 61  LEU A HD12 1 
ATOM   936  H HD13 . LEU A 1 58  ? 22.169 27.473 22.095 0.00 51.79  ? 61  LEU A HD13 1 
ATOM   937  H HD21 . LEU A 1 58  ? 21.541 24.571 22.644 0.00 56.40  ? 61  LEU A HD21 1 
ATOM   938  H HD22 . LEU A 1 58  ? 21.402 25.677 23.776 0.00 56.40  ? 61  LEU A HD22 1 
ATOM   939  H HD23 . LEU A 1 58  ? 20.154 24.773 23.391 0.00 56.40  ? 61  LEU A HD23 1 
ATOM   940  N N    . LEU A 1 59  ? 17.016 26.941 20.742 1.00 33.66  ? 62  LEU A N    1 
ATOM   941  C CA   . LEU A 1 59  ? 16.286 26.157 19.754 1.00 32.62  ? 62  LEU A CA   1 
ATOM   942  C C    . LEU A 1 59  ? 15.527 27.021 18.755 1.00 39.27  ? 62  LEU A C    1 
ATOM   943  O O    . LEU A 1 59  ? 14.959 26.478 17.800 1.00 48.96  ? 62  LEU A O    1 
ATOM   944  C CB   . LEU A 1 59  ? 15.312 25.210 20.460 1.00 33.12  ? 62  LEU A CB   1 
ATOM   945  C CG   . LEU A 1 59  ? 15.940 24.223 21.450 1.00 41.35  ? 62  LEU A CG   1 
ATOM   946  C CD1  . LEU A 1 59  ? 14.858 23.465 22.204 1.00 43.80  ? 62  LEU A CD1  1 
ATOM   947  C CD2  . LEU A 1 59  ? 16.882 23.255 20.746 1.00 46.76  ? 62  LEU A CD2  1 
ATOM   948  H H    . LEU A 1 59  ? 16.596 27.040 21.486 0.00 40.44  ? 62  LEU A H    1 
ATOM   949  H HA   . LEU A 1 59  ? 16.919 25.618 19.253 0.00 39.20  ? 62  LEU A HA   1 
ATOM   950  H HB2  . LEU A 1 59  ? 14.673 25.747 20.955 0.00 39.79  ? 62  LEU A HB2  1 
ATOM   951  H HB3  . LEU A 1 59  ? 14.853 24.687 19.784 0.00 39.79  ? 62  LEU A HB3  1 
ATOM   952  H HG   . LEU A 1 59  ? 16.467 24.724 22.092 0.00 49.67  ? 62  LEU A HG   1 
ATOM   953  H HD11 . LEU A 1 59  ? 15.278 22.841 22.817 0.00 52.61  ? 62  LEU A HD11 1 
ATOM   954  H HD12 . LEU A 1 59  ? 14.314 24.099 22.698 0.00 52.61  ? 62  LEU A HD12 1 
ATOM   955  H HD13 . LEU A 1 59  ? 14.308 22.983 21.568 0.00 52.61  ? 62  LEU A HD13 1 
ATOM   956  H HD21 . LEU A 1 59  ? 17.236 22.629 21.397 0.00 56.17  ? 62  LEU A HD21 1 
ATOM   957  H HD22 . LEU A 1 59  ? 16.390 22.776 20.061 0.00 56.17  ? 62  LEU A HD22 1 
ATOM   958  H HD23 . LEU A 1 59  ? 17.607 23.757 20.342 0.00 56.17  ? 62  LEU A HD23 1 
ATOM   959  N N    . GLY A 1 60  ? 15.499 28.338 18.948 1.00 44.98  ? 63  GLY A N    1 
ATOM   960  C CA   . GLY A 1 60  ? 14.881 29.243 18.003 1.00 48.44  ? 63  GLY A CA   1 
ATOM   961  C C    . GLY A 1 60  ? 13.422 29.551 18.257 1.00 50.69  ? 63  GLY A C    1 
ATOM   962  O O    . GLY A 1 60  ? 12.826 30.319 17.490 1.00 46.71  ? 63  GLY A O    1 
ATOM   963  H H    . GLY A 1 60  ? 15.838 28.732 19.633 0.00 54.02  ? 63  GLY A H    1 
ATOM   964  H HA2  . GLY A 1 60  ? 15.365 30.084 18.019 0.00 58.18  ? 63  GLY A HA2  1 
ATOM   965  H HA3  . GLY A 1 60  ? 14.949 28.857 17.116 0.00 58.18  ? 63  GLY A HA3  1 
ATOM   966  N N    . TYR A 1 61  ? 12.822 28.982 19.305 1.00 41.34  ? 64  TYR A N    1 
ATOM   967  C CA   . TYR A 1 61  ? 11.416 29.252 19.582 1.00 40.04  ? 64  TYR A CA   1 
ATOM   968  C C    . TYR A 1 61  ? 11.199 30.670 20.098 1.00 42.61  ? 64  TYR A C    1 
ATOM   969  O O    . TYR A 1 61  ? 10.166 31.282 19.804 1.00 47.95  ? 64  TYR A O    1 
ATOM   970  C CB   . TYR A 1 61  ? 10.881 28.241 20.596 1.00 46.21  ? 64  TYR A CB   1 
ATOM   971  C CG   . TYR A 1 61  ? 9.400  28.374 20.865 1.00 44.88  ? 64  TYR A CG   1 
ATOM   972  C CD1  . TYR A 1 61  ? 8.468  27.726 20.067 1.00 50.11  ? 64  TYR A CD1  1 
ATOM   973  C CD2  . TYR A 1 61  ? 8.933  29.156 21.913 1.00 47.33  ? 64  TYR A CD2  1 
ATOM   974  C CE1  . TYR A 1 61  ? 7.113  27.846 20.309 1.00 55.33  ? 64  TYR A CE1  1 
ATOM   975  C CE2  . TYR A 1 61  ? 7.580  29.284 22.163 1.00 54.33  ? 64  TYR A CE2  1 
ATOM   976  C CZ   . TYR A 1 61  ? 6.674  28.626 21.357 1.00 51.15  ? 64  TYR A CZ   1 
ATOM   977  O OH   . TYR A 1 61  ? 5.326  28.750 21.601 1.00 66.06  ? 64  TYR A OH   1 
ATOM   978  H H    . TYR A 1 61  ? 13.202 28.446 19.859 0.00 49.66  ? 64  TYR A H    1 
ATOM   979  H HA   . TYR A 1 61  ? 10.915 29.154 18.757 0.00 48.10  ? 64  TYR A HA   1 
ATOM   980  H HB2  . TYR A 1 61  ? 11.041 27.346 20.258 0.00 55.50  ? 64  TYR A HB2  1 
ATOM   981  H HB3  . TYR A 1 61  ? 11.347 28.366 21.437 0.00 55.50  ? 64  TYR A HB3  1 
ATOM   982  H HD1  . TYR A 1 61  ? 8.760  27.202 19.356 0.00 60.18  ? 64  TYR A HD1  1 
ATOM   983  H HD2  . TYR A 1 61  ? 9.542  29.602 22.457 0.00 56.85  ? 64  TYR A HD2  1 
ATOM   984  H HE1  . TYR A 1 61  ? 6.500  27.403 19.768 0.00 66.45  ? 64  TYR A HE1  1 
ATOM   985  H HE2  . TYR A 1 61  ? 7.282  29.810 22.869 0.00 65.25  ? 64  TYR A HE2  1 
ATOM   986  H HH   . TYR A 1 61  ? 5.199  29.233 22.276 0.00 79.32  ? 64  TYR A HH   1 
ATOM   987  N N    . GLY A 1 62  ? 12.151 31.207 20.857 1.00 41.68  ? 65  GLY A N    1 
ATOM   988  C CA   . GLY A 1 62  ? 11.973 32.498 21.494 1.00 43.15  ? 65  GLY A CA   1 
ATOM   989  C C    . GLY A 1 62  ? 12.513 33.662 20.689 1.00 42.39  ? 65  GLY A C    1 
ATOM   990  O O    . GLY A 1 62  ? 12.978 34.655 21.258 1.00 40.13  ? 65  GLY A O    1 
ATOM   991  H H    . GLY A 1 62  ? 12.911 30.838 21.018 0.00 50.07  ? 65  GLY A H    1 
ATOM   992  H HA2  . GLY A 1 62  ? 11.026 32.650 21.639 0.00 51.83  ? 65  GLY A HA2  1 
ATOM   993  H HA3  . GLY A 1 62  ? 12.427 32.492 22.351 0.00 51.83  ? 65  GLY A HA3  1 
ATOM   994  N N    . LEU A 1 63  ? 12.451 33.557 19.363 1.00 44.58  ? 66  LEU A N    1 
ATOM   995  C CA   . LEU A 1 63  ? 12.963 34.579 18.464 1.00 42.25  ? 66  LEU A CA   1 
ATOM   996  C C    . LEU A 1 63  ? 11.864 35.002 17.501 1.00 56.37  ? 66  LEU A C    1 
ATOM   997  O O    . LEU A 1 63  ? 11.049 34.178 17.076 1.00 48.58  ? 66  LEU A O    1 
ATOM   998  C CB   . LEU A 1 63  ? 14.179 34.063 17.680 1.00 52.08  ? 66  LEU A CB   1 
ATOM   999  C CG   . LEU A 1 63  ? 14.709 34.933 16.536 1.00 47.71  ? 66  LEU A CG   1 
ATOM   1000 C CD1  . LEU A 1 63  ? 15.231 36.259 17.060 1.00 60.65  ? 66  LEU A CD1  1 
ATOM   1001 C CD2  . LEU A 1 63  ? 15.795 34.197 15.767 1.00 49.41  ? 66  LEU A CD2  1 
ATOM   1002 H H    . LEU A 1 63  ? 12.107 32.883 18.954 0.00 53.55  ? 66  LEU A H    1 
ATOM   1003 H HA   . LEU A 1 63  ? 13.235 35.359 18.972 0.00 50.75  ? 66  LEU A HA   1 
ATOM   1004 H HB2  . LEU A 1 63  ? 14.910 33.951 18.308 0.00 62.54  ? 66  LEU A HB2  1 
ATOM   1005 H HB3  . LEU A 1 63  ? 13.940 33.207 17.292 0.00 62.54  ? 66  LEU A HB3  1 
ATOM   1006 H HG   . LEU A 1 63  ? 13.980 35.124 15.926 0.00 57.30  ? 66  LEU A HG   1 
ATOM   1007 H HD11 . LEU A 1 63  ? 15.430 36.839 16.308 0.00 72.84  ? 66  LEU A HD11 1 
ATOM   1008 H HD12 . LEU A 1 63  ? 14.553 36.666 17.621 0.00 72.84  ? 66  LEU A HD12 1 
ATOM   1009 H HD13 . LEU A 1 63  ? 16.036 36.100 17.577 0.00 72.84  ? 66  LEU A HD13 1 
ATOM   1010 H HD21 . LEU A 1 63  ? 16.115 34.766 15.050 0.00 59.34  ? 66  LEU A HD21 1 
ATOM   1011 H HD22 . LEU A 1 63  ? 16.522 33.985 16.372 0.00 59.34  ? 66  LEU A HD22 1 
ATOM   1012 H HD23 . LEU A 1 63  ? 15.422 33.380 15.399 0.00 59.34  ? 66  LEU A HD23 1 
ATOM   1013 N N    . THR A 1 64  ? 11.845 36.289 17.162 1.00 51.87  ? 67  THR A N    1 
ATOM   1014 C CA   . THR A 1 64  ? 10.912 36.804 16.170 1.00 51.09  ? 67  THR A CA   1 
ATOM   1015 C C    . THR A 1 64  ? 11.569 37.964 15.433 1.00 43.41  ? 67  THR A C    1 
ATOM   1016 O O    . THR A 1 64  ? 12.556 38.543 15.895 1.00 53.27  ? 67  THR A O    1 
ATOM   1017 C CB   . THR A 1 64  ? 9.584  37.238 16.811 1.00 46.06  ? 67  THR A CB   1 
ATOM   1018 O OG1  . THR A 1 64  ? 8.532  37.159 15.839 1.00 63.28  ? 67  THR A OG1  1 
ATOM   1019 C CG2  . THR A 1 64  ? 9.667  38.660 17.360 1.00 42.54  ? 67  THR A CG2  1 
ATOM   1020 H H    . THR A 1 64  ? 12.367 36.886 17.495 0.00 62.30  ? 67  THR A H    1 
ATOM   1021 H HA   . THR A 1 64  ? 10.714 36.111 15.521 0.00 61.35  ? 67  THR A HA   1 
ATOM   1022 H HB   . THR A 1 64  ? 9.384  36.648 17.554 0.00 55.32  ? 67  THR A HB   1 
ATOM   1023 H HG1  . THR A 1 64  ? 7.805  37.404 16.181 0.00 75.99  ? 67  THR A HG1  1 
ATOM   1024 H HG21 . THR A 1 64  ? 8.934  38.822 17.974 0.00 51.10  ? 67  THR A HG21 1 
ATOM   1025 H HG22 . THR A 1 64  ? 10.506 38.785 17.831 0.00 51.10  ? 67  THR A HG22 1 
ATOM   1026 H HG23 . THR A 1 64  ? 9.616  39.300 16.632 0.00 51.10  ? 67  THR A HG23 1 
ATOM   1027 N N    . MET A 1 65  ? 11.009 38.291 14.273 1.00 46.78  ? 68  MET A N    1 
ATOM   1028 C CA   . MET A 1 65  ? 11.522 39.354 13.419 1.00 44.39  ? 68  MET A CA   1 
ATOM   1029 C C    . MET A 1 65  ? 10.604 40.564 13.533 1.00 55.93  ? 68  MET A C    1 
ATOM   1030 O O    . MET A 1 65  ? 9.386  40.440 13.364 1.00 57.52  ? 68  MET A O    1 
ATOM   1031 C CB   . MET A 1 65  ? 11.607 38.883 11.965 1.00 66.83  ? 68  MET A CB   1 
ATOM   1032 C CG   . MET A 1 65  ? 12.467 37.630 11.763 1.00 69.43  ? 68  MET A CG   1 
ATOM   1033 S SD   . MET A 1 65  ? 14.224 37.766 12.175 1.00 69.38  ? 68  MET A SD   1 
ATOM   1034 C CE   . MET A 1 65  ? 14.588 39.458 11.723 1.00 71.34  ? 68  MET A CE   1 
ATOM   1035 H H    . MET A 1 65  ? 10.313 37.900 13.951 0.00 56.19  ? 68  MET A H    1 
ATOM   1036 H HA   . MET A 1 65  ? 12.415 39.603 13.705 0.00 53.32  ? 68  MET A HA   1 
ATOM   1037 H HB2  . MET A 1 65  ? 10.712 38.680 11.652 0.00 80.25  ? 68  MET A HB2  1 
ATOM   1038 H HB3  . MET A 1 65  ? 11.993 39.595 11.430 0.00 80.25  ? 68  MET A HB3  1 
ATOM   1039 H HG2  . MET A 1 65  ? 12.101 36.923 12.317 0.00 83.37  ? 68  MET A HG2  1 
ATOM   1040 H HG3  . MET A 1 65  ? 12.416 37.379 10.827 0.00 83.37  ? 68  MET A HG3  1 
ATOM   1041 H HE1  . MET A 1 65  ? 15.505 39.659 11.966 0.00 85.66  ? 68  MET A HE1  1 
ATOM   1042 H HE2  . MET A 1 65  ? 14.469 39.561 10.766 0.00 85.66  ? 68  MET A HE2  1 
ATOM   1043 H HE3  . MET A 1 65  ? 13.982 40.048 12.197 0.00 85.66  ? 68  MET A HE3  1 
ATOM   1044 N N    . VAL A 1 66  ? 11.183 41.724 13.821 1.00 47.16  ? 69  VAL A N    1 
ATOM   1045 C CA   . VAL A 1 66  ? 10.436 42.958 14.026 1.00 47.38  ? 69  VAL A CA   1 
ATOM   1046 C C    . VAL A 1 66  ? 10.866 43.963 12.962 1.00 52.12  ? 69  VAL A C    1 
ATOM   1047 O O    . VAL A 1 66  ? 12.032 44.366 12.932 1.00 55.39  ? 69  VAL A O    1 
ATOM   1048 C CB   . VAL A 1 66  ? 10.655 43.538 15.434 1.00 57.57  ? 69  VAL A CB   1 
ATOM   1049 C CG1  . VAL A 1 66  ? 9.937  44.877 15.581 1.00 58.15  ? 69  VAL A CG1  1 
ATOM   1050 C CG2  . VAL A 1 66  ? 10.174 42.559 16.492 1.00 43.92  ? 69  VAL A CG2  1 
ATOM   1051 H H    . VAL A 1 66  ? 12.034 41.823 13.904 0.00 56.64  ? 69  VAL A H    1 
ATOM   1052 H HA   . VAL A 1 66  ? 9.490  42.777 13.908 0.00 56.91  ? 69  VAL A HA   1 
ATOM   1053 H HB   . VAL A 1 66  ? 11.604 43.688 15.565 0.00 69.13  ? 69  VAL A HB   1 
ATOM   1054 H HG11 . VAL A 1 66  ? 10.021 45.181 16.499 0.00 69.83  ? 69  VAL A HG11 1 
ATOM   1055 H HG12 . VAL A 1 66  ? 10.345 45.522 14.981 0.00 69.83  ? 69  VAL A HG12 1 
ATOM   1056 H HG13 . VAL A 1 66  ? 9.001  44.761 15.355 0.00 69.83  ? 69  VAL A HG13 1 
ATOM   1057 H HG21 . VAL A 1 66  ? 10.313 42.949 17.369 0.00 52.76  ? 69  VAL A HG21 1 
ATOM   1058 H HG22 . VAL A 1 66  ? 9.231  42.382 16.354 0.00 52.76  ? 69  VAL A HG22 1 
ATOM   1059 H HG23 . VAL A 1 66  ? 10.680 41.735 16.413 0.00 52.76  ? 69  VAL A HG23 1 
ATOM   1060 N N    . PRO A 1 67  ? 9.977  44.388 12.063 1.00 61.96  ? 70  PRO A N    1 
ATOM   1061 C CA   . PRO A 1 67  ? 10.345 45.443 11.103 1.00 62.68  ? 70  PRO A CA   1 
ATOM   1062 C C    . PRO A 1 67  ? 10.536 46.784 11.799 1.00 56.66  ? 70  PRO A C    1 
ATOM   1063 O O    . PRO A 1 67  ? 9.632  47.281 12.474 1.00 77.34  ? 70  PRO A O    1 
ATOM   1064 C CB   . PRO A 1 67  ? 9.157  45.486 10.134 1.00 61.43  ? 70  PRO A CB   1 
ATOM   1065 C CG   . PRO A 1 67  ? 8.351  44.277 10.380 1.00 74.34  ? 70  PRO A CG   1 
ATOM   1066 C CD   . PRO A 1 67  ? 8.793  43.620 11.642 1.00 63.05  ? 70  PRO A CD   1 
ATOM   1067 H HA   . PRO A 1 67  ? 11.156 45.197 10.631 0.00 75.27  ? 70  PRO A HA   1 
ATOM   1068 H HB2  . PRO A 1 67  ? 8.633  46.284 10.303 0.00 73.77  ? 70  PRO A HB2  1 
ATOM   1069 H HB3  . PRO A 1 67  ? 9.487  45.493 9.222  0.00 73.77  ? 70  PRO A HB3  1 
ATOM   1070 H HG2  . PRO A 1 67  ? 7.419  44.535 10.454 0.00 89.27  ? 70  PRO A HG2  1 
ATOM   1071 H HG3  . PRO A 1 67  ? 8.469  43.668 9.634  0.00 89.27  ? 70  PRO A HG3  1 
ATOM   1072 H HD2  . PRO A 1 67  ? 8.097  43.672 12.315 0.00 75.71  ? 70  PRO A HD2  1 
ATOM   1073 H HD3  . PRO A 1 67  ? 9.029  42.693 11.479 0.00 75.71  ? 70  PRO A HD3  1 
ATOM   1074 N N    . PHE A 1 68  ? 11.720 47.370 11.628 1.00 61.34  ? 71  PHE A N    1 
ATOM   1075 C CA   . PHE A 1 68  ? 11.940 48.772 11.956 1.00 59.29  ? 71  PHE A CA   1 
ATOM   1076 C C    . PHE A 1 68  ? 13.268 49.197 11.350 1.00 78.21  ? 71  PHE A C    1 
ATOM   1077 O O    . PHE A 1 68  ? 14.217 48.409 11.314 1.00 89.40  ? 71  PHE A O    1 
ATOM   1078 C CB   . PHE A 1 68  ? 11.906 49.026 13.476 1.00 73.87  ? 71  PHE A CB   1 
ATOM   1079 C CG   . PHE A 1 68  ? 13.108 48.511 14.233 1.00 47.25  ? 71  PHE A CG   1 
ATOM   1080 C CD1  . PHE A 1 68  ? 14.338 49.150 14.152 1.00 75.65  ? 71  PHE A CD1  1 
ATOM   1081 C CD2  . PHE A 1 68  ? 12.995 47.399 15.051 1.00 48.91  ? 71  PHE A CD2  1 
ATOM   1082 C CE1  . PHE A 1 68  ? 15.430 48.679 14.857 1.00 62.40  ? 71  PHE A CE1  1 
ATOM   1083 C CE2  . PHE A 1 68  ? 14.084 46.925 15.758 1.00 64.69  ? 71  PHE A CE2  1 
ATOM   1084 C CZ   . PHE A 1 68  ? 15.302 47.566 15.662 1.00 57.65  ? 71  PHE A CZ   1 
ATOM   1085 H H    . PHE A 1 68  ? 12.417 46.971 11.320 0.00 73.66  ? 71  PHE A H    1 
ATOM   1086 H HA   . PHE A 1 68  ? 11.237 49.316 11.566 0.00 71.20  ? 71  PHE A HA   1 
ATOM   1087 H HB2  . PHE A 1 68  ? 11.855 49.983 13.627 0.00 88.70  ? 71  PHE A HB2  1 
ATOM   1088 H HB3  . PHE A 1 68  ? 11.122 48.589 13.843 0.00 88.70  ? 71  PHE A HB3  1 
ATOM   1089 H HD1  . PHE A 1 68  ? 14.429 49.905 13.616 0.00 90.83  ? 71  PHE A HD1  1 
ATOM   1090 H HD2  . PHE A 1 68  ? 12.175 46.966 15.125 0.00 58.74  ? 71  PHE A HD2  1 
ATOM   1091 H HE1  . PHE A 1 68  ? 16.250 49.112 14.789 0.00 74.93  ? 71  PHE A HE1  1 
ATOM   1092 H HE2  . PHE A 1 68  ? 13.996 46.174 16.299 0.00 77.68  ? 71  PHE A HE2  1 
ATOM   1093 H HZ   . PHE A 1 68  ? 16.035 47.248 16.138 0.00 69.23  ? 71  PHE A HZ   1 
ATOM   1094 N N    . GLY A 1 69  ? 13.323 50.437 10.871 1.00 81.97  ? 72  GLY A N    1 
ATOM   1095 C CA   . GLY A 1 69  ? 14.497 50.904 10.161 1.00 89.83  ? 72  GLY A CA   1 
ATOM   1096 C C    . GLY A 1 69  ? 14.671 50.285 8.793  1.00 85.95  ? 72  GLY A C    1 
ATOM   1097 O O    . GLY A 1 69  ? 15.805 50.131 8.329  1.00 104.06 ? 72  GLY A O    1 
ATOM   1098 H H    . GLY A 1 69  ? 12.696 51.020 10.947 0.00 98.41  ? 72  GLY A H    1 
ATOM   1099 H HA2  . GLY A 1 69  ? 14.435 51.866 10.049 0.00 107.84 ? 72  GLY A HA2  1 
ATOM   1100 H HA3  . GLY A 1 69  ? 15.286 50.698 10.686 0.00 107.84 ? 72  GLY A HA3  1 
ATOM   1101 N N    . GLY A 1 70  ? 13.574 49.923 8.130  1.00 87.68  ? 73  GLY A N    1 
ATOM   1102 C CA   . GLY A 1 70  ? 13.653 49.312 6.819  1.00 68.75  ? 73  GLY A CA   1 
ATOM   1103 C C    . GLY A 1 70  ? 14.307 47.952 6.793  1.00 82.96  ? 73  GLY A C    1 
ATOM   1104 O O    . GLY A 1 70  ? 14.665 47.474 5.712  1.00 81.46  ? 73  GLY A O    1 
ATOM   1105 H H    . GLY A 1 70  ? 12.772 50.023 8.424  0.00 105.27 ? 73  GLY A H    1 
ATOM   1106 H HA2  . GLY A 1 70  ? 12.754 49.215 6.467  0.00 82.55  ? 73  GLY A HA2  1 
ATOM   1107 H HA3  . GLY A 1 70  ? 14.160 49.896 6.234  0.00 82.55  ? 73  GLY A HA3  1 
ATOM   1108 N N    . GLU A 1 71  ? 14.476 47.312 7.948  1.00 80.32  ? 74  GLU A N    1 
ATOM   1109 C CA   . GLU A 1 71  ? 15.140 46.022 8.034  1.00 66.85  ? 74  GLU A CA   1 
ATOM   1110 C C    . GLU A 1 71  ? 14.367 45.120 8.982  1.00 65.53  ? 74  GLU A C    1 
ATOM   1111 O O    . GLU A 1 71  ? 13.832 45.585 9.993  1.00 84.08  ? 74  GLU A O    1 
ATOM   1112 C CB   . GLU A 1 71  ? 16.585 46.171 8.530  1.00 69.56  ? 74  GLU A CB   1 
ATOM   1113 C CG   . GLU A 1 71  ? 17.177 47.553 8.311  1.00 95.60  ? 74  GLU A CG   1 
ATOM   1114 C CD   . GLU A 1 71  ? 18.662 47.610 8.614  1.00 114.63 ? 74  GLU A CD   1 
ATOM   1115 O OE1  . GLU A 1 71  ? 19.243 46.558 8.956  1.00 118.96 ? 74  GLU A OE1  1 
ATOM   1116 O OE2  . GLU A 1 71  ? 19.248 48.708 8.515  1.00 125.05 ? 74  GLU A OE2  1 
ATOM   1117 H H    . GLU A 1 71  ? 14.208 47.614 8.707  0.00 96.43  ? 74  GLU A H    1 
ATOM   1118 H HA   . GLU A 1 71  ? 15.154 45.606 7.158  0.00 80.27  ? 74  GLU A HA   1 
ATOM   1119 N N    . GLN A 1 72  ? 14.307 43.834 8.649  1.00 68.03  ? 75  GLN A N    1 
ATOM   1120 C CA   . GLN A 1 72  ? 13.749 42.835 9.554  1.00 66.95  ? 75  GLN A CA   1 
ATOM   1121 C C    . GLN A 1 72  ? 14.793 42.524 10.621 1.00 50.63  ? 75  GLN A C    1 
ATOM   1122 O O    . GLN A 1 72  ? 15.863 41.989 10.313 1.00 76.17  ? 75  GLN A O    1 
ATOM   1123 C CB   . GLN A 1 72  ? 13.346 41.577 8.789  1.00 68.63  ? 75  GLN A CB   1 
ATOM   1124 C CG   . GLN A 1 72  ? 11.892 41.551 8.333  1.00 80.81  ? 75  GLN A CG   1 
ATOM   1125 C CD   . GLN A 1 72  ? 11.485 42.807 7.588  1.00 94.28  ? 75  GLN A CD   1 
ATOM   1126 O OE1  . GLN A 1 72  ? 11.067 43.795 8.193  1.00 106.36 ? 75  GLN A OE1  1 
ATOM   1127 N NE2  . GLN A 1 72  ? 11.599 42.772 6.265  1.00 119.48 ? 75  GLN A NE2  1 
ATOM   1128 H H    . GLN A 1 72  ? 14.584 43.513 7.901  0.00 81.68  ? 75  GLN A H    1 
ATOM   1129 H HA   . GLN A 1 72  ? 12.953 43.187 9.983  0.00 80.40  ? 75  GLN A HA   1 
ATOM   1130 H HB2  . GLN A 1 72  ? 13.902 41.506 7.997  0.00 82.41  ? 75  GLN A HB2  1 
ATOM   1131 H HB3  . GLN A 1 72  ? 13.487 40.808 9.363  0.00 82.41  ? 75  GLN A HB3  1 
ATOM   1132 H HG2  . GLN A 1 72  ? 11.761 40.795 7.740  0.00 97.02  ? 75  GLN A HG2  1 
ATOM   1133 H HG3  . GLN A 1 72  ? 11.319 41.465 9.111  0.00 97.02  ? 75  GLN A HG3  1 
ATOM   1134 H HE21 . GLN A 1 72  ? 11.891 42.062 5.877  0.00 143.42 ? 75  GLN A HE21 1 
ATOM   1135 H HE22 . GLN A 1 72  ? 11.381 43.459 5.796  0.00 143.42 ? 75  GLN A HE22 1 
ATOM   1136 N N    . ASN A 1 73  ? 14.488 42.861 11.876 1.00 50.17  ? 76  ASN A N    1 
ATOM   1137 C CA   . ASN A 1 73  ? 15.456 42.779 12.962 1.00 47.01  ? 76  ASN A CA   1 
ATOM   1138 C C    . ASN A 1 73  ? 15.125 41.622 13.893 1.00 55.59  ? 76  ASN A C    1 
ATOM   1139 O O    . ASN A 1 73  ? 13.982 41.522 14.358 1.00 54.58  ? 76  ASN A O    1 
ATOM   1140 C CB   . ASN A 1 73  ? 15.479 44.093 13.748 1.00 54.23  ? 76  ASN A CB   1 
ATOM   1141 C CG   . ASN A 1 73  ? 15.793 45.288 12.870 1.00 73.21  ? 76  ASN A CG   1 
ATOM   1142 O OD1  . ASN A 1 73  ? 16.957 45.583 12.599 1.00 75.91  ? 76  ASN A OD1  1 
ATOM   1143 N ND2  . ASN A 1 73  ? 14.753 45.977 12.409 1.00 53.95  ? 76  ASN A ND2  1 
ATOM   1144 H H    . ASN A 1 73  ? 13.714 43.143 12.124 0.00 60.25  ? 76  ASN A H    1 
ATOM   1145 H HA   . ASN A 1 73  ? 16.338 42.620 12.592 0.00 56.46  ? 76  ASN A HA   1 
ATOM   1146 H HB2  . ASN A 1 73  ? 14.608 44.236 14.152 0.00 65.13  ? 76  ASN A HB2  1 
ATOM   1147 H HB3  . ASN A 1 73  ? 16.159 44.039 14.437 0.00 65.13  ? 76  ASN A HB3  1 
ATOM   1148 H HD21 . ASN A 1 73  ? 14.881 46.663 11.907 0.00 64.79  ? 76  ASN A HD21 1 
ATOM   1149 H HD22 . ASN A 1 73  ? 13.954 45.736 12.614 0.00 64.79  ? 76  ASN A HD22 1 
ATOM   1150 N N    . PRO A 1 74  ? 16.077 40.731 14.187 1.00 63.76  ? 77  PRO A N    1 
ATOM   1151 C CA   . PRO A 1 74  ? 15.773 39.558 15.025 1.00 41.60  ? 77  PRO A CA   1 
ATOM   1152 C C    . PRO A 1 74  ? 15.735 39.939 16.498 1.00 39.01  ? 77  PRO A C    1 
ATOM   1153 O O    . PRO A 1 74  ? 16.748 40.346 17.072 1.00 48.79  ? 77  PRO A O    1 
ATOM   1154 C CB   . PRO A 1 74  ? 16.927 38.594 14.720 1.00 44.24  ? 77  PRO A CB   1 
ATOM   1155 C CG   . PRO A 1 74  ? 18.040 39.447 14.241 1.00 66.99  ? 77  PRO A CG   1 
ATOM   1156 C CD   . PRO A 1 74  ? 17.461 40.711 13.679 1.00 65.35  ? 77  PRO A CD   1 
ATOM   1157 H HA   . PRO A 1 74  ? 14.927 39.160 14.767 0.00 49.97  ? 77  PRO A HA   1 
ATOM   1158 H HB2  . PRO A 1 74  ? 17.179 38.118 15.527 0.00 53.14  ? 77  PRO A HB2  1 
ATOM   1159 H HB3  . PRO A 1 74  ? 16.655 37.963 14.035 0.00 53.14  ? 77  PRO A HB3  1 
ATOM   1160 H HG2  . PRO A 1 74  ? 18.626 39.651 14.986 0.00 80.44  ? 77  PRO A HG2  1 
ATOM   1161 H HG3  . PRO A 1 74  ? 18.531 38.971 13.553 0.00 80.44  ? 77  PRO A HG3  1 
ATOM   1162 H HD2  . PRO A 1 74  ? 17.953 41.484 13.998 0.00 78.47  ? 77  PRO A HD2  1 
ATOM   1163 H HD3  . PRO A 1 74  ? 17.469 40.689 12.709 0.00 78.47  ? 77  PRO A HD3  1 
ATOM   1164 N N    . ILE A 1 75  ? 14.561 39.805 17.109 1.00 41.98  ? 78  ILE A N    1 
ATOM   1165 C CA   . ILE A 1 75  ? 14.334 40.184 18.500 1.00 43.07  ? 78  ILE A CA   1 
ATOM   1166 C C    . ILE A 1 75  ? 14.049 38.913 19.292 1.00 49.75  ? 78  ILE A C    1 
ATOM   1167 O O    . ILE A 1 75  ? 13.124 38.161 18.961 1.00 43.45  ? 78  ILE A O    1 
ATOM   1168 C CB   . ILE A 1 75  ? 13.171 41.182 18.629 1.00 55.60  ? 78  ILE A CB   1 
ATOM   1169 C CG1  . ILE A 1 75  ? 13.489 42.529 17.959 1.00 53.43  ? 78  ILE A CG1  1 
ATOM   1170 C CG2  . ILE A 1 75  ? 12.819 41.418 20.095 1.00 53.60  ? 78  ILE A CG2  1 
ATOM   1171 C CD1  . ILE A 1 75  ? 14.957 42.924 17.899 1.00 57.44  ? 78  ILE A CD1  1 
ATOM   1172 H H    . ILE A 1 75  ? 13.860 39.488 16.726 0.00 50.42  ? 78  ILE A H    1 
ATOM   1173 H HA   . ILE A 1 75  ? 15.136 40.595 18.857 0.00 51.73  ? 78  ILE A HA   1 
ATOM   1174 H HB   . ILE A 1 75  ? 12.414 40.785 18.171 0.00 66.77  ? 78  ILE A HB   1 
ATOM   1175 H HG12 . ILE A 1 75  ? 13.165 42.495 17.045 0.00 64.17  ? 78  ILE A HG12 1 
ATOM   1176 H HG13 . ILE A 1 75  ? 13.026 43.226 18.449 0.00 64.17  ? 78  ILE A HG13 1 
ATOM   1177 H HG21 . ILE A 1 75  ? 12.107 42.074 20.147 0.00 64.37  ? 78  ILE A HG21 1 
ATOM   1178 H HG22 . ILE A 1 75  ? 12.527 40.580 20.488 0.00 64.37  ? 78  ILE A HG22 1 
ATOM   1179 H HG23 . ILE A 1 75  ? 13.605 41.745 20.559 0.00 64.37  ? 78  ILE A HG23 1 
ATOM   1180 H HD11 . ILE A 1 75  ? 15.027 43.826 17.549 0.00 68.98  ? 78  ILE A HD11 1 
ATOM   1181 H HD12 . ILE A 1 75  ? 15.332 42.885 18.793 0.00 68.98  ? 78  ILE A HD12 1 
ATOM   1182 H HD13 . ILE A 1 75  ? 15.427 42.306 17.316 0.00 68.98  ? 78  ILE A HD13 1 
ATOM   1183 N N    . TYR A 1 76  ? 14.841 38.673 20.337 1.00 32.83  ? 79  TYR A N    1 
ATOM   1184 C CA   . TYR A 1 76  ? 14.626 37.545 21.243 1.00 41.59  ? 79  TYR A CA   1 
ATOM   1185 C C    . TYR A 1 76  ? 13.619 37.970 22.304 1.00 44.03  ? 79  TYR A C    1 
ATOM   1186 O O    . TYR A 1 76  ? 13.974 38.522 23.347 1.00 38.88  ? 79  TYR A O    1 
ATOM   1187 C CB   . TYR A 1 76  ? 15.943 37.097 21.867 1.00 36.93  ? 79  TYR A CB   1 
ATOM   1188 C CG   . TYR A 1 76  ? 16.794 36.243 20.955 1.00 37.66  ? 79  TYR A CG   1 
ATOM   1189 C CD1  . TYR A 1 76  ? 16.506 34.897 20.767 1.00 35.26  ? 79  TYR A CD1  1 
ATOM   1190 C CD2  . TYR A 1 76  ? 17.876 36.783 20.273 1.00 45.83  ? 79  TYR A CD2  1 
ATOM   1191 C CE1  . TYR A 1 76  ? 17.277 34.111 19.934 1.00 33.51  ? 79  TYR A CE1  1 
ATOM   1192 C CE2  . TYR A 1 76  ? 18.651 36.005 19.436 1.00 46.84  ? 79  TYR A CE2  1 
ATOM   1193 C CZ   . TYR A 1 76  ? 18.347 34.669 19.270 1.00 51.37  ? 79  TYR A CZ   1 
ATOM   1194 O OH   . TYR A 1 76  ? 19.118 33.891 18.438 1.00 48.38  ? 79  TYR A OH   1 
ATOM   1195 H H    . TYR A 1 76  ? 15.520 39.158 20.546 0.00 39.44  ? 79  TYR A H    1 
ATOM   1196 H HA   . TYR A 1 76  ? 14.253 36.802 20.744 0.00 49.96  ? 79  TYR A HA   1 
ATOM   1197 H HB2  . TYR A 1 76  ? 16.460 37.884 22.102 0.00 44.37  ? 79  TYR A HB2  1 
ATOM   1198 H HB3  . TYR A 1 76  ? 15.750 36.578 22.664 0.00 44.37  ? 79  TYR A HB3  1 
ATOM   1199 H HD1  . TYR A 1 76  ? 15.780 34.519 21.209 0.00 42.37  ? 79  TYR A HD1  1 
ATOM   1200 H HD2  . TYR A 1 76  ? 18.081 37.683 20.381 0.00 55.05  ? 79  TYR A HD2  1 
ATOM   1201 H HE1  . TYR A 1 76  ? 17.076 33.210 19.822 0.00 40.27  ? 79  TYR A HE1  1 
ATOM   1202 H HE2  . TYR A 1 76  ? 19.375 36.379 18.987 0.00 56.26  ? 79  TYR A HE2  1 
ATOM   1203 H HH   . TYR A 1 76  ? 19.755 34.343 18.130 0.00 58.11  ? 79  TYR A HH   1 
ATOM   1204 N N    . TRP A 1 77  ? 12.337 37.710 22.033 1.00 31.53  ? 80  TRP A N    1 
ATOM   1205 C CA   . TRP A 1 77  ? 11.289 38.104 22.968 1.00 37.43  ? 80  TRP A CA   1 
ATOM   1206 C C    . TRP A 1 77  ? 11.292 37.256 24.231 1.00 37.97  ? 80  TRP A C    1 
ATOM   1207 O O    . TRP A 1 77  ? 10.739 37.684 25.250 1.00 38.74  ? 80  TRP A O    1 
ATOM   1208 C CB   . TRP A 1 77  ? 9.916  38.021 22.295 1.00 51.19  ? 80  TRP A CB   1 
ATOM   1209 C CG   . TRP A 1 77  ? 9.555  36.655 21.780 1.00 41.28  ? 80  TRP A CG   1 
ATOM   1210 C CD1  . TRP A 1 77  ? 9.707  36.190 20.505 1.00 43.58  ? 80  TRP A CD1  1 
ATOM   1211 C CD2  . TRP A 1 77  ? 8.971  35.581 22.530 1.00 36.14  ? 80  TRP A CD2  1 
ATOM   1212 N NE1  . TRP A 1 77  ? 9.257  34.893 20.416 1.00 41.12  ? 80  TRP A NE1  1 
ATOM   1213 C CE2  . TRP A 1 77  ? 8.800  34.497 21.645 1.00 37.55  ? 80  TRP A CE2  1 
ATOM   1214 C CE3  . TRP A 1 77  ? 8.576  35.432 23.864 1.00 39.64  ? 80  TRP A CE3  1 
ATOM   1215 C CZ2  . TRP A 1 77  ? 8.255  33.281 22.051 1.00 52.66  ? 80  TRP A CZ2  1 
ATOM   1216 C CZ3  . TRP A 1 77  ? 8.036  34.224 24.264 1.00 45.07  ? 80  TRP A CZ3  1 
ATOM   1217 C CH2  . TRP A 1 77  ? 7.880  33.164 23.361 1.00 51.95  ? 80  TRP A CH2  1 
ATOM   1218 H H    . TRP A 1 77  ? 12.054 37.312 21.325 0.00 37.89  ? 80  TRP A H    1 
ATOM   1219 H HA   . TRP A 1 77  ? 11.440 39.028 23.224 0.00 44.97  ? 80  TRP A HA   1 
ATOM   1220 H HB2  . TRP A 1 77  ? 9.239  38.278 22.941 0.00 61.48  ? 80  TRP A HB2  1 
ATOM   1221 H HB3  . TRP A 1 77  ? 9.904  38.630 21.541 0.00 61.48  ? 80  TRP A HB3  1 
ATOM   1222 H HD1  . TRP A 1 77  ? 10.064 36.679 19.799 0.00 52.35  ? 80  TRP A HD1  1 
ATOM   1223 H HE1  . TRP A 1 77  ? 9.262  34.410 19.704 0.00 49.39  ? 80  TRP A HE1  1 
ATOM   1224 H HE3  . TRP A 1 77  ? 8.676  36.131 24.469 0.00 47.62  ? 80  TRP A HE3  1 
ATOM   1225 H HZ2  . TRP A 1 77  ? 8.150  32.575 21.454 0.00 63.25  ? 80  TRP A HZ2  1 
ATOM   1226 H HZ3  . TRP A 1 77  ? 7.771  34.113 25.149 0.00 54.14  ? 80  TRP A HZ3  1 
ATOM   1227 H HH2  . TRP A 1 77  ? 7.513  32.364 23.659 0.00 62.39  ? 80  TRP A HH2  1 
ATOM   1228 N N    . ALA A 1 78  ? 11.905 36.071 24.192 1.00 39.10  ? 81  ALA A N    1 
ATOM   1229 C CA   . ALA A 1 78  ? 11.917 35.200 25.362 1.00 36.55  ? 81  ALA A CA   1 
ATOM   1230 C C    . ALA A 1 78  ? 12.689 35.803 26.527 1.00 34.69  ? 81  ALA A C    1 
ATOM   1231 O O    . ALA A 1 78  ? 12.520 35.352 27.665 1.00 35.23  ? 81  ALA A O    1 
ATOM   1232 C CB   . ALA A 1 78  ? 12.511 33.841 24.993 1.00 45.45  ? 81  ALA A CB   1 
ATOM   1233 H H    . ALA A 1 78  ? 12.317 35.753 23.507 0.00 46.97  ? 81  ALA A H    1 
ATOM   1234 H HA   . ALA A 1 78  ? 11.003 35.061 25.654 0.00 43.91  ? 81  ALA A HA   1 
ATOM   1235 H HB1  . ALA A 1 78  ? 12.555 33.289 25.790 0.00 54.59  ? 81  ALA A HB1  1 
ATOM   1236 H HB2  . ALA A 1 78  ? 11.945 33.419 24.329 0.00 54.59  ? 81  ALA A HB2  1 
ATOM   1237 H HB3  . ALA A 1 78  ? 13.402 33.973 24.633 0.00 54.59  ? 81  ALA A HB3  1 
ATOM   1238 N N    . ARG A 1 79  ? 13.535 36.804 26.274 1.00 37.51  ? 82  ARG A N    1 
ATOM   1239 C CA   . ARG A 1 79  ? 14.244 37.454 27.370 1.00 44.65  ? 82  ARG A CA   1 
ATOM   1240 C C    . ARG A 1 79  ? 13.271 38.112 28.338 1.00 42.51  ? 82  ARG A C    1 
ATOM   1241 O O    . ARG A 1 79  ? 13.490 38.105 29.555 1.00 39.19  ? 82  ARG A O    1 
ATOM   1242 C CB   . ARG A 1 79  ? 15.226 38.492 26.826 1.00 46.15  ? 82  ARG A CB   1 
ATOM   1243 C CG   . ARG A 1 79  ? 16.382 37.901 26.038 1.00 40.89  ? 82  ARG A CG   1 
ATOM   1244 C CD   . ARG A 1 79  ? 17.480 38.928 25.829 1.00 51.06  ? 82  ARG A CD   1 
ATOM   1245 N NE   . ARG A 1 79  ? 18.582 38.410 25.027 1.00 56.15  ? 82  ARG A NE   1 
ATOM   1246 C CZ   . ARG A 1 79  ? 19.616 37.739 25.516 1.00 40.67  ? 82  ARG A CZ   1 
ATOM   1247 N NH1  . ARG A 1 79  ? 19.666 37.374 26.787 1.00 49.76  ? 82  ARG A NH1  1 
ATOM   1248 N NH2  . ARG A 1 79  ? 20.619 37.413 24.705 1.00 56.23  ? 82  ARG A NH2  1 
ATOM   1249 H H    . ARG A 1 79  ? 13.711 37.118 25.493 0.00 45.06  ? 82  ARG A H    1 
ATOM   1250 H HA   . ARG A 1 79  ? 14.752 36.782 27.852 0.00 53.63  ? 82  ARG A HA   1 
ATOM   1251 H HB2  . ARG A 1 79  ? 14.746 39.094 26.237 0.00 55.43  ? 82  ARG A HB2  1 
ATOM   1252 H HB3  . ARG A 1 79  ? 15.601 38.986 27.572 0.00 55.43  ? 82  ARG A HB3  1 
ATOM   1253 H HG2  . ARG A 1 79  ? 16.754 37.149 26.525 0.00 49.11  ? 82  ARG A HG2  1 
ATOM   1254 H HG3  . ARG A 1 79  ? 16.065 37.609 25.169 0.00 49.11  ? 82  ARG A HG3  1 
ATOM   1255 H HD2  . ARG A 1 79  ? 17.111 39.699 25.370 0.00 61.32  ? 82  ARG A HD2  1 
ATOM   1256 H HD3  . ARG A 1 79  ? 17.835 39.194 26.691 0.00 61.32  ? 82  ARG A HD3  1 
ATOM   1257 H HE   . ARG A 1 79  ? 18.559 38.548 24.178 0.00 67.43  ? 82  ARG A HE   1 
ATOM   1258 H HH11 . ARG A 1 79  ? 19.018 37.572 27.317 0.00 59.77  ? 82  ARG A HH11 1 
ATOM   1259 H HH12 . ARG A 1 79  ? 20.347 36.939 27.083 0.00 59.77  ? 82  ARG A HH12 1 
ATOM   1260 H HH21 . ARG A 1 79  ? 20.592 37.637 23.875 0.00 67.52  ? 82  ARG A HH21 1 
ATOM   1261 H HH22 . ARG A 1 79  ? 21.295 36.978 25.011 0.00 67.52  ? 82  ARG A HH22 1 
ATOM   1262 N N    . TYR A 1 80  ? 12.186 38.686 27.817 1.00 38.56  ? 83  TYR A N    1 
ATOM   1263 C CA   . TYR A 1 80  ? 11.242 39.402 28.666 1.00 35.56  ? 83  TYR A CA   1 
ATOM   1264 C C    . TYR A 1 80  ? 10.290 38.460 29.393 1.00 35.10  ? 83  TYR A C    1 
ATOM   1265 O O    . TYR A 1 80  ? 9.846  38.777 30.502 1.00 37.20  ? 83  TYR A O    1 
ATOM   1266 C CB   . TYR A 1 80  ? 10.478 40.429 27.828 1.00 35.42  ? 83  TYR A CB   1 
ATOM   1267 C CG   . TYR A 1 80  ? 11.402 41.308 27.011 1.00 39.28  ? 83  TYR A CG   1 
ATOM   1268 C CD1  . TYR A 1 80  ? 11.881 40.897 25.771 1.00 34.75  ? 83  TYR A CD1  1 
ATOM   1269 C CD2  . TYR A 1 80  ? 11.832 42.530 27.506 1.00 38.99  ? 83  TYR A CD2  1 
ATOM   1270 C CE1  . TYR A 1 80  ? 12.739 41.697 25.038 1.00 32.49  ? 83  TYR A CE1  1 
ATOM   1271 C CE2  . TYR A 1 80  ? 12.690 43.333 26.782 1.00 42.02  ? 83  TYR A CE2  1 
ATOM   1272 C CZ   . TYR A 1 80  ? 13.141 42.913 25.551 1.00 44.24  ? 83  TYR A CZ   1 
ATOM   1273 O OH   . TYR A 1 80  ? 13.997 43.714 24.830 1.00 47.06  ? 83  TYR A OH   1 
ATOM   1274 H H    . TYR A 1 80  ? 11.977 38.674 26.983 0.00 46.32  ? 83  TYR A H    1 
ATOM   1275 H HA   . TYR A 1 80  ? 11.728 39.888 29.350 0.00 42.72  ? 83  TYR A HA   1 
ATOM   1276 H HB2  . TYR A 1 80  ? 9.886  39.962 27.216 0.00 42.56  ? 83  TYR A HB2  1 
ATOM   1277 H HB3  . TYR A 1 80  ? 9.961  40.999 28.418 0.00 42.56  ? 83  TYR A HB3  1 
ATOM   1278 H HD1  . TYR A 1 80  ? 11.621 40.073 25.430 0.00 41.76  ? 83  TYR A HD1  1 
ATOM   1279 H HD2  . TYR A 1 80  ? 11.537 42.814 28.341 0.00 46.84  ? 83  TYR A HD2  1 
ATOM   1280 H HE1  . TYR A 1 80  ? 13.044 41.416 24.205 0.00 39.04  ? 83  TYR A HE1  1 
ATOM   1281 H HE2  . TYR A 1 80  ? 12.961 44.154 27.124 0.00 50.48  ? 83  TYR A HE2  1 
ATOM   1282 H HH   . TYR A 1 80  ? 14.226 43.325 24.122 0.00 56.53  ? 83  TYR A HH   1 
ATOM   1283 N N    . ALA A 1 81  ? 9.975  37.302 28.805 1.00 31.88  ? 84  ALA A N    1 
ATOM   1284 C CA   . ALA A 1 81  ? 9.226  36.291 29.545 1.00 27.41  ? 84  ALA A CA   1 
ATOM   1285 C C    . ALA A 1 81  ? 10.056 35.747 30.699 1.00 32.25  ? 84  ALA A C    1 
ATOM   1286 O O    . ALA A 1 81  ? 9.532  35.495 31.791 1.00 37.67  ? 84  ALA A O    1 
ATOM   1287 C CB   . ALA A 1 81  ? 8.797  35.163 28.608 1.00 44.30  ? 84  ALA A CB   1 
ATOM   1288 H H    . ALA A 1 81  ? 10.181 37.083 27.999 0.00 38.30  ? 84  ALA A H    1 
ATOM   1289 H HA   . ALA A 1 81  ? 8.421  36.693 29.909 0.00 32.94  ? 84  ALA A HA   1 
ATOM   1290 H HB1  . ALA A 1 81  ? 8.300  34.502 29.115 0.00 53.21  ? 84  ALA A HB1  1 
ATOM   1291 H HB2  . ALA A 1 81  ? 8.238  35.531 27.906 0.00 53.21  ? 84  ALA A HB2  1 
ATOM   1292 H HB3  . ALA A 1 81  ? 9.588  34.756 28.221 0.00 53.21  ? 84  ALA A HB3  1 
ATOM   1293 N N    . ASP A 1 82  ? 11.354 35.554 30.466 1.00 33.61  ? 85  ASP A N    1 
ATOM   1294 C CA   . ASP A 1 82  ? 12.286 35.241 31.544 1.00 31.92  ? 85  ASP A CA   1 
ATOM   1295 C C    . ASP A 1 82  ? 12.247 36.316 32.626 1.00 37.34  ? 85  ASP A C    1 
ATOM   1296 O O    . ASP A 1 82  ? 11.953 36.035 33.794 1.00 37.95  ? 85  ASP A O    1 
ATOM   1297 C CB   . ASP A 1 82  ? 13.695 35.102 30.953 1.00 46.19  ? 85  ASP A CB   1 
ATOM   1298 C CG   . ASP A 1 82  ? 14.781 34.932 32.010 1.00 48.26  ? 85  ASP A CG   1 
ATOM   1299 O OD1  . ASP A 1 82  ? 14.521 35.130 33.214 1.00 43.22  ? 85  ASP A OD1  1 
ATOM   1300 O OD2  . ASP A 1 82  ? 15.919 34.601 31.620 1.00 40.86  ? 85  ASP A OD2  1 
ATOM   1301 H H    . ASP A 1 82  ? 11.721 35.600 29.690 0.00 40.39  ? 85  ASP A H    1 
ATOM   1302 H HA   . ASP A 1 82  ? 12.040 34.399 31.958 0.00 38.36  ? 85  ASP A HA   1 
ATOM   1303 H HB2  . ASP A 1 82  ? 13.717 34.322 30.377 0.00 55.48  ? 85  ASP A HB2  1 
ATOM   1304 H HB3  . ASP A 1 82  ? 13.900 35.899 30.441 0.00 55.48  ? 85  ASP A HB3  1 
ATOM   1305 N N    . TRP A 1 83  ? 12.538 37.562 32.248 1.00 39.22  ? 86  TRP A N    1 
ATOM   1306 C CA   . TRP A 1 83  ? 12.720 38.621 33.236 1.00 37.09  ? 86  TRP A CA   1 
ATOM   1307 C C    . TRP A 1 83  ? 11.424 38.951 33.968 1.00 40.04  ? 86  TRP A C    1 
ATOM   1308 O O    . TRP A 1 83  ? 11.465 39.411 35.115 1.00 43.57  ? 86  TRP A O    1 
ATOM   1309 C CB   . TRP A 1 83  ? 13.272 39.872 32.554 1.00 33.32  ? 86  TRP A CB   1 
ATOM   1310 C CG   . TRP A 1 83  ? 14.658 39.703 32.008 1.00 30.24  ? 86  TRP A CG   1 
ATOM   1311 C CD1  . TRP A 1 83  ? 15.600 38.801 32.416 1.00 32.13  ? 86  TRP A CD1  1 
ATOM   1312 C CD2  . TRP A 1 83  ? 15.258 40.457 30.949 1.00 33.48  ? 86  TRP A CD2  1 
ATOM   1313 N NE1  . TRP A 1 83  ? 16.749 38.948 31.677 1.00 41.97  ? 86  TRP A NE1  1 
ATOM   1314 C CE2  . TRP A 1 83  ? 16.565 39.958 30.770 1.00 36.14  ? 86  TRP A CE2  1 
ATOM   1315 C CE3  . TRP A 1 83  ? 14.818 41.506 30.135 1.00 39.17  ? 86  TRP A CE3  1 
ATOM   1316 C CZ2  . TRP A 1 83  ? 17.434 40.472 29.811 1.00 41.40  ? 86  TRP A CZ2  1 
ATOM   1317 C CZ3  . TRP A 1 83  ? 15.684 42.015 29.184 1.00 47.39  ? 86  TRP A CZ3  1 
ATOM   1318 C CH2  . TRP A 1 83  ? 16.976 41.498 29.029 1.00 39.74  ? 86  TRP A CH2  1 
ATOM   1319 H H    . TRP A 1 83  ? 12.636 37.817 31.432 0.00 47.12  ? 86  TRP A H    1 
ATOM   1320 H HA   . TRP A 1 83  ? 13.362 38.320 33.898 0.00 44.56  ? 86  TRP A HA   1 
ATOM   1321 H HB2  . TRP A 1 83  ? 12.690 40.106 31.814 0.00 40.04  ? 86  TRP A HB2  1 
ATOM   1322 H HB3  . TRP A 1 83  ? 13.295 40.595 33.200 0.00 40.04  ? 86  TRP A HB3  1 
ATOM   1323 H HD1  . TRP A 1 83  ? 15.480 38.177 33.096 0.00 38.61  ? 86  TRP A HD1  1 
ATOM   1324 H HE1  . TRP A 1 83  ? 17.466 38.483 31.769 0.00 50.42  ? 86  TRP A HE1  1 
ATOM   1325 H HE3  . TRP A 1 83  ? 13.961 41.854 30.232 0.00 47.05  ? 86  TRP A HE3  1 
ATOM   1326 H HZ2  . TRP A 1 83  ? 18.293 40.132 29.706 0.00 49.73  ? 86  TRP A HZ2  1 
ATOM   1327 H HZ3  . TRP A 1 83  ? 15.402 42.712 28.636 0.00 56.92  ? 86  TRP A HZ3  1 
ATOM   1328 H HH2  . TRP A 1 83  ? 17.536 41.860 28.381 0.00 47.74  ? 86  TRP A HH2  1 
ATOM   1329 N N    . LEU A 1 84  ? 10.271 38.735 33.329 1.00 34.89  ? 87  LEU A N    1 
ATOM   1330 C CA   . LEU A 1 84  ? 9.002  39.030 33.987 1.00 33.27  ? 87  LEU A CA   1 
ATOM   1331 C C    . LEU A 1 84  ? 8.859  38.252 35.288 1.00 49.99  ? 87  LEU A C    1 
ATOM   1332 O O    . LEU A 1 84  ? 8.342  38.779 36.281 1.00 46.37  ? 87  LEU A O    1 
ATOM   1333 C CB   . LEU A 1 84  ? 7.836  38.714 33.048 1.00 37.23  ? 87  LEU A CB   1 
ATOM   1334 C CG   . LEU A 1 84  ? 6.432  38.969 33.609 1.00 33.16  ? 87  LEU A CG   1 
ATOM   1335 C CD1  . LEU A 1 84  ? 6.196  40.455 33.823 1.00 63.64  ? 87  LEU A CD1  1 
ATOM   1336 C CD2  . LEU A 1 84  ? 5.368  38.382 32.691 1.00 40.81  ? 87  LEU A CD2  1 
ATOM   1337 H H    . LEU A 1 84  ? 10.200 38.423 32.531 0.00 41.91  ? 87  LEU A H    1 
ATOM   1338 H HA   . LEU A 1 84  ? 8.974  39.977 34.195 0.00 39.98  ? 87  LEU A HA   1 
ATOM   1339 H HB2  . LEU A 1 84  ? 7.931  39.262 32.253 0.00 44.73  ? 87  LEU A HB2  1 
ATOM   1340 H HB3  . LEU A 1 84  ? 7.884  37.775 32.812 0.00 44.73  ? 87  LEU A HB3  1 
ATOM   1341 H HG   . LEU A 1 84  ? 6.358  38.530 34.471 0.00 39.85  ? 87  LEU A HG   1 
ATOM   1342 H HD11 . LEU A 1 84  ? 5.277  40.592 34.102 0.00 76.42  ? 87  LEU A HD11 1 
ATOM   1343 H HD12 . LEU A 1 84  ? 6.802  40.775 34.510 0.00 76.42  ? 87  LEU A HD12 1 
ATOM   1344 H HD13 . LEU A 1 84  ? 6.363  40.924 32.991 0.00 76.42  ? 87  LEU A HD13 1 
ATOM   1345 H HD21 . LEU A 1 84  ? 4.493  38.555 33.071 0.00 49.02  ? 87  LEU A HD21 1 
ATOM   1346 H HD22 . LEU A 1 84  ? 5.439  38.799 31.819 0.00 49.02  ? 87  LEU A HD22 1 
ATOM   1347 H HD23 . LEU A 1 84  ? 5.512  37.426 32.613 0.00 49.02  ? 87  LEU A HD23 1 
ATOM   1348 N N    . PHE A 1 85  ? 9.317  37.002 35.308 1.00 44.77  ? 88  PHE A N    1 
ATOM   1349 C CA   . PHE A 1 85  ? 9.123  36.130 36.459 1.00 55.90  ? 88  PHE A CA   1 
ATOM   1350 C C    . PHE A 1 85  ? 10.349 36.013 37.352 1.00 48.83  ? 88  PHE A C    1 
ATOM   1351 O O    . PHE A 1 85  ? 10.200 35.748 38.549 1.00 47.07  ? 88  PHE A O    1 
ATOM   1352 C CB   . PHE A 1 85  ? 8.707  34.732 35.990 1.00 52.66  ? 88  PHE A CB   1 
ATOM   1353 C CG   . PHE A 1 85  ? 7.365  34.701 35.320 1.00 42.26  ? 88  PHE A CG   1 
ATOM   1354 C CD1  . PHE A 1 85  ? 6.206  34.844 36.063 1.00 45.24  ? 88  PHE A CD1  1 
ATOM   1355 C CD2  . PHE A 1 85  ? 7.262  34.541 33.949 1.00 46.72  ? 88  PHE A CD2  1 
ATOM   1356 C CE1  . PHE A 1 85  ? 4.969  34.822 35.454 1.00 49.31  ? 88  PHE A CE1  1 
ATOM   1357 C CE2  . PHE A 1 85  ? 6.025  34.518 33.333 1.00 52.58  ? 88  PHE A CE2  1 
ATOM   1358 C CZ   . PHE A 1 85  ? 4.878  34.659 34.087 1.00 61.28  ? 88  PHE A CZ   1 
ATOM   1359 H H    . PHE A 1 85  ? 9.747  36.634 34.660 0.00 53.78  ? 88  PHE A H    1 
ATOM   1360 H HA   . PHE A 1 85  ? 8.406  36.492 37.003 0.00 67.13  ? 88  PHE A HA   1 
ATOM   1361 H HB2  . PHE A 1 85  ? 9.364  34.407 35.355 0.00 63.24  ? 88  PHE A HB2  1 
ATOM   1362 H HB3  . PHE A 1 85  ? 8.668  34.143 36.759 0.00 63.24  ? 88  PHE A HB3  1 
ATOM   1363 H HD1  . PHE A 1 85  ? 6.263  34.957 36.985 0.00 54.34  ? 88  PHE A HD1  1 
ATOM   1364 H HD2  . PHE A 1 85  ? 8.033  34.448 33.437 0.00 56.11  ? 88  PHE A HD2  1 
ATOM   1365 H HE1  . PHE A 1 85  ? 4.197  34.917 35.964 0.00 59.22  ? 88  PHE A HE1  1 
ATOM   1366 H HE2  . PHE A 1 85  ? 5.966  34.408 32.411 0.00 63.14  ? 88  PHE A HE2  1 
ATOM   1367 H HZ   . PHE A 1 85  ? 4.044  34.644 33.674 0.00 73.58  ? 88  PHE A HZ   1 
ATOM   1368 N N    . THR A 1 86  ? 11.553 36.200 36.813 1.00 32.68  ? 89  THR A N    1 
ATOM   1369 C CA   . THR A 1 86  ? 12.759 36.061 37.619 1.00 32.02  ? 89  THR A CA   1 
ATOM   1370 C C    . THR A 1 86  ? 13.149 37.340 38.349 1.00 44.87  ? 89  THR A C    1 
ATOM   1371 O O    . THR A 1 86  ? 13.681 37.261 39.462 1.00 39.24  ? 89  THR A O    1 
ATOM   1372 C CB   . THR A 1 86  ? 13.933 35.600 36.749 1.00 34.27  ? 89  THR A CB   1 
ATOM   1373 O OG1  . THR A 1 86  ? 14.111 36.501 35.648 1.00 40.05  ? 89  THR A OG1  1 
ATOM   1374 C CG2  . THR A 1 86  ? 13.693 34.189 36.225 1.00 31.59  ? 89  THR A CG2  1 
ATOM   1375 H H    . THR A 1 86  ? 11.694 36.407 35.990 0.00 39.26  ? 89  THR A H    1 
ATOM   1376 H HA   . THR A 1 86  ? 12.594 35.378 38.289 0.00 38.48  ? 89  THR A HA   1 
ATOM   1377 H HB   . THR A 1 86  ? 14.743 35.591 37.282 0.00 41.17  ? 89  THR A HB   1 
ATOM   1378 H HG1  . THR A 1 86  ? 14.792 36.285 35.207 0.00 48.11  ? 89  THR A HG1  1 
ATOM   1379 H HG21 . THR A 1 86  ? 14.461 33.889 35.714 0.00 37.95  ? 89  THR A HG21 1 
ATOM   1380 H HG22 . THR A 1 86  ? 13.550 33.580 36.966 0.00 37.95  ? 89  THR A HG22 1 
ATOM   1381 H HG23 . THR A 1 86  ? 12.910 34.177 35.652 0.00 37.95  ? 89  THR A HG23 1 
ATOM   1382 N N    . THR A 1 87  ? 12.901 38.514 37.767 1.00 34.14  ? 90  THR A N    1 
ATOM   1383 C CA   . THR A 1 87  ? 13.333 39.749 38.414 1.00 41.67  ? 90  THR A CA   1 
ATOM   1384 C C    . THR A 1 87  ? 12.499 40.063 39.655 1.00 35.96  ? 90  THR A C    1 
ATOM   1385 O O    . THR A 1 87  ? 13.058 40.543 40.648 1.00 39.80  ? 90  THR A O    1 
ATOM   1386 C CB   . THR A 1 87  ? 13.295 40.933 37.442 1.00 34.88  ? 90  THR A CB   1 
ATOM   1387 O OG1  . THR A 1 87  ? 12.002 41.041 36.840 1.00 44.63  ? 90  THR A OG1  1 
ATOM   1388 C CG2  . THR A 1 87  ? 14.356 40.776 36.363 1.00 41.50  ? 90  THR A CG2  1 
ATOM   1389 H H    . THR A 1 87  ? 12.495 38.618 37.016 0.00 41.02  ? 90  THR A H    1 
ATOM   1390 H HA   . THR A 1 87  ? 14.249 39.617 38.705 0.00 50.06  ? 90  THR A HA   1 
ATOM   1391 H HB   . THR A 1 87  ? 13.479 41.751 37.932 0.00 41.90  ? 90  THR A HB   1 
ATOM   1392 H HG1  . THR A 1 87  ? 11.539 41.607 37.252 0.00 53.61  ? 90  THR A HG1  1 
ATOM   1393 H HG21 . THR A 1 87  ? 14.356 41.554 35.783 0.00 49.85  ? 90  THR A HG21 1 
ATOM   1394 H HG22 . THR A 1 87  ? 15.232 40.687 36.770 0.00 49.85  ? 90  THR A HG22 1 
ATOM   1395 H HG23 . THR A 1 87  ? 14.173 39.986 35.831 0.00 49.85  ? 90  THR A HG23 1 
ATOM   1396 N N    . PRO A 1 88  ? 11.180 39.830 39.662 1.00 36.95  ? 91  PRO A N    1 
ATOM   1397 C CA   . PRO A 1 88  ? 10.446 40.037 40.921 1.00 43.10  ? 91  PRO A CA   1 
ATOM   1398 C C    . PRO A 1 88  ? 10.838 39.043 41.996 1.00 38.59  ? 91  PRO A C    1 
ATOM   1399 O O    . PRO A 1 88  ? 10.789 39.380 43.186 1.00 41.38  ? 91  PRO A O    1 
ATOM   1400 C CB   . PRO A 1 88  ? 8.973  39.882 40.517 1.00 52.35  ? 91  PRO A CB   1 
ATOM   1401 C CG   . PRO A 1 88  ? 8.975  39.203 39.217 1.00 41.67  ? 91  PRO A CG   1 
ATOM   1402 C CD   . PRO A 1 88  ? 10.271 39.504 38.546 1.00 41.56  ? 91  PRO A CD   1 
ATOM   1403 H HA   . PRO A 1 88  ? 10.586 40.942 41.242 0.00 51.77  ? 91  PRO A HA   1 
ATOM   1404 H HB2  . PRO A 1 88  ? 8.508  39.350 41.182 0.00 62.87  ? 91  PRO A HB2  1 
ATOM   1405 H HB3  . PRO A 1 88  ? 8.561  40.757 40.446 0.00 62.87  ? 91  PRO A HB3  1 
ATOM   1406 H HG2  . PRO A 1 88  ? 8.882  38.247 39.356 0.00 50.06  ? 91  PRO A HG2  1 
ATOM   1407 H HG3  . PRO A 1 88  ? 8.235  39.534 38.683 0.00 50.06  ? 91  PRO A HG3  1 
ATOM   1408 H HD2  . PRO A 1 88  ? 10.592 38.730 38.057 0.00 49.93  ? 91  PRO A HD2  1 
ATOM   1409 H HD3  . PRO A 1 88  ? 10.179 40.260 37.946 0.00 49.93  ? 91  PRO A HD3  1 
ATOM   1410 N N    . LEU A 1 89  ? 11.222 37.823 41.612 1.00 36.75  ? 92  LEU A N    1 
ATOM   1411 C CA   . LEU A 1 89  ? 11.673 36.840 42.590 1.00 41.13  ? 92  LEU A CA   1 
ATOM   1412 C C    . LEU A 1 89  ? 12.968 37.286 43.255 1.00 42.10  ? 92  LEU A C    1 
ATOM   1413 O O    . LEU A 1 89  ? 13.151 37.099 44.464 1.00 36.92  ? 92  LEU A O    1 
ATOM   1414 C CB   . LEU A 1 89  ? 11.860 35.485 41.907 1.00 44.67  ? 92  LEU A CB   1 
ATOM   1415 C CG   . LEU A 1 89  ? 10.582 34.722 41.549 1.00 41.95  ? 92  LEU A CG   1 
ATOM   1416 C CD1  . LEU A 1 89  ? 10.917 33.466 40.757 1.00 47.23  ? 92  LEU A CD1  1 
ATOM   1417 C CD2  . LEU A 1 89  ? 9.783  34.368 42.794 1.00 44.52  ? 92  LEU A CD2  1 
ATOM   1418 H H    . LEU A 1 89  ? 11.230 37.545 40.798 0.00 44.15  ? 92  LEU A H    1 
ATOM   1419 H HA   . LEU A 1 89  ? 10.998 36.743 43.279 0.00 49.41  ? 92  LEU A HA   1 
ATOM   1420 H HB2  . LEU A 1 89  ? 12.348 35.629 41.082 0.00 53.66  ? 92  LEU A HB2  1 
ATOM   1421 H HB3  . LEU A 1 89  ? 12.374 34.917 42.502 0.00 53.66  ? 92  LEU A HB3  1 
ATOM   1422 H HG   . LEU A 1 89  ? 10.026 35.293 40.996 0.00 50.39  ? 92  LEU A HG   1 
ATOM   1423 H HD11 . LEU A 1 89  ? 10.094 32.999 40.542 0.00 56.73  ? 92  LEU A HD11 1 
ATOM   1424 H HD12 . LEU A 1 89  ? 11.377 33.720 39.942 0.00 56.73  ? 92  LEU A HD12 1 
ATOM   1425 H HD13 . LEU A 1 89  ? 11.489 32.897 41.296 0.00 56.73  ? 92  LEU A HD13 1 
ATOM   1426 H HD21 . LEU A 1 89  ? 9.077  33.749 42.551 0.00 53.48  ? 92  LEU A HD21 1 
ATOM   1427 H HD22 . LEU A 1 89  ? 10.375 33.957 43.443 0.00 53.48  ? 92  LEU A HD22 1 
ATOM   1428 H HD23 . LEU A 1 89  ? 9.399  35.179 43.163 0.00 53.48  ? 92  LEU A HD23 1 
ATOM   1429 N N    . LEU A 1 90  ? 13.880 37.876 42.479 1.00 36.50  ? 93  LEU A N    1 
ATOM   1430 C CA   . LEU A 1 90  ? 15.125 38.379 43.047 1.00 34.03  ? 93  LEU A CA   1 
ATOM   1431 C C    . LEU A 1 90  ? 14.857 39.510 44.032 1.00 38.00  ? 93  LEU A C    1 
ATOM   1432 O O    . LEU A 1 90  ? 15.506 39.601 45.080 1.00 37.88  ? 93  LEU A O    1 
ATOM   1433 C CB   . LEU A 1 90  ? 16.051 38.853 41.927 1.00 40.94  ? 93  LEU A CB   1 
ATOM   1434 C CG   . LEU A 1 90  ? 16.674 37.754 41.062 1.00 47.02  ? 93  LEU A CG   1 
ATOM   1435 C CD1  . LEU A 1 90  ? 17.262 38.341 39.786 1.00 50.33  ? 93  LEU A CD1  1 
ATOM   1436 C CD2  . LEU A 1 90  ? 17.734 36.992 41.839 1.00 41.62  ? 93  LEU A CD2  1 
ATOM   1437 H H    . LEU A 1 90  ? 13.801 37.996 41.631 0.00 43.85  ? 93  LEU A H    1 
ATOM   1438 H HA   . LEU A 1 90  ? 15.570 37.662 43.525 0.00 40.88  ? 93  LEU A HA   1 
ATOM   1439 H HB2  . LEU A 1 90  ? 15.541 39.429 41.336 0.00 49.18  ? 93  LEU A HB2  1 
ATOM   1440 H HB3  . LEU A 1 90  ? 16.781 39.351 42.327 0.00 49.18  ? 93  LEU A HB3  1 
ATOM   1441 H HG   . LEU A 1 90  ? 15.979 37.126 40.810 0.00 56.47  ? 93  LEU A HG   1 
ATOM   1442 H HD11 . LEU A 1 90  ? 17.644 37.624 39.256 0.00 60.44  ? 93  LEU A HD11 1 
ATOM   1443 H HD12 . LEU A 1 90  ? 16.557 38.782 39.287 0.00 60.44  ? 93  LEU A HD12 1 
ATOM   1444 H HD13 . LEU A 1 90  ? 17.951 38.981 40.021 0.00 60.44  ? 93  LEU A HD13 1 
ATOM   1445 H HD21 . LEU A 1 90  ? 18.162 36.355 41.247 0.00 49.99  ? 93  LEU A HD21 1 
ATOM   1446 H HD22 . LEU A 1 90  ? 18.390 37.621 42.178 0.00 49.99  ? 93  LEU A HD22 1 
ATOM   1447 H HD23 . LEU A 1 90  ? 17.311 36.526 42.577 0.00 49.99  ? 93  LEU A HD23 1 
ATOM   1448 N N    . LEU A 1 91  ? 13.902 40.384 43.708 1.00 34.00  ? 94  LEU A N    1 
ATOM   1449 C CA   . LEU A 1 91  ? 13.545 41.465 44.620 1.00 42.76  ? 94  LEU A CA   1 
ATOM   1450 C C    . LEU A 1 91  ? 12.901 40.927 45.890 1.00 34.99  ? 94  LEU A C    1 
ATOM   1451 O O    . LEU A 1 91  ? 13.091 41.496 46.971 1.00 47.62  ? 94  LEU A O    1 
ATOM   1452 C CB   . LEU A 1 91  ? 12.601 42.442 43.920 1.00 37.94  ? 94  LEU A CB   1 
ATOM   1453 C CG   . LEU A 1 91  ? 13.204 43.268 42.781 1.00 37.31  ? 94  LEU A CG   1 
ATOM   1454 C CD1  . LEU A 1 91  ? 12.127 44.096 42.097 1.00 49.38  ? 94  LEU A CD1  1 
ATOM   1455 C CD2  . LEU A 1 91  ? 14.327 44.163 43.285 1.00 44.16  ? 94  LEU A CD2  1 
ATOM   1456 H H    . LEU A 1 91  ? 13.452 40.373 42.975 0.00 40.85  ? 94  LEU A H    1 
ATOM   1457 H HA   . LEU A 1 91  ? 14.348 41.948 44.869 0.00 51.36  ? 94  LEU A HA   1 
ATOM   1458 H HB2  . LEU A 1 91  ? 11.864 41.934 43.546 0.00 45.57  ? 94  LEU A HB2  1 
ATOM   1459 H HB3  . LEU A 1 91  ? 12.270 43.068 44.584 0.00 45.57  ? 94  LEU A HB3  1 
ATOM   1460 H HG   . LEU A 1 91  ? 13.585 42.661 42.127 0.00 44.82  ? 94  LEU A HG   1 
ATOM   1461 H HD11 . LEU A 1 91  ? 12.531 44.610 41.381 0.00 59.30  ? 94  LEU A HD11 1 
ATOM   1462 H HD12 . LEU A 1 91  ? 11.452 43.500 41.737 0.00 59.30  ? 94  LEU A HD12 1 
ATOM   1463 H HD13 . LEU A 1 91  ? 11.728 44.694 42.748 0.00 59.30  ? 94  LEU A HD13 1 
ATOM   1464 H HD21 . LEU A 1 91  ? 14.566 44.793 42.587 0.00 53.05  ? 94  LEU A HD21 1 
ATOM   1465 H HD22 . LEU A 1 91  ? 14.021 44.641 44.072 0.00 53.05  ? 94  LEU A HD22 1 
ATOM   1466 H HD23 . LEU A 1 91  ? 15.093 43.612 43.510 0.00 53.05  ? 94  LEU A HD23 1 
ATOM   1467 N N    . LEU A 1 92  ? 12.134 39.840 45.778 1.00 34.76  ? 95  LEU A N    1 
ATOM   1468 C CA   . LEU A 1 92  ? 11.538 39.227 46.960 1.00 37.57  ? 95  LEU A CA   1 
ATOM   1469 C C    . LEU A 1 92  ? 12.601 38.635 47.876 1.00 52.59  ? 95  LEU A C    1 
ATOM   1470 O O    . LEU A 1 92  ? 12.445 38.666 49.102 1.00 40.56  ? 95  LEU A O    1 
ATOM   1471 C CB   . LEU A 1 92  ? 10.534 38.155 46.535 1.00 34.58  ? 95  LEU A CB   1 
ATOM   1472 C CG   . LEU A 1 92  ? 9.626  37.562 47.615 1.00 55.99  ? 95  LEU A CG   1 
ATOM   1473 C CD1  . LEU A 1 92  ? 8.708  38.618 48.207 1.00 54.38  ? 95  LEU A CD1  1 
ATOM   1474 C CD2  . LEU A 1 92  ? 8.816  36.422 47.022 1.00 64.85  ? 95  LEU A CD2  1 
ATOM   1475 H H    . LEU A 1 92  ? 11.947 39.445 45.038 1.00 41.77  ? 95  LEU A H    1 
ATOM   1476 H HA   . LEU A 1 92  ? 11.058 39.903 47.462 1.00 45.14  ? 95  LEU A HA   1 
ATOM   1477 H HB2  . LEU A 1 92  ? 9.953  38.545 45.863 1.00 41.55  ? 95  LEU A HB2  1 
ATOM   1478 H HB3  . LEU A 1 92  ? 11.034 37.417 46.153 1.00 41.55  ? 95  LEU A HB3  1 
ATOM   1479 H HG   . LEU A 1 92  ? 10.173 37.221 48.339 1.00 67.24  ? 95  LEU A HG   1 
ATOM   1480 H HD11 . LEU A 1 92  ? 8.093  38.192 48.824 1.00 65.31  ? 95  LEU A HD11 1 
ATOM   1481 H HD12 . LEU A 1 92  ? 9.245  39.276 48.677 1.00 65.31  ? 95  LEU A HD12 1 
ATOM   1482 H HD13 . LEU A 1 92  ? 8.215  39.046 47.490 1.00 65.31  ? 95  LEU A HD13 1 
ATOM   1483 H HD21 . LEU A 1 92  ? 8.262  36.033 47.718 1.00 77.87  ? 95  LEU A HD21 1 
ATOM   1484 H HD22 . LEU A 1 92  ? 8.257  36.768 46.309 1.00 77.87  ? 95  LEU A HD22 1 
ATOM   1485 H HD23 . LEU A 1 92  ? 9.423  35.752 46.671 1.00 77.87  ? 95  LEU A HD23 1 
ATOM   1486 N N    . ASP A 1 93  ? 13.682 38.095 47.307 1.00 40.92  ? 96  ASP A N    1 
ATOM   1487 C CA   . ASP A 1 93  ? 14.787 37.625 48.137 1.00 38.73  ? 96  ASP A CA   1 
ATOM   1488 C C    . ASP A 1 93  ? 15.330 38.751 49.007 1.00 44.94  ? 96  ASP A C    1 
ATOM   1489 O O    . ASP A 1 93  ? 15.584 38.557 50.202 1.00 46.81  ? 96  ASP A O    1 
ATOM   1490 C CB   . ASP A 1 93  ? 15.899 37.048 47.258 1.00 42.89  ? 96  ASP A CB   1 
ATOM   1491 C CG   . ASP A 1 93  ? 15.881 35.531 47.205 1.00 39.17  ? 96  ASP A CG   1 
ATOM   1492 O OD1  . ASP A 1 93  ? 15.263 34.901 48.087 1.00 43.82  ? 96  ASP A OD1  1 
ATOM   1493 O OD2  . ASP A 1 93  ? 16.488 34.966 46.273 1.00 40.90  ? 96  ASP A OD2  1 
ATOM   1494 H H    . ASP A 1 93  ? 13.797 37.993 46.461 0.00 49.15  ? 96  ASP A H    1 
ATOM   1495 H HA   . ASP A 1 93  ? 14.464 36.917 48.716 0.00 46.53  ? 96  ASP A HA   1 
ATOM   1496 H HB2  . ASP A 1 93  ? 15.792 37.381 46.354 0.00 51.52  ? 96  ASP A HB2  1 
ATOM   1497 H HB3  . ASP A 1 93  ? 16.758 37.325 47.614 0.00 51.52  ? 96  ASP A HB3  1 
ATOM   1498 N N    . LEU A 1 94  ? 15.510 39.938 48.425 1.00 43.16  ? 97  LEU A N    1 
ATOM   1499 C CA   . LEU A 1 94  ? 16.020 41.070 49.191 1.00 47.72  ? 97  LEU A CA   1 
ATOM   1500 C C    . LEU A 1 94  ? 14.994 41.566 50.204 1.00 40.74  ? 97  LEU A C    1 
ATOM   1501 O O    . LEU A 1 94  ? 15.346 41.880 51.346 1.00 42.16  ? 97  LEU A O    1 
ATOM   1502 C CB   . LEU A 1 94  ? 16.422 42.203 48.247 1.00 44.65  ? 97  LEU A CB   1 
ATOM   1503 C CG   . LEU A 1 94  ? 17.610 41.938 47.319 1.00 41.51  ? 97  LEU A CG   1 
ATOM   1504 C CD1  . LEU A 1 94  ? 17.743 43.043 46.281 1.00 59.54  ? 97  LEU A CD1  1 
ATOM   1505 C CD2  . LEU A 1 94  ? 18.891 41.811 48.127 1.00 53.03  ? 97  LEU A CD2  1 
ATOM   1506 H H    . LEU A 1 94  ? 15.347 40.110 47.598 0.00 51.85  ? 97  LEU A H    1 
ATOM   1507 H HA   . LEU A 1 94  ? 16.808 40.782 49.678 0.00 57.31  ? 97  LEU A HA   1 
ATOM   1508 H HB2  . LEU A 1 94  ? 15.661 42.407 47.682 0.00 53.63  ? 97  LEU A HB2  1 
ATOM   1509 H HB3  . LEU A 1 94  ? 16.651 42.976 48.787 0.00 53.63  ? 97  LEU A HB3  1 
ATOM   1510 H HG   . LEU A 1 94  ? 17.461 41.103 46.848 0.00 49.87  ? 97  LEU A HG   1 
ATOM   1511 H HD11 . LEU A 1 94  ? 18.476 42.827 45.683 0.00 71.50  ? 97  LEU A HD11 1 
ATOM   1512 H HD12 . LEU A 1 94  ? 16.915 43.106 45.779 0.00 71.50  ? 97  LEU A HD12 1 
ATOM   1513 H HD13 . LEU A 1 94  ? 17.921 43.882 46.733 0.00 71.50  ? 97  LEU A HD13 1 
ATOM   1514 H HD21 . LEU A 1 94  ? 19.644 41.761 47.518 0.00 63.69  ? 97  LEU A HD21 1 
ATOM   1515 H HD22 . LEU A 1 94  ? 18.980 42.588 48.701 0.00 63.69  ? 97  LEU A HD22 1 
ATOM   1516 H HD23 . LEU A 1 94  ? 18.846 41.005 48.665 0.00 63.69  ? 97  LEU A HD23 1 
ATOM   1517 N N    . ALA A 1 95  ? 13.723 41.648 49.805 1.00 32.97  ? 98  ALA A N    1 
ATOM   1518 C CA   . ALA A 1 95  ? 12.709 42.209 50.692 1.00 47.67  ? 98  ALA A CA   1 
ATOM   1519 C C    . ALA A 1 95  ? 12.471 41.314 51.900 1.00 55.08  ? 98  ALA A C    1 
ATOM   1520 O O    . ALA A 1 95  ? 12.275 41.807 53.017 1.00 55.67  ? 98  ALA A O    1 
ATOM   1521 C CB   . ALA A 1 95  ? 11.406 42.429 49.924 1.00 48.06  ? 98  ALA A CB   1 
ATOM   1522 H H    . ALA A 1 95  ? 13.428 41.389 49.039 0.00 39.62  ? 98  ALA A H    1 
ATOM   1523 H HA   . ALA A 1 95  ? 13.019 43.070 51.014 0.00 57.26  ? 98  ALA A HA   1 
ATOM   1524 H HB1  . ALA A 1 95  ? 10.740 42.791 50.530 0.00 57.72  ? 98  ALA A HB1  1 
ATOM   1525 H HB2  . ALA A 1 95  ? 11.568 43.054 49.200 0.00 57.72  ? 98  ALA A HB2  1 
ATOM   1526 H HB3  . ALA A 1 95  ? 11.102 41.580 49.568 0.00 57.72  ? 98  ALA A HB3  1 
ATOM   1527 N N    . LEU A 1 96  ? 12.481 39.996 51.699 1.00 38.42  ? 99  LEU A N    1 
ATOM   1528 C CA   . LEU A 1 96  ? 12.282 39.082 52.817 1.00 42.72  ? 99  LEU A CA   1 
ATOM   1529 C C    . LEU A 1 96  ? 13.502 39.054 53.727 1.00 52.51  ? 99  LEU A C    1 
ATOM   1530 O O    . LEU A 1 96  ? 13.374 38.800 54.931 1.00 44.83  ? 99  LEU A O    1 
ATOM   1531 C CB   . LEU A 1 96  ? 11.973 37.682 52.288 1.00 46.41  ? 99  LEU A CB   1 
ATOM   1532 C CG   . LEU A 1 96  ? 10.599 37.511 51.633 1.00 58.16  ? 99  LEU A CG   1 
ATOM   1533 C CD1  . LEU A 1 96  ? 10.397 36.072 51.189 1.00 60.18  ? 99  LEU A CD1  1 
ATOM   1534 C CD2  . LEU A 1 96  ? 9.468  37.949 52.556 1.00 67.48  ? 99  LEU A CD2  1 
ATOM   1535 H H    . LEU A 1 96  ? 12.599 39.613 50.937 0.00 46.16  ? 99  LEU A H    1 
ATOM   1536 H HA   . LEU A 1 96  ? 11.522 39.377 53.344 0.00 51.32  ? 99  LEU A HA   1 
ATOM   1537 H HB2  . LEU A 1 96  ? 12.641 37.454 51.623 0.00 55.74  ? 99  LEU A HB2  1 
ATOM   1538 H HB3  . LEU A 1 96  ? 12.019 37.060 53.031 0.00 55.74  ? 99  LEU A HB3  1 
ATOM   1539 H HG   . LEU A 1 96  ? 10.566 38.084 50.851 0.00 69.85  ? 99  LEU A HG   1 
ATOM   1540 H HD11 . LEU A 1 96  ? 9.601  36.021 50.636 0.00 72.26  ? 99  LEU A HD11 1 
ATOM   1541 H HD12 . LEU A 1 96  ? 11.172 35.787 50.680 0.00 72.26  ? 99  LEU A HD12 1 
ATOM   1542 H HD13 . LEU A 1 96  ? 10.291 35.511 51.973 0.00 72.26  ? 99  LEU A HD13 1 
ATOM   1543 H HD21 . LEU A 1 96  ? 8.621  37.682 52.166 0.00 81.03  ? 99  LEU A HD21 1 
ATOM   1544 H HD22 . LEU A 1 96  ? 9.583  37.523 53.420 0.00 81.03  ? 99  LEU A HD22 1 
ATOM   1545 H HD23 . LEU A 1 96  ? 9.497  38.913 52.656 0.00 81.03  ? 99  LEU A HD23 1 
ATOM   1546 N N    . LEU A 1 97  ? 14.686 39.314 53.170 1.00 49.92  ? 100 LEU A N    1 
ATOM   1547 C CA   . LEU A 1 97  ? 15.897 39.380 53.977 1.00 55.59  ? 100 LEU A CA   1 
ATOM   1548 C C    . LEU A 1 97  ? 15.820 40.489 55.019 1.00 46.08  ? 100 LEU A C    1 
ATOM   1549 O O    . LEU A 1 97  ? 16.381 40.352 56.112 1.00 55.23  ? 100 LEU A O    1 
ATOM   1550 C CB   . LEU A 1 97  ? 17.106 39.591 53.065 1.00 42.63  ? 100 LEU A CB   1 
ATOM   1551 C CG   . LEU A 1 97  ? 18.499 39.334 53.643 1.00 55.61  ? 100 LEU A CG   1 
ATOM   1552 C CD1  . LEU A 1 97  ? 18.651 37.888 54.082 1.00 64.48  ? 100 LEU A CD1  1 
ATOM   1553 C CD2  . LEU A 1 97  ? 19.561 39.700 52.615 1.00 54.87  ? 100 LEU A CD2  1 
ATOM   1554 H H    . LEU A 1 97  ? 14.812 39.455 52.331 0.00 59.95  ? 100 LEU A H    1 
ATOM   1555 H HA   . LEU A 1 97  ? 16.011 38.540 54.449 0.00 66.76  ? 100 LEU A HA   1 
ATOM   1556 H HB2  . LEU A 1 97  ? 17.007 38.998 52.304 0.00 51.21  ? 100 LEU A HB2  1 
ATOM   1557 H HB3  . LEU A 1 97  ? 17.094 40.515 52.769 0.00 51.21  ? 100 LEU A HB3  1 
ATOM   1558 H HG   . LEU A 1 97  ? 18.624 39.890 54.428 0.00 66.79  ? 100 LEU A HG   1 
ATOM   1559 H HD11 . LEU A 1 97  ? 19.582 37.720 54.298 0.00 77.42  ? 100 LEU A HD11 1 
ATOM   1560 H HD12 . LEU A 1 97  ? 18.097 37.735 54.863 0.00 77.42  ? 100 LEU A HD12 1 
ATOM   1561 H HD13 . LEU A 1 97  ? 18.370 37.307 53.358 0.00 77.42  ? 100 LEU A HD13 1 
ATOM   1562 H HD21 . LEU A 1 97  ? 20.438 39.565 53.006 0.00 65.90  ? 100 LEU A HD21 1 
ATOM   1563 H HD22 . LEU A 1 97  ? 19.455 39.133 51.836 0.00 65.90  ? 100 LEU A HD22 1 
ATOM   1564 H HD23 . LEU A 1 97  ? 19.450 40.631 52.364 0.00 65.90  ? 100 LEU A HD23 1 
ATOM   1565 N N    . VAL A 1 98  ? 15.129 41.586 54.706 1.00 48.21  ? 101 VAL A N    1 
ATOM   1566 C CA   . VAL A 1 98  ? 15.032 42.737 55.597 1.00 55.28  ? 101 VAL A CA   1 
ATOM   1567 C C    . VAL A 1 98  ? 13.671 42.842 56.261 1.00 48.02  ? 101 VAL A C    1 
ATOM   1568 O O    . VAL A 1 98  ? 13.442 43.787 57.032 1.00 59.10  ? 101 VAL A O    1 
ATOM   1569 C CB   . VAL A 1 98  ? 15.360 44.049 54.857 1.00 66.49  ? 101 VAL A CB   1 
ATOM   1570 C CG1  . VAL A 1 98  ? 16.846 44.122 54.532 1.00 77.02  ? 101 VAL A CG1  1 
ATOM   1571 C CG2  . VAL A 1 98  ? 14.509 44.201 53.599 1.00 53.65  ? 101 VAL A CG2  1 
ATOM   1572 H H    . VAL A 1 98  ? 14.700 41.686 53.967 0.00 57.90  ? 101 VAL A H    1 
ATOM   1573 H HA   . VAL A 1 98  ? 15.689 42.623 56.301 0.00 66.39  ? 101 VAL A HA   1 
ATOM   1574 H HB   . VAL A 1 98  ? 15.145 44.795 55.439 0.00 79.84  ? 101 VAL A HB   1 
ATOM   1575 H HG11 . VAL A 1 98  ? 17.034 44.971 54.102 0.00 92.47  ? 101 VAL A HG11 1 
ATOM   1576 H HG12 . VAL A 1 98  ? 17.353 44.049 55.356 0.00 92.47  ? 101 VAL A HG12 1 
ATOM   1577 H HG13 . VAL A 1 98  ? 17.075 43.391 53.937 0.00 92.47  ? 101 VAL A HG13 1 
ATOM   1578 H HG21 . VAL A 1 98  ? 14.750 45.028 53.153 0.00 64.43  ? 101 VAL A HG21 1 
ATOM   1579 H HG22 . VAL A 1 98  ? 14.677 43.447 53.012 0.00 64.43  ? 101 VAL A HG22 1 
ATOM   1580 H HG23 . VAL A 1 98  ? 13.573 44.222 53.852 0.00 64.43  ? 101 VAL A HG23 1 
ATOM   1581 N N    . ASP A 1 99  ? 12.757 41.909 55.992 1.00 51.83  ? 102 ASP A N    1 
ATOM   1582 C CA   . ASP A 1 99  ? 11.421 41.927 56.588 1.00 53.27  ? 102 ASP A CA   1 
ATOM   1583 C C    . ASP A 1 99  ? 10.647 43.172 56.162 1.00 58.26  ? 102 ASP A C    1 
ATOM   1584 O O    . ASP A 1 99  ? 10.002 43.834 56.977 1.00 50.78  ? 102 ASP A O    1 
ATOM   1585 C CB   . ASP A 1 99  ? 11.501 41.841 58.113 1.00 61.89  ? 102 ASP A CB   1 
ATOM   1586 C CG   . ASP A 1 99  ? 10.201 41.382 58.744 1.00 68.15  ? 102 ASP A CG   1 
ATOM   1587 O OD1  . ASP A 1 99  ? 9.431  40.659 58.077 1.00 87.78  ? 102 ASP A OD1  1 
ATOM   1588 O OD2  . ASP A 1 99  ? 9.951  41.743 59.913 1.00 91.34  ? 102 ASP A OD2  1 
ATOM   1589 H H    . ASP A 1 99  ? 12.889 41.246 55.460 0.00 62.25  ? 102 ASP A H    1 
ATOM   1590 H HA   . ASP A 1 99  ? 10.932 41.153 56.268 0.00 63.98  ? 102 ASP A HA   1 
ATOM   1591 H HB2  . ASP A 1 99  ? 12.193 41.207 58.358 0.00 74.32  ? 102 ASP A HB2  1 
ATOM   1592 H HB3  . ASP A 1 99  ? 11.713 42.718 58.468 0.00 74.32  ? 102 ASP A HB3  1 
ATOM   1593 N N    . ALA A 1 100 ? 10.716 43.493 54.873 1.00 58.74  ? 103 ALA A N    1 
ATOM   1594 C CA   . ALA A 1 100 ? 10.029 44.669 54.362 1.00 53.65  ? 103 ALA A CA   1 
ATOM   1595 C C    . ALA A 1 100 ? 8.526  44.557 54.594 1.00 47.26  ? 103 ALA A C    1 
ATOM   1596 O O    . ALA A 1 100 ? 7.967  43.461 54.689 1.00 51.66  ? 103 ALA A O    1 
ATOM   1597 C CB   . ALA A 1 100 ? 10.318 44.845 52.872 1.00 53.12  ? 103 ALA A CB   1 
ATOM   1598 H H    . ALA A 1 100 ? 11.151 43.049 54.280 0.00 70.54  ? 103 ALA A H    1 
ATOM   1599 H HA   . ALA A 1 100 ? 10.349 45.458 54.828 0.00 64.44  ? 103 ALA A HA   1 
ATOM   1600 H HB1  . ALA A 1 100 ? 9.853  45.634 52.551 0.00 63.79  ? 103 ALA A HB1  1 
ATOM   1601 H HB2  . ALA A 1 100 ? 11.274 44.951 52.746 0.00 63.79  ? 103 ALA A HB2  1 
ATOM   1602 H HB3  . ALA A 1 100 ? 10.006 44.060 52.395 0.00 63.79  ? 103 ALA A HB3  1 
ATOM   1603 N N    . ASP A 1 101 ? 7.873  45.712 54.688 1.00 49.02  ? 104 ASP A N    1 
ATOM   1604 C CA   . ASP A 1 101 ? 6.433  45.757 54.872 1.00 66.00  ? 104 ASP A CA   1 
ATOM   1605 C C    . ASP A 1 101 ? 5.714  45.430 53.564 1.00 57.67  ? 104 ASP A C    1 
ATOM   1606 O O    . ASP A 1 101 ? 6.260  45.581 52.468 1.00 57.31  ? 104 ASP A O    1 
ATOM   1607 C CB   . ASP A 1 101 ? 6.003  47.131 55.387 1.00 58.89  ? 104 ASP A CB   1 
ATOM   1608 C CG   . ASP A 1 101 ? 6.196  48.227 54.358 1.00 66.61  ? 104 ASP A CG   1 
ATOM   1609 O OD1  . ASP A 1 101 ? 7.316  48.774 54.274 1.00 78.78  ? 104 ASP A OD1  1 
ATOM   1610 O OD2  . ASP A 1 101 ? 5.229  48.541 53.633 1.00 77.99  ? 104 ASP A OD2  1 
ATOM   1611 H H    . ASP A 1 101 ? 8.246  46.486 54.648 0.00 58.88  ? 104 ASP A H    1 
ATOM   1612 H HA   . ASP A 1 101 ? 6.168  45.096 55.530 0.00 79.26  ? 104 ASP A HA   1 
ATOM   1613 H HB2  . ASP A 1 101 ? 5.063  47.102 55.621 1.00 70.72  ? 104 ASP A HB2  1 
ATOM   1614 H HB3  . ASP A 1 101 ? 6.533  47.356 56.168 1.00 70.72  ? 104 ASP A HB3  1 
ATOM   1615 N N    . GLN A 1 102 ? 4.461  44.987 53.697 1.00 54.53  ? 105 GLN A N    1 
ATOM   1616 C CA   . GLN A 1 102 ? 3.728  44.478 52.540 1.00 51.97  ? 105 GLN A CA   1 
ATOM   1617 C C    . GLN A 1 102 ? 3.528  45.557 51.483 1.00 59.46  ? 105 GLN A C    1 
ATOM   1618 O O    . GLN A 1 102 ? 3.653  45.289 50.283 1.00 56.21  ? 105 GLN A O    1 
ATOM   1619 C CB   . GLN A 1 102 ? 2.379  43.903 52.979 1.00 64.46  ? 105 GLN A CB   1 
ATOM   1620 C CG   . GLN A 1 102 ? 2.469  42.791 54.020 1.00 74.97  ? 105 GLN A CG   1 
ATOM   1621 C CD   . GLN A 1 102 ? 2.579  43.308 55.442 1.00 98.59  ? 105 GLN A CD   1 
ATOM   1622 O OE1  . GLN A 1 102 ? 3.263  44.296 55.706 1.00 86.10  ? 105 GLN A OE1  1 
ATOM   1623 N NE2  . GLN A 1 102 ? 1.905  42.635 56.368 1.00 117.08 ? 105 GLN A NE2  1 
ATOM   1624 H H    . GLN A 1 102 ? 4.021  44.971 54.435 0.00 65.48  ? 105 GLN A H    1 
ATOM   1625 H HA   . GLN A 1 102 ? 4.246  43.761 52.142 0.00 62.41  ? 105 GLN A HA   1 
ATOM   1626 H HB2  . GLN A 1 102 ? 1.849  44.619 53.363 0.00 77.40  ? 105 GLN A HB2  1 
ATOM   1627 H HB3  . GLN A 1 102 ? 1.931  43.539 52.200 0.00 77.40  ? 105 GLN A HB3  1 
ATOM   1628 H HG2  . GLN A 1 102 ? 1.672  42.242 53.963 0.00 90.01  ? 105 GLN A HG2  1 
ATOM   1629 H HG3  . GLN A 1 102 ? 3.256  42.253 53.837 0.00 90.01  ? 105 GLN A HG3  1 
ATOM   1630 H HE21 . GLN A 1 102 ? 1.439  41.947 56.146 0.00 140.55 ? 105 GLN A HE21 1 
ATOM   1631 H HE22 . GLN A 1 102 ? 1.934  42.888 57.190 0.00 140.55 ? 105 GLN A HE22 1 
ATOM   1632 N N    . GLY A 1 103 ? 3.210  46.782 51.904 1.00 45.87  ? 106 GLY A N    1 
ATOM   1633 C CA   . GLY A 1 103 ? 3.014  47.850 50.938 1.00 38.26  ? 106 GLY A CA   1 
ATOM   1634 C C    . GLY A 1 103 ? 4.252  48.113 50.103 1.00 48.44  ? 106 GLY A C    1 
ATOM   1635 O O    . GLY A 1 103 ? 4.157  48.413 48.910 1.00 48.98  ? 106 GLY A O    1 
ATOM   1636 H H    . GLY A 1 103 ? 3.104  47.012 52.726 0.00 55.09  ? 106 GLY A H    1 
ATOM   1637 H HA2  . GLY A 1 103 ? 2.288  47.613 50.340 0.00 45.97  ? 106 GLY A HA2  1 
ATOM   1638 H HA3  . GLY A 1 103 ? 2.783  48.668 51.406 0.00 45.97  ? 106 GLY A HA3  1 
ATOM   1639 N N    . THR A 1 104 ? 5.432  48.000 50.717 1.00 45.49  ? 107 THR A N    1 
ATOM   1640 C CA   . THR A 1 104 ? 6.672  48.246 49.989 1.00 49.93  ? 107 THR A CA   1 
ATOM   1641 C C    . THR A 1 104 ? 6.934  47.146 48.968 1.00 42.92  ? 107 THR A C    1 
ATOM   1642 O O    . THR A 1 104 ? 7.364  47.424 47.842 1.00 43.16  ? 107 THR A O    1 
ATOM   1643 C CB   . THR A 1 104 ? 7.837  48.353 50.973 1.00 54.27  ? 107 THR A CB   1 
ATOM   1644 O OG1  . THR A 1 104 ? 7.665  49.513 51.796 1.00 54.33  ? 107 THR A OG1  1 
ATOM   1645 C CG2  . THR A 1 104 ? 9.167  48.467 50.241 1.00 65.67  ? 107 THR A CG2  1 
ATOM   1646 H H    . THR A 1 104 ? 5.538  47.786 51.543 0.00 54.64  ? 107 THR A H    1 
ATOM   1647 H HA   . THR A 1 104 ? 6.599  49.088 49.513 0.00 59.97  ? 107 THR A HA   1 
ATOM   1648 H HB   . THR A 1 104 ? 7.858  47.554 51.523 0.00 65.18  ? 107 THR A HB   1 
ATOM   1649 H HG1  . THR A 1 104 ? 8.299  49.574 52.344 0.00 65.25  ? 107 THR A HG1  1 
ATOM   1650 H HG21 . THR A 1 104 ? 9.890  48.566 50.880 0.00 78.85  ? 107 THR A HG21 1 
ATOM   1651 H HG22 . THR A 1 104 ? 9.322  47.671 49.710 0.00 78.85  ? 107 THR A HG22 1 
ATOM   1652 H HG23 . THR A 1 104 ? 9.158  49.240 49.655 0.00 78.85  ? 107 THR A HG23 1 
ATOM   1653 N N    . ILE A 1 105 ? 6.684  45.892 49.345 1.00 42.73  ? 108 ILE A N    1 
ATOM   1654 C CA   . ILE A 1 105 ? 6.901  44.778 48.426 1.00 49.39  ? 108 ILE A CA   1 
ATOM   1655 C C    . ILE A 1 105 ? 5.996  44.912 47.210 1.00 49.24  ? 108 ILE A C    1 
ATOM   1656 O O    . ILE A 1 105 ? 6.409  44.638 46.076 1.00 52.75  ? 108 ILE A O    1 
ATOM   1657 C CB   . ILE A 1 105 ? 6.681  43.438 49.154 1.00 52.28  ? 108 ILE A CB   1 
ATOM   1658 C CG1  . ILE A 1 105 ? 7.539  43.374 50.424 1.00 62.03  ? 108 ILE A CG1  1 
ATOM   1659 C CG2  . ILE A 1 105 ? 6.992  42.265 48.228 1.00 53.17  ? 108 ILE A CG2  1 
ATOM   1660 C CD1  . ILE A 1 105 ? 7.168  42.257 51.358 1.00 48.79  ? 108 ILE A CD1  1 
ATOM   1661 H H    . ILE A 1 105 ? 6.390  45.662 50.120 0.00 51.33  ? 108 ILE A H    1 
ATOM   1662 H HA   . ILE A 1 105 ? 7.820  44.804 48.118 0.00 59.32  ? 108 ILE A HA   1 
ATOM   1663 H HB   . ILE A 1 105 ? 5.748  43.379 49.412 0.00 62.78  ? 108 ILE A HB   1 
ATOM   1664 H HG12 . ILE A 1 105 ? 8.466  43.249 50.168 0.00 74.49  ? 108 ILE A HG12 1 
ATOM   1665 H HG13 . ILE A 1 105 ? 7.439  44.209 50.909 0.00 74.49  ? 108 ILE A HG13 1 
ATOM   1666 H HG21 . ILE A 1 105 ? 6.828  41.435 48.704 0.00 63.86  ? 108 ILE A HG21 1 
ATOM   1667 H HG22 . ILE A 1 105 ? 6.418  42.318 47.448 0.00 63.86  ? 108 ILE A HG22 1 
ATOM   1668 H HG23 . ILE A 1 105 ? 7.922  42.314 47.958 0.00 63.86  ? 108 ILE A HG23 1 
ATOM   1669 H HD11 . ILE A 1 105 ? 7.765  42.273 52.122 0.00 58.60  ? 108 ILE A HD11 1 
ATOM   1670 H HD12 . ILE A 1 105 ? 6.252  42.381 51.651 0.00 58.60  ? 108 ILE A HD12 1 
ATOM   1671 H HD13 . ILE A 1 105 ? 7.254  41.412 50.889 0.00 58.60  ? 108 ILE A HD13 1 
ATOM   1672 N N    . LEU A 1 106 ? 4.749  45.335 47.423 1.00 36.40  ? 109 LEU A N    1 
ATOM   1673 C CA   . LEU A 1 106 ? 3.840  45.532 46.300 1.00 44.71  ? 109 LEU A CA   1 
ATOM   1674 C C    . LEU A 1 106 ? 4.326  46.655 45.393 1.00 44.23  ? 109 LEU A C    1 
ATOM   1675 O O    . LEU A 1 106 ? 4.238  46.550 44.164 1.00 43.01  ? 109 LEU A O    1 
ATOM   1676 C CB   . LEU A 1 106 ? 2.431  45.829 46.815 1.00 59.23  ? 109 LEU A CB   1 
ATOM   1677 C CG   . LEU A 1 106 ? 1.295  45.824 45.786 1.00 74.59  ? 109 LEU A CG   1 
ATOM   1678 C CD1  . LEU A 1 106 ? 1.409  44.652 44.820 1.00 63.13  ? 109 LEU A CD1  1 
ATOM   1679 C CD2  . LEU A 1 106 ? -0.055 45.807 46.486 1.00 85.84  ? 109 LEU A CD2  1 
ATOM   1680 H H    . LEU A 1 106 ? 4.412  45.512 48.194 1.00 43.74  ? 109 LEU A H    1 
ATOM   1681 H HA   . LEU A 1 106 ? 3.803  44.716 45.777 1.00 53.71  ? 109 LEU A HA   1 
ATOM   1682 H HB2  . LEU A 1 106 ? 2.211  45.160 47.482 1.00 71.13  ? 109 LEU A HB2  1 
ATOM   1683 H HB3  . LEU A 1 106 ? 2.441  46.711 47.219 1.00 71.13  ? 109 LEU A HB3  1 
ATOM   1684 H HG   . LEU A 1 106 ? 1.362  46.635 45.259 1.00 89.57  ? 109 LEU A HG   1 
ATOM   1685 H HD11 . LEU A 1 106 ? 0.610  44.616 44.272 1.00 75.81  ? 109 LEU A HD11 1 
ATOM   1686 H HD12 . LEU A 1 106 ? 2.190  44.780 44.258 1.00 75.81  ? 109 LEU A HD12 1 
ATOM   1687 H HD13 . LEU A 1 106 ? 1.499  43.831 45.328 1.00 75.81  ? 109 LEU A HD13 1 
ATOM   1688 H HD21 . LEU A 1 106 ? -0.757 45.792 45.817 1.00 103.06 ? 109 LEU A HD21 1 
ATOM   1689 H HD22 . LEU A 1 106 ? -0.112 45.016 47.044 1.00 103.06 ? 109 LEU A HD22 1 
ATOM   1690 H HD23 . LEU A 1 106 ? -0.136 46.604 47.033 1.00 103.06 ? 109 LEU A HD23 1 
ATOM   1691 N N    . ALA A 1 107 ? 4.840  47.737 45.981 1.00 45.68  ? 110 ALA A N    1 
ATOM   1692 C CA   . ALA A 1 107 ? 5.387  48.825 45.178 1.00 47.19  ? 110 ALA A CA   1 
ATOM   1693 C C    . ALA A 1 107 ? 6.566  48.351 44.338 1.00 33.69  ? 110 ALA A C    1 
ATOM   1694 O O    . ALA A 1 107 ? 6.706  48.740 43.173 1.00 44.00  ? 110 ALA A O    1 
ATOM   1695 C CB   . ALA A 1 107 ? 5.808  49.980 46.085 1.00 52.02  ? 110 ALA A CB   1 
ATOM   1696 H H    . ALA A 1 107 ? 4.883  47.863 46.831 0.00 54.86  ? 110 ALA A H    1 
ATOM   1697 H HA   . ALA A 1 107 ? 4.699  49.148 44.575 0.00 56.68  ? 110 ALA A HA   1 
ATOM   1698 H HB1  . ALA A 1 107 ? 6.230  50.667 45.547 0.00 62.47  ? 110 ALA A HB1  1 
ATOM   1699 H HB2  . ALA A 1 107 ? 5.021  50.339 46.524 0.00 62.47  ? 110 ALA A HB2  1 
ATOM   1700 H HB3  . ALA A 1 107 ? 6.434  49.649 46.748 0.00 62.47  ? 110 ALA A HB3  1 
ATOM   1701 N N    . LEU A 1 108 ? 7.427  47.508 44.913 1.00 37.42  ? 111 LEU A N    1 
ATOM   1702 C CA   . LEU A 1 108 ? 8.600  47.035 44.185 1.00 35.16  ? 111 LEU A CA   1 
ATOM   1703 C C    . LEU A 1 108 ? 8.202  46.089 43.060 1.00 49.70  ? 111 LEU A C    1 
ATOM   1704 O O    . LEU A 1 108 ? 8.663  46.233 41.921 1.00 41.71  ? 111 LEU A O    1 
ATOM   1705 C CB   . LEU A 1 108 ? 9.566  46.342 45.148 1.00 39.38  ? 111 LEU A CB   1 
ATOM   1706 C CG   . LEU A 1 108 ? 10.557 47.229 45.903 1.00 52.60  ? 111 LEU A CG   1 
ATOM   1707 C CD1  . LEU A 1 108 ? 11.312 46.404 46.933 1.00 53.27  ? 111 LEU A CD1  1 
ATOM   1708 C CD2  . LEU A 1 108 ? 11.525 47.899 44.942 1.00 50.23  ? 111 LEU A CD2  1 
ATOM   1709 H H    . LEU A 1 108 ? 7.354  47.201 45.713 0.00 44.96  ? 111 LEU A H    1 
ATOM   1710 H HA   . LEU A 1 108 ? 9.054  47.798 43.794 0.00 42.25  ? 111 LEU A HA   1 
ATOM   1711 H HB2  . LEU A 1 108 ? 9.038  45.876 45.815 0.00 47.31  ? 111 LEU A HB2  1 
ATOM   1712 H HB3  . LEU A 1 108 ? 10.090 45.706 44.636 0.00 47.31  ? 111 LEU A HB3  1 
ATOM   1713 H HG   . LEU A 1 108 ? 10.069 47.929 46.365 0.00 63.17  ? 111 LEU A HG   1 
ATOM   1714 H HD11 . LEU A 1 108 ? 11.949 46.975 47.390 0.00 63.98  ? 111 LEU A HD11 1 
ATOM   1715 H HD12 . LEU A 1 108 ? 10.679 46.039 47.571 0.00 63.98  ? 111 LEU A HD12 1 
ATOM   1716 H HD13 . LEU A 1 108 ? 11.779 45.684 46.481 0.00 63.98  ? 111 LEU A HD13 1 
ATOM   1717 H HD21 . LEU A 1 108 ? 12.229 48.329 45.452 0.00 60.32  ? 111 LEU A HD21 1 
ATOM   1718 H HD22 . LEU A 1 108 ? 11.905 47.225 44.357 0.00 60.32  ? 111 LEU A HD22 1 
ATOM   1719 H HD23 . LEU A 1 108 ? 11.044 48.559 44.418 0.00 60.32  ? 111 LEU A HD23 1 
ATOM   1720 N N    . VAL A 1 109 ? 7.347  45.110 43.362 1.00 44.50  ? 112 VAL A N    1 
ATOM   1721 C CA   . VAL A 1 109 ? 6.934  44.148 42.344 1.00 44.51  ? 112 VAL A CA   1 
ATOM   1722 C C    . VAL A 1 109 ? 6.134  44.844 41.251 1.00 39.33  ? 112 VAL A C    1 
ATOM   1723 O O    . VAL A 1 109 ? 6.254  44.511 40.065 1.00 40.02  ? 112 VAL A O    1 
ATOM   1724 C CB   . VAL A 1 109 ? 6.131  43.005 42.990 1.00 34.18  ? 112 VAL A CB   1 
ATOM   1725 C CG1  . VAL A 1 109 ? 5.473  42.150 41.918 1.00 50.02  ? 112 VAL A CG1  1 
ATOM   1726 C CG2  . VAL A 1 109 ? 7.031  42.166 43.888 1.00 34.30  ? 112 VAL A CG2  1 
ATOM   1727 H H    . VAL A 1 109 ? 6.998  44.983 44.137 0.00 53.45  ? 112 VAL A H    1 
ATOM   1728 H HA   . VAL A 1 109 ? 7.728  43.767 41.938 0.00 53.47  ? 112 VAL A HA   1 
ATOM   1729 H HB   . VAL A 1 109 ? 5.427  43.379 43.543 0.00 41.07  ? 112 VAL A HB   1 
ATOM   1730 H HG11 . VAL A 1 109 ? 5.190  41.310 42.312 0.00 60.07  ? 112 VAL A HG11 1 
ATOM   1731 H HG12 . VAL A 1 109 ? 4.704  42.625 41.563 0.00 60.07  ? 112 VAL A HG12 1 
ATOM   1732 H HG13 . VAL A 1 109 ? 6.114  41.984 41.209 0.00 60.07  ? 112 VAL A HG13 1 
ATOM   1733 H HG21 . VAL A 1 109 ? 6.488  41.519 44.365 0.00 41.21  ? 112 VAL A HG21 1 
ATOM   1734 H HG22 . VAL A 1 109 ? 7.686  41.708 43.339 0.00 41.21  ? 112 VAL A HG22 1 
ATOM   1735 H HG23 . VAL A 1 109 ? 7.479  42.750 44.520 0.00 41.21  ? 112 VAL A HG23 1 
ATOM   1736 N N    . GLY A 1 110 ? 5.306  45.820 41.630 1.00 35.60  ? 113 GLY A N    1 
ATOM   1737 C CA   . GLY A 1 110 ? 4.501  46.516 40.640 1.00 31.26  ? 113 GLY A CA   1 
ATOM   1738 C C    . GLY A 1 110 ? 5.334  47.394 39.726 1.00 51.00  ? 113 GLY A C    1 
ATOM   1739 O O    . GLY A 1 110 ? 5.105  47.435 38.514 1.00 40.71  ? 113 GLY A O    1 
ATOM   1740 H H    . GLY A 1 110 ? 5.197  46.090 42.439 0.00 42.77  ? 113 GLY A H    1 
ATOM   1741 H HA2  . GLY A 1 110 ? 4.033  45.865 40.094 0.00 37.57  ? 113 GLY A HA2  1 
ATOM   1742 H HA3  . GLY A 1 110 ? 3.851  47.076 41.092 0.00 37.57  ? 113 GLY A HA3  1 
ATOM   1743 N N    . ALA A 1 111 ? 6.307  48.113 40.291 1.00 39.13  ? 114 ALA A N    1 
ATOM   1744 C CA   . ALA A 1 111 ? 7.218  48.888 39.457 1.00 35.29  ? 114 ALA A CA   1 
ATOM   1745 C C    . ALA A 1 111 ? 8.104  47.976 38.621 1.00 44.44  ? 114 ALA A C    1 
ATOM   1746 O O    . ALA A 1 111 ? 8.472  48.329 37.495 1.00 35.56  ? 114 ALA A O    1 
ATOM   1747 C CB   . ALA A 1 111 ? 8.072  49.809 40.325 1.00 38.51  ? 114 ALA A CB   1 
ATOM   1748 H H    . ALA A 1 111 ? 6.456  48.166 41.136 0.00 47.01  ? 114 ALA A H    1 
ATOM   1749 H HA   . ALA A 1 111 ? 6.699  49.445 38.855 0.00 42.40  ? 114 ALA A HA   1 
ATOM   1750 H HB1  . ALA A 1 111 ? 8.662  50.325 39.753 0.00 46.27  ? 114 ALA A HB1  1 
ATOM   1751 H HB2  . ALA A 1 111 ? 7.489  50.405 40.822 0.00 46.27  ? 114 ALA A HB2  1 
ATOM   1752 H HB3  . ALA A 1 111 ? 8.595  49.270 40.939 0.00 46.27  ? 114 ALA A HB3  1 
ATOM   1753 N N    . ASP A 1 112 ? 8.455  46.805 39.157 1.00 33.73  ? 115 ASP A N    1 
ATOM   1754 C CA   . ASP A 1 112 ? 9.224  45.835 38.385 1.00 34.53  ? 115 ASP A CA   1 
ATOM   1755 C C    . ASP A 1 112 ? 8.440  45.358 37.167 1.00 46.20  ? 115 ASP A C    1 
ATOM   1756 O O    . ASP A 1 112 ? 9.002  45.218 36.074 1.00 42.75  ? 115 ASP A O    1 
ATOM   1757 C CB   . ASP A 1 112 ? 9.605  44.653 39.277 1.00 31.81  ? 115 ASP A CB   1 
ATOM   1758 C CG   . ASP A 1 112 ? 10.615 43.729 38.625 1.00 39.36  ? 115 ASP A CG   1 
ATOM   1759 O OD1  . ASP A 1 112 ? 10.208 42.880 37.805 1.00 42.61  ? 115 ASP A OD1  1 
ATOM   1760 O OD2  . ASP A 1 112 ? 11.817 43.847 38.940 1.00 46.41  ? 115 ASP A OD2  1 
ATOM   1761 H H    . ASP A 1 112 ? 8.263  46.552 39.956 0.00 40.53  ? 115 ASP A H    1 
ATOM   1762 H HA   . ASP A 1 112 ? 10.040 46.253 38.070 0.00 41.48  ? 115 ASP A HA   1 
ATOM   1763 H HB2  . ASP A 1 112 ? 9.994  44.990 40.099 0.00 38.22  ? 115 ASP A HB2  1 
ATOM   1764 H HB3  . ASP A 1 112 ? 8.809  44.136 39.474 0.00 38.22  ? 115 ASP A HB3  1 
ATOM   1765 N N    . GLY A 1 113 ? 7.140  45.107 37.335 1.00 36.88  ? 116 GLY A N    1 
ATOM   1766 C CA   . GLY A 1 113 ? 6.328  44.676 36.209 1.00 32.29  ? 116 GLY A CA   1 
ATOM   1767 C C    . GLY A 1 113 ? 6.195  45.745 35.141 1.00 42.96  ? 116 GLY A C    1 
ATOM   1768 O O    . GLY A 1 113 ? 6.214  45.444 33.944 1.00 40.84  ? 116 GLY A O    1 
ATOM   1769 H H    . GLY A 1 113 ? 6.715  45.178 38.079 0.00 44.30  ? 116 GLY A H    1 
ATOM   1770 H HA2  . GLY A 1 113 ? 6.732  43.891 35.805 0.00 38.80  ? 116 GLY A HA2  1 
ATOM   1771 H HA3  . GLY A 1 113 ? 5.440  44.447 36.523 0.00 38.80  ? 116 GLY A HA3  1 
ATOM   1772 N N    . ILE A 1 114 ? 6.047  47.005 35.555 1.00 41.36  ? 117 ILE A N    1 
ATOM   1773 C CA   . ILE A 1 114 ? 6.042  48.107 34.596 1.00 35.75  ? 117 ILE A CA   1 
ATOM   1774 C C    . ILE A 1 114 ? 7.365  48.156 33.845 1.00 33.65  ? 117 ILE A C    1 
ATOM   1775 O O    . ILE A 1 114 ? 7.400  48.375 32.628 1.00 40.59  ? 117 ILE A O    1 
ATOM   1776 C CB   . ILE A 1 114 ? 5.753  49.439 35.318 1.00 53.56  ? 117 ILE A CB   1 
ATOM   1777 C CG1  . ILE A 1 114 ? 4.345  49.462 35.928 1.00 47.54  ? 117 ILE A CG1  1 
ATOM   1778 C CG2  . ILE A 1 114 ? 5.896  50.612 34.360 1.00 44.18  ? 117 ILE A CG2  1 
ATOM   1779 C CD1  . ILE A 1 114 ? 3.217  49.152 34.960 1.00 49.21  ? 117 ILE A CD1  1 
ATOM   1780 H H    . ILE A 1 114 ? 5.950  47.245 36.375 0.00 49.69  ? 117 ILE A H    1 
ATOM   1781 H HA   . ILE A 1 114 ? 5.333  47.955 33.951 0.00 42.95  ? 117 ILE A HA   1 
ATOM   1782 H HB   . ILE A 1 114 ? 6.403  49.515 36.034 0.00 64.33  ? 117 ILE A HB   1 
ATOM   1783 H HG12 . ILE A 1 114 ? 4.308  48.802 36.638 0.00 57.10  ? 117 ILE A HG12 1 
ATOM   1784 H HG13 . ILE A 1 114 ? 4.182  50.347 36.289 0.00 57.10  ? 117 ILE A HG13 1 
ATOM   1785 H HG21 . ILE A 1 114 ? 5.581  51.418 34.798 0.00 53.07  ? 117 ILE A HG21 1 
ATOM   1786 H HG22 . ILE A 1 114 ? 6.831  50.711 34.119 0.00 53.07  ? 117 ILE A HG22 1 
ATOM   1787 H HG23 . ILE A 1 114 ? 5.367  50.438 33.566 0.00 53.07  ? 117 ILE A HG23 1 
ATOM   1788 H HD11 . ILE A 1 114 ? 2.386  49.082 35.456 0.00 59.10  ? 117 ILE A HD11 1 
ATOM   1789 H HD12 . ILE A 1 114 ? 3.154  49.867 34.309 0.00 59.10  ? 117 ILE A HD12 1 
ATOM   1790 H HD13 . ILE A 1 114 ? 3.406  48.312 34.513 0.00 59.10  ? 117 ILE A HD13 1 
ATOM   1791 N N    . MET A 1 115 ? 8.474  47.952 34.560 1.00 32.97  ? 118 MET A N    1 
ATOM   1792 C CA   . MET A 1 115 ? 9.791  48.001 33.934 1.00 33.90  ? 118 MET A CA   1 
ATOM   1793 C C    . MET A 1 115 ? 9.906  46.985 32.804 1.00 44.29  ? 118 MET A C    1 
ATOM   1794 O O    . MET A 1 115 ? 10.319 47.324 31.688 1.00 36.17  ? 118 MET A O    1 
ATOM   1795 C CB   . MET A 1 115 ? 10.870 47.743 34.984 1.00 33.35  ? 118 MET A CB   1 
ATOM   1796 C CG   . MET A 1 115 ? 12.204 47.329 34.390 1.00 42.44  ? 118 MET A CG   1 
ATOM   1797 S SD   . MET A 1 115 ? 13.601 47.669 35.470 1.00 44.47  ? 118 MET A SD   1 
ATOM   1798 C CE   . MET A 1 115 ? 13.511 46.268 36.577 1.00 48.53  ? 118 MET A CE   1 
ATOM   1799 H H    . MET A 1 115 ? 8.489  47.784 35.403 0.00 39.61  ? 118 MET A H    1 
ATOM   1800 H HA   . MET A 1 115 ? 9.922  48.890 33.570 0.00 40.73  ? 118 MET A HA   1 
ATOM   1801 H HB2  . MET A 1 115 ? 11.011 48.556 35.494 0.00 40.07  ? 118 MET A HB2  1 
ATOM   1802 H HB3  . MET A 1 115 ? 10.571 47.031 35.571 0.00 40.07  ? 118 MET A HB3  1 
ATOM   1803 H HG2  . MET A 1 115 ? 12.188 46.375 34.217 0.00 50.98  ? 118 MET A HG2  1 
ATOM   1804 H HG3  . MET A 1 115 ? 12.344 47.814 33.562 0.00 50.98  ? 118 MET A HG3  1 
ATOM   1805 H HE1  . MET A 1 115 ? 14.229 46.331 37.225 0.00 58.28  ? 118 MET A HE1  1 
ATOM   1806 H HE2  . MET A 1 115 ? 12.654 46.278 37.030 0.00 58.28  ? 118 MET A HE2  1 
ATOM   1807 H HE3  . MET A 1 115 ? 13.602 45.451 36.061 0.00 58.28  ? 118 MET A HE3  1 
ATOM   1808 N N    . ILE A 1 116 ? 9.563  45.728 33.082 1.00 40.15  ? 119 ILE A N    1 
ATOM   1809 C CA   . ILE A 1 116 ? 9.718  44.679 32.081 1.00 38.44  ? 119 ILE A CA   1 
ATOM   1810 C C    . ILE A 1 116 ? 8.628  44.783 31.025 1.00 40.15  ? 119 ILE A C    1 
ATOM   1811 O O    . ILE A 1 116 ? 8.867  44.520 29.841 1.00 37.31  ? 119 ILE A O    1 
ATOM   1812 C CB   . ILE A 1 116 ? 9.715  43.297 32.761 1.00 47.01  ? 119 ILE A CB   1 
ATOM   1813 C CG1  . ILE A 1 116 ? 10.868 43.178 33.765 1.00 43.41  ? 119 ILE A CG1  1 
ATOM   1814 C CG2  . ILE A 1 116 ? 9.810  42.193 31.719 1.00 41.49  ? 119 ILE A CG2  1 
ATOM   1815 C CD1  . ILE A 1 116 ? 12.241 43.472 33.189 1.00 33.57  ? 119 ILE A CD1  1 
ATOM   1816 H H    . ILE A 1 116 ? 9.241  45.460 33.833 0.00 48.23  ? 119 ILE A H    1 
ATOM   1817 H HA   . ILE A 1 116 ? 10.574 44.795 31.639 0.00 46.18  ? 119 ILE A HA   1 
ATOM   1818 H HB   . ILE A 1 116 ? 8.879  43.205 33.245 0.00 56.46  ? 119 ILE A HB   1 
ATOM   1819 H HG12 . ILE A 1 116 ? 10.714 43.805 34.488 0.00 52.14  ? 119 ILE A HG12 1 
ATOM   1820 H HG13 . ILE A 1 116 ? 10.885 42.271 34.109 0.00 52.14  ? 119 ILE A HG13 1 
ATOM   1821 H HG21 . ILE A 1 116 ? 10.028 41.359 32.162 0.00 49.84  ? 119 ILE A HG21 1 
ATOM   1822 H HG22 . ILE A 1 116 ? 8.956  42.114 31.265 0.00 49.84  ? 119 ILE A HG22 1 
ATOM   1823 H HG23 . ILE A 1 116 ? 10.504 42.421 31.081 0.00 49.84  ? 119 ILE A HG23 1 
ATOM   1824 H HD11 . ILE A 1 116 ? 12.917 43.206 33.831 0.00 40.33  ? 119 ILE A HD11 1 
ATOM   1825 H HD12 . ILE A 1 116 ? 12.352 42.972 32.365 0.00 40.33  ? 119 ILE A HD12 1 
ATOM   1826 H HD13 . ILE A 1 116 ? 12.311 44.423 33.010 0.00 40.33  ? 119 ILE A HD13 1 
ATOM   1827 N N    . GLY A 1 117 ? 7.419  45.174 31.433 1.00 35.86  ? 120 GLY A N    1 
ATOM   1828 C CA   . GLY A 1 117 ? 6.317  45.243 30.490 1.00 45.87  ? 120 GLY A CA   1 
ATOM   1829 C C    . GLY A 1 117 ? 6.491  46.329 29.445 1.00 46.46  ? 120 GLY A C    1 
ATOM   1830 O O    . GLY A 1 117 ? 6.167  46.128 28.271 1.00 37.12  ? 120 GLY A O    1 
ATOM   1831 H H    . GLY A 1 117 ? 7.219  45.400 32.238 0.00 43.09  ? 120 GLY A H    1 
ATOM   1832 H HA2  . GLY A 1 117 ? 6.237  44.392 30.031 0.00 55.09  ? 120 GLY A HA2  1 
ATOM   1833 H HA3  . GLY A 1 117 ? 5.495  45.418 30.974 0.00 55.09  ? 120 GLY A HA3  1 
ATOM   1834 N N    . THR A 1 118 ? 6.996  47.498 29.850 1.00 31.75  ? 121 THR A N    1 
ATOM   1835 C CA   . THR A 1 118 ? 7.249  48.550 28.870 1.00 38.44  ? 121 THR A CA   1 
ATOM   1836 C C    . THR A 1 118 ? 8.489  48.246 28.039 1.00 51.86  ? 121 THR A C    1 
ATOM   1837 O O    . THR A 1 118 ? 8.589  48.696 26.892 1.00 38.68  ? 121 THR A O    1 
ATOM   1838 C CB   . THR A 1 118 ? 7.394  49.909 29.559 1.00 37.14  ? 121 THR A CB   1 
ATOM   1839 O OG1  . THR A 1 118 ? 8.433  49.854 30.545 1.00 38.64  ? 121 THR A OG1  1 
ATOM   1840 C CG2  . THR A 1 118 ? 6.078  50.327 30.209 1.00 37.07  ? 121 THR A CG2  1 
ATOM   1841 H H    . THR A 1 118 ? 7.194  47.699 30.663 0.00 38.16  ? 121 THR A H    1 
ATOM   1842 H HA   . THR A 1 118 ? 6.486  48.604 28.275 0.00 46.18  ? 121 THR A HA   1 
ATOM   1843 H HB   . THR A 1 118 ? 7.627  50.580 28.898 0.00 44.62  ? 121 THR A HB   1 
ATOM   1844 H HG1  . THR A 1 118 ? 8.248  49.275 31.124 0.00 46.42  ? 121 THR A HG1  1 
ATOM   1845 H HG21 . THR A 1 118 ? 6.183  51.186 30.648 0.00 44.53  ? 121 THR A HG21 1 
ATOM   1846 H HG22 . THR A 1 118 ? 5.383  50.400 29.536 0.00 44.53  ? 121 THR A HG22 1 
ATOM   1847 H HG23 . THR A 1 118 ? 5.809  49.667 30.868 0.00 44.53  ? 121 THR A HG23 1 
ATOM   1848 N N    . GLY A 1 119 ? 9.438  47.490 28.594 1.00 34.46  ? 122 GLY A N    1 
ATOM   1849 C CA   . GLY A 1 119 ? 10.579 47.061 27.805 1.00 32.48  ? 122 GLY A CA   1 
ATOM   1850 C C    . GLY A 1 119 ? 10.197 46.087 26.711 1.00 41.92  ? 122 GLY A C    1 
ATOM   1851 O O    . GLY A 1 119 ? 10.806 46.086 25.636 1.00 39.44  ? 122 GLY A O    1 
ATOM   1852 H H    . GLY A 1 119 ? 9.441  47.220 29.410 0.00 41.40  ? 122 GLY A H    1 
ATOM   1853 H HA2  . GLY A 1 119 ? 10.993 47.836 27.394 0.00 39.03  ? 122 GLY A HA2  1 
ATOM   1854 H HA3  . GLY A 1 119 ? 11.225 46.629 28.386 0.00 39.03  ? 122 GLY A HA3  1 
ATOM   1855 N N    . LEU A 1 120 ? 9.191  45.246 26.964 1.00 39.62  ? 123 LEU A N    1 
ATOM   1856 C CA   . LEU A 1 120 ? 8.678  44.367 25.918 1.00 48.49  ? 123 LEU A CA   1 
ATOM   1857 C C    . LEU A 1 120 ? 7.990  45.166 24.819 1.00 40.53  ? 123 LEU A C    1 
ATOM   1858 O O    . LEU A 1 120 ? 8.173  44.881 23.629 1.00 40.95  ? 123 LEU A O    1 
ATOM   1859 C CB   . LEU A 1 120 ? 7.714  43.347 26.522 1.00 40.57  ? 123 LEU A CB   1 
ATOM   1860 C CG   . LEU A 1 120 ? 6.979  42.438 25.534 1.00 38.51  ? 123 LEU A CG   1 
ATOM   1861 C CD1  . LEU A 1 120 ? 7.960  41.603 24.723 1.00 40.09  ? 123 LEU A CD1  1 
ATOM   1862 C CD2  . LEU A 1 120 ? 5.992  41.549 26.273 1.00 51.51  ? 123 LEU A CD2  1 
ATOM   1863 H H    . LEU A 1 120 ? 8.795  45.168 27.723 0.00 47.59  ? 123 LEU A H    1 
ATOM   1864 H HA   . LEU A 1 120 ? 9.420  43.884 25.521 0.00 58.24  ? 123 LEU A HA   1 
ATOM   1865 H HB2  . LEU A 1 120 ? 8.218  42.772 27.118 0.00 48.73  ? 123 LEU A HB2  1 
ATOM   1866 H HB3  . LEU A 1 120 ? 7.038  43.831 27.022 0.00 48.73  ? 123 LEU A HB3  1 
ATOM   1867 H HG   . LEU A 1 120 ? 6.483  42.988 24.908 0.00 46.26  ? 123 LEU A HG   1 
ATOM   1868 H HD11 . LEU A 1 120 ? 7.462  40.984 24.165 0.00 48.15  ? 123 LEU A HD11 1 
ATOM   1869 H HD12 . LEU A 1 120 ? 8.493  42.193 24.167 0.00 48.15  ? 123 LEU A HD12 1 
ATOM   1870 H HD13 . LEU A 1 120 ? 8.535  41.112 25.330 0.00 48.15  ? 123 LEU A HD13 1 
ATOM   1871 H HD21 . LEU A 1 120 ? 5.545  40.973 25.633 0.00 61.86  ? 123 LEU A HD21 1 
ATOM   1872 H HD22 . LEU A 1 120 ? 6.474  41.012 26.921 0.00 61.86  ? 123 LEU A HD22 1 
ATOM   1873 H HD23 . LEU A 1 120 ? 5.341  42.108 26.725 0.00 61.86  ? 123 LEU A HD23 1 
ATOM   1874 N N    . VAL A 1 121 ? 7.190  46.166 25.196 1.00 33.44  ? 124 VAL A N    1 
ATOM   1875 C CA   . VAL A 1 121 ? 6.523  46.996 24.196 1.00 40.64  ? 124 VAL A CA   1 
ATOM   1876 C C    . VAL A 1 121 ? 7.554  47.717 23.338 1.00 43.83  ? 124 VAL A C    1 
ATOM   1877 O O    . VAL A 1 121 ? 7.394  47.839 22.117 1.00 36.94  ? 124 VAL A O    1 
ATOM   1878 C CB   . VAL A 1 121 ? 5.563  47.987 24.882 1.00 43.72  ? 124 VAL A CB   1 
ATOM   1879 C CG1  . VAL A 1 121 ? 5.168  49.106 23.924 1.00 47.05  ? 124 VAL A CG1  1 
ATOM   1880 C CG2  . VAL A 1 121 ? 4.332  47.261 25.402 1.00 65.23  ? 124 VAL A CG2  1 
ATOM   1881 H H    . VAL A 1 121 ? 7.019  46.380 26.011 0.00 40.18  ? 124 VAL A H    1 
ATOM   1882 H HA   . VAL A 1 121 ? 5.997  46.423 23.616 0.00 48.82  ? 124 VAL A HA   1 
ATOM   1883 H HB   . VAL A 1 121 ? 6.017  48.391 25.638 0.00 52.51  ? 124 VAL A HB   1 
ATOM   1884 H HG11 . VAL A 1 121 ? 4.401  49.576 24.287 0.00 56.51  ? 124 VAL A HG11 1 
ATOM   1885 H HG12 . VAL A 1 121 ? 5.916  49.717 23.827 0.00 56.51  ? 124 VAL A HG12 1 
ATOM   1886 H HG13 . VAL A 1 121 ? 4.943  48.720 23.063 0.00 56.51  ? 124 VAL A HG13 1 
ATOM   1887 H HG21 . VAL A 1 121 ? 3.750  47.901 25.841 0.00 78.33  ? 124 VAL A HG21 1 
ATOM   1888 H HG22 . VAL A 1 121 ? 3.868  46.850 24.656 0.00 78.33  ? 124 VAL A HG22 1 
ATOM   1889 H HG23 . VAL A 1 121 ? 4.611  46.580 26.034 0.00 78.33  ? 124 VAL A HG23 1 
ATOM   1890 N N    . GLY A 1 122 ? 8.630  48.203 23.960 1.00 39.28  ? 125 GLY A N    1 
ATOM   1891 C CA   . GLY A 1 122 ? 9.654  48.910 23.212 1.00 45.71  ? 125 GLY A CA   1 
ATOM   1892 C C    . GLY A 1 122 ? 10.417 48.018 22.254 1.00 40.11  ? 125 GLY A C    1 
ATOM   1893 O O    . GLY A 1 122 ? 10.849 48.473 21.192 1.00 39.66  ? 125 GLY A O    1 
ATOM   1894 H H    . GLY A 1 122 ? 8.785  48.135 24.804 0.00 47.19  ? 125 GLY A H    1 
ATOM   1895 H HA2  . GLY A 1 122 ? 9.238  49.619 22.698 0.00 54.90  ? 125 GLY A HA2  1 
ATOM   1896 H HA3  . GLY A 1 122 ? 10.289 49.299 23.833 0.00 54.90  ? 125 GLY A HA3  1 
ATOM   1897 N N    . ALA A 1 123 ? 10.596 46.744 22.610 1.00 37.53  ? 126 ALA A N    1 
ATOM   1898 C CA   . ALA A 1 123 ? 11.332 45.826 21.747 1.00 45.31  ? 126 ALA A CA   1 
ATOM   1899 C C    . ALA A 1 123 ? 10.529 45.406 20.522 1.00 40.38  ? 126 ALA A C    1 
ATOM   1900 O O    . ALA A 1 123 ? 11.124 45.016 19.512 1.00 40.76  ? 126 ALA A O    1 
ATOM   1901 C CB   . ALA A 1 123 ? 11.747 44.584 22.535 1.00 32.24  ? 126 ALA A CB   1 
ATOM   1902 H H    . ALA A 1 123 ? 10.304 46.392 23.338 0.00 45.09  ? 126 ALA A H    1 
ATOM   1903 H HA   . ALA A 1 123 ? 12.135 46.275 21.439 0.00 54.42  ? 126 ALA A HA   1 
ATOM   1904 H HB1  . ALA A 1 123 ? 12.242 43.989 21.950 0.00 38.74  ? 126 ALA A HB1  1 
ATOM   1905 H HB2  . ALA A 1 123 ? 12.305 44.855 23.281 0.00 38.74  ? 126 ALA A HB2  1 
ATOM   1906 H HB3  . ALA A 1 123 ? 10.951 44.137 22.863 0.00 38.74  ? 126 ALA A HB3  1 
ATOM   1907 N N    . LEU A 1 124 ? 9.201  45.473 20.588 1.00 36.13  ? 127 LEU A N    1 
ATOM   1908 C CA   . LEU A 1 124 ? 8.333  45.039 19.502 1.00 37.70  ? 127 LEU A CA   1 
ATOM   1909 C C    . LEU A 1 124 ? 7.747  46.203 18.714 1.00 44.11  ? 127 LEU A C    1 
ATOM   1910 O O    . LEU A 1 124 ? 6.999  45.973 17.759 1.00 40.81  ? 127 LEU A O    1 
ATOM   1911 C CB   . LEU A 1 124 ? 7.198  44.174 20.061 1.00 47.68  ? 127 LEU A CB   1 
ATOM   1912 C CG   . LEU A 1 124 ? 7.641  42.896 20.779 1.00 54.45  ? 127 LEU A CG   1 
ATOM   1913 C CD1  . LEU A 1 124 ? 6.451  42.163 21.376 1.00 49.47  ? 127 LEU A CD1  1 
ATOM   1914 C CD2  . LEU A 1 124 ? 8.403  41.982 19.833 1.00 42.67  ? 127 LEU A CD2  1 
ATOM   1915 H H    . LEU A 1 124 ? 8.771  45.773 21.270 0.00 43.40  ? 127 LEU A H    1 
ATOM   1916 H HA   . LEU A 1 124 ? 8.851  44.497 18.886 0.00 45.29  ? 127 LEU A HA   1 
ATOM   1917 H HB2  . LEU A 1 124 ? 6.695  44.704 20.698 0.00 57.26  ? 127 LEU A HB2  1 
ATOM   1918 H HB3  . LEU A 1 124 ? 6.626  43.909 19.325 0.00 57.26  ? 127 LEU A HB3  1 
ATOM   1919 H HG   . LEU A 1 124 ? 8.235  43.144 21.505 0.00 65.39  ? 127 LEU A HG   1 
ATOM   1920 H HD11 . LEU A 1 124 ? 6.768  41.373 21.841 0.00 59.41  ? 127 LEU A HD11 1 
ATOM   1921 H HD12 . LEU A 1 124 ? 5.996  42.752 21.997 0.00 59.41  ? 127 LEU A HD12 1 
ATOM   1922 H HD13 . LEU A 1 124 ? 5.847  41.906 20.661 0.00 59.41  ? 127 LEU A HD13 1 
ATOM   1923 H HD21 . LEU A 1 124 ? 8.535  41.122 20.263 0.00 51.25  ? 127 LEU A HD21 1 
ATOM   1924 H HD22 . LEU A 1 124 ? 7.888  41.869 19.019 0.00 51.25  ? 127 LEU A HD22 1 
ATOM   1925 H HD23 . LEU A 1 124 ? 9.261  42.384 19.628 0.00 51.25  ? 127 LEU A HD23 1 
ATOM   1926 N N    . THR A 1 125 ? 8.072  47.439 19.085 1.00 39.00  ? 128 THR A N    1 
ATOM   1927 C CA   . THR A 1 125 ? 7.497  48.613 18.443 1.00 39.05  ? 128 THR A CA   1 
ATOM   1928 C C    . THR A 1 125 ? 8.149  48.830 17.082 1.00 39.31  ? 128 THR A C    1 
ATOM   1929 O O    . THR A 1 125 ? 9.376  48.766 16.953 1.00 44.57  ? 128 THR A O    1 
ATOM   1930 C CB   . THR A 1 125 ? 7.686  49.842 19.336 1.00 32.37  ? 128 THR A CB   1 
ATOM   1931 O OG1  . THR A 1 125 ? 6.710  49.828 20.388 1.00 41.55  ? 128 THR A OG1  1 
ATOM   1932 C CG2  . THR A 1 125 ? 7.534  51.131 18.539 1.00 35.50  ? 128 THR A CG2  1 
ATOM   1933 H H    . THR A 1 125 ? 8.630  47.625 19.713 0.00 46.85  ? 128 THR A H    1 
ATOM   1934 H HA   . THR A 1 125 ? 6.545  48.483 18.305 0.00 46.91  ? 128 THR A HA   1 
ATOM   1935 H HB   . THR A 1 125 ? 8.579  49.822 19.713 0.00 38.74  ? 128 THR A HB   1 
ATOM   1936 H HG1  . THR A 1 125 ? 6.792  50.515 20.864 0.00 49.91  ? 128 THR A HG1  1 
ATOM   1937 H HG21 . THR A 1 125 ? 7.361  51.874 19.139 0.00 42.65  ? 128 THR A HG21 1 
ATOM   1938 H HG22 . THR A 1 125 ? 8.347  51.311 18.042 0.00 42.65  ? 128 THR A HG22 1 
ATOM   1939 H HG23 . THR A 1 125 ? 6.795  51.051 17.916 0.00 42.65  ? 128 THR A HG23 1 
ATOM   1940 N N    . LYS A 1 126 ? 7.325  49.086 16.064 1.00 39.45  ? 129 LYS A N    1 
ATOM   1941 C CA   . LYS A 1 126 ? 7.824  49.211 14.699 1.00 46.53  ? 129 LYS A CA   1 
ATOM   1942 C C    . LYS A 1 126 ? 8.248  50.630 14.349 1.00 52.75  ? 129 LYS A C    1 
ATOM   1943 O O    . LYS A 1 126 ? 9.088  50.811 13.460 1.00 54.07  ? 129 LYS A O    1 
ATOM   1944 C CB   . LYS A 1 126 ? 6.763  48.740 13.698 1.00 50.29  ? 129 LYS A CB   1 
ATOM   1945 C CG   . LYS A 1 126 ? 5.841  47.649 14.219 1.00 59.27  ? 129 LYS A CG   1 
ATOM   1946 C CD   . LYS A 1 126 ? 5.131  46.921 13.088 1.00 74.56  ? 129 LYS A CD   1 
ATOM   1947 C CE   . LYS A 1 126 ? 3.667  47.314 13.015 1.00 81.90  ? 129 LYS A CE   1 
ATOM   1948 N NZ   . LYS A 1 126 ? 2.933  46.559 11.963 1.00 109.83 ? 129 LYS A NZ   1 
ATOM   1949 H H    . LYS A 1 126 ? 6.475  49.192 16.141 0.00 47.39  ? 129 LYS A H    1 
ATOM   1950 H HA   . LYS A 1 126 ? 8.599  48.635 14.605 0.00 55.89  ? 129 LYS A HA   1 
ATOM   1951 H HB2  . LYS A 1 126 ? 6.210  49.499 13.455 0.00 60.40  ? 129 LYS A HB2  1 
ATOM   1952 H HB3  . LYS A 1 126 ? 7.213  48.392 12.912 0.00 60.40  ? 129 LYS A HB3  1 
ATOM   1953 H HG2  . LYS A 1 126 ? 6.363  47.001 14.718 0.00 71.17  ? 129 LYS A HG2  1 
ATOM   1954 H HG3  . LYS A 1 126 ? 5.168  48.046 14.794 0.00 71.17  ? 129 LYS A HG3  1 
ATOM   1955 H HD2  . LYS A 1 126 ? 5.552  47.149 12.244 0.00 89.52  ? 129 LYS A HD2  1 
ATOM   1956 H HD3  . LYS A 1 126 ? 5.185  45.964 13.237 0.00 89.52  ? 129 LYS A HD3  1 
ATOM   1957 H HE2  . LYS A 1 126 ? 3.245  47.129 13.869 0.00 98.33  ? 129 LYS A HE2  1 
ATOM   1958 H HE3  . LYS A 1 126 ? 3.601  48.259 12.810 0.00 98.33  ? 129 LYS A HE3  1 
ATOM   1959 H HZ1  . LYS A 1 126 ? 2.084  46.824 11.935 0.00 131.85 ? 129 LYS A HZ1  1 
ATOM   1960 H HZ2  . LYS A 1 126 ? 3.307  46.703 11.168 0.00 131.85 ? 129 LYS A HZ2  1 
ATOM   1961 H HZ3  . LYS A 1 126 ? 2.958  45.687 12.140 0.00 131.85 ? 129 LYS A HZ3  1 
ATOM   1962 N N    . VAL A 1 127 ? 7.688  51.638 15.012 1.00 42.27  ? 130 VAL A N    1 
ATOM   1963 C CA   . VAL A 1 127 ? 8.093  53.022 14.785 1.00 46.04  ? 130 VAL A CA   1 
ATOM   1964 C C    . VAL A 1 127 ? 9.376  53.262 15.576 1.00 55.85  ? 130 VAL A C    1 
ATOM   1965 O O    . VAL A 1 127 ? 9.372  53.244 16.809 1.00 49.83  ? 130 VAL A O    1 
ATOM   1966 C CB   . VAL A 1 127 ? 6.990  54.008 15.184 1.00 52.34  ? 130 VAL A CB   1 
ATOM   1967 C CG1  . VAL A 1 127 ? 7.471  55.440 15.019 1.00 49.87  ? 130 VAL A CG1  1 
ATOM   1968 C CG2  . VAL A 1 127 ? 5.741  53.765 14.341 1.00 53.62  ? 130 VAL A CG2  1 
ATOM   1969 H H    . VAL A 1 127 ? 7.068  51.546 15.601 0.00 50.77  ? 130 VAL A H    1 
ATOM   1970 H HA   . VAL A 1 127 ? 8.284  53.155 13.843 0.00 55.30  ? 130 VAL A HA   1 
ATOM   1971 H HB   . VAL A 1 127 ? 6.764  53.871 16.117 0.00 62.86  ? 130 VAL A HB   1 
ATOM   1972 H HG11 . VAL A 1 127 ? 6.708  56.037 15.062 0.00 59.90  ? 130 VAL A HG11 1 
ATOM   1973 H HG12 . VAL A 1 127 ? 8.094  55.648 15.732 0.00 59.90  ? 130 VAL A HG12 1 
ATOM   1974 H HG13 . VAL A 1 127 ? 7.912  55.528 14.159 0.00 59.90  ? 130 VAL A HG13 1 
ATOM   1975 H HG21 . VAL A 1 127 ? 5.073  54.431 14.567 0.00 64.40  ? 130 VAL A HG21 1 
ATOM   1976 H HG22 . VAL A 1 127 ? 5.974  53.836 13.402 0.00 64.40  ? 130 VAL A HG22 1 
ATOM   1977 H HG23 . VAL A 1 127 ? 5.400  52.877 14.531 0.00 64.40  ? 130 VAL A HG23 1 
ATOM   1978 N N    . TYR A 1 128 ? 10.477 53.494 14.859 1.00 36.30  ? 131 TYR A N    1 
ATOM   1979 C CA   . TYR A 1 128 ? 11.803 53.474 15.471 1.00 40.69  ? 131 TYR A CA   1 
ATOM   1980 C C    . TYR A 1 128 ? 11.910 54.469 16.623 1.00 41.21  ? 131 TYR A C    1 
ATOM   1981 O O    . TYR A 1 128 ? 12.373 54.124 17.716 1.00 38.76  ? 131 TYR A O    1 
ATOM   1982 C CB   . TYR A 1 128 ? 12.856 53.766 14.401 1.00 37.05  ? 131 TYR A CB   1 
ATOM   1983 C CG   . TYR A 1 128 ? 14.283 53.726 14.890 1.00 47.05  ? 131 TYR A CG   1 
ATOM   1984 C CD1  . TYR A 1 128 ? 14.890 52.523 15.224 1.00 56.36  ? 131 TYR A CD1  1 
ATOM   1985 C CD2  . TYR A 1 128 ? 15.029 54.891 15.003 1.00 53.64  ? 131 TYR A CD2  1 
ATOM   1986 C CE1  . TYR A 1 128 ? 16.196 52.482 15.664 1.00 55.58  ? 131 TYR A CE1  1 
ATOM   1987 C CE2  . TYR A 1 128 ? 16.335 54.859 15.443 1.00 45.69  ? 131 TYR A CE2  1 
ATOM   1988 C CZ   . TYR A 1 128 ? 16.912 53.651 15.772 1.00 56.40  ? 131 TYR A CZ   1 
ATOM   1989 O OH   . TYR A 1 128 ? 18.212 53.605 16.210 1.00 69.74  ? 131 TYR A OH   1 
ATOM   1990 H H    . TYR A 1 128 ? 10.483 53.666 14.016 0.00 43.61  ? 131 TYR A H    1 
ATOM   1991 H HA   . TYR A 1 128 ? 11.966 52.591 15.838 0.00 48.88  ? 131 TYR A HA   1 
ATOM   1992 H HB2  . TYR A 1 128 ? 12.770 53.105 13.696 0.00 44.51  ? 131 TYR A HB2  1 
ATOM   1993 H HB3  . TYR A 1 128 ? 12.695 54.653 14.044 0.00 44.51  ? 131 TYR A HB3  1 
ATOM   1994 H HD1  . TYR A 1 128 ? 14.408 51.731 15.150 0.00 67.68  ? 131 TYR A HD1  1 
ATOM   1995 H HD2  . TYR A 1 128 ? 14.642 55.706 14.779 0.00 64.43  ? 131 TYR A HD2  1 
ATOM   1996 H HE1  . TYR A 1 128 ? 16.590 51.670 15.887 0.00 66.74  ? 131 TYR A HE1  1 
ATOM   1997 H HE2  . TYR A 1 128 ? 16.824 55.647 15.517 0.00 54.87  ? 131 TYR A HE2  1 
ATOM   1998 H HH   . TYR A 1 128 ? 18.416 54.331 16.580 0.00 83.74  ? 131 TYR A HH   1 
ATOM   1999 N N    A SER A 1 129 ? 11.484 55.714 16.397 0.82 34.28  ? 132 SER A N    1 
ATOM   2000 N N    B SER A 1 129 ? 11.489 55.716 16.392 0.18 34.38  ? 132 SER A N    1 
ATOM   2001 C CA   A SER A 1 129 ? 11.635 56.739 17.426 0.82 44.96  ? 132 SER A CA   1 
ATOM   2002 C CA   B SER A 1 129 ? 11.623 56.743 17.420 0.18 44.93  ? 132 SER A CA   1 
ATOM   2003 C C    A SER A 1 129 ? 10.841 56.405 18.683 0.82 42.28  ? 132 SER A C    1 
ATOM   2004 C C    B SER A 1 129 ? 10.854 56.383 18.684 0.18 42.32  ? 132 SER A C    1 
ATOM   2005 O O    A SER A 1 129 ? 11.239 56.794 19.788 0.82 47.87  ? 132 SER A O    1 
ATOM   2006 O O    B SER A 1 129 ? 11.284 56.727 19.791 0.18 47.62  ? 132 SER A O    1 
ATOM   2007 C CB   A SER A 1 129 ? 11.206 58.099 16.874 0.82 48.75  ? 132 SER A CB   1 
ATOM   2008 C CB   B SER A 1 129 ? 11.142 58.090 16.878 0.18 48.66  ? 132 SER A CB   1 
ATOM   2009 O OG   A SER A 1 129 ? 9.804  58.153 16.677 0.82 62.42  ? 132 SER A OG   1 
ATOM   2010 O OG   B SER A 1 129 ? 11.974 58.543 15.824 0.18 49.86  ? 132 SER A OG   1 
ATOM   2011 H H    A SER A 1 129 ? 11.112 55.985 15.670 0.82 41.16  ? 132 SER A H    1 
ATOM   2012 H H    B SER A 1 129 ? 11.129 55.986 15.660 0.18 41.31  ? 132 SER A H    1 
ATOM   2013 H HA   A SER A 1 129 ? 12.571 56.793 17.673 0.82 54.00  ? 132 SER A HA   1 
ATOM   2014 H HA   B SER A 1 129 ? 12.561 56.826 17.653 0.18 53.97  ? 132 SER A HA   1 
ATOM   2015 H HB2  A SER A 1 129 ? 11.461 58.789 17.506 0.82 58.55  ? 132 SER A HB2  1 
ATOM   2016 H HB2  B SER A 1 129 ? 10.237 57.990 16.544 0.18 58.44  ? 132 SER A HB2  1 
ATOM   2017 H HB3  A SER A 1 129 ? 11.649 58.247 16.024 0.82 58.55  ? 132 SER A HB3  1 
ATOM   2018 H HB3  B SER A 1 129 ? 11.161 58.742 17.596 0.18 58.44  ? 132 SER A HB3  1 
ATOM   2019 H HG   A SER A 1 129 ? 9.581  58.915 16.403 0.82 74.96  ? 132 SER A HG   1 
ATOM   2020 H HG   B SER A 1 129 ? 11.709 59.292 15.551 0.18 59.88  ? 132 SER A HG   1 
ATOM   2021 N N    . TYR A 1 130 ? 9.720  55.693 18.545 1.00 37.56  ? 133 TYR A N    1 
ATOM   2022 C CA   . TYR A 1 130 ? 8.913  55.355 19.713 1.00 30.96  ? 133 TYR A CA   1 
ATOM   2023 C C    . TYR A 1 130 ? 9.581  54.310 20.596 1.00 39.06  ? 133 TYR A C    1 
ATOM   2024 O O    . TYR A 1 130 ? 9.274  54.241 21.791 1.00 36.84  ? 133 TYR A O    1 
ATOM   2025 C CB   . TYR A 1 130 ? 7.535  54.848 19.283 1.00 42.87  ? 133 TYR A CB   1 
ATOM   2026 C CG   . TYR A 1 130 ? 6.620  55.905 18.696 1.00 48.78  ? 133 TYR A CG   1 
ATOM   2027 C CD1  . TYR A 1 130 ? 6.876  57.262 18.867 1.00 56.49  ? 133 TYR A CD1  1 
ATOM   2028 C CD2  . TYR A 1 130 ? 5.500  55.541 17.962 1.00 45.16  ? 133 TYR A CD2  1 
ATOM   2029 C CE1  . TYR A 1 130 ? 6.041  58.220 18.330 1.00 54.99  ? 133 TYR A CE1  1 
ATOM   2030 C CE2  . TYR A 1 130 ? 4.657  56.494 17.422 1.00 47.42  ? 133 TYR A CE2  1 
ATOM   2031 C CZ   . TYR A 1 130 ? 4.934  57.833 17.608 1.00 63.78  ? 133 TYR A CZ   1 
ATOM   2032 O OH   . TYR A 1 130 ? 4.102  58.789 17.073 1.00 68.41  ? 133 TYR A OH   1 
ATOM   2033 H H    . TYR A 1 130 ? 9.414  55.401 17.797 0.00 45.12  ? 133 TYR A H    1 
ATOM   2034 H HA   . TYR A 1 130 ? 8.788  56.161 20.237 0.00 37.20  ? 133 TYR A HA   1 
ATOM   2035 H HB2  . TYR A 1 130 ? 7.657  54.162 18.608 0.00 51.50  ? 133 TYR A HB2  1 
ATOM   2036 H HB3  . TYR A 1 130 ? 7.089  54.475 20.059 0.00 51.50  ? 133 TYR A HB3  1 
ATOM   2037 H HD1  . TYR A 1 130 ? 7.624  57.528 19.352 0.00 67.84  ? 133 TYR A HD1  1 
ATOM   2038 H HD2  . TYR A 1 130 ? 5.314  54.640 17.830 0.00 54.24  ? 133 TYR A HD2  1 
ATOM   2039 H HE1  . TYR A 1 130 ? 6.224  59.123 18.455 0.00 66.03  ? 133 TYR A HE1  1 
ATOM   2040 H HE2  . TYR A 1 130 ? 3.908  56.235 16.936 0.00 56.95  ? 133 TYR A HE2  1 
ATOM   2041 H HH   . TYR A 1 130 ? 4.389  59.556 17.259 0.00 82.15  ? 133 TYR A HH   1 
ATOM   2042 N N    . ARG A 1 131 ? 10.482 53.498 20.040 1.00 43.90  ? 134 ARG A N    1 
ATOM   2043 C CA   . ARG A 1 131 ? 11.167 52.495 20.847 1.00 40.60  ? 134 ARG A CA   1 
ATOM   2044 C C    . ARG A 1 131 ? 11.903 53.130 22.018 1.00 40.64  ? 134 ARG A C    1 
ATOM   2045 O O    . ARG A 1 131 ? 11.992 52.530 23.095 1.00 40.62  ? 134 ARG A O    1 
ATOM   2046 C CB   . ARG A 1 131 ? 12.144 51.706 19.976 1.00 37.10  ? 134 ARG A CB   1 
ATOM   2047 C CG   . ARG A 1 131 ? 11.477 50.920 18.857 1.00 47.06  ? 134 ARG A CG   1 
ATOM   2048 C CD   . ARG A 1 131 ? 12.506 50.314 17.917 1.00 44.24  ? 134 ARG A CD   1 
ATOM   2049 N NE   . ARG A 1 131 ? 13.267 49.245 18.552 1.00 44.71  ? 134 ARG A NE   1 
ATOM   2050 C CZ   . ARG A 1 131 ? 12.844 47.993 18.671 1.00 37.93  ? 134 ARG A CZ   1 
ATOM   2051 N NH1  . ARG A 1 131 ? 11.663 47.614 18.209 1.00 44.23  ? 134 ARG A NH1  1 
ATOM   2052 N NH2  . ARG A 1 131 ? 13.627 47.098 19.266 1.00 39.28  ? 134 ARG A NH2  1 
ATOM   2053 H H    . ARG A 1 131 ? 10.711 53.509 19.211 0.00 52.73  ? 134 ARG A H    1 
ATOM   2054 H HA   . ARG A 1 131 ? 10.510 51.876 21.203 0.00 48.77  ? 134 ARG A HA   1 
ATOM   2055 H HB2  . ARG A 1 131 ? 12.769 52.326 19.570 0.00 44.57  ? 134 ARG A HB2  1 
ATOM   2056 H HB3  . ARG A 1 131 ? 12.620 51.074 20.538 0.00 44.57  ? 134 ARG A HB3  1 
ATOM   2057 H HG2  . ARG A 1 131 ? 10.950 50.200 19.238 0.00 56.52  ? 134 ARG A HG2  1 
ATOM   2058 H HG3  . ARG A 1 131 ? 10.906 51.513 18.343 0.00 56.52  ? 134 ARG A HG3  1 
ATOM   2059 H HD2  . ARG A 1 131 ? 12.052 49.944 17.144 0.00 53.14  ? 134 ARG A HD2  1 
ATOM   2060 H HD3  . ARG A 1 131 ? 13.128 51.004 17.638 0.00 53.14  ? 134 ARG A HD3  1 
ATOM   2061 H HE   . ARG A 1 131 ? 14.042 49.438 18.870 0.00 53.71  ? 134 ARG A HE   1 
ATOM   2062 H HH11 . ARG A 1 131 ? 11.149 48.185 17.820 0.00 53.13  ? 134 ARG A HH11 1 
ATOM   2063 H HH12 . ARG A 1 131 ? 11.408 46.798 18.297 0.00 53.13  ? 134 ARG A HH12 1 
ATOM   2064 H HH21 . ARG A 1 131 ? 14.397 47.334 19.569 0.00 47.19  ? 134 ARG A HH21 1 
ATOM   2065 H HH22 . ARG A 1 131 ? 13.363 46.284 19.349 0.00 47.19  ? 134 ARG A HH22 1 
ATOM   2066 N N    . PHE A 1 132 ? 12.433 54.341 21.829 1.00 36.63  ? 135 PHE A N    1 
ATOM   2067 C CA   . PHE A 1 132 ? 13.174 55.017 22.886 1.00 40.29  ? 135 PHE A CA   1 
ATOM   2068 C C    . PHE A 1 132 ? 12.263 55.710 23.887 1.00 42.74  ? 135 PHE A C    1 
ATOM   2069 O O    . PHE A 1 132 ? 12.705 56.011 25.001 1.00 40.89  ? 135 PHE A O    1 
ATOM   2070 C CB   . PHE A 1 132 ? 14.143 56.026 22.268 1.00 41.52  ? 135 PHE A CB   1 
ATOM   2071 C CG   . PHE A 1 132 ? 15.145 55.400 21.343 1.00 38.79  ? 135 PHE A CG   1 
ATOM   2072 C CD1  . PHE A 1 132 ? 16.233 54.710 21.848 1.00 61.90  ? 135 PHE A CD1  1 
ATOM   2073 C CD2  . PHE A 1 132 ? 14.989 55.485 19.969 1.00 47.28  ? 135 PHE A CD2  1 
ATOM   2074 C CE1  . PHE A 1 132 ? 17.154 54.126 21.000 1.00 57.91  ? 135 PHE A CE1  1 
ATOM   2075 C CE2  . PHE A 1 132 ? 15.907 54.902 19.117 1.00 63.02  ? 135 PHE A CE2  1 
ATOM   2076 C CZ   . PHE A 1 132 ? 16.990 54.220 19.634 1.00 60.52  ? 135 PHE A CZ   1 
ATOM   2077 H H    . PHE A 1 132 ? 12.375 54.789 21.098 0.00 44.01  ? 135 PHE A H    1 
ATOM   2078 H HA   . PHE A 1 132 ? 13.699 54.365 23.376 0.00 48.40  ? 135 PHE A HA   1 
ATOM   2079 H HB2  . PHE A 1 132 ? 13.635 56.677 21.760 0.00 49.88  ? 135 PHE A HB2  1 
ATOM   2080 H HB3  . PHE A 1 132 ? 14.632 56.468 22.980 0.00 49.88  ? 135 PHE A HB3  1 
ATOM   2081 H HD1  . PHE A 1 132 ? 16.345 54.638 22.768 0.00 74.33  ? 135 PHE A HD1  1 
ATOM   2082 H HD2  . PHE A 1 132 ? 14.258 55.940 19.617 0.00 56.78  ? 135 PHE A HD2  1 
ATOM   2083 H HE1  . PHE A 1 132 ? 17.884 53.669 21.351 0.00 69.54  ? 135 PHE A HE1  1 
ATOM   2084 H HE2  . PHE A 1 132 ? 15.796 54.970 18.196 0.00 75.67  ? 135 PHE A HE2  1 
ATOM   2085 H HZ   . PHE A 1 132 ? 17.607 53.825 19.062 0.00 72.67  ? 135 PHE A HZ   1 
ATOM   2086 N N    . VAL A 1 133 ? 11.008 55.971 23.518 1.00 41.22  ? 136 VAL A N    1 
ATOM   2087 C CA   . VAL A 1 133 ? 10.037 56.451 24.494 1.00 36.23  ? 136 VAL A CA   1 
ATOM   2088 C C    . VAL A 1 133 ? 9.742  55.365 25.520 1.00 41.25  ? 136 VAL A C    1 
ATOM   2089 O O    . VAL A 1 133 ? 9.667  55.631 26.725 1.00 42.12  ? 136 VAL A O    1 
ATOM   2090 C CB   . VAL A 1 133 ? 8.755  56.919 23.783 1.00 52.80  ? 136 VAL A CB   1 
ATOM   2091 C CG1  . VAL A 1 133 ? 7.666  57.242 24.798 1.00 44.35  ? 136 VAL A CG1  1 
ATOM   2092 C CG2  . VAL A 1 133 ? 9.047  58.123 22.896 1.00 42.82  ? 136 VAL A CG2  1 
ATOM   2093 H H    . VAL A 1 133 ? 10.699 55.880 22.720 0.00 49.52  ? 136 VAL A H    1 
ATOM   2094 H HA   . VAL A 1 133 ? 10.415 57.212 24.962 0.00 43.52  ? 136 VAL A HA   1 
ATOM   2095 H HB   . VAL A 1 133 ? 8.430  56.202 23.216 0.00 63.41  ? 136 VAL A HB   1 
ATOM   2096 H HG11 . VAL A 1 133 ? 6.968  57.753 24.360 0.00 53.27  ? 136 VAL A HG11 1 
ATOM   2097 H HG12 . VAL A 1 133 ? 7.302  56.412 25.145 0.00 53.27  ? 136 VAL A HG12 1 
ATOM   2098 H HG13 . VAL A 1 133 ? 8.053  57.761 25.521 0.00 53.27  ? 136 VAL A HG13 1 
ATOM   2099 H HG21 . VAL A 1 133 ? 8.223  58.412 22.474 0.00 51.43  ? 136 VAL A HG21 1 
ATOM   2100 H HG22 . VAL A 1 133 ? 9.406  58.839 23.444 0.00 51.43  ? 136 VAL A HG22 1 
ATOM   2101 H HG23 . VAL A 1 133 ? 9.694  57.868 22.220 0.00 51.43  ? 136 VAL A HG23 1 
ATOM   2102 N N    . TRP A 1 134 ? 9.575  54.122 25.060 1.00 35.45  ? 137 TRP A N    1 
ATOM   2103 C CA   . TRP A 1 134 ? 9.308  53.023 25.981 1.00 47.67  ? 137 TRP A CA   1 
ATOM   2104 C C    . TRP A 1 134 ? 10.554 52.655 26.777 1.00 48.69  ? 137 TRP A C    1 
ATOM   2105 O O    . TRP A 1 134 ? 10.447 52.241 27.938 1.00 39.22  ? 137 TRP A O    1 
ATOM   2106 C CB   . TRP A 1 134 ? 8.781  51.818 25.203 1.00 36.91  ? 137 TRP A CB   1 
ATOM   2107 C CG   . TRP A 1 134 ? 7.453  52.086 24.560 1.00 36.98  ? 137 TRP A CG   1 
ATOM   2108 C CD1  . TRP A 1 134 ? 7.204  52.237 23.226 1.00 39.74  ? 137 TRP A CD1  1 
ATOM   2109 C CD2  . TRP A 1 134 ? 6.195  52.256 25.224 1.00 43.97  ? 137 TRP A CD2  1 
ATOM   2110 N NE1  . TRP A 1 134 ? 5.868  52.482 23.018 1.00 38.81  ? 137 TRP A NE1  1 
ATOM   2111 C CE2  . TRP A 1 134 ? 5.227  52.499 24.229 1.00 34.24  ? 137 TRP A CE2  1 
ATOM   2112 C CE3  . TRP A 1 134 ? 5.792  52.222 26.563 1.00 48.28  ? 137 TRP A CE3  1 
ATOM   2113 C CZ2  . TRP A 1 134 ? 3.883  52.707 24.529 1.00 39.33  ? 137 TRP A CZ2  1 
ATOM   2114 C CZ3  . TRP A 1 134 ? 4.456  52.428 26.859 1.00 49.39  ? 137 TRP A CZ3  1 
ATOM   2115 C CH2  . TRP A 1 134 ? 3.518  52.668 25.846 1.00 54.94  ? 137 TRP A CH2  1 
ATOM   2116 H H    . TRP A 1 134 ? 9.610  53.894 24.232 0.00 42.59  ? 137 TRP A H    1 
ATOM   2117 H HA   . TRP A 1 134 ? 8.623  53.289 26.614 0.00 57.25  ? 137 TRP A HA   1 
ATOM   2118 H HB2  . TRP A 1 134 ? 9.414  51.591 24.503 0.00 44.35  ? 137 TRP A HB2  1 
ATOM   2119 H HB3  . TRP A 1 134 ? 8.676  51.070 25.811 0.00 44.35  ? 137 TRP A HB3  1 
ATOM   2120 H HD1  . TRP A 1 134 ? 7.845  52.182 22.554 0.00 47.74  ? 137 TRP A HD1  1 
ATOM   2121 H HE1  . TRP A 1 134 ? 5.496  52.605 22.253 0.00 46.63  ? 137 TRP A HE1  1 
ATOM   2122 H HE3  . TRP A 1 134 ? 6.409  52.065 27.240 0.00 57.99  ? 137 TRP A HE3  1 
ATOM   2123 H HZ2  . TRP A 1 134 ? 3.257  52.866 23.859 0.00 47.25  ? 137 TRP A HZ2  1 
ATOM   2124 H HZ3  . TRP A 1 134 ? 4.176  52.407 27.745 0.00 59.32  ? 137 TRP A HZ3  1 
ATOM   2125 H HH2  . TRP A 1 134 ? 2.626  52.803 26.075 0.00 65.98  ? 137 TRP A HH2  1 
ATOM   2126 N N    . TRP A 1 135 ? 11.738 52.803 26.176 1.00 37.00  ? 138 TRP A N    1 
ATOM   2127 C CA   . TRP A 1 135 ? 12.979 52.623 26.923 1.00 39.90  ? 138 TRP A CA   1 
ATOM   2128 C C    . TRP A 1 135 ? 13.072 53.604 28.085 1.00 43.15  ? 138 TRP A C    1 
ATOM   2129 O O    . TRP A 1 135 ? 13.510 53.238 29.183 1.00 37.85  ? 138 TRP A O    1 
ATOM   2130 C CB   . TRP A 1 135 ? 14.177 52.791 25.987 1.00 42.61  ? 138 TRP A CB   1 
ATOM   2131 C CG   . TRP A 1 135 ? 15.506 52.739 26.688 1.00 36.94  ? 138 TRP A CG   1 
ATOM   2132 C CD1  . TRP A 1 135 ? 16.295 51.641 26.876 1.00 38.60  ? 138 TRP A CD1  1 
ATOM   2133 C CD2  . TRP A 1 135 ? 16.199 53.838 27.292 1.00 40.88  ? 138 TRP A CD2  1 
ATOM   2134 N NE1  . TRP A 1 135 ? 17.436 51.988 27.560 1.00 42.60  ? 138 TRP A NE1  1 
ATOM   2135 C CE2  . TRP A 1 135 ? 17.400 53.332 27.827 1.00 47.83  ? 138 TRP A CE2  1 
ATOM   2136 C CE3  . TRP A 1 135 ? 15.920 55.201 27.433 1.00 57.77  ? 138 TRP A CE3  1 
ATOM   2137 C CZ2  . TRP A 1 135 ? 18.320 54.140 28.491 1.00 49.17  ? 138 TRP A CZ2  1 
ATOM   2138 C CZ3  . TRP A 1 135 ? 16.834 56.002 28.092 1.00 51.68  ? 138 TRP A CZ3  1 
ATOM   2139 C CH2  . TRP A 1 135 ? 18.019 55.470 28.613 1.00 56.22  ? 138 TRP A CH2  1 
ATOM   2140 H H    . TRP A 1 135 ? 11.846 53.006 25.348 0.00 44.45  ? 138 TRP A H    1 
ATOM   2141 H HA   . TRP A 1 135 ? 12.998 51.723 27.285 0.00 47.94  ? 138 TRP A HA   1 
ATOM   2142 H HB2  . TRP A 1 135 ? 14.162 52.079 25.329 0.00 51.18  ? 138 TRP A HB2  1 
ATOM   2143 H HB3  . TRP A 1 135 ? 14.110 53.653 25.546 0.00 51.18  ? 138 TRP A HB3  1 
ATOM   2144 H HD1  . TRP A 1 135 ? 16.090 50.782 26.584 0.00 46.37  ? 138 TRP A HD1  1 
ATOM   2145 H HE1  . TRP A 1 135 ? 18.068 51.450 27.783 0.00 51.17  ? 138 TRP A HE1  1 
ATOM   2146 H HE3  . TRP A 1 135 ? 15.134 55.562 27.089 0.00 69.37  ? 138 TRP A HE3  1 
ATOM   2147 H HZ2  . TRP A 1 135 ? 19.108 53.790 28.838 0.00 59.06  ? 138 TRP A HZ2  1 
ATOM   2148 H HZ3  . TRP A 1 135 ? 16.659 56.910 28.192 0.00 62.06  ? 138 TRP A HZ3  1 
ATOM   2149 H HH2  . TRP A 1 135 ? 18.616 56.032 29.052 0.00 67.51  ? 138 TRP A HH2  1 
ATOM   2150 N N    . ALA A 1 136 ? 12.670 54.856 27.862 1.00 34.43  ? 139 ALA A N    1 
ATOM   2151 C CA   . ALA A 1 136 ? 12.799 55.867 28.906 1.00 38.97  ? 139 ALA A CA   1 
ATOM   2152 C C    . ALA A 1 136 ? 11.823 55.611 30.046 1.00 48.06  ? 139 ALA A C    1 
ATOM   2153 O O    . ALA A 1 136 ? 12.163 55.807 31.219 1.00 41.44  ? 139 ALA A O    1 
ATOM   2154 C CB   . ALA A 1 136 ? 12.583 57.258 28.314 1.00 39.66  ? 139 ALA A CB   1 
ATOM   2155 H H    . ALA A 1 136 ? 12.324 55.140 27.128 0.00 41.36  ? 139 ALA A H    1 
ATOM   2156 H HA   . ALA A 1 136 ? 13.698 55.831 29.269 0.00 46.81  ? 139 ALA A HA   1 
ATOM   2157 H HB1  . ALA A 1 136 ? 12.688 57.920 29.015 0.00 47.64  ? 139 ALA A HB1  1 
ATOM   2158 H HB2  . ALA A 1 136 ? 13.240 57.410 27.616 0.00 47.64  ? 139 ALA A HB2  1 
ATOM   2159 H HB3  . ALA A 1 136 ? 11.689 57.308 27.942 0.00 47.64  ? 139 ALA A HB3  1 
ATOM   2160 N N    . ILE A 1 137 ? 10.604 55.173 29.724 1.00 41.91  ? 140 ILE A N    1 
ATOM   2161 C CA   . ILE A 1 137 ? 9.634  54.856 30.767 1.00 42.32  ? 140 ILE A CA   1 
ATOM   2162 C C    . ILE A 1 137 ? 10.107 53.663 31.588 1.00 39.56  ? 140 ILE A C    1 
ATOM   2163 O O    . ILE A 1 137 ? 10.006 53.661 32.821 1.00 39.18  ? 140 ILE A O    1 
ATOM   2164 C CB   . ILE A 1 137 ? 8.249  54.602 30.143 1.00 46.68  ? 140 ILE A CB   1 
ATOM   2165 C CG1  . ILE A 1 137 ? 7.663  55.908 29.601 1.00 47.64  ? 140 ILE A CG1  1 
ATOM   2166 C CG2  . ILE A 1 137 ? 7.309  53.983 31.169 1.00 45.56  ? 140 ILE A CG2  1 
ATOM   2167 C CD1  . ILE A 1 137 ? 6.520  55.703 28.630 1.00 57.62  ? 140 ILE A CD1  1 
ATOM   2168 H H    . ILE A 1 137 ? 10.319 55.054 28.922 0.00 50.35  ? 140 ILE A H    1 
ATOM   2169 H HA   . ILE A 1 137 ? 9.559  55.617 31.363 0.00 50.83  ? 140 ILE A HA   1 
ATOM   2170 H HB   . ILE A 1 137 ? 8.355  53.980 29.406 0.00 56.07  ? 140 ILE A HB   1 
ATOM   2171 H HG12 . ILE A 1 137 ? 7.330  56.433 30.345 0.00 57.22  ? 140 ILE A HG12 1 
ATOM   2172 H HG13 . ILE A 1 137 ? 8.362  56.395 29.137 0.00 57.22  ? 140 ILE A HG13 1 
ATOM   2173 H HG21 . ILE A 1 137 ? 6.395  54.080 30.859 0.00 54.73  ? 140 ILE A HG21 1 
ATOM   2174 H HG22 . ILE A 1 137 ? 7.526  53.043 31.270 0.00 54.73  ? 140 ILE A HG22 1 
ATOM   2175 H HG23 . ILE A 1 137 ? 7.420  54.442 32.017 0.00 54.73  ? 140 ILE A HG23 1 
ATOM   2176 H HD11 . ILE A 1 137 ? 6.267  56.561 28.255 0.00 69.20  ? 140 ILE A HD11 1 
ATOM   2177 H HD12 . ILE A 1 137 ? 6.809  55.105 27.923 0.00 69.20  ? 140 ILE A HD12 1 
ATOM   2178 H HD13 . ILE A 1 137 ? 5.768  55.315 29.105 0.00 69.20  ? 140 ILE A HD13 1 
ATOM   2179 N N    . SER A 1 138 ? 10.629 52.630 30.922 1.00 34.81  ? 141 SER A N    1 
ATOM   2180 C CA   . SER A 1 138 ? 11.153 51.475 31.644 1.00 40.45  ? 141 SER A CA   1 
ATOM   2181 C C    . SER A 1 138 ? 12.313 51.872 32.548 1.00 42.18  ? 141 SER A C    1 
ATOM   2182 O O    . SER A 1 138 ? 12.404 51.414 33.694 1.00 38.18  ? 141 SER A O    1 
ATOM   2183 C CB   . SER A 1 138 ? 11.594 50.397 30.655 1.00 40.52  ? 141 SER A CB   1 
ATOM   2184 O OG   . SER A 1 138 ? 12.165 49.288 31.329 1.00 39.31  ? 141 SER A OG   1 
ATOM   2185 H H    . SER A 1 138 ? 10.690 52.576 30.066 0.00 41.82  ? 141 SER A H    1 
ATOM   2186 H HA   . SER A 1 138 ? 10.448 51.107 32.200 0.00 48.59  ? 141 SER A HA   1 
ATOM   2187 H HB2  . SER A 1 138 ? 10.821 50.095 30.152 0.00 48.68  ? 141 SER A HB2  1 
ATOM   2188 H HB3  . SER A 1 138 ? 12.255 50.773 30.053 0.00 48.68  ? 141 SER A HB3  1 
ATOM   2189 H HG   . SER A 1 138 ? 11.602 48.949 31.852 0.00 47.22  ? 141 SER A HG   1 
ATOM   2190 N N    . THR A 1 139 ? 13.209 52.730 32.052 1.00 39.19  ? 142 THR A N    1 
ATOM   2191 C CA   . THR A 1 139 ? 14.363 53.137 32.848 1.00 37.53  ? 142 THR A CA   1 
ATOM   2192 C C    . THR A 1 139 ? 13.947 53.977 34.049 1.00 50.42  ? 142 THR A C    1 
ATOM   2193 O O    . THR A 1 139 ? 14.597 53.918 35.099 1.00 42.97  ? 142 THR A O    1 
ATOM   2194 C CB   . THR A 1 139 ? 15.354 53.909 31.975 1.00 51.84  ? 142 THR A CB   1 
ATOM   2195 O OG1  . THR A 1 139 ? 15.887 53.039 30.967 1.00 41.10  ? 142 THR A OG1  1 
ATOM   2196 C CG2  . THR A 1 139 ? 16.499 54.466 32.813 1.00 53.13  ? 142 THR A CG2  1 
ATOM   2197 H H    . THR A 1 139 ? 13.171 53.084 31.270 0.00 47.08  ? 142 THR A H    1 
ATOM   2198 H HA   . THR A 1 139 ? 14.811 52.343 33.179 0.00 45.08  ? 142 THR A HA   1 
ATOM   2199 H HB   . THR A 1 139 ? 14.896 54.653 31.554 0.00 62.26  ? 142 THR A HB   1 
ATOM   2200 H HG1  . THR A 1 139 ? 15.266 52.749 30.481 0.00 49.37  ? 142 THR A HG1  1 
ATOM   2201 H HG21 . THR A 1 139 ? 17.218 54.765 32.235 0.00 63.81  ? 142 THR A HG21 1 
ATOM   2202 H HG22 . THR A 1 139 ? 16.187 55.217 33.342 0.00 63.81  ? 142 THR A HG22 1 
ATOM   2203 H HG23 . THR A 1 139 ? 16.838 53.780 33.409 0.00 63.81  ? 142 THR A HG23 1 
ATOM   2204 N N    . ALA A 1 140 ? 12.877 54.764 33.918 1.00 40.99  ? 143 ALA A N    1 
ATOM   2205 C CA   . ALA A 1 140 ? 12.381 55.518 35.065 1.00 41.01  ? 143 ALA A CA   1 
ATOM   2206 C C    . ALA A 1 140 ? 11.834 54.583 36.137 1.00 39.38  ? 143 ALA A C    1 
ATOM   2207 O O    . ALA A 1 140 ? 12.012 54.830 37.335 1.00 47.64  ? 143 ALA A O    1 
ATOM   2208 C CB   . ALA A 1 140 ? 11.308 56.511 34.618 1.00 42.01  ? 143 ALA A CB   1 
ATOM   2209 H H    . ALA A 1 140 ? 12.432 54.877 33.191 0.00 49.24  ? 143 ALA A H    1 
ATOM   2210 H HA   . ALA A 1 140 ? 13.113 56.025 35.449 0.00 49.27  ? 143 ALA A HA   1 
ATOM   2211 H HB1  . ALA A 1 140 ? 10.994 57.006 35.390 0.00 50.46  ? 143 ALA A HB1  1 
ATOM   2212 H HB2  . ALA A 1 140 ? 11.693 57.120 33.968 0.00 50.46  ? 143 ALA A HB2  1 
ATOM   2213 H HB3  . ALA A 1 140 ? 10.572 56.021 34.217 0.00 50.46  ? 143 ALA A HB3  1 
ATOM   2214 N N    . ALA A 1 141 ? 11.170 53.501 35.724 1.00 44.23  ? 144 ALA A N    1 
ATOM   2215 C CA   . ALA A 1 141 ? 10.680 52.525 36.692 1.00 49.46  ? 144 ALA A CA   1 
ATOM   2216 C C    . ALA A 1 141 ? 11.835 51.854 37.423 1.00 47.33  ? 144 ALA A C    1 
ATOM   2217 O O    . ALA A 1 141 ? 11.751 51.596 38.630 1.00 43.48  ? 144 ALA A O    1 
ATOM   2218 C CB   . ALA A 1 141 ? 9.809  51.482 35.991 1.00 32.80  ? 144 ALA A CB   1 
ATOM   2219 H H    . ALA A 1 141 ? 10.993 53.313 34.904 0.00 53.13  ? 144 ALA A H    1 
ATOM   2220 H HA   . ALA A 1 141 ? 10.130 52.981 37.348 0.00 59.41  ? 144 ALA A HA   1 
ATOM   2221 H HB1  . ALA A 1 141 ? 9.504  50.834 36.646 0.00 39.41  ? 144 ALA A HB1  1 
ATOM   2222 H HB2  . ALA A 1 141 ? 9.048  51.926 35.586 0.00 39.41  ? 144 ALA A HB2  1 
ATOM   2223 H HB3  . ALA A 1 141 ? 10.335 51.038 35.308 0.00 39.41  ? 144 ALA A HB3  1 
ATOM   2224 N N    . MET A 1 142 ? 12.927 51.565 36.710 1.00 41.64  ? 145 MET A N    1 
ATOM   2225 C CA   . MET A 1 142 ? 14.087 50.961 37.356 1.00 43.23  ? 145 MET A CA   1 
ATOM   2226 C C    . MET A 1 142 ? 14.681 51.902 38.394 1.00 40.92  ? 145 MET A C    1 
ATOM   2227 O O    . MET A 1 142 ? 15.093 51.466 39.476 1.00 46.82  ? 145 MET A O    1 
ATOM   2228 C CB   . MET A 1 142 ? 15.142 50.592 36.312 1.00 60.82  ? 145 MET A CB   1 
ATOM   2229 C CG   . MET A 1 142 ? 16.277 49.732 36.865 1.00 45.72  ? 145 MET A CG   1 
ATOM   2230 S SD   . MET A 1 142 ? 17.693 49.577 35.760 1.00 47.80  ? 145 MET A SD   1 
ATOM   2231 C CE   . MET A 1 142 ? 18.342 51.247 35.765 1.00 42.26  ? 145 MET A CE   1 
ATOM   2232 H H    . MET A 1 142 ? 13.017 51.706 35.866 0.00 50.02  ? 145 MET A H    1 
ATOM   2233 H HA   . MET A 1 142 ? 13.804 50.143 37.793 0.00 51.93  ? 145 MET A HA   1 
ATOM   2234 H HB2  . MET A 1 142 ? 14.714 50.095 35.598 0.00 73.03  ? 145 MET A HB2  1 
ATOM   2235 H HB3  . MET A 1 142 ? 15.532 51.408 35.961 0.00 73.03  ? 145 MET A HB3  1 
ATOM   2236 H HG2  . MET A 1 142 ? 16.591 50.128 37.692 0.00 54.91  ? 145 MET A HG2  1 
ATOM   2237 H HG3  . MET A 1 142 ? 15.936 48.840 37.032 0.00 54.91  ? 145 MET A HG3  1 
ATOM   2238 H HE1  . MET A 1 142 ? 19.130 51.281 35.200 0.00 50.76  ? 145 MET A HE1  1 
ATOM   2239 H HE2  . MET A 1 142 ? 17.663 51.850 35.424 0.00 50.76  ? 145 MET A HE2  1 
ATOM   2240 H HE3  . MET A 1 142 ? 18.576 51.492 36.674 0.00 50.76  ? 145 MET A HE3  1 
ATOM   2241 N N    . LEU A 1 143 ? 14.733 53.199 38.084 1.00 33.64  ? 146 LEU A N    1 
ATOM   2242 C CA   . LEU A 1 143 ? 15.328 54.154 39.011 1.00 39.77  ? 146 LEU A CA   1 
ATOM   2243 C C    . LEU A 1 143 ? 14.503 54.281 40.282 1.00 44.45  ? 146 LEU A C    1 
ATOM   2244 O O    . LEU A 1 143 ? 15.059 54.535 41.358 1.00 42.43  ? 146 LEU A O    1 
ATOM   2245 C CB   . LEU A 1 143 ? 15.479 55.516 38.336 1.00 52.61  ? 146 LEU A CB   1 
ATOM   2246 C CG   . LEU A 1 143 ? 16.599 55.616 37.297 1.00 63.47  ? 146 LEU A CG   1 
ATOM   2247 C CD1  . LEU A 1 143 ? 16.389 56.823 36.396 1.00 60.23  ? 146 LEU A CD1  1 
ATOM   2248 C CD2  . LEU A 1 143 ? 17.961 55.680 37.971 1.00 46.93  ? 146 LEU A CD2  1 
ATOM   2249 H H    . LEU A 1 143 ? 14.436 53.544 37.354 0.00 40.42  ? 146 LEU A H    1 
ATOM   2250 H HA   . LEU A 1 143 ? 16.213 53.844 39.256 0.00 47.78  ? 146 LEU A HA   1 
ATOM   2251 H HB2  . LEU A 1 143 ? 14.646 55.726 37.884 0.00 63.19  ? 146 LEU A HB2  1 
ATOM   2252 H HB3  . LEU A 1 143 ? 15.661 56.178 39.022 0.00 63.19  ? 146 LEU A HB3  1 
ATOM   2253 H HG   . LEU A 1 143 ? 16.581 54.821 36.743 0.00 76.22  ? 146 LEU A HG   1 
ATOM   2254 H HD11 . LEU A 1 143 ? 17.113 56.866 35.752 0.00 72.33  ? 146 LEU A HD11 1 
ATOM   2255 H HD12 . LEU A 1 143 ? 15.541 56.729 35.935 0.00 72.33  ? 146 LEU A HD12 1 
ATOM   2256 H HD13 . LEU A 1 143 ? 16.382 57.626 36.940 0.00 72.33  ? 146 LEU A HD13 1 
ATOM   2257 H HD21 . LEU A 1 143 ? 18.648 55.750 37.289 0.00 56.37  ? 146 LEU A HD21 1 
ATOM   2258 H HD22 . LEU A 1 143 ? 17.990 56.457 38.551 0.00 56.37  ? 146 LEU A HD22 1 
ATOM   2259 H HD23 . LEU A 1 143 ? 18.094 54.873 38.492 0.00 56.37  ? 146 LEU A HD23 1 
ATOM   2260 N N    . TYR A 1 144 ? 13.183 54.113 40.184 1.00 46.37  ? 147 TYR A N    1 
ATOM   2261 C CA   . TYR A 1 144 ? 12.363 54.062 41.388 1.00 51.50  ? 147 TYR A CA   1 
ATOM   2262 C C    . TYR A 1 144 ? 12.717 52.844 42.229 1.00 51.92  ? 147 TYR A C    1 
ATOM   2263 O O    . TYR A 1 144 ? 12.726 52.912 43.464 1.00 48.33  ? 147 TYR A O    1 
ATOM   2264 C CB   . TYR A 1 144 ? 10.882 54.027 41.023 1.00 53.10  ? 147 TYR A CB   1 
ATOM   2265 C CG   . TYR A 1 144 ? 10.002 53.772 42.220 1.00 39.02  ? 147 TYR A CG   1 
ATOM   2266 C CD1  . TYR A 1 144 ? 9.803  54.756 43.177 1.00 48.18  ? 147 TYR A CD1  1 
ATOM   2267 C CD2  . TYR A 1 144 ? 9.412  52.533 42.421 1.00 43.61  ? 147 TYR A CD2  1 
ATOM   2268 C CE1  . TYR A 1 144 ? 9.010  54.527 44.282 1.00 59.27  ? 147 TYR A CE1  1 
ATOM   2269 C CE2  . TYR A 1 144 ? 8.619  52.291 43.525 1.00 53.73  ? 147 TYR A CE2  1 
ATOM   2270 C CZ   . TYR A 1 144 ? 8.424  53.291 44.454 1.00 58.56  ? 147 TYR A CZ   1 
ATOM   2271 O OH   . TYR A 1 144 ? 7.637  53.057 45.558 1.00 67.97  ? 147 TYR A OH   1 
ATOM   2272 H H    . TYR A 1 144 ? 12.748 54.029 39.446 0.00 55.69  ? 147 TYR A H    1 
ATOM   2273 H HA   . TYR A 1 144 ? 12.527 54.864 41.908 0.00 61.85  ? 147 TYR A HA   1 
ATOM   2274 H HB2  . TYR A 1 144 ? 10.629 54.882 40.640 0.00 63.77  ? 147 TYR A HB2  1 
ATOM   2275 H HB3  . TYR A 1 144 ? 10.730 53.318 40.380 0.00 63.77  ? 147 TYR A HB3  1 
ATOM   2276 H HD1  . TYR A 1 144 ? 10.211 55.586 43.072 0.00 57.86  ? 147 TYR A HD1  1 
ATOM   2277 H HD2  . TYR A 1 144 ? 9.552  51.854 41.801 0.00 52.38  ? 147 TYR A HD2  1 
ATOM   2278 H HE1  . TYR A 1 144 ? 8.873  55.201 44.908 0.00 71.18  ? 147 TYR A HE1  1 
ATOM   2279 H HE2  . TYR A 1 144 ? 8.220  51.459 43.641 0.00 64.53  ? 147 TYR A HE2  1 
ATOM   2280 H HH   . TYR A 1 144 ? 7.511  52.232 45.651 0.00 81.62  ? 147 TYR A HH   1 
ATOM   2281 N N    . ILE A 1 145 ? 13.004 51.717 41.576 1.00 37.82  ? 148 ILE A N    1 
ATOM   2282 C CA   . ILE A 1 145 ? 13.358 50.503 42.304 1.00 35.48  ? 148 ILE A CA   1 
ATOM   2283 C C    . ILE A 1 145 ? 14.706 50.673 42.996 1.00 45.91  ? 148 ILE A C    1 
ATOM   2284 O O    . ILE A 1 145 ? 14.868 50.320 44.170 1.00 35.77  ? 148 ILE A O    1 
ATOM   2285 C CB   . ILE A 1 145 ? 13.358 49.292 41.352 1.00 52.99  ? 148 ILE A CB   1 
ATOM   2286 C CG1  . ILE A 1 145 ? 11.926 48.936 40.944 1.00 52.47  ? 148 ILE A CG1  1 
ATOM   2287 C CG2  . ILE A 1 145 ? 14.036 48.098 42.006 1.00 43.93  ? 148 ILE A CG2  1 
ATOM   2288 C CD1  . ILE A 1 145 ? 11.838 48.065 39.703 1.00 44.96  ? 148 ILE A CD1  1 
ATOM   2289 H H    . ILE A 1 145 ? 13.001 51.631 40.721 0.00 45.43  ? 148 ILE A H    1 
ATOM   2290 H HA   . ILE A 1 145 ? 12.690 50.346 42.989 0.00 42.62  ? 148 ILE A HA   1 
ATOM   2291 H HB   . ILE A 1 145 ? 13.858 49.532 40.555 0.00 63.64  ? 148 ILE A HB   1 
ATOM   2292 H HG12 . ILE A 1 145 ? 11.505 48.454 41.673 0.00 63.01  ? 148 ILE A HG12 1 
ATOM   2293 H HG13 . ILE A 1 145 ? 11.440 49.756 40.764 0.00 63.01  ? 148 ILE A HG13 1 
ATOM   2294 H HG21 . ILE A 1 145 ? 13.795 47.293 41.520 0.00 52.77  ? 148 ILE A HG21 1 
ATOM   2295 H HG22 . ILE A 1 145 ? 14.997 48.226 41.979 0.00 52.77  ? 148 ILE A HG22 1 
ATOM   2296 H HG23 . ILE A 1 145 ? 13.737 48.030 42.926 0.00 52.77  ? 148 ILE A HG23 1 
ATOM   2297 H HD11 . ILE A 1 145 ? 10.906 47.959 39.456 0.00 54.00  ? 148 ILE A HD11 1 
ATOM   2298 H HD12 . ILE A 1 145 ? 12.325 48.493 38.982 0.00 54.00  ? 148 ILE A HD12 1 
ATOM   2299 H HD13 . ILE A 1 145 ? 12.229 47.198 39.897 0.00 54.00  ? 148 ILE A HD13 1 
ATOM   2300 N N    . LEU A 1 146 ? 15.695 51.215 42.279 1.00 41.18  ? 149 LEU A N    1 
ATOM   2301 C CA   . LEU A 1 146 ? 17.013 51.406 42.877 1.00 43.26  ? 149 LEU A CA   1 
ATOM   2302 C C    . LEU A 1 146 ? 16.941 52.364 44.059 1.00 59.17  ? 149 LEU A C    1 
ATOM   2303 O O    . LEU A 1 146 ? 17.639 52.179 45.063 1.00 55.93  ? 149 LEU A O    1 
ATOM   2304 C CB   . LEU A 1 146 ? 17.998 51.924 41.827 1.00 43.01  ? 149 LEU A CB   1 
ATOM   2305 C CG   . LEU A 1 146 ? 18.221 51.038 40.598 1.00 53.93  ? 149 LEU A CG   1 
ATOM   2306 C CD1  . LEU A 1 146 ? 19.385 51.565 39.772 1.00 60.76  ? 149 LEU A CD1  1 
ATOM   2307 C CD2  . LEU A 1 146 ? 18.449 49.584 40.988 1.00 60.01  ? 149 LEU A CD2  1 
ATOM   2308 H H    . LEU A 1 146 ? 15.628 51.474 41.462 0.00 49.46  ? 149 LEU A H    1 
ATOM   2309 H HA   . LEU A 1 146 ? 17.340 50.551 43.197 0.00 51.96  ? 149 LEU A HA   1 
ATOM   2310 H HB2  . LEU A 1 146 ? 17.672 52.779 41.506 0.00 51.66  ? 149 LEU A HB2  1 
ATOM   2311 H HB3  . LEU A 1 146 ? 18.861 52.038 42.256 0.00 51.66  ? 149 LEU A HB3  1 
ATOM   2312 H HG   . LEU A 1 146 ? 17.421 51.063 40.051 0.00 64.77  ? 149 LEU A HG   1 
ATOM   2313 H HD11 . LEU A 1 146 ? 19.511 50.990 39.002 0.00 72.96  ? 149 LEU A HD11 1 
ATOM   2314 H HD12 . LEU A 1 146 ? 19.182 52.468 39.481 0.00 72.96  ? 149 LEU A HD12 1 
ATOM   2315 H HD13 . LEU A 1 146 ? 20.186 51.566 40.320 0.00 72.96  ? 149 LEU A HD13 1 
ATOM   2316 H HD21 . LEU A 1 146 ? 18.735 49.089 40.205 0.00 72.06  ? 149 LEU A HD21 1 
ATOM   2317 H HD22 . LEU A 1 146 ? 19.133 49.545 41.673 0.00 72.06  ? 149 LEU A HD22 1 
ATOM   2318 H HD23 . LEU A 1 146 ? 17.618 49.215 41.327 0.00 72.06  ? 149 LEU A HD23 1 
ATOM   2319 N N    . TYR A 1 147 ? 16.099 53.395 43.957 1.00 36.56  ? 150 TYR A N    1 
ATOM   2320 C CA   . TYR A 1 147 ? 15.923 54.325 45.066 1.00 56.13  ? 150 TYR A CA   1 
ATOM   2321 C C    . TYR A 1 147 ? 15.432 53.604 46.316 1.00 68.05  ? 150 TYR A C    1 
ATOM   2322 O O    . TYR A 1 147 ? 15.973 53.794 47.411 1.00 43.68  ? 150 TYR A O    1 
ATOM   2323 C CB   . TYR A 1 147 ? 14.947 55.430 44.664 1.00 51.91  ? 150 TYR A CB   1 
ATOM   2324 C CG   . TYR A 1 147 ? 14.698 56.447 45.753 1.00 53.99  ? 150 TYR A CG   1 
ATOM   2325 C CD1  . TYR A 1 147 ? 15.646 57.414 46.061 1.00 60.29  ? 150 TYR A CD1  1 
ATOM   2326 C CD2  . TYR A 1 147 ? 13.514 56.436 46.476 1.00 66.64  ? 150 TYR A CD2  1 
ATOM   2327 C CE1  . TYR A 1 147 ? 15.418 58.342 47.059 1.00 76.41  ? 150 TYR A CE1  1 
ATOM   2328 C CE2  . TYR A 1 147 ? 13.276 57.358 47.473 1.00 74.94  ? 150 TYR A CE2  1 
ATOM   2329 C CZ   . TYR A 1 147 ? 14.231 58.309 47.761 1.00 74.66  ? 150 TYR A CZ   1 
ATOM   2330 O OH   . TYR A 1 147 ? 13.996 59.230 48.755 1.00 82.32  ? 150 TYR A OH   1 
ATOM   2331 H H    . TYR A 1 147 ? 15.624 53.574 43.263 0.00 43.92  ? 150 TYR A H    1 
ATOM   2332 H HA   . TYR A 1 147 ? 16.779 54.734 45.273 0.00 67.41  ? 150 TYR A HA   1 
ATOM   2333 H HB2  . TYR A 1 147 ? 15.307 55.901 43.896 0.00 62.34  ? 150 TYR A HB2  1 
ATOM   2334 H HB3  . TYR A 1 147 ? 14.095 55.026 44.436 0.00 62.34  ? 150 TYR A HB3  1 
ATOM   2335 H HD1  . TYR A 1 147 ? 16.447 57.437 45.589 0.00 72.40  ? 150 TYR A HD1  1 
ATOM   2336 H HD2  . TYR A 1 147 ? 12.868 55.795 46.284 0.00 80.01  ? 150 TYR A HD2  1 
ATOM   2337 H HE1  . TYR A 1 147 ? 16.060 58.985 47.255 0.00 91.74  ? 150 TYR A HE1  1 
ATOM   2338 H HE2  . TYR A 1 147 ? 12.477 57.339 47.948 0.00 89.98  ? 150 TYR A HE2  1 
ATOM   2339 H HH   . TYR A 1 147 ? 13.247 59.088 49.107 0.00 98.83  ? 150 TYR A HH   1 
ATOM   2340 N N    . VAL A 1 148 ? 14.399 52.771 46.169 1.00 52.57  ? 151 VAL A N    1 
ATOM   2341 C CA   . VAL A 1 148 ? 13.843 52.066 47.321 1.00 49.60  ? 151 VAL A CA   1 
ATOM   2342 C C    . VAL A 1 148 ? 14.897 51.174 47.964 1.00 64.51  ? 151 VAL A C    1 
ATOM   2343 O O    . VAL A 1 148 ? 14.965 51.056 49.194 1.00 53.88  ? 151 VAL A O    1 
ATOM   2344 C CB   . VAL A 1 148 ? 12.601 51.258 46.900 1.00 68.55  ? 151 VAL A CB   1 
ATOM   2345 C CG1  . VAL A 1 148 ? 12.149 50.339 48.027 1.00 57.29  ? 151 VAL A CG1  1 
ATOM   2346 C CG2  . VAL A 1 148 ? 11.476 52.195 46.489 1.00 53.09  ? 151 VAL A CG2  1 
ATOM   2347 H H    . VAL A 1 148 ? 14.009 52.599 45.423 0.00 63.14  ? 151 VAL A H    1 
ATOM   2348 H HA   . VAL A 1 148 ? 13.568 52.722 47.980 0.00 59.58  ? 151 VAL A HA   1 
ATOM   2349 H HB   . VAL A 1 148 ? 12.830 50.705 46.137 0.00 82.32  ? 151 VAL A HB   1 
ATOM   2350 H HG11 . VAL A 1 148 ? 11.244 50.041 47.849 0.00 68.80  ? 151 VAL A HG11 1 
ATOM   2351 H HG12 . VAL A 1 148 ? 12.746 49.576 48.071 0.00 68.80  ? 151 VAL A HG12 1 
ATOM   2352 H HG13 . VAL A 1 148 ? 12.177 50.829 48.864 0.00 68.80  ? 151 VAL A HG13 1 
ATOM   2353 H HG21 . VAL A 1 148 ? 10.710 51.668 46.213 0.00 63.76  ? 151 VAL A HG21 1 
ATOM   2354 H HG22 . VAL A 1 148 ? 11.237 52.753 47.246 0.00 63.76  ? 151 VAL A HG22 1 
ATOM   2355 H HG23 . VAL A 1 148 ? 11.779 52.749 45.753 0.00 63.76  ? 151 VAL A HG23 1 
ATOM   2356 N N    . LEU A 1 149 ? 15.737 50.533 47.148 1.00 55.67  ? 152 LEU A N    1 
ATOM   2357 C CA   . LEU A 1 149 ? 16.727 49.610 47.688 1.00 56.90  ? 152 LEU A CA   1 
ATOM   2358 C C    . LEU A 1 149 ? 17.788 50.314 48.523 1.00 66.49  ? 152 LEU A C    1 
ATOM   2359 O O    . LEU A 1 149 ? 18.420 49.668 49.365 1.00 61.50  ? 152 LEU A O    1 
ATOM   2360 C CB   . LEU A 1 149 ? 17.401 48.833 46.553 1.00 52.77  ? 152 LEU A CB   1 
ATOM   2361 C CG   . LEU A 1 149 ? 16.520 47.858 45.767 1.00 68.41  ? 152 LEU A CG   1 
ATOM   2362 C CD1  . LEU A 1 149 ? 17.340 47.150 44.698 1.00 49.68  ? 152 LEU A CD1  1 
ATOM   2363 C CD2  . LEU A 1 149 ? 15.847 46.849 46.686 1.00 55.24  ? 152 LEU A CD2  1 
ATOM   2364 H H    . LEU A 1 149 ? 15.751 50.615 46.292 0.00 66.85  ? 152 LEU A H    1 
ATOM   2365 H HA   . LEU A 1 149 ? 16.270 48.974 48.260 0.00 68.33  ? 152 LEU A HA   1 
ATOM   2366 H HB2  . LEU A 1 149 ? 17.751 49.476 45.917 0.00 63.38  ? 152 LEU A HB2  1 
ATOM   2367 H HB3  . LEU A 1 149 ? 18.127 48.315 46.935 0.00 63.38  ? 152 LEU A HB3  1 
ATOM   2368 H HG   . LEU A 1 149 ? 15.816 48.363 45.330 0.00 82.14  ? 152 LEU A HG   1 
ATOM   2369 H HD11 . LEU A 1 149 ? 16.761 46.549 44.203 0.00 59.67  ? 152 LEU A HD11 1 
ATOM   2370 H HD12 . LEU A 1 149 ? 17.718 47.813 44.099 0.00 59.67  ? 152 LEU A HD12 1 
ATOM   2371 H HD13 . LEU A 1 149 ? 18.050 46.648 45.126 0.00 59.67  ? 152 LEU A HD13 1 
ATOM   2372 H HD21 . LEU A 1 149 ? 15.421 46.164 46.146 0.00 66.34  ? 152 LEU A HD21 1 
ATOM   2373 H HD22 . LEU A 1 149 ? 16.518 46.447 47.260 0.00 66.34  ? 152 LEU A HD22 1 
ATOM   2374 H HD23 . LEU A 1 149 ? 15.182 47.306 47.224 0.00 66.34  ? 152 LEU A HD23 1 
ATOM   2375 N N    A PHE A 1 150 ? 18.014 51.608 48.286 0.55 70.75  ? 153 PHE A N    1 
ATOM   2376 N N    B PHE A 1 150 ? 17.984 51.619 48.341 0.45 70.75  ? 153 PHE A N    1 
ATOM   2377 C CA   A PHE A 1 150 ? 19.009 52.401 49.002 0.55 68.38  ? 153 PHE A CA   1 
ATOM   2378 C CA   B PHE A 1 150 ? 19.018 52.333 49.079 0.45 68.42  ? 153 PHE A CA   1 
ATOM   2379 C C    A PHE A 1 150 ? 18.415 53.223 50.134 0.55 69.74  ? 153 PHE A C    1 
ATOM   2380 C C    B PHE A 1 150 ? 18.478 53.324 50.100 0.45 69.71  ? 153 PHE A C    1 
ATOM   2381 O O    A PHE A 1 150 ? 18.986 53.270 51.228 0.55 74.23  ? 153 PHE A O    1 
ATOM   2382 O O    B PHE A 1 150 ? 19.161 53.590 51.091 0.45 74.84  ? 153 PHE A O    1 
ATOM   2383 C CB   A PHE A 1 150 ? 19.721 53.360 48.042 0.55 75.32  ? 153 PHE A CB   1 
ATOM   2384 C CB   B PHE A 1 150 ? 19.950 53.069 48.107 0.45 74.58  ? 153 PHE A CB   1 
ATOM   2385 C CG   A PHE A 1 150 ? 20.938 52.781 47.387 0.55 73.74  ? 153 PHE A CG   1 
ATOM   2386 C CG   B PHE A 1 150 ? 21.408 52.828 48.377 0.45 70.34  ? 153 PHE A CG   1 
ATOM   2387 C CD1  A PHE A 1 150 ? 22.112 52.608 48.101 0.55 69.67  ? 153 PHE A CD1  1 
ATOM   2388 C CD1  B PHE A 1 150 ? 21.999 53.299 49.537 0.45 72.63  ? 153 PHE A CD1  1 
ATOM   2389 C CD2  A PHE A 1 150 ? 20.920 52.445 46.047 0.55 63.48  ? 153 PHE A CD2  1 
ATOM   2390 C CD2  B PHE A 1 150 ? 22.182 52.110 47.481 0.45 75.18  ? 153 PHE A CD2  1 
ATOM   2391 C CE1  A PHE A 1 150 ? 23.237 52.084 47.494 0.55 74.97  ? 153 PHE A CE1  1 
ATOM   2392 C CE1  B PHE A 1 150 ? 23.338 53.071 49.791 0.45 77.54  ? 153 PHE A CE1  1 
ATOM   2393 C CE2  A PHE A 1 150 ? 22.041 51.929 45.435 0.55 59.01  ? 153 PHE A CE2  1 
ATOM   2394 C CE2  B PHE A 1 150 ? 23.521 51.877 47.730 0.45 71.90  ? 153 PHE A CE2  1 
ATOM   2395 C CZ   A PHE A 1 150 ? 23.200 51.745 46.159 0.55 73.59  ? 153 PHE A CZ   1 
ATOM   2396 C CZ   B PHE A 1 150 ? 24.100 52.358 48.887 0.45 77.38  ? 153 PHE A CZ   1 
ATOM   2397 H H    A PHE A 1 150 ? 17.587 52.063 47.694 0.55 84.95  ? 153 PHE A H    1 
ATOM   2398 H H    B PHE A 1 150 ? 17.532 52.108 47.798 0.45 84.96  ? 153 PHE A H    1 
ATOM   2399 H HA   A PHE A 1 150 ? 19.665 51.791 49.373 0.55 82.11  ? 153 PHE A HA   1 
ATOM   2400 H HA   B PHE A 1 150 ? 19.551 51.685 49.565 0.45 82.16  ? 153 PHE A HA   1 
ATOM   2401 H HB2  A PHE A 1 150 ? 19.102 53.614 47.341 0.55 90.44  ? 153 PHE A HB2  1 
ATOM   2402 H HB2  B PHE A 1 150 ? 19.761 52.768 47.205 0.45 89.55  ? 153 PHE A HB2  1 
ATOM   2403 H HB3  A PHE A 1 150 ? 20.000 54.145 48.539 0.55 90.44  ? 153 PHE A HB3  1 
ATOM   2404 H HB3  B PHE A 1 150 ? 19.788 54.022 48.180 0.45 89.55  ? 153 PHE A HB3  1 
ATOM   2405 H HD1  A PHE A 1 150 ? 22.144 52.846 48.999 0.55 83.65  ? 153 PHE A HD1  1 
ATOM   2406 H HD1  B PHE A 1 150 ? 21.489 53.774 50.153 0.45 87.21  ? 153 PHE A HD1  1 
ATOM   2407 H HD2  A PHE A 1 150 ? 20.142 52.568 45.552 0.55 76.22  ? 153 PHE A HD2  1 
ATOM   2408 H HD2  B PHE A 1 150 ? 21.796 51.780 46.702 0.45 90.27  ? 153 PHE A HD2  1 
ATOM   2409 H HE1  A PHE A 1 150 ? 24.017 51.961 47.985 0.55 90.01  ? 153 PHE A HE1  1 
ATOM   2410 H HE1  B PHE A 1 150 ? 23.726 53.398 50.571 0.45 93.10  ? 153 PHE A HE1  1 
ATOM   2411 H HE2  A PHE A 1 150 ? 22.016 51.704 44.533 0.55 70.86  ? 153 PHE A HE2  1 
ATOM   2412 H HE2  B PHE A 1 150 ? 24.032 51.397 47.119 0.45 86.33  ? 153 PHE A HE2  1 
ATOM   2413 H HZ   A PHE A 1 150 ? 23.956 51.392 45.746 0.55 88.35  ? 153 PHE A HZ   1 
ATOM   2414 H HZ   B PHE A 1 150 ? 25.001 52.203 49.057 0.45 92.91  ? 153 PHE A HZ   1 
ATOM   2415 N N    . PHE A 1 151 ? 17.283 53.882 49.891 1.00 60.76  ? 154 PHE A N    1 
ATOM   2416 C CA   . PHE A 1 151 ? 16.685 54.813 50.841 1.00 77.63  ? 154 PHE A CA   1 
ATOM   2417 C C    . PHE A 1 151 ? 15.436 54.245 51.507 1.00 89.49  ? 154 PHE A C    1 
ATOM   2418 O O    . PHE A 1 151 ? 14.635 55.004 52.063 1.00 83.39  ? 154 PHE A O    1 
ATOM   2419 C CB   . PHE A 1 151 ? 16.358 56.137 50.149 1.00 73.57  ? 154 PHE A CB   1 
ATOM   2420 C CG   . PHE A 1 151 ? 17.553 56.812 49.532 1.00 63.48  ? 154 PHE A CG   1 
ATOM   2421 C CD1  . PHE A 1 151 ? 18.094 56.349 48.343 1.00 72.30  ? 154 PHE A CD1  1 
ATOM   2422 C CD2  . PHE A 1 151 ? 18.138 57.908 50.145 1.00 74.06  ? 154 PHE A CD2  1 
ATOM   2423 C CE1  . PHE A 1 151 ? 19.192 56.969 47.776 1.00 75.25  ? 154 PHE A CE1  1 
ATOM   2424 C CE2  . PHE A 1 151 ? 19.237 58.531 49.583 1.00 81.54  ? 154 PHE A CE2  1 
ATOM   2425 C CZ   . PHE A 1 151 ? 19.764 58.060 48.398 1.00 76.87  ? 154 PHE A CZ   1 
ATOM   2426 H H    . PHE A 1 151 ? 16.830 53.804 49.164 0.00 72.97  ? 154 PHE A H    1 
ATOM   2427 H HA   . PHE A 1 151 ? 17.334 54.990 51.540 0.00 93.20  ? 154 PHE A HA   1 
ATOM   2428 H HB2  . PHE A 1 151 ? 15.716 55.969 49.442 0.00 88.33  ? 154 PHE A HB2  1 
ATOM   2429 H HB3  . PHE A 1 151 ? 15.980 56.745 50.803 0.00 88.33  ? 154 PHE A HB3  1 
ATOM   2430 H HD1  . PHE A 1 151 ? 17.713 55.613 47.922 0.00 86.82  ? 154 PHE A HD1  1 
ATOM   2431 H HD2  . PHE A 1 151 ? 17.787 58.228 50.945 0.00 88.93  ? 154 PHE A HD2  1 
ATOM   2432 H HE1  . PHE A 1 151 ? 19.545 56.651 46.977 0.00 90.35  ? 154 PHE A HE1  1 
ATOM   2433 H HE2  . PHE A 1 151 ? 19.620 59.266 50.004 0.00 97.90  ? 154 PHE A HE2  1 
ATOM   2434 H HZ   . PHE A 1 151 ? 20.504 58.478 48.019 0.00 92.29  ? 154 PHE A HZ   1 
ATOM   2435 N N    . GLY A 1 152 ? 15.254 52.927 51.466 1.00 100.98 ? 155 GLY A N    1 
ATOM   2436 C CA   . GLY A 1 152 ? 14.114 52.298 52.103 1.00 103.44 ? 155 GLY A CA   1 
ATOM   2437 C C    . GLY A 1 152 ? 14.483 51.007 52.803 1.00 102.39 ? 155 GLY A C    1 
ATOM   2438 O O    . GLY A 1 152 ? 14.105 50.786 53.958 1.00 104.15 ? 155 GLY A O    1 
ATOM   2439 H H    . GLY A 1 152 ? 15.783 52.376 51.071 0.00 120.92 ? 155 GLY A H    1 
ATOM   2440 H HA2  . GLY A 1 152 ? 13.738 52.905 52.760 0.00 123.88 ? 155 GLY A HA2  1 
ATOM   2441 H HA3  . GLY A 1 152 ? 13.441 52.101 51.433 0.00 123.88 ? 155 GLY A HA3  1 
ATOM   2442 N N    . PHE A 1 153 ? 15.227 50.145 52.109 1.00 94.17  ? 156 PHE A N    1 
ATOM   2443 C CA   . PHE A 1 153 ? 15.652 48.879 52.696 1.00 98.66  ? 156 PHE A CA   1 
ATOM   2444 C C    . PHE A 1 153 ? 16.896 49.058 53.559 1.00 106.83 ? 156 PHE A C    1 
ATOM   2445 O O    . PHE A 1 153 ? 16.964 48.538 54.678 1.00 100.90 ? 156 PHE A O    1 
ATOM   2446 C CB   . PHE A 1 153 ? 15.924 47.855 51.593 1.00 85.11  ? 156 PHE A CB   1 
ATOM   2447 C CG   . PHE A 1 153 ? 14.690 47.195 51.045 1.00 85.56  ? 156 PHE A CG   1 
ATOM   2448 C CD1  . PHE A 1 153 ? 13.431 47.715 51.285 1.00 90.79  ? 156 PHE A CD1  1 
ATOM   2449 C CD2  . PHE A 1 153 ? 14.800 46.048 50.276 1.00 81.32  ? 156 PHE A CD2  1 
ATOM   2450 C CE1  . PHE A 1 153 ? 12.307 47.099 50.776 1.00 91.73  ? 156 PHE A CE1  1 
ATOM   2451 C CE2  . PHE A 1 153 ? 13.678 45.432 49.764 1.00 82.42  ? 156 PHE A CE2  1 
ATOM   2452 C CZ   . PHE A 1 153 ? 12.431 45.957 50.015 1.00 87.60  ? 156 PHE A CZ   1 
ATOM   2453 H H    . PHE A 1 153 ? 15.496 50.270 51.302 0.00 112.74 ? 156 PHE A H    1 
ATOM   2454 H HA   . PHE A 1 153 ? 14.936 48.544 53.258 0.00 118.44 ? 156 PHE A HA   1 
ATOM   2455 H HB2  . PHE A 1 153 ? 16.369 48.303 50.857 0.00 101.88 ? 156 PHE A HB2  1 
ATOM   2456 H HB3  . PHE A 1 153 ? 16.495 47.158 51.952 0.00 101.88 ? 156 PHE A HB3  1 
ATOM   2457 H HD1  . PHE A 1 153 ? 13.341 48.487 51.794 0.00 108.69 ? 156 PHE A HD1  1 
ATOM   2458 H HD2  . PHE A 1 153 ? 15.640 45.690 50.103 0.00 97.33  ? 156 PHE A HD2  1 
ATOM   2459 H HE1  . PHE A 1 153 ? 11.465 47.454 50.947 0.00 109.82 ? 156 PHE A HE1  1 
ATOM   2460 H HE2  . PHE A 1 153 ? 13.764 44.662 49.249 0.00 98.65  ? 156 PHE A HE2  1 
ATOM   2461 H HZ   . PHE A 1 153 ? 11.673 45.543 49.671 0.00 104.87 ? 156 PHE A HZ   1 
ATOM   2462 N N    . THR A 1 154 ? 17.895 49.782 53.048 1.00 104.85 ? 157 THR A N    1 
ATOM   2463 C CA   . THR A 1 154 ? 19.140 49.954 53.791 1.00 114.42 ? 157 THR A CA   1 
ATOM   2464 C C    . THR A 1 154 ? 18.888 50.537 55.175 1.00 118.66 ? 157 THR A C    1 
ATOM   2465 O O    . THR A 1 154 ? 19.590 50.191 56.133 1.00 112.80 ? 157 THR A O    1 
ATOM   2466 C CB   . THR A 1 154 ? 20.099 50.852 53.009 1.00 99.25  ? 157 THR A CB   1 
ATOM   2467 O OG1  . THR A 1 154 ? 20.470 50.210 51.782 1.00 83.16  ? 157 THR A OG1  1 
ATOM   2468 C CG2  . THR A 1 154 ? 21.352 51.147 53.823 1.00 93.66  ? 157 THR A CG2  1 
ATOM   2469 H H    . THR A 1 154 ? 17.877 50.178 52.285 0.00 125.87 ? 157 THR A H    1 
ATOM   2470 H HA   . THR A 1 154 ? 19.559 49.086 53.900 0.00 137.36 ? 157 THR A HA   1 
ATOM   2471 H HB   . THR A 1 154 ? 19.659 51.694 52.814 0.00 119.15 ? 157 THR A HB   1 
ATOM   2472 H HG1  . THR A 1 154 ? 19.792 50.097 51.300 0.00 99.53  ? 157 THR A HG1  1 
ATOM   2473 H HG21 . THR A 1 154 ? 22.031 51.543 53.255 0.00 112.44 ? 157 THR A HG21 1 
ATOM   2474 H HG22 . THR A 1 154 ? 21.143 51.764 54.542 0.00 112.44 ? 157 THR A HG22 1 
ATOM   2475 H HG23 . THR A 1 154 ? 21.700 50.326 54.204 0.00 112.44 ? 157 THR A HG23 1 
ATOM   2476 N N    . SER A 1 155 ? 17.897 51.421 55.302 1.00 184.75 ? 158 SER A N    1 
ATOM   2477 C CA   . SER A 1 155 ? 17.607 52.023 56.598 1.00 188.62 ? 158 SER A CA   1 
ATOM   2478 C C    . SER A 1 155 ? 17.095 50.993 57.596 1.00 191.77 ? 158 SER A C    1 
ATOM   2479 O O    . SER A 1 155 ? 17.315 51.139 58.804 1.00 197.15 ? 158 SER A O    1 
ATOM   2480 C CB   . SER A 1 155 ? 16.586 53.147 56.433 1.00 197.04 ? 158 SER A CB   1 
ATOM   2481 O OG   . SER A 1 155 ? 15.344 52.642 55.972 1.00 193.33 ? 158 SER A OG   1 
ATOM   2482 H H    . SER A 1 155 ? 17.387 51.684 54.662 0.00 221.75 ? 158 SER A H    1 
ATOM   2483 H HA   . SER A 1 155 ? 18.425 52.404 56.954 0.00 226.39 ? 158 SER A HA   1 
ATOM   2484 N N    . LYS A 1 156 ? 16.415 49.951 57.118 1.00 149.32 ? 159 LYS A N    1 
ATOM   2485 C CA   . LYS A 1 156 ? 15.835 48.949 58.002 1.00 142.35 ? 159 LYS A CA   1 
ATOM   2486 C C    . LYS A 1 156 ? 16.788 47.794 58.276 1.00 132.34 ? 159 LYS A C    1 
ATOM   2487 O O    . LYS A 1 156 ? 16.782 47.244 59.384 1.00 119.67 ? 159 LYS A O    1 
ATOM   2488 C CB   . LYS A 1 156 ? 14.533 48.414 57.396 1.00 130.61 ? 159 LYS A CB   1 
ATOM   2489 C CG   . LYS A 1 156 ? 13.477 48.021 58.419 1.00 151.25 ? 159 LYS A CG   1 
ATOM   2490 C CD   . LYS A 1 156 ? 12.173 47.610 57.726 1.00 130.20 ? 159 LYS A CD   1 
ATOM   2491 C CE   . LYS A 1 156 ? 11.386 46.536 58.471 1.00 127.51 ? 159 LYS A CE   1 
ATOM   2492 N NZ   . LYS A 1 156 ? 12.218 45.490 59.087 1.00 122.83 ? 159 LYS A NZ   1 
ATOM   2493 H H    . LYS A 1 156 ? 16.277 49.803 56.282 0.00 179.24 ? 159 LYS A H    1 
ATOM   2494 H HA   . LYS A 1 156 ? 15.618 49.360 58.854 0.00 170.87 ? 159 LYS A HA   1 
ATOM   2495 H HB2  . LYS A 1 156 ? 14.151 49.102 56.828 0.00 156.78 ? 159 LYS A HB2  1 
ATOM   2496 H HB3  . LYS A 1 156 ? 14.739 47.626 56.869 0.00 156.78 ? 159 LYS A HB3  1 
ATOM   2497 H HG2  . LYS A 1 156 ? 13.797 47.271 58.943 0.00 181.55 ? 159 LYS A HG2  1 
ATOM   2498 H HG3  . LYS A 1 156 ? 13.292 48.776 58.999 0.00 181.55 ? 159 LYS A HG3  1 
ATOM   2499 H HD2  . LYS A 1 156 ? 11.602 48.390 57.647 0.00 156.29 ? 159 LYS A HD2  1 
ATOM   2500 H HD3  . LYS A 1 156 ? 12.384 47.262 56.846 0.00 156.29 ? 159 LYS A HD3  1 
ATOM   2501 H HE2  . LYS A 1 156 ? 10.877 46.960 59.179 0.00 153.06 ? 159 LYS A HE2  1 
ATOM   2502 H HE3  . LYS A 1 156 ? 10.786 46.102 57.845 0.00 153.06 ? 159 LYS A HE3  1 
ATOM   2503 H HZ1  . LYS A 1 156 ? 11.708 44.804 59.337 0.00 147.45 ? 159 LYS A HZ1  1 
ATOM   2504 H HZ2  . LYS A 1 156 ? 12.825 45.201 58.504 0.00 147.45 ? 159 LYS A HZ2  1 
ATOM   2505 H HZ3  . LYS A 1 156 ? 12.635 45.815 59.803 0.00 147.45 ? 159 LYS A HZ3  1 
ATOM   2506 N N    . ALA A 1 157 ? 17.608 47.416 57.292 1.00 122.49 ? 160 ALA A N    1 
ATOM   2507 C CA   . ALA A 1 157 ? 18.584 46.353 57.506 1.00 92.18  ? 160 ALA A CA   1 
ATOM   2508 C C    . ALA A 1 157 ? 19.548 46.707 58.630 1.00 109.29 ? 160 ALA A C    1 
ATOM   2509 O O    . ALA A 1 157 ? 19.920 45.845 59.436 1.00 92.25  ? 160 ALA A O    1 
ATOM   2510 C CB   . ALA A 1 157 ? 19.355 46.083 56.214 1.00 94.48  ? 160 ALA A CB   1 
ATOM   2511 H H    . ALA A 1 157 ? 17.618 47.756 56.502 0.00 147.04 ? 160 ALA A H    1 
ATOM   2512 H HA   . ALA A 1 157 ? 18.113 45.542 57.754 0.00 110.67 ? 160 ALA A HA   1 
ATOM   2513 H HB1  . ALA A 1 157 ? 19.968 45.345 56.360 0.00 113.43 ? 160 ALA A HB1  1 
ATOM   2514 H HB2  . ALA A 1 157 ? 18.726 45.856 55.512 0.00 113.43 ? 160 ALA A HB2  1 
ATOM   2515 H HB3  . ALA A 1 157 ? 19.851 46.880 55.969 0.00 113.43 ? 160 ALA A HB3  1 
ATOM   2516 N N    . GLU A 1 158 ? 19.963 47.973 58.702 1.00 127.18 ? 161 GLU A N    1 
ATOM   2517 C CA   . GLU A 1 158 ? 20.914 48.404 59.719 1.00 138.19 ? 161 GLU A CA   1 
ATOM   2518 C C    . GLU A 1 158 ? 20.383 48.226 61.135 1.00 136.22 ? 161 GLU A C    1 
ATOM   2519 O O    . GLU A 1 158 ? 21.172 48.293 62.085 1.00 140.91 ? 161 GLU A O    1 
ATOM   2520 C CB   . GLU A 1 158 ? 21.288 49.870 59.485 1.00 160.46 ? 161 GLU A CB   1 
ATOM   2521 C CG   . GLU A 1 158 ? 22.425 50.061 58.494 1.00 163.45 ? 161 GLU A CG   1 
ATOM   2522 C CD   . GLU A 1 158 ? 22.853 51.510 58.366 1.00 184.89 ? 161 GLU A CD   1 
ATOM   2523 O OE1  . GLU A 1 158 ? 22.328 52.356 59.120 1.00 202.16 ? 161 GLU A OE1  1 
ATOM   2524 O OE2  . GLU A 1 158 ? 23.714 51.803 57.510 1.00 176.00 ? 161 GLU A OE2  1 
ATOM   2525 H H    . GLU A 1 158 ? 19.707 48.600 58.172 0.00 152.67 ? 161 GLU A H    1 
ATOM   2526 H HA   . GLU A 1 158 ? 21.719 47.869 59.640 0.00 165.88 ? 161 GLU A HA   1 
ATOM   2527 H HB2  . GLU A 1 158 ? 20.512 50.338 59.139 0.00 192.60 ? 161 GLU A HB2  1 
ATOM   2528 H HB3  . GLU A 1 158 ? 21.562 50.260 60.329 0.00 192.60 ? 161 GLU A HB3  1 
ATOM   2529 H HG2  . GLU A 1 158 ? 23.192 49.547 58.790 0.00 196.20 ? 161 GLU A HG2  1 
ATOM   2530 H HG3  . GLU A 1 158 ? 22.138 49.755 57.619 0.00 196.20 ? 161 GLU A HG3  1 
ATOM   2531 N N    . SER A 1 159 ? 19.079 47.999 61.301 1.00 127.22 ? 162 SER A N    1 
ATOM   2532 C CA   . SER A 1 159 ? 18.470 47.807 62.611 1.00 123.42 ? 162 SER A CA   1 
ATOM   2533 C C    . SER A 1 159 ? 18.113 46.347 62.874 1.00 122.63 ? 162 SER A C    1 
ATOM   2534 O O    . SER A 1 159 ? 17.233 46.067 63.694 1.00 116.05 ? 162 SER A O    1 
ATOM   2535 C CB   . SER A 1 159 ? 17.225 48.687 62.745 1.00 138.61 ? 162 SER A CB   1 
ATOM   2536 O OG   . SER A 1 159 ? 16.238 48.321 61.796 1.00 127.98 ? 162 SER A OG   1 
ATOM   2537 H H    . SER A 1 159 ? 18.517 47.951 60.653 0.00 152.71 ? 162 SER A H    1 
ATOM   2538 H HA   . SER A 1 159 ? 19.107 48.080 63.289 0.00 148.16 ? 162 SER A HA   1 
ATOM   2539 H HB2  . SER A 1 159 ? 16.859 48.580 63.637 0.00 166.38 ? 162 SER A HB2  1 
ATOM   2540 H HB3  . SER A 1 159 ? 17.477 49.612 62.597 0.00 166.38 ? 162 SER A HB3  1 
ATOM   2541 H HG   . SER A 1 159 ? 16.544 48.402 61.018 0.00 153.63 ? 162 SER A HG   1 
ATOM   2542 N N    . MET A 1 160 ? 18.776 45.413 62.198 1.00 103.65 ? 163 MET A N    1 
ATOM   2543 C CA   . MET A 1 160 ? 18.519 43.988 62.363 1.00 100.66 ? 163 MET A CA   1 
ATOM   2544 C C    . MET A 1 160 ? 19.801 43.251 62.744 1.00 96.66  ? 163 MET A C    1 
ATOM   2545 O O    . MET A 1 160 ? 20.826 43.856 63.070 1.00 97.23  ? 163 MET A O    1 
ATOM   2546 C CB   . MET A 1 160 ? 17.908 43.396 61.093 1.00 97.62  ? 163 MET A CB   1 
ATOM   2547 C CG   . MET A 1 160 ? 16.538 43.908 60.793 1.00 111.34 ? 163 MET A CG   1 
ATOM   2548 S SD   . MET A 1 160 ? 15.645 42.727 59.786 1.00 107.13 ? 163 MET A SD   1 
ATOM   2549 C CE   . MET A 1 160 ? 13.994 43.210 60.228 1.00 104.71 ? 163 MET A CE   1 
ATOM   2550 H H    . MET A 1 160 ? 19.393 45.586 61.625 0.00 124.12 ? 163 MET A H    1 
ATOM   2551 H HA   . MET A 1 160 ? 17.881 43.898 63.088 0.00 120.54 ? 163 MET A HA   1 
ATOM   2552 H HB2  . MET A 1 160 ? 18.479 43.617 60.340 0.00 117.20 ? 163 MET A HB2  1 
ATOM   2553 H HB3  . MET A 1 160 ? 17.850 42.433 61.193 0.00 117.20 ? 163 MET A HB3  1 
ATOM   2554 H HG2  . MET A 1 160 ? 16.052 44.041 61.622 0.00 133.67 ? 163 MET A HG2  1 
ATOM   2555 H HG3  . MET A 1 160 ? 16.602 44.746 60.308 0.00 133.67 ? 163 MET A HG3  1 
ATOM   2556 H HE1  . MET A 1 160 ? 13.362 42.661 59.738 0.00 125.40 ? 163 MET A HE1  1 
ATOM   2557 H HE2  . MET A 1 160 ? 13.873 43.083 61.182 0.00 125.40 ? 163 MET A HE2  1 
ATOM   2558 H HE3  . MET A 1 160 ? 13.867 44.145 60.000 0.00 125.40 ? 163 MET A HE3  1 
ATOM   2559 N N    . ARG A 1 161 ? 19.720 41.927 62.704 1.00 93.07  ? 164 ARG A N    1 
ATOM   2560 C CA   . ARG A 1 161 ? 20.861 41.090 63.038 1.00 92.55  ? 164 ARG A CA   1 
ATOM   2561 C C    . ARG A 1 161 ? 22.058 41.496 62.178 1.00 84.50  ? 164 ARG A C    1 
ATOM   2562 O O    . ARG A 1 161 ? 21.896 41.758 60.979 1.00 81.57  ? 164 ARG A O    1 
ATOM   2563 C CB   . ARG A 1 161 ? 20.536 39.603 62.828 1.00 92.04  ? 164 ARG A CB   1 
ATOM   2564 C CG   . ARG A 1 161 ? 19.045 39.225 62.822 1.00 99.88  ? 164 ARG A CG   1 
ATOM   2565 C CD   . ARG A 1 161 ? 18.793 37.872 63.470 1.00 91.74  ? 164 ARG A CD   1 
ATOM   2566 N NE   . ARG A 1 161 ? 19.621 36.815 62.900 1.00 91.09  ? 164 ARG A NE   1 
ATOM   2567 C CZ   . ARG A 1 161 ? 19.279 36.067 61.858 1.00 87.03  ? 164 ARG A CZ   1 
ATOM   2568 N NH1  . ARG A 1 161 ? 18.129 36.238 61.226 1.00 106.84 ? 164 ARG A NH1  1 
ATOM   2569 N NH2  . ARG A 1 161 ? 20.114 35.120 61.440 1.00 81.94  ? 164 ARG A NH2  1 
ATOM   2570 H H    . ARG A 1 161 ? 19.013 41.487 62.487 0.00 111.43 ? 164 ARG A H    1 
ATOM   2571 H HA   . ARG A 1 161 ? 21.087 41.212 63.974 0.00 111.11 ? 164 ARG A HA   1 
ATOM   2572 H HB2  . ARG A 1 161 ? 20.903 39.332 61.972 0.00 110.50 ? 164 ARG A HB2  1 
ATOM   2573 H HB3  . ARG A 1 161 ? 20.955 39.099 63.543 0.00 110.50 ? 164 ARG A HB3  1 
ATOM   2574 H HG2  . ARG A 1 161 ? 18.544 39.894 63.314 0.00 119.91 ? 164 ARG A HG2  1 
ATOM   2575 H HG3  . ARG A 1 161 ? 18.731 39.184 61.905 0.00 119.91 ? 164 ARG A HG3  1 
ATOM   2576 H HD2  . ARG A 1 161 ? 18.992 37.932 64.417 0.00 110.14 ? 164 ARG A HD2  1 
ATOM   2577 H HD3  . ARG A 1 161 ? 17.863 37.627 63.342 0.00 110.14 ? 164 ARG A HD3  1 
ATOM   2578 H HE   . ARG A 1 161 ? 20.385 36.665 63.265 0.00 109.36 ? 164 ARG A HE   1 
ATOM   2579 H HH11 . ARG A 1 161 ? 17.581 36.847 61.489 0.00 128.26 ? 164 ARG A HH11 1 
ATOM   2580 H HH12 . ARG A 1 161 ? 17.929 35.741 60.553 0.00 128.26 ? 164 ARG A HH12 1 
ATOM   2581 H HH21 . ARG A 1 161 ? 20.863 34.998 61.844 0.00 98.38  ? 164 ARG A HH21 1 
ATOM   2582 H HH22 . ARG A 1 161 ? 19.904 34.628 60.766 0.00 98.38  ? 164 ARG A HH22 1 
ATOM   2583 N N    . PRO A 1 162 ? 23.266 41.574 62.748 1.00 55.52  ? 165 PRO A N    1 
ATOM   2584 C CA   . PRO A 1 162 ? 24.412 42.033 61.943 1.00 68.57  ? 165 PRO A CA   1 
ATOM   2585 C C    . PRO A 1 162 ? 24.650 41.195 60.699 1.00 59.02  ? 165 PRO A C    1 
ATOM   2586 O O    . PRO A 1 162 ? 25.045 41.737 59.659 1.00 53.79  ? 165 PRO A O    1 
ATOM   2587 C CB   . PRO A 1 162 ? 25.591 41.947 62.923 1.00 51.60  ? 165 PRO A CB   1 
ATOM   2588 C CG   . PRO A 1 162 ? 24.986 41.960 64.279 1.00 58.63  ? 165 PRO A CG   1 
ATOM   2589 C CD   . PRO A 1 162 ? 23.623 41.360 64.162 1.00 66.78  ? 165 PRO A CD   1 
ATOM   2590 H HA   . PRO A 1 162 ? 24.276 42.958 61.684 0.00 82.34  ? 165 PRO A HA   1 
ATOM   2591 H HB2  . PRO A 1 162 ? 26.082 41.124 62.773 0.00 61.97  ? 165 PRO A HB2  1 
ATOM   2592 H HB3  . PRO A 1 162 ? 26.176 42.710 62.799 0.00 61.97  ? 165 PRO A HB3  1 
ATOM   2593 H HG2  . PRO A 1 162 ? 25.536 41.436 64.882 0.00 70.41  ? 165 PRO A HG2  1 
ATOM   2594 H HG3  . PRO A 1 162 ? 24.926 42.875 64.595 0.00 70.41  ? 165 PRO A HG3  1 
ATOM   2595 H HD2  . PRO A 1 162 ? 23.646 40.413 64.371 0.00 80.18  ? 165 PRO A HD2  1 
ATOM   2596 H HD3  . PRO A 1 162 ? 22.996 41.813 64.747 0.00 80.18  ? 165 PRO A HD3  1 
ATOM   2597 N N    . GLU A 1 163 ? 24.422 39.881 60.774 1.00 69.80  ? 166 GLU A N    1 
ATOM   2598 C CA   . GLU A 1 163 ? 24.630 39.029 59.607 1.00 59.49  ? 166 GLU A CA   1 
ATOM   2599 C C    . GLU A 1 163 ? 23.625 39.327 58.503 1.00 48.39  ? 166 GLU A C    1 
ATOM   2600 O O    . GLU A 1 163 ? 23.944 39.166 57.319 1.00 58.47  ? 166 GLU A O    1 
ATOM   2601 C CB   . GLU A 1 163 ? 24.563 37.557 60.018 1.00 60.17  ? 166 GLU A CB   1 
ATOM   2602 C CG   . GLU A 1 163 ? 23.214 37.101 60.553 1.00 71.41  ? 166 GLU A CG   1 
ATOM   2603 C CD   . GLU A 1 163 ? 23.166 37.104 62.067 1.00 76.32  ? 166 GLU A CD   1 
ATOM   2604 O OE1  . GLU A 1 163 ? 23.441 38.164 62.670 1.00 73.00  ? 166 GLU A OE1  1 
ATOM   2605 O OE2  . GLU A 1 163 ? 22.852 36.049 62.656 1.00 77.57  ? 166 GLU A OE2  1 
ATOM   2606 H H    . GLU A 1 163 ? 24.151 39.467 61.478 0.00 83.81  ? 166 GLU A H    1 
ATOM   2607 H HA   . GLU A 1 163 ? 25.516 39.199 59.250 0.00 71.44  ? 166 GLU A HA   1 
ATOM   2608 H HB2  . GLU A 1 163 ? 24.767 37.012 59.241 0.00 72.25  ? 166 GLU A HB2  1 
ATOM   2609 H HB3  . GLU A 1 163 ? 25.220 37.402 60.714 0.00 72.25  ? 166 GLU A HB3  1 
ATOM   2610 H HG2  . GLU A 1 163 ? 22.524 37.701 60.227 0.00 85.75  ? 166 GLU A HG2  1 
ATOM   2611 H HG3  . GLU A 1 163 ? 23.039 36.197 60.247 0.00 85.75  ? 166 GLU A HG3  1 
ATOM   2612 N N    . VAL A 1 164 ? 22.415 39.762 58.862 1.00 49.24  ? 167 VAL A N    1 
ATOM   2613 C CA   . VAL A 1 164 ? 21.427 40.111 57.847 1.00 53.61  ? 167 VAL A CA   1 
ATOM   2614 C C    . VAL A 1 164 ? 21.789 41.438 57.192 1.00 57.25  ? 167 VAL A C    1 
ATOM   2615 O O    . VAL A 1 164 ? 21.630 41.611 55.978 1.00 68.49  ? 167 VAL A O    1 
ATOM   2616 C CB   . VAL A 1 164 ? 20.018 40.149 58.466 1.00 51.99  ? 167 VAL A CB   1 
ATOM   2617 C CG1  . VAL A 1 164 ? 19.016 40.719 57.477 1.00 56.59  ? 167 VAL A CG1  1 
ATOM   2618 C CG2  . VAL A 1 164 ? 19.594 38.758 58.913 1.00 59.35  ? 167 VAL A CG2  1 
ATOM   2619 H H    . VAL A 1 164 ? 22.148 39.862 59.673 0.00 59.14  ? 167 VAL A H    1 
ATOM   2620 H HA   . VAL A 1 164 ? 21.433 39.426 57.160 0.00 64.38  ? 167 VAL A HA   1 
ATOM   2621 H HB   . VAL A 1 164 ? 20.036 40.726 59.246 0.00 62.44  ? 167 VAL A HB   1 
ATOM   2622 H HG11 . VAL A 1 164 ? 18.119 40.507 57.779 0.00 67.96  ? 167 VAL A HG11 1 
ATOM   2623 H HG12 . VAL A 1 164 ? 19.131 41.681 57.429 0.00 67.96  ? 167 VAL A HG12 1 
ATOM   2624 H HG13 . VAL A 1 164 ? 19.173 40.323 56.605 0.00 67.96  ? 167 VAL A HG13 1 
ATOM   2625 H HG21 . VAL A 1 164 ? 18.740 38.820 59.370 0.00 71.27  ? 167 VAL A HG21 1 
ATOM   2626 H HG22 . VAL A 1 164 ? 19.511 38.187 58.133 0.00 71.27  ? 167 VAL A HG22 1 
ATOM   2627 H HG23 . VAL A 1 164 ? 20.266 38.401 59.515 0.00 71.27  ? 167 VAL A HG23 1 
ATOM   2628 N N    . ALA A 1 165 ? 22.285 42.392 57.982 1.00 54.68  ? 168 ALA A N    1 
ATOM   2629 C CA   . ALA A 1 165 ? 22.668 43.687 57.430 1.00 57.58  ? 168 ALA A CA   1 
ATOM   2630 C C    . ALA A 1 165 ? 23.883 43.563 56.519 1.00 60.16  ? 168 ALA A C    1 
ATOM   2631 O O    . ALA A 1 165 ? 23.944 44.206 55.464 1.00 52.67  ? 168 ALA A O    1 
ATOM   2632 C CB   . ALA A 1 165 ? 22.946 44.674 58.563 1.00 62.26  ? 168 ALA A CB   1 
ATOM   2633 H H    . ALA A 1 165 ? 22.408 42.315 58.830 0.00 65.66  ? 168 ALA A H    1 
ATOM   2634 H HA   . ALA A 1 165 ? 21.932 44.032 56.901 0.00 69.15  ? 168 ALA A HA   1 
ATOM   2635 H HB1  . ALA A 1 165 ? 23.188 45.532 58.181 0.00 74.76  ? 168 ALA A HB1  1 
ATOM   2636 H HB2  . ALA A 1 165 ? 22.147 44.766 59.105 0.00 74.76  ? 168 ALA A HB2  1 
ATOM   2637 H HB3  . ALA A 1 165 ? 23.676 44.335 59.104 0.00 74.76  ? 168 ALA A HB3  1 
ATOM   2638 N N    . SER A 1 166 ? 24.862 42.742 56.908 1.00 51.57  ? 169 SER A N    1 
ATOM   2639 C CA   . SER A 1 166 ? 26.062 42.591 56.093 1.00 51.93  ? 169 SER A CA   1 
ATOM   2640 C C    . SER A 1 166 ? 25.755 41.877 54.783 1.00 51.31  ? 169 SER A C    1 
ATOM   2641 O O    . SER A 1 166 ? 26.265 42.262 53.725 1.00 51.18  ? 169 SER A O    1 
ATOM   2642 C CB   . SER A 1 166 ? 27.133 41.834 56.877 1.00 56.84  ? 169 SER A CB   1 
ATOM   2643 O OG   . SER A 1 166 ? 28.433 42.254 56.501 1.00 64.17  ? 169 SER A OG   1 
ATOM   2644 H H    . SER A 1 166 ? 24.853 42.271 57.627 0.00 61.93  ? 169 SER A H    1 
ATOM   2645 H HA   . SER A 1 166 ? 26.409 43.472 55.881 0.00 62.36  ? 169 SER A HA   1 
ATOM   2646 H HB2  . SER A 1 166 ? 27.009 42.003 57.824 0.00 68.26  ? 169 SER A HB2  1 
ATOM   2647 H HB3  . SER A 1 166 ? 27.044 40.885 56.695 0.00 68.26  ? 169 SER A HB3  1 
ATOM   2648 H HG   . SER A 1 166 ? 29.009 41.849 56.958 0.00 77.05  ? 169 SER A HG   1 
ATOM   2649 N N    . THR A 1 167 ? 24.926 40.832 54.832 1.00 46.21  ? 170 THR A N    1 
ATOM   2650 C CA   . THR A 1 167 ? 24.592 40.101 53.614 1.00 50.27  ? 170 THR A CA   1 
ATOM   2651 C C    . THR A 1 167 ? 23.724 40.945 52.690 1.00 58.79  ? 170 THR A C    1 
ATOM   2652 O O    . THR A 1 167 ? 23.936 40.959 51.471 1.00 47.05  ? 170 THR A O    1 
ATOM   2653 C CB   . THR A 1 167 ? 23.888 38.791 53.965 1.00 49.55  ? 170 THR A CB   1 
ATOM   2654 O OG1  . THR A 1 167 ? 24.726 38.017 54.833 1.00 54.24  ? 170 THR A OG1  1 
ATOM   2655 C CG2  . THR A 1 167 ? 23.581 37.988 52.704 1.00 42.00  ? 170 THR A CG2  1 
ATOM   2656 H H    . THR A 1 167 ? 24.552 40.532 55.546 0.00 55.50  ? 170 THR A H    1 
ATOM   2657 H HA   . THR A 1 167 ? 25.412 39.884 53.143 0.00 60.38  ? 170 THR A HA   1 
ATOM   2658 H HB   . THR A 1 167 ? 23.049 38.985 54.411 0.00 59.51  ? 170 THR A HB   1 
ATOM   2659 H HG1  . THR A 1 167 ? 24.300 37.356 55.129 0.00 65.14  ? 170 THR A HG1  1 
ATOM   2660 H HG21 . THR A 1 167 ? 23.248 37.109 52.944 0.00 50.45  ? 170 THR A HG21 1 
ATOM   2661 H HG22 . THR A 1 167 ? 22.909 38.445 52.175 0.00 50.45  ? 170 THR A HG22 1 
ATOM   2662 H HG23 . THR A 1 167 ? 24.385 37.886 52.172 0.00 50.45  ? 170 THR A HG23 1 
ATOM   2663 N N    . PHE A 1 168 ? 22.743 41.657 53.249 1.00 45.50  ? 171 PHE A N    1 
ATOM   2664 C CA   . PHE A 1 168 ? 21.923 42.541 52.428 1.00 54.13  ? 171 PHE A CA   1 
ATOM   2665 C C    . PHE A 1 168 ? 22.772 43.598 51.732 1.00 50.21  ? 171 PHE A C    1 
ATOM   2666 O O    . PHE A 1 168 ? 22.578 43.876 50.543 1.00 49.40  ? 171 PHE A O    1 
ATOM   2667 C CB   . PHE A 1 168 ? 20.846 43.212 53.277 1.00 49.60  ? 171 PHE A CB   1 
ATOM   2668 C CG   . PHE A 1 168 ? 20.109 44.293 52.549 1.00 55.56  ? 171 PHE A CG   1 
ATOM   2669 C CD1  . PHE A 1 168 ? 19.157 43.979 51.596 1.00 52.47  ? 171 PHE A CD1  1 
ATOM   2670 C CD2  . PHE A 1 168 ? 20.392 45.625 52.796 1.00 48.34  ? 171 PHE A CD2  1 
ATOM   2671 C CE1  . PHE A 1 168 ? 18.489 44.974 50.915 1.00 58.27  ? 171 PHE A CE1  1 
ATOM   2672 C CE2  . PHE A 1 168 ? 19.728 46.624 52.119 1.00 56.43  ? 171 PHE A CE2  1 
ATOM   2673 C CZ   . PHE A 1 168 ? 18.779 46.298 51.174 1.00 59.63  ? 171 PHE A CZ   1 
ATOM   2674 H H    . PHE A 1 168 ? 22.538 41.646 54.084 0.00 54.65  ? 171 PHE A H    1 
ATOM   2675 H HA   . PHE A 1 168 ? 21.483 42.005 51.750 0.00 65.00  ? 171 PHE A HA   1 
ATOM   2676 H HB2  . PHE A 1 168 ? 20.199 42.542 53.551 0.00 59.57  ? 171 PHE A HB2  1 
ATOM   2677 H HB3  . PHE A 1 168 ? 21.263 43.609 54.058 0.00 59.57  ? 171 PHE A HB3  1 
ATOM   2678 H HD1  . PHE A 1 168 ? 18.966 43.087 51.412 0.00 63.01  ? 171 PHE A HD1  1 
ATOM   2679 H HD2  . PHE A 1 168 ? 21.038 45.848 53.427 0.00 58.06  ? 171 PHE A HD2  1 
ATOM   2680 H HE1  . PHE A 1 168 ? 17.844 44.753 50.282 0.00 69.98  ? 171 PHE A HE1  1 
ATOM   2681 H HE2  . PHE A 1 168 ? 19.920 47.516 52.298 0.00 67.77  ? 171 PHE A HE2  1 
ATOM   2682 H HZ   . PHE A 1 168 ? 18.333 46.970 50.711 0.00 71.61  ? 171 PHE A HZ   1 
ATOM   2683 N N    . LYS A 1 169 ? 23.712 44.207 52.459 1.00 50.98  ? 172 LYS A N    1 
ATOM   2684 C CA   . LYS A 1 169 ? 24.529 45.262 51.867 1.00 51.64  ? 172 LYS A CA   1 
ATOM   2685 C C    . LYS A 1 169 ? 25.312 44.747 50.666 1.00 53.95  ? 172 LYS A C    1 
ATOM   2686 O O    . LYS A 1 169 ? 25.502 45.472 49.682 1.00 54.19  ? 172 LYS A O    1 
ATOM   2687 C CB   . LYS A 1 169 ? 25.479 45.842 52.915 1.00 66.71  ? 172 LYS A CB   1 
ATOM   2688 C CG   . LYS A 1 169 ? 24.934 47.059 53.648 1.00 68.67  ? 172 LYS A CG   1 
ATOM   2689 C CD   . LYS A 1 169 ? 25.634 47.269 54.984 1.00 87.95  ? 172 LYS A CD   1 
ATOM   2690 C CE   . LYS A 1 169 ? 24.926 48.327 55.819 1.00 100.71 ? 172 LYS A CE   1 
ATOM   2691 N NZ   . LYS A 1 169 ? 25.413 49.700 55.501 1.00 123.67 ? 172 LYS A NZ   1 
ATOM   2692 H H    . LYS A 1 169 ? 23.893 44.029 53.280 0.00 61.23  ? 172 LYS A H    1 
ATOM   2693 H HA   . LYS A 1 169 ? 23.944 45.974 51.564 0.00 62.02  ? 172 LYS A HA   1 
ATOM   2694 N N    . VAL A 1 170 ? 25.776 43.499 50.727 1.00 45.72  ? 173 VAL A N    1 
ATOM   2695 C CA   . VAL A 1 170 ? 26.529 42.938 49.610 1.00 52.23  ? 173 VAL A CA   1 
ATOM   2696 C C    . VAL A 1 170 ? 25.601 42.642 48.439 1.00 48.26  ? 173 VAL A C    1 
ATOM   2697 O O    . VAL A 1 170 ? 25.917 42.954 47.284 1.00 44.07  ? 173 VAL A O    1 
ATOM   2698 C CB   . VAL A 1 170 ? 27.289 41.677 50.062 1.00 47.14  ? 173 VAL A CB   1 
ATOM   2699 C CG1  . VAL A 1 170 ? 27.938 40.980 48.870 1.00 52.53  ? 173 VAL A CG1  1 
ATOM   2700 C CG2  . VAL A 1 170 ? 28.333 42.034 51.108 1.00 54.44  ? 173 VAL A CG2  1 
ATOM   2701 H H    . VAL A 1 170 ? 25.671 42.965 51.393 0.00 54.91  ? 173 VAL A H    1 
ATOM   2702 H HA   . VAL A 1 170 ? 27.180 43.593 49.314 0.00 62.72  ? 173 VAL A HA   1 
ATOM   2703 H HB   . VAL A 1 170 ? 26.658 41.059 50.462 0.00 56.62  ? 173 VAL A HB   1 
ATOM   2704 H HG11 . VAL A 1 170 ? 28.496 40.256 49.193 0.00 63.08  ? 173 VAL A HG11 1 
ATOM   2705 H HG12 . VAL A 1 170 ? 27.242 40.629 48.292 0.00 63.08  ? 173 VAL A HG12 1 
ATOM   2706 H HG13 . VAL A 1 170 ? 28.478 41.623 48.384 0.00 63.08  ? 173 VAL A HG13 1 
ATOM   2707 H HG21 . VAL A 1 170 ? 28.812 41.230 51.363 0.00 65.38  ? 173 VAL A HG21 1 
ATOM   2708 H HG22 . VAL A 1 170 ? 28.950 42.681 50.732 0.00 65.38  ? 173 VAL A HG22 1 
ATOM   2709 H HG23 . VAL A 1 170 ? 27.888 42.413 51.882 0.00 65.38  ? 173 VAL A HG23 1 
ATOM   2710 N N    . LEU A 1 171 ? 24.445 42.034 48.713 1.00 39.66  ? 174 LEU A N    1 
ATOM   2711 C CA   . LEU A 1 171 ? 23.520 41.696 47.638 1.00 41.29  ? 174 LEU A CA   1 
ATOM   2712 C C    . LEU A 1 171 ? 22.870 42.945 47.059 1.00 47.34  ? 174 LEU A C    1 
ATOM   2713 O O    . LEU A 1 171 ? 22.487 42.957 45.884 1.00 40.96  ? 174 LEU A O    1 
ATOM   2714 C CB   . LEU A 1 171 ? 22.461 40.724 48.156 1.00 43.59  ? 174 LEU A CB   1 
ATOM   2715 C CG   . LEU A 1 171 ? 22.980 39.334 48.538 1.00 51.57  ? 174 LEU A CG   1 
ATOM   2716 C CD1  . LEU A 1 171 ? 21.869 38.514 49.170 1.00 44.96  ? 174 LEU A CD1  1 
ATOM   2717 C CD2  . LEU A 1 171 ? 23.577 38.599 47.346 1.00 39.71  ? 174 LEU A CD2  1 
ATOM   2718 H H    . LEU A 1 171 ? 24.178 41.812 49.500 0.00 47.64  ? 174 LEU A H    1 
ATOM   2719 H HA   . LEU A 1 171 ? 24.003 41.253 46.923 0.00 49.59  ? 174 LEU A HA   1 
ATOM   2720 H HB2  . LEU A 1 171 ? 22.054 41.110 48.948 0.00 52.36  ? 174 LEU A HB2  1 
ATOM   2721 H HB3  . LEU A 1 171 ? 21.792 40.604 47.464 0.00 52.36  ? 174 LEU A HB3  1 
ATOM   2722 H HG   . LEU A 1 171 ? 23.694 39.444 49.186 0.00 61.93  ? 174 LEU A HG   1 
ATOM   2723 H HD11 . LEU A 1 171 ? 22.218 37.642 49.410 0.00 54.01  ? 174 LEU A HD11 1 
ATOM   2724 H HD12 . LEU A 1 171 ? 21.551 38.973 49.963 0.00 54.01  ? 174 LEU A HD12 1 
ATOM   2725 H HD13 . LEU A 1 171 ? 21.146 38.417 48.531 0.00 54.01  ? 174 LEU A HD13 1 
ATOM   2726 H HD21 . LEU A 1 171 ? 23.756 37.680 47.598 0.00 47.70  ? 174 LEU A HD21 1 
ATOM   2727 H HD22 . LEU A 1 171 ? 22.944 38.623 46.611 0.00 47.70  ? 174 LEU A HD22 1 
ATOM   2728 H HD23 . LEU A 1 171 ? 24.402 39.038 47.085 0.00 47.70  ? 174 LEU A HD23 1 
ATOM   2729 N N    A ARG A 1 172 ? 22.729 43.996 47.872 0.79 41.75  ? 175 ARG A N    1 
ATOM   2730 N N    B ARG A 1 172 ? 22.737 44.003 47.861 0.21 42.20  ? 175 ARG A N    1 
ATOM   2731 C CA   A ARG A 1 172 ? 22.224 45.269 47.369 0.79 52.34  ? 175 ARG A CA   1 
ATOM   2732 C CA   B ARG A 1 172 ? 22.212 45.255 47.331 0.21 52.13  ? 175 ARG A CA   1 
ATOM   2733 C C    A ARG A 1 172 ? 23.210 45.899 46.393 0.79 49.38  ? 175 ARG A C    1 
ATOM   2734 C C    B ARG A 1 172 ? 23.210 45.912 46.386 0.21 49.43  ? 175 ARG A C    1 
ATOM   2735 O O    A ARG A 1 172 ? 22.814 46.399 45.334 0.79 42.26  ? 175 ARG A O    1 
ATOM   2736 O O    B ARG A 1 172 ? 22.824 46.441 45.338 0.21 42.62  ? 175 ARG A O    1 
ATOM   2737 C CB   A ARG A 1 172 ? 21.949 46.214 48.544 0.79 59.16  ? 175 ARG A CB   1 
ATOM   2738 C CB   B ARG A 1 172 ? 21.859 46.202 48.477 0.21 58.88  ? 175 ARG A CB   1 
ATOM   2739 C CG   A ARG A 1 172 ? 21.622 47.659 48.161 0.79 60.02  ? 175 ARG A CG   1 
ATOM   2740 C CG   B ARG A 1 172 ? 21.170 47.477 48.027 0.21 59.12  ? 175 ARG A CG   1 
ATOM   2741 C CD   A ARG A 1 172 ? 21.926 48.622 49.301 0.79 65.78  ? 175 ARG A CD   1 
ATOM   2742 C CD   B ARG A 1 172 ? 22.057 48.688 48.252 0.21 64.45  ? 175 ARG A CD   1 
ATOM   2743 N NE   A ARG A 1 172 ? 23.357 48.856 49.461 0.79 71.50  ? 175 ARG A NE   1 
ATOM   2744 N NE   B ARG A 1 172 ? 22.132 49.054 49.663 0.21 64.04  ? 175 ARG A NE   1 
ATOM   2745 C CZ   A ARG A 1 172 ? 23.896 49.560 50.448 0.79 69.88  ? 175 ARG A CZ   1 
ATOM   2746 C CZ   B ARG A 1 172 ? 23.249 49.130 50.376 0.21 66.99  ? 175 ARG A CZ   1 
ATOM   2747 N NH1  A ARG A 1 172 ? 23.150 50.126 51.383 0.79 64.15  ? 175 ARG A NH1  1 
ATOM   2748 N NH1  B ARG A 1 172 ? 24.436 48.876 49.845 0.21 61.72  ? 175 ARG A NH1  1 
ATOM   2749 N NH2  A ARG A 1 172 ? 25.218 49.702 50.497 0.79 55.29  ? 175 ARG A NH2  1 
ATOM   2750 N NH2  B ARG A 1 172 ? 23.176 49.472 51.659 0.21 64.93  ? 175 ARG A NH2  1 
ATOM   2751 H H    A ARG A 1 172 ? 22.918 43.996 48.711 0.79 50.15  ? 175 ARG A H    1 
ATOM   2752 H H    B ARG A 1 172 ? 22.940 44.019 48.696 0.21 50.70  ? 175 ARG A H    1 
ATOM   2753 H HA   A ARG A 1 172 ? 21.388 45.120 46.899 0.79 62.86  ? 175 ARG A HA   1 
ATOM   2754 H HA   B ARG A 1 172 ? 21.399 45.069 46.835 0.21 62.61  ? 175 ARG A HA   1 
ATOM   2755 H HB2  A ARG A 1 172 ? 21.193 45.869 49.043 0.79 71.04  ? 175 ARG A HB2  1 
ATOM   2756 H HB2  B ARG A 1 172 ? 21.262 45.743 49.088 0.21 70.70  ? 175 ARG A HB2  1 
ATOM   2757 H HB3  A ARG A 1 172 ? 22.738 46.237 49.109 0.79 71.04  ? 175 ARG A HB3  1 
ATOM   2758 H HB3  B ARG A 1 172 ? 22.675 46.453 48.936 0.21 70.70  ? 175 ARG A HB3  1 
ATOM   2759 H HG2  A ARG A 1 172 ? 22.156 47.917 47.393 0.79 72.08  ? 175 ARG A HG2  1 
ATOM   2760 H HG2  B ARG A 1 172 ? 20.968 47.418 47.080 0.21 70.99  ? 175 ARG A HG2  1 
ATOM   2761 H HG3  A ARG A 1 172 ? 20.678 47.729 47.946 0.79 72.08  ? 175 ARG A HG3  1 
ATOM   2762 H HG3  B ARG A 1 172 ? 20.352 47.598 48.534 0.21 70.99  ? 175 ARG A HG3  1 
ATOM   2763 H HD2  A ARG A 1 172 ? 21.499 49.474 49.121 0.79 78.98  ? 175 ARG A HD2  1 
ATOM   2764 H HD2  B ARG A 1 172 ? 22.954 48.488 47.942 0.21 77.39  ? 175 ARG A HD2  1 
ATOM   2765 H HD3  A ARG A 1 172 ? 21.586 48.250 50.130 0.79 78.98  ? 175 ARG A HD3  1 
ATOM   2766 H HD3  B ARG A 1 172 ? 21.697 49.443 47.762 0.21 77.39  ? 175 ARG A HD3  1 
ATOM   2767 H HE   A ARG A 1 172 ? 23.887 48.515 48.876 0.79 85.86  ? 175 ARG A HE   1 
ATOM   2768 H HE   B ARG A 1 172 ? 21.393 49.234 50.065 0.21 76.90  ? 175 ARG A HE   1 
ATOM   2769 H HH11 A ARG A 1 172 ? 22.294 50.042 51.359 0.79 77.03  ? 175 ARG A HH11 1 
ATOM   2770 H HH11 B ARG A 1 172 ? 24.497 48.653 49.016 0.21 74.12  ? 175 ARG A HH11 1 
ATOM   2771 H HH12 A ARG A 1 172 ? 23.521 50.578 52.014 0.79 77.03  ? 175 ARG A HH12 1 
ATOM   2772 H HH12 B ARG A 1 172 ? 25.144 48.932 50.329 0.21 74.12  ? 175 ARG A HH12 1 
ATOM   2773 H HH21 A ARG A 1 172 ? 25.712 49.340 49.894 0.79 66.39  ? 175 ARG A HH21 1 
ATOM   2774 H HH21 B ARG A 1 172 ? 23.892 49.525 52.132 0.21 77.97  ? 175 ARG A HH21 1 
ATOM   2775 H HH22 A ARG A 1 172 ? 25.578 50.156 51.133 0.79 66.39  ? 175 ARG A HH22 1 
ATOM   2776 H HH22 B ARG A 1 172 ? 22.412 49.640 52.016 0.21 77.97  ? 175 ARG A HH22 1 
ATOM   2777 N N    . ASN A 1 173 ? 24.498 45.888 46.738 1.00 51.82  ? 176 ASN A N    1 
ATOM   2778 C CA   . ASN A 1 173 ? 25.502 46.501 45.877 1.00 50.93  ? 176 ASN A CA   1 
ATOM   2779 C C    . ASN A 1 173 ? 25.648 45.733 44.569 1.00 42.05  ? 176 ASN A C    1 
ATOM   2780 O O    . ASN A 1 173 ? 25.794 46.338 43.500 1.00 54.42  ? 176 ASN A O    1 
ATOM   2781 C CB   . ASN A 1 173 ? 26.840 46.576 46.611 1.00 58.65  ? 176 ASN A CB   1 
ATOM   2782 C CG   . ASN A 1 173 ? 26.840 47.617 47.713 1.00 54.72  ? 176 ASN A CG   1 
ATOM   2783 O OD1  . ASN A 1 173 ? 25.881 48.372 47.871 1.00 72.41  ? 176 ASN A OD1  1 
ATOM   2784 N ND2  . ASN A 1 173 ? 27.921 47.662 48.483 1.00 64.69  ? 176 ASN A ND2  1 
ATOM   2785 H H    . ASN A 1 173 ? 24.808 45.535 47.458 0.00 62.23  ? 176 ASN A H    1 
ATOM   2786 H HA   . ASN A 1 173 ? 25.226 47.406 45.663 0.00 61.16  ? 176 ASN A HA   1 
ATOM   2787 H HB2  . ASN A 1 173 ? 27.031 45.714 47.011 0.00 70.43  ? 176 ASN A HB2  1 
ATOM   2788 H HB3  . ASN A 1 173 ? 27.536 46.809 45.977 0.00 70.43  ? 176 ASN A HB3  1 
ATOM   2789 H HD21 . ASN A 1 173 ? 27.970 48.235 49.122 0.00 77.68  ? 176 ASN A HD21 1 
ATOM   2790 H HD22 . ASN A 1 173 ? 28.572 47.119 48.342 0.00 77.68  ? 176 ASN A HD22 1 
ATOM   2791 N N    . VAL A 1 174 ? 25.611 44.401 44.634 1.00 38.48  ? 177 VAL A N    1 
ATOM   2792 C CA   . VAL A 1 174 ? 25.665 43.599 43.416 1.00 47.36  ? 177 VAL A CA   1 
ATOM   2793 C C    . VAL A 1 174 ? 24.472 43.912 42.522 1.00 46.42  ? 177 VAL A C    1 
ATOM   2794 O O    . VAL A 1 174 ? 24.616 44.085 41.306 1.00 51.81  ? 177 VAL A O    1 
ATOM   2795 C CB   . VAL A 1 174 ? 25.726 42.101 43.769 1.00 40.41  ? 177 VAL A CB   1 
ATOM   2796 C CG1  . VAL A 1 174 ? 25.488 41.249 42.530 1.00 47.22  ? 177 VAL A CG1  1 
ATOM   2797 C CG2  . VAL A 1 174 ? 27.064 41.759 44.409 1.00 51.57  ? 177 VAL A CG2  1 
ATOM   2798 H H    . VAL A 1 174 ? 25.556 43.945 45.361 0.00 46.23  ? 177 VAL A H    1 
ATOM   2799 H HA   . VAL A 1 174 ? 26.472 43.827 42.929 0.00 56.88  ? 177 VAL A HA   1 
ATOM   2800 H HB   . VAL A 1 174 ? 25.026 41.900 44.410 0.00 48.55  ? 177 VAL A HB   1 
ATOM   2801 H HG11 . VAL A 1 174 ? 25.800 40.346 42.702 0.00 56.72  ? 177 VAL A HG11 1 
ATOM   2802 H HG12 . VAL A 1 174 ? 24.538 41.238 42.332 0.00 56.72  ? 177 VAL A HG12 1 
ATOM   2803 H HG13 . VAL A 1 174 ? 25.976 41.631 41.785 0.00 56.72  ? 177 VAL A HG13 1 
ATOM   2804 H HG21 . VAL A 1 174 ? 27.066 40.821 44.657 0.00 61.94  ? 177 VAL A HG21 1 
ATOM   2805 H HG22 . VAL A 1 174 ? 27.774 41.933 43.771 0.00 61.94  ? 177 VAL A HG22 1 
ATOM   2806 H HG23 . VAL A 1 174 ? 27.187 42.309 45.198 0.00 61.94  ? 177 VAL A HG23 1 
ATOM   2807 N N    . THR A 1 175 ? 23.278 44.001 43.111 1.00 46.81  ? 178 THR A N    1 
ATOM   2808 C CA   . THR A 1 175 ? 22.066 44.200 42.322 1.00 41.44  ? 178 THR A CA   1 
ATOM   2809 C C    . THR A 1 175 ? 22.110 45.519 41.559 1.00 43.34  ? 178 THR A C    1 
ATOM   2810 O O    . THR A 1 175 ? 21.780 45.572 40.368 1.00 49.14  ? 178 THR A O    1 
ATOM   2811 C CB   . THR A 1 175 ? 20.839 44.145 43.237 1.00 45.40  ? 178 THR A CB   1 
ATOM   2812 O OG1  . THR A 1 175 ? 20.718 42.832 43.802 1.00 41.85  ? 178 THR A OG1  1 
ATOM   2813 C CG2  . THR A 1 175 ? 19.566 44.484 42.471 1.00 45.22  ? 178 THR A CG2  1 
ATOM   2814 H H    . THR A 1 175 ? 23.145 43.950 43.960 0.00 56.23  ? 178 THR A H    1 
ATOM   2815 H HA   . THR A 1 175 ? 21.995 43.484 41.672 0.00 49.78  ? 178 THR A HA   1 
ATOM   2816 H HB   . THR A 1 175 ? 20.943 44.797 43.947 0.00 54.53  ? 178 THR A HB   1 
ATOM   2817 H HG1  . THR A 1 175 ? 21.415 42.639 44.230 0.00 50.27  ? 178 THR A HG1  1 
ATOM   2818 H HG21 . THR A 1 175 ? 18.788 44.274 43.010 0.00 54.32  ? 178 THR A HG21 1 
ATOM   2819 H HG22 . THR A 1 175 ? 19.552 45.430 42.253 0.00 54.32  ? 178 THR A HG22 1 
ATOM   2820 H HG23 . THR A 1 175 ? 19.526 43.972 41.648 0.00 54.32  ? 178 THR A HG23 1 
ATOM   2821 N N    . VAL A 1 176 ? 22.519 46.599 42.229 1.00 37.37  ? 179 VAL A N    1 
ATOM   2822 C CA   . VAL A 1 176 ? 22.468 47.918 41.605 1.00 40.62  ? 179 VAL A CA   1 
ATOM   2823 C C    . VAL A 1 176 ? 23.489 48.019 40.477 1.00 49.86  ? 179 VAL A C    1 
ATOM   2824 O O    . VAL A 1 176 ? 23.233 48.654 39.447 1.00 52.14  ? 179 VAL A O    1 
ATOM   2825 C CB   . VAL A 1 176 ? 22.678 49.011 42.667 1.00 50.58  ? 179 VAL A CB   1 
ATOM   2826 C CG1  . VAL A 1 176 ? 22.780 50.392 42.018 1.00 63.34  ? 179 VAL A CG1  1 
ATOM   2827 C CG2  . VAL A 1 176 ? 21.542 48.970 43.674 1.00 55.93  ? 179 VAL A CG2  1 
ATOM   2828 H H    . VAL A 1 176 ? 22.825 46.593 43.032 0.00 44.90  ? 179 VAL A H    1 
ATOM   2829 H HA   . VAL A 1 176 ? 21.589 48.042 41.214 0.00 48.80  ? 179 VAL A HA   1 
ATOM   2830 H HB   . VAL A 1 176 ? 23.513 48.847 43.133 0.00 60.75  ? 179 VAL A HB   1 
ATOM   2831 H HG11 . VAL A 1 176 ? 22.899 51.059 42.712 0.00 76.06  ? 179 VAL A HG11 1 
ATOM   2832 H HG12 . VAL A 1 176 ? 23.540 50.402 41.416 0.00 76.06  ? 179 VAL A HG12 1 
ATOM   2833 H HG13 . VAL A 1 176 ? 21.964 50.570 41.525 0.00 76.06  ? 179 VAL A HG13 1 
ATOM   2834 H HG21 . VAL A 1 176 ? 21.691 49.652 44.347 0.00 67.16  ? 179 VAL A HG21 1 
ATOM   2835 H HG22 . VAL A 1 176 ? 20.705 49.139 43.213 0.00 67.16  ? 179 VAL A HG22 1 
ATOM   2836 H HG23 . VAL A 1 176 ? 21.519 48.094 44.089 0.00 67.16  ? 179 VAL A HG23 1 
ATOM   2837 N N    . VAL A 1 177 ? 24.657 47.400 40.649 1.00 48.09  ? 180 VAL A N    1 
ATOM   2838 C CA   . VAL A 1 177 ? 25.684 47.462 39.614 1.00 56.77  ? 180 VAL A CA   1 
ATOM   2839 C C    . VAL A 1 177 ? 25.272 46.639 38.400 1.00 42.67  ? 180 VAL A C    1 
ATOM   2840 O O    . VAL A 1 177 ? 25.511 47.037 37.254 1.00 44.63  ? 180 VAL A O    1 
ATOM   2841 C CB   . VAL A 1 177 ? 27.037 46.996 40.183 1.00 47.92  ? 180 VAL A CB   1 
ATOM   2842 C CG1  . VAL A 1 177 ? 28.085 46.911 39.080 1.00 55.47  ? 180 VAL A CG1  1 
ATOM   2843 C CG2  . VAL A 1 177 ? 27.498 47.940 41.282 1.00 52.04  ? 180 VAL A CG2  1 
ATOM   2844 H H    . VAL A 1 177 ? 24.875 46.944 41.345 0.00 57.76  ? 180 VAL A H    1 
ATOM   2845 H HA   . VAL A 1 177 ? 25.778 48.384 39.329 0.00 68.17  ? 180 VAL A HA   1 
ATOM   2846 H HB   . VAL A 1 177 ? 26.929 46.110 40.563 0.00 57.55  ? 180 VAL A HB   1 
ATOM   2847 H HG11 . VAL A 1 177 ? 28.956 46.769 39.483 0.00 66.62  ? 180 VAL A HG11 1 
ATOM   2848 H HG12 . VAL A 1 177 ? 27.867 46.171 38.493 0.00 66.62  ? 180 VAL A HG12 1 
ATOM   2849 H HG13 . VAL A 1 177 ? 28.084 47.742 38.579 0.00 66.62  ? 180 VAL A HG13 1 
ATOM   2850 H HG21 . VAL A 1 177 ? 28.337 47.616 41.644 0.00 62.50  ? 180 VAL A HG21 1 
ATOM   2851 H HG22 . VAL A 1 177 ? 27.620 48.826 40.906 0.00 62.50  ? 180 VAL A HG22 1 
ATOM   2852 H HG23 . VAL A 1 177 ? 26.824 47.965 41.979 0.00 62.50  ? 180 VAL A HG23 1 
ATOM   2853 N N    . LEU A 1 178 ? 24.644 45.484 38.627 1.00 34.48  ? 181 LEU A N    1 
ATOM   2854 C CA   . LEU A 1 178 ? 24.301 44.597 37.520 1.00 36.17  ? 181 LEU A CA   1 
ATOM   2855 C C    . LEU A 1 178 ? 23.011 45.022 36.826 1.00 47.22  ? 181 LEU A C    1 
ATOM   2856 O O    . LEU A 1 178 ? 22.918 44.950 35.595 1.00 46.40  ? 181 LEU A O    1 
ATOM   2857 C CB   . LEU A 1 178 ? 24.189 43.157 38.023 1.00 44.83  ? 181 LEU A CB   1 
ATOM   2858 C CG   . LEU A 1 178 ? 25.465 42.550 38.620 1.00 49.30  ? 181 LEU A CG   1 
ATOM   2859 C CD1  . LEU A 1 178 ? 25.302 41.052 38.831 1.00 53.65  ? 181 LEU A CD1  1 
ATOM   2860 C CD2  . LEU A 1 178 ? 26.679 42.830 37.740 1.00 47.31  ? 181 LEU A CD2  1 
ATOM   2861 H H    . LEU A 1 178 ? 24.410 45.195 39.402 0.00 41.42  ? 181 LEU A H    1 
ATOM   2862 H HA   . LEU A 1 178 ? 25.013 44.635 36.862 0.00 43.46  ? 181 LEU A HA   1 
ATOM   2863 H HB2  . LEU A 1 178 ? 23.509 43.130 38.714 0.00 53.85  ? 181 LEU A HB2  1 
ATOM   2864 H HB3  . LEU A 1 178 ? 23.926 42.595 37.277 0.00 53.85  ? 181 LEU A HB3  1 
ATOM   2865 H HG   . LEU A 1 178 ? 25.622 42.966 39.481 0.00 59.21  ? 181 LEU A HG   1 
ATOM   2866 H HD11 . LEU A 1 178 ? 26.121 40.696 39.210 0.00 64.43  ? 181 LEU A HD11 1 
ATOM   2867 H HD12 . LEU A 1 178 ? 24.562 40.898 39.438 0.00 64.43  ? 181 LEU A HD12 1 
ATOM   2868 H HD13 . LEU A 1 178 ? 25.123 40.631 37.976 0.00 64.43  ? 181 LEU A HD13 1 
ATOM   2869 H HD21 . LEU A 1 178 ? 27.433 42.318 38.071 0.00 56.83  ? 181 LEU A HD21 1 
ATOM   2870 H HD22 . LEU A 1 178 ? 26.476 42.568 36.829 0.00 56.83  ? 181 LEU A HD22 1 
ATOM   2871 H HD23 . LEU A 1 178 ? 26.882 43.778 37.775 0.00 56.83  ? 181 LEU A HD23 1 
ATOM   2872 N N    . TRP A 1 179 ? 22.006 45.466 37.586 1.00 38.78  ? 182 TRP A N    1 
ATOM   2873 C CA   . TRP A 1 179 ? 20.750 45.866 36.958 1.00 51.80  ? 182 TRP A CA   1 
ATOM   2874 C C    . TRP A 1 179 ? 20.921 47.135 36.133 1.00 52.74  ? 182 TRP A C    1 
ATOM   2875 O O    . TRP A 1 179 ? 20.269 47.290 35.095 1.00 39.66  ? 182 TRP A O    1 
ATOM   2876 C CB   . TRP A 1 179 ? 19.661 46.073 38.012 1.00 37.15  ? 182 TRP A CB   1 
ATOM   2877 C CG   . TRP A 1 179 ? 19.136 44.796 38.615 1.00 44.14  ? 182 TRP A CG   1 
ATOM   2878 C CD1  . TRP A 1 179 ? 19.867 43.708 38.997 1.00 45.86  ? 182 TRP A CD1  1 
ATOM   2879 C CD2  . TRP A 1 179 ? 17.765 44.472 38.889 1.00 44.62  ? 182 TRP A CD2  1 
ATOM   2880 N NE1  . TRP A 1 179 ? 19.040 42.735 39.503 1.00 48.15  ? 182 TRP A NE1  1 
ATOM   2881 C CE2  . TRP A 1 179 ? 17.745 43.177 39.444 1.00 39.18  ? 182 TRP A CE2  1 
ATOM   2882 C CE3  . TRP A 1 179 ? 16.553 45.151 38.720 1.00 45.09  ? 182 TRP A CE3  1 
ATOM   2883 C CZ2  . TRP A 1 179 ? 16.563 42.548 39.833 1.00 49.21  ? 182 TRP A CZ2  1 
ATOM   2884 C CZ3  . TRP A 1 179 ? 15.380 44.523 39.107 1.00 46.86  ? 182 TRP A CZ3  1 
ATOM   2885 C CH2  . TRP A 1 179 ? 15.395 43.235 39.657 1.00 42.22  ? 182 TRP A CH2  1 
ATOM   2886 H H    . TRP A 1 179 ? 22.026 45.543 38.442 0.00 46.58  ? 182 TRP A H    1 
ATOM   2887 H HA   . TRP A 1 179 ? 20.462 45.151 36.370 0.00 62.21  ? 182 TRP A HA   1 
ATOM   2888 H HB2  . TRP A 1 179 ? 20.024 46.611 38.733 0.00 44.63  ? 182 TRP A HB2  1 
ATOM   2889 H HB3  . TRP A 1 179 ? 18.913 46.533 37.600 0.00 44.63  ? 182 TRP A HB3  1 
ATOM   2890 H HD1  . TRP A 1 179 ? 20.792 43.637 38.925 0.00 55.08  ? 182 TRP A HD1  1 
ATOM   2891 H HE1  . TRP A 1 179 ? 19.295 41.972 39.807 0.00 57.83  ? 182 TRP A HE1  1 
ATOM   2892 H HE3  . TRP A 1 179 ? 16.536 46.007 38.355 0.00 54.16  ? 182 TRP A HE3  1 
ATOM   2893 H HZ2  . TRP A 1 179 ? 16.570 41.692 40.198 0.00 59.10  ? 182 TRP A HZ2  1 
ATOM   2894 H HZ3  . TRP A 1 179 ? 14.569 44.965 39.000 0.00 56.28  ? 182 TRP A HZ3  1 
ATOM   2895 H HH2  . TRP A 1 179 ? 14.592 42.839 39.908 0.00 50.72  ? 182 TRP A HH2  1 
ATOM   2896 N N    . SER A 1 180 ? 21.794 48.046 36.572 1.00 42.12  ? 183 SER A N    1 
ATOM   2897 C CA   . SER A 1 180 ? 21.994 49.302 35.858 1.00 41.63  ? 183 SER A CA   1 
ATOM   2898 C C    . SER A 1 180 ? 22.626 49.101 34.486 1.00 47.12  ? 183 SER A C    1 
ATOM   2899 O O    . SER A 1 180 ? 22.538 49.999 33.642 1.00 48.31  ? 183 SER A O    1 
ATOM   2900 C CB   . SER A 1 180 ? 22.867 50.240 36.692 1.00 40.24  ? 183 SER A CB   1 
ATOM   2901 O OG   . SER A 1 180 ? 22.208 50.624 37.885 1.00 60.81  ? 183 SER A OG   1 
ATOM   2902 H H    . SER A 1 180 ? 22.278 47.959 37.277 0.00 50.59  ? 183 SER A H    1 
ATOM   2903 H HA   . SER A 1 180 ? 21.130 49.722 35.727 0.00 50.01  ? 183 SER A HA   1 
ATOM   2904 H HB2  . SER A 1 180 ? 23.691 49.782 36.921 0.00 48.34  ? 183 SER A HB2  1 
ATOM   2905 H HB3  . SER A 1 180 ? 23.063 51.034 36.171 0.00 48.34  ? 183 SER A HB3  1 
ATOM   2906 H HG   . SER A 1 180 ? 22.714 51.107 38.350 0.00 73.02  ? 183 SER A HG   1 
ATOM   2907 N N    . ALA A 1 181 ? 23.259 47.951 34.243 1.00 41.12  ? 184 ALA A N    1 
ATOM   2908 C CA   . ALA A 1 181 ? 23.919 47.723 32.963 1.00 50.85  ? 184 ALA A CA   1 
ATOM   2909 C C    . ALA A 1 181 ? 22.936 47.330 31.867 1.00 35.36  ? 184 ALA A C    1 
ATOM   2910 O O    . ALA A 1 181 ? 23.160 47.660 30.698 1.00 37.42  ? 184 ALA A O    1 
ATOM   2911 C CB   . ALA A 1 181 ? 24.992 46.642 33.113 1.00 37.72  ? 184 ALA A CB   1 
ATOM   2912 H H    . ALA A 1 181 ? 23.319 47.297 34.797 0.00 49.39  ? 184 ALA A H    1 
ATOM   2913 H HA   . ALA A 1 181 ? 24.355 48.545 32.689 0.00 61.07  ? 184 ALA A HA   1 
ATOM   2914 H HB1  . ALA A 1 181 ? 25.459 46.542 32.269 0.00 45.32  ? 184 ALA A HB1  1 
ATOM   2915 H HB2  . ALA A 1 181 ? 25.615 46.910 33.806 0.00 45.32  ? 184 ALA A HB2  1 
ATOM   2916 H HB3  . ALA A 1 181 ? 24.565 45.806 33.356 0.00 45.32  ? 184 ALA A HB3  1 
ATOM   2917 N N    . TYR A 1 182 ? 21.848 46.643 32.218 1.00 35.76  ? 185 TYR A N    1 
ATOM   2918 C CA   . TYR A 1 182 ? 20.886 46.184 31.216 1.00 38.97  ? 185 TYR A CA   1 
ATOM   2919 C C    . TYR A 1 182 ? 20.371 47.295 30.311 1.00 38.03  ? 185 TYR A C    1 
ATOM   2920 O O    . TYR A 1 182 ? 20.344 47.095 29.086 1.00 38.21  ? 185 TYR A O    1 
ATOM   2921 C CB   . TYR A 1 182 ? 19.714 45.479 31.913 1.00 36.42  ? 185 TYR A CB   1 
ATOM   2922 C CG   . TYR A 1 182 ? 20.027 44.068 32.349 1.00 45.13  ? 185 TYR A CG   1 
ATOM   2923 C CD1  . TYR A 1 182 ? 20.747 43.817 33.509 1.00 42.91  ? 185 TYR A CD1  1 
ATOM   2924 C CD2  . TYR A 1 182 ? 19.612 42.984 31.587 1.00 31.77  ? 185 TYR A CD2  1 
ATOM   2925 C CE1  . TYR A 1 182 ? 21.036 42.524 33.900 1.00 45.13  ? 185 TYR A CE1  1 
ATOM   2926 C CE2  . TYR A 1 182 ? 19.897 41.691 31.970 1.00 46.25  ? 185 TYR A CE2  1 
ATOM   2927 C CZ   . TYR A 1 182 ? 20.609 41.466 33.126 1.00 44.95  ? 185 TYR A CZ   1 
ATOM   2928 O OH   . TYR A 1 182 ? 20.894 40.178 33.508 1.00 45.66  ? 185 TYR A OH   1 
ATOM   2929 H H    . TYR A 1 182 ? 21.645 46.430 33.026 0.00 42.97  ? 185 TYR A H    1 
ATOM   2930 H HA   . TYR A 1 182 ? 21.348 45.539 30.657 0.00 46.81  ? 185 TYR A HA   1 
ATOM   2931 H HB2  . TYR A 1 182 ? 19.470 45.986 32.703 0.00 43.75  ? 185 TYR A HB2  1 
ATOM   2932 H HB3  . TYR A 1 182 ? 18.963 45.440 31.299 0.00 43.75  ? 185 TYR A HB3  1 
ATOM   2933 H HD1  . TYR A 1 182 ? 21.038 44.529 34.031 0.00 51.54  ? 185 TYR A HD1  1 
ATOM   2934 H HD2  . TYR A 1 182 ? 19.133 43.133 30.804 0.00 38.17  ? 185 TYR A HD2  1 
ATOM   2935 H HE1  . TYR A 1 182 ? 21.517 42.368 34.681 0.00 54.21  ? 185 TYR A HE1  1 
ATOM   2936 H HE2  . TYR A 1 182 ? 19.610 40.975 31.450 0.00 55.56  ? 185 TYR A HE2  1 
ATOM   2937 H HH   . TYR A 1 182 ? 20.650 39.640 32.910 0.00 54.84  ? 185 TYR A HH   1 
ATOM   2938 N N    . PRO A 1 183 ? 19.931 48.448 30.818 1.00 37.02  ? 186 PRO A N    1 
ATOM   2939 C CA   . PRO A 1 183 ? 19.450 49.496 29.903 1.00 33.98  ? 186 PRO A CA   1 
ATOM   2940 C C    . PRO A 1 183 ? 20.527 50.023 28.970 1.00 38.72  ? 186 PRO A C    1 
ATOM   2941 O O    . PRO A 1 183 ? 20.206 50.514 27.881 1.00 42.75  ? 186 PRO A O    1 
ATOM   2942 C CB   . PRO A 1 183 ? 18.937 50.592 30.852 1.00 40.28  ? 186 PRO A CB   1 
ATOM   2943 C CG   . PRO A 1 183 ? 19.486 50.248 32.200 1.00 46.76  ? 186 PRO A CG   1 
ATOM   2944 C CD   . PRO A 1 183 ? 19.632 48.769 32.223 1.00 41.85  ? 186 PRO A CD   1 
ATOM   2945 H HA   . PRO A 1 183 ? 18.708 49.159 29.377 0.00 40.82  ? 186 PRO A HA   1 
ATOM   2946 H HB2  . PRO A 1 183 ? 19.261 51.457 30.559 0.00 48.38  ? 186 PRO A HB2  1 
ATOM   2947 H HB3  . PRO A 1 183 ? 17.967 50.587 30.864 0.00 48.38  ? 186 PRO A HB3  1 
ATOM   2948 H HG2  . PRO A 1 183 ? 20.346 50.679 32.322 0.00 56.16  ? 186 PRO A HG2  1 
ATOM   2949 H HG3  . PRO A 1 183 ? 18.868 50.542 32.888 0.00 56.16  ? 186 PRO A HG3  1 
ATOM   2950 H HD2  . PRO A 1 183 ? 20.362 48.501 32.803 0.00 50.27  ? 186 PRO A HD2  1 
ATOM   2951 H HD3  . PRO A 1 183 ? 18.808 48.343 32.508 0.00 50.27  ? 186 PRO A HD3  1 
ATOM   2952 N N    . VAL A 1 184 ? 21.800 49.938 29.365 1.00 39.74  ? 187 VAL A N    1 
ATOM   2953 C CA   . VAL A 1 184 ? 22.875 50.427 28.508 1.00 36.12  ? 187 VAL A CA   1 
ATOM   2954 C C    . VAL A 1 184 ? 23.092 49.480 27.335 1.00 33.62  ? 187 VAL A C    1 
ATOM   2955 O O    . VAL A 1 184 ? 23.281 49.919 26.195 1.00 45.88  ? 187 VAL A O    1 
ATOM   2956 C CB   . VAL A 1 184 ? 24.162 50.620 29.330 1.00 41.78  ? 187 VAL A CB   1 
ATOM   2957 C CG1  . VAL A 1 184 ? 25.298 51.105 28.441 1.00 43.99  ? 187 VAL A CG1  1 
ATOM   2958 C CG2  . VAL A 1 184 ? 23.919 51.594 30.476 1.00 46.62  ? 187 VAL A CG2  1 
ATOM   2959 H H    . VAL A 1 184 ? 22.062 49.606 30.114 0.00 47.74  ? 187 VAL A H    1 
ATOM   2960 H HA   . VAL A 1 184 ? 22.616 51.291 28.150 0.00 43.39  ? 187 VAL A HA   1 
ATOM   2961 H HB   . VAL A 1 184 ? 24.424 49.767 29.710 0.00 50.18  ? 187 VAL A HB   1 
ATOM   2962 H HG11 . VAL A 1 184 ? 26.031 51.405 29.000 0.00 52.84  ? 187 VAL A HG11 1 
ATOM   2963 H HG12 . VAL A 1 184 ? 25.591 50.373 27.876 0.00 52.84  ? 187 VAL A HG12 1 
ATOM   2964 H HG13 . VAL A 1 184 ? 24.978 51.838 27.892 0.00 52.84  ? 187 VAL A HG13 1 
ATOM   2965 H HG21 . VAL A 1 184 ? 24.752 51.735 30.953 0.00 56.00  ? 187 VAL A HG21 1 
ATOM   2966 H HG22 . VAL A 1 184 ? 23.600 52.435 30.113 0.00 56.00  ? 187 VAL A HG22 1 
ATOM   2967 H HG23 . VAL A 1 184 ? 23.255 51.219 31.075 0.00 56.00  ? 187 VAL A HG23 1 
ATOM   2968 N N    . VAL A 1 185 ? 23.061 48.170 27.591 1.00 34.91  ? 188 VAL A N    1 
ATOM   2969 C CA   . VAL A 1 185 ? 23.223 47.195 26.515 1.00 44.76  ? 188 VAL A CA   1 
ATOM   2970 C C    . VAL A 1 185 ? 22.041 47.260 25.556 1.00 41.96  ? 188 VAL A C    1 
ATOM   2971 O O    . VAL A 1 185 ? 22.213 47.220 24.332 1.00 38.21  ? 188 VAL A O    1 
ATOM   2972 C CB   . VAL A 1 185 ? 23.402 45.776 27.091 1.00 41.19  ? 188 VAL A CB   1 
ATOM   2973 C CG1  . VAL A 1 185 ? 23.947 44.838 26.029 1.00 48.27  ? 188 VAL A CG1  1 
ATOM   2974 C CG2  . VAL A 1 185 ? 24.352 45.780 28.283 1.00 41.38  ? 188 VAL A CG2  1 
ATOM   2975 H H    . VAL A 1 185 ? 22.948 47.825 28.371 0.00 41.94  ? 188 VAL A H    1 
ATOM   2976 H HA   . VAL A 1 185 ? 24.027 47.420 26.022 0.00 53.77  ? 188 VAL A HA   1 
ATOM   2977 H HB   . VAL A 1 185 ? 22.532 45.463 27.385 0.00 49.47  ? 188 VAL A HB   1 
ATOM   2978 H HG11 . VAL A 1 185 ? 24.044 43.952 26.410 0.00 57.97  ? 188 VAL A HG11 1 
ATOM   2979 H HG12 . VAL A 1 185 ? 23.327 44.811 25.283 0.00 57.97  ? 188 VAL A HG12 1 
ATOM   2980 H HG13 . VAL A 1 185 ? 24.809 45.166 25.730 0.00 57.97  ? 188 VAL A HG13 1 
ATOM   2981 H HG21 . VAL A 1 185 ? 24.447 44.873 28.614 0.00 49.70  ? 188 VAL A HG21 1 
ATOM   2982 H HG22 . VAL A 1 185 ? 25.215 46.120 27.998 0.00 49.70  ? 188 VAL A HG22 1 
ATOM   2983 H HG23 . VAL A 1 185 ? 23.985 46.349 28.978 0.00 49.70  ? 188 VAL A HG23 1 
ATOM   2984 N N    . TRP A 1 186 ? 20.825 47.352 26.096 1.00 37.43  ? 189 TRP A N    1 
ATOM   2985 C CA   . TRP A 1 186 ? 19.637 47.450 25.255 1.00 32.47  ? 189 TRP A CA   1 
ATOM   2986 C C    . TRP A 1 186 ? 19.707 48.672 24.348 1.00 31.77  ? 189 TRP A C    1 
ATOM   2987 O O    . TRP A 1 186 ? 19.299 48.616 23.182 1.00 48.39  ? 189 TRP A O    1 
ATOM   2988 C CB   . TRP A 1 186 ? 18.396 47.501 26.147 1.00 35.32  ? 189 TRP A CB   1 
ATOM   2989 C CG   . TRP A 1 186 ? 17.078 47.274 25.457 1.00 41.05  ? 189 TRP A CG   1 
ATOM   2990 C CD1  . TRP A 1 186 ? 16.337 46.129 25.477 1.00 47.26  ? 189 TRP A CD1  1 
ATOM   2991 C CD2  . TRP A 1 186 ? 16.325 48.224 24.691 1.00 37.09  ? 189 TRP A CD2  1 
ATOM   2992 N NE1  . TRP A 1 186 ? 15.180 46.299 24.758 1.00 47.55  ? 189 TRP A NE1  1 
ATOM   2993 C CE2  . TRP A 1 186 ? 15.147 47.577 24.265 1.00 63.16  ? 189 TRP A CE2  1 
ATOM   2994 C CE3  . TRP A 1 186 ? 16.535 49.555 24.316 1.00 45.73  ? 189 TRP A CE3  1 
ATOM   2995 C CZ2  . TRP A 1 186 ? 14.185 48.212 23.483 1.00 51.11  ? 189 TRP A CZ2  1 
ATOM   2996 C CZ3  . TRP A 1 186 ? 15.577 50.185 23.538 1.00 51.23  ? 189 TRP A CZ3  1 
ATOM   2997 C CH2  . TRP A 1 186 ? 14.418 49.513 23.131 1.00 50.20  ? 189 TRP A CH2  1 
ATOM   2998 H H    . TRP A 1 186 ? 20.662 47.360 26.941 0.00 44.97  ? 189 TRP A H    1 
ATOM   2999 H HA   . TRP A 1 186 ? 19.574 46.667 24.686 0.00 39.02  ? 189 TRP A HA   1 
ATOM   3000 H HB2  . TRP A 1 186 ? 18.484 46.816 26.828 0.00 42.44  ? 189 TRP A HB2  1 
ATOM   3001 H HB3  . TRP A 1 186 ? 18.355 48.377 26.560 0.00 42.44  ? 189 TRP A HB3  1 
ATOM   3002 H HD1  . TRP A 1 186 ? 16.580 45.345 25.915 0.00 56.76  ? 189 TRP A HD1  1 
ATOM   3003 H HE1  . TRP A 1 186 ? 14.574 45.701 24.637 0.00 57.11  ? 189 TRP A HE1  1 
ATOM   3004 H HE3  . TRP A 1 186 ? 17.302 50.008 24.583 0.00 54.92  ? 189 TRP A HE3  1 
ATOM   3005 H HZ2  . TRP A 1 186 ? 13.414 47.769 23.211 0.00 61.38  ? 189 TRP A HZ2  1 
ATOM   3006 H HZ3  . TRP A 1 186 ? 15.706 51.069 23.281 0.00 61.53  ? 189 TRP A HZ3  1 
ATOM   3007 H HH2  . TRP A 1 186 ? 13.792 49.961 22.609 0.00 60.29  ? 189 TRP A HH2  1 
ATOM   3008 N N    . LEU A 1 187 ? 20.243 49.781 24.862 1.00 37.42  ? 190 LEU A N    1 
ATOM   3009 C CA   . LEU A 1 187 ? 20.247 51.029 24.103 1.00 39.10  ? 190 LEU A CA   1 
ATOM   3010 C C    . LEU A 1 187 ? 21.253 50.987 22.957 1.00 51.84  ? 190 LEU A C    1 
ATOM   3011 O O    . LEU A 1 187 ? 20.953 51.444 21.848 1.00 42.85  ? 190 LEU A O    1 
ATOM   3012 C CB   . LEU A 1 187 ? 20.544 52.201 25.040 1.00 38.52  ? 190 LEU A CB   1 
ATOM   3013 C CG   . LEU A 1 187 ? 20.462 53.603 24.432 1.00 52.81  ? 190 LEU A CG   1 
ATOM   3014 C CD1  . LEU A 1 187 ? 19.032 53.935 24.035 1.00 53.48  ? 190 LEU A CD1  1 
ATOM   3015 C CD2  . LEU A 1 187 ? 20.998 54.632 25.413 1.00 53.73  ? 190 LEU A CD2  1 
ATOM   3016 H H    . LEU A 1 187 ? 20.607 49.837 25.640 0.00 44.96  ? 190 LEU A H    1 
ATOM   3017 H HA   . LEU A 1 187 ? 19.368 51.162 23.716 0.00 46.97  ? 190 LEU A HA   1 
ATOM   3018 H HB2  . LEU A 1 187 ? 19.906 52.170 25.771 0.00 46.27  ? 190 LEU A HB2  1 
ATOM   3019 H HB3  . LEU A 1 187 ? 21.445 52.091 25.382 0.00 46.27  ? 190 LEU A HB3  1 
ATOM   3020 H HG   . LEU A 1 187 ? 21.007 53.632 23.630 0.00 63.42  ? 190 LEU A HG   1 
ATOM   3021 H HD11 . LEU A 1 187 ? 18.997 54.851 23.718 0.00 64.23  ? 190 LEU A HD11 1 
ATOM   3022 H HD12 . LEU A 1 187 ? 18.750 53.330 23.332 0.00 64.23  ? 190 LEU A HD12 1 
ATOM   3023 H HD13 . LEU A 1 187 ? 18.457 53.832 24.810 0.00 64.23  ? 190 LEU A HD13 1 
ATOM   3024 H HD21 . LEU A 1 187 ? 20.932 55.513 25.014 0.00 64.53  ? 190 LEU A HD21 1 
ATOM   3025 H HD22 . LEU A 1 187 ? 20.471 54.597 26.227 0.00 64.53  ? 190 LEU A HD22 1 
ATOM   3026 H HD23 . LEU A 1 187 ? 21.925 54.427 25.611 0.00 64.53  ? 190 LEU A HD23 1 
ATOM   3027 N N    . ILE A 1 188 ? 22.454 50.447 23.200 1.00 42.97  ? 191 ILE A N    1 
ATOM   3028 C CA   . ILE A 1 188 ? 23.485 50.403 22.164 1.00 46.23  ? 191 ILE A CA   1 
ATOM   3029 C C    . ILE A 1 188 ? 23.429 49.121 21.347 1.00 55.48  ? 191 ILE A C    1 
ATOM   3030 O O    . ILE A 1 188 ? 24.206 48.972 20.393 1.00 50.53  ? 191 ILE A O    1 
ATOM   3031 C CB   . ILE A 1 188 ? 24.911 50.527 22.745 1.00 56.75  ? 191 ILE A CB   1 
ATOM   3032 C CG1  . ILE A 1 188 ? 25.183 49.412 23.765 1.00 50.78  ? 191 ILE A CG1  1 
ATOM   3033 C CG2  . ILE A 1 188 ? 25.104 51.904 23.373 1.00 62.83  ? 191 ILE A CG2  1 
ATOM   3034 C CD1  . ILE A 1 188 ? 26.370 49.663 24.671 1.00 67.44  ? 191 ILE A CD1  1 
ATOM   3035 H H    . ILE A 1 188 ? 22.691 50.103 23.952 0.00 51.61  ? 191 ILE A H    1 
ATOM   3036 H HA   . ILE A 1 188 ? 23.317 51.166 21.590 0.00 55.53  ? 191 ILE A HA   1 
ATOM   3037 H HB   . ILE A 1 188 ? 25.548 50.426 22.020 0.00 68.15  ? 191 ILE A HB   1 
ATOM   3038 H HG12 . ILE A 1 188 ? 24.400 49.313 24.329 0.00 60.99  ? 191 ILE A HG12 1 
ATOM   3039 H HG13 . ILE A 1 188 ? 25.352 48.587 23.283 0.00 60.99  ? 191 ILE A HG13 1 
ATOM   3040 H HG21 . ILE A 1 188 ? 26.049 52.042 23.546 0.00 75.45  ? 191 ILE A HG21 1 
ATOM   3041 H HG22 . ILE A 1 188 ? 24.778 52.580 22.758 0.00 75.45  ? 191 ILE A HG22 1 
ATOM   3042 H HG23 . ILE A 1 188 ? 24.606 51.945 24.204 0.00 75.45  ? 191 ILE A HG23 1 
ATOM   3043 H HD11 . ILE A 1 188 ? 26.564 48.853 25.169 0.00 80.98  ? 191 ILE A HD11 1 
ATOM   3044 H HD12 . ILE A 1 188 ? 27.135 49.909 24.128 0.00 80.98  ? 191 ILE A HD12 1 
ATOM   3045 H HD13 . ILE A 1 188 ? 26.153 50.383 25.283 0.00 80.98  ? 191 ILE A HD13 1 
ATOM   3046 N N    . GLY A 1 189 ? 22.546 48.190 21.692 1.00 45.24  ? 192 GLY A N    1 
ATOM   3047 C CA   . GLY A 1 189 ? 22.461 46.911 21.021 1.00 58.14  ? 192 GLY A CA   1 
ATOM   3048 C C    . GLY A 1 189 ? 21.466 46.904 19.881 1.00 44.82  ? 192 GLY A C    1 
ATOM   3049 O O    . GLY A 1 189 ? 21.021 47.947 19.395 1.00 52.19  ? 192 GLY A O    1 
ATOM   3050 H H    . GLY A 1 189 ? 21.974 48.283 22.328 0.00 54.34  ? 192 GLY A H    1 
ATOM   3051 H HA2  . GLY A 1 189 ? 23.333 46.680 20.664 0.00 69.82  ? 192 GLY A HA2  1 
ATOM   3052 H HA3  . GLY A 1 189 ? 22.193 46.233 21.661 0.00 69.82  ? 192 GLY A HA3  1 
ATOM   3053 N N    A SER A 1 190 ? 21.108 45.691 19.454 0.85 42.08  ? 193 SER A N    1 
ATOM   3054 N N    B SER A 1 190 ? 21.108 45.692 19.453 0.15 42.42  ? 193 SER A N    1 
ATOM   3055 C CA   A SER A 1 190 ? 20.241 45.536 18.290 0.85 51.01  ? 193 SER A CA   1 
ATOM   3056 C CA   B SER A 1 190 ? 20.243 45.543 18.288 0.15 50.87  ? 193 SER A CA   1 
ATOM   3057 C C    A SER A 1 190 ? 18.848 46.104 18.533 0.85 50.99  ? 193 SER A C    1 
ATOM   3058 C C    B SER A 1 190 ? 18.850 46.110 18.534 0.15 50.86  ? 193 SER A C    1 
ATOM   3059 O O    A SER A 1 190 ? 18.190 46.551 17.587 0.85 52.17  ? 193 SER A O    1 
ATOM   3060 O O    B SER A 1 190 ? 18.195 46.564 17.589 0.15 52.00  ? 193 SER A O    1 
ATOM   3061 C CB   A SER A 1 190 ? 20.155 44.059 17.904 0.85 47.40  ? 193 SER A CB   1 
ATOM   3062 C CB   B SER A 1 190 ? 20.153 44.069 17.893 0.15 47.50  ? 193 SER A CB   1 
ATOM   3063 O OG   A SER A 1 190 ? 19.617 43.286 18.963 0.85 58.41  ? 193 SER A OG   1 
ATOM   3064 O OG   B SER A 1 190 ? 21.364 43.625 17.307 0.15 55.02  ? 193 SER A OG   1 
ATOM   3065 H H    A SER A 1 190 ? 21.351 44.950 19.817 0.85 50.55  ? 193 SER A H    1 
ATOM   3066 H H    B SER A 1 190 ? 21.350 44.950 19.816 0.15 50.96  ? 193 SER A H    1 
ATOM   3067 H HA   A SER A 1 190 ? 20.629 46.024 17.547 0.85 61.26  ? 193 SER A HA   1 
ATOM   3068 H HA   B SER A 1 190 ? 20.634 46.033 17.548 0.15 61.10  ? 193 SER A HA   1 
ATOM   3069 H HB2  A SER A 1 190 ? 19.582 43.970 17.126 0.85 56.93  ? 193 SER A HB2  1 
ATOM   3070 H HB2  B SER A 1 190 ? 19.974 43.541 18.687 0.15 57.06  ? 193 SER A HB2  1 
ATOM   3071 H HB3  A SER A 1 190 ? 21.046 43.735 17.698 0.85 56.93  ? 193 SER A HB3  1 
ATOM   3072 H HB3  B SER A 1 190 ? 19.433 43.958 17.252 0.15 57.06  ? 193 SER A HB3  1 
ATOM   3073 H HG   A SER A 1 190 ? 20.123 43.325 19.632 0.85 70.14  ? 193 SER A HG   1 
ATOM   3074 H HG   B SER A 1 190 ? 21.547 44.094 16.635 0.15 66.07  ? 193 SER A HG   1 
ATOM   3075 N N    . GLU A 1 191 ? 18.376 46.096 19.783 1.00 42.98  ? 194 GLU A N    1 
ATOM   3076 C CA   . GLU A 1 191 ? 17.039 46.611 20.066 1.00 39.10  ? 194 GLU A CA   1 
ATOM   3077 C C    . GLU A 1 191 ? 16.965 48.126 19.947 1.00 44.84  ? 194 GLU A C    1 
ATOM   3078 O O    . GLU A 1 191 ? 15.868 48.665 19.765 1.00 51.01  ? 194 GLU A O    1 
ATOM   3079 C CB   . GLU A 1 191 ? 16.584 46.212 21.472 1.00 40.35  ? 194 GLU A CB   1 
ATOM   3080 C CG   . GLU A 1 191 ? 16.314 44.731 21.663 1.00 51.43  ? 194 GLU A CG   1 
ATOM   3081 C CD   . GLU A 1 191 ? 17.564 43.970 22.046 1.00 47.72  ? 194 GLU A CD   1 
ATOM   3082 O OE1  . GLU A 1 191 ? 18.636 44.603 22.120 1.00 51.01  ? 194 GLU A OE1  1 
ATOM   3083 O OE2  . GLU A 1 191 ? 17.475 42.748 22.287 1.00 55.19  ? 194 GLU A OE2  1 
ATOM   3084 H H    . GLU A 1 191 ? 18.805 45.803 20.468 0.00 51.63  ? 194 GLU A H    1 
ATOM   3085 H HA   . GLU A 1 191 ? 16.431 46.212 19.425 0.00 46.97  ? 194 GLU A HA   1 
ATOM   3086 H HB2  . GLU A 1 191 ? 17.277 46.465 22.102 0.00 48.47  ? 194 GLU A HB2  1 
ATOM   3087 H HB3  . GLU A 1 191 ? 15.763 46.686 21.675 0.00 48.47  ? 194 GLU A HB3  1 
ATOM   3088 H HG2  . GLU A 1 191 ? 15.660 44.615 22.370 0.00 61.76  ? 194 GLU A HG2  1 
ATOM   3089 H HG3  . GLU A 1 191 ? 15.976 44.359 20.833 0.00 61.76  ? 194 GLU A HG3  1 
ATOM   3090 N N    . GLY A 1 192 ? 18.094 48.821 20.060 1.00 42.45  ? 195 GLY A N    1 
ATOM   3091 C CA   . GLY A 1 192 ? 18.093 50.270 20.056 1.00 44.14  ? 195 GLY A CA   1 
ATOM   3092 C C    . GLY A 1 192 ? 18.909 50.868 18.930 1.00 47.31  ? 195 GLY A C    1 
ATOM   3093 O O    . GLY A 1 192 ? 18.523 50.781 17.760 1.00 45.70  ? 195 GLY A O    1 
ATOM   3094 H H    . GLY A 1 192 ? 18.875 48.470 20.140 0.00 50.99  ? 195 GLY A H    1 
ATOM   3095 H HA2  . GLY A 1 192 ? 17.181 50.587 19.969 0.00 53.02  ? 195 GLY A HA2  1 
ATOM   3096 H HA3  . GLY A 1 192 ? 18.460 50.589 20.896 0.00 53.02  ? 195 GLY A HA3  1 
ATOM   3097 N N    . ALA A 1 193 ? 20.046 51.475 19.274 1.00 46.43  ? 196 ALA A N    1 
ATOM   3098 C CA   . ALA A 1 193 ? 20.846 52.181 18.280 1.00 42.94  ? 196 ALA A CA   1 
ATOM   3099 C C    . ALA A 1 193 ? 21.561 51.235 17.323 1.00 65.77  ? 196 ALA A C    1 
ATOM   3100 O O    . ALA A 1 193 ? 21.929 51.653 16.220 1.00 47.74  ? 196 ALA A O    1 
ATOM   3101 C CB   . ALA A 1 193 ? 21.864 53.086 18.976 1.00 48.71  ? 196 ALA A CB   1 
ATOM   3102 H H    . ALA A 1 193 ? 20.372 51.492 20.069 0.00 55.77  ? 196 ALA A H    1 
ATOM   3103 H HA   . ALA A 1 193 ? 20.257 52.741 17.751 0.00 51.58  ? 196 ALA A HA   1 
ATOM   3104 H HB1  . ALA A 1 193 ? 22.382 53.555 18.304 0.00 58.51  ? 196 ALA A HB1  1 
ATOM   3105 H HB2  . ALA A 1 193 ? 21.390 53.724 19.533 0.00 58.51  ? 196 ALA A HB2  1 
ATOM   3106 H HB3  . ALA A 1 193 ? 22.450 52.540 19.524 0.00 58.51  ? 196 ALA A HB3  1 
ATOM   3107 N N    . GLY A 1 194 ? 21.772 49.981 17.715 1.00 49.25  ? 197 GLY A N    1 
ATOM   3108 C CA   . GLY A 1 194 ? 22.385 49.015 16.822 1.00 57.66  ? 197 GLY A CA   1 
ATOM   3109 C C    . GLY A 1 194 ? 23.868 49.209 16.602 1.00 59.76  ? 197 GLY A C    1 
ATOM   3110 O O    . GLY A 1 194 ? 24.372 48.893 15.519 1.00 55.13  ? 197 GLY A O    1 
ATOM   3111 H H    . GLY A 1 194 ? 21.569 49.669 18.490 0.00 59.15  ? 197 GLY A H    1 
ATOM   3112 H HA2  . GLY A 1 194 ? 22.253 48.126 17.187 0.00 69.24  ? 197 GLY A HA2  1 
ATOM   3113 H HA3  . GLY A 1 194 ? 21.948 49.069 15.958 0.00 69.24  ? 197 GLY A HA3  1 
ATOM   3114 N N    . ILE A 1 195 ? 24.588 49.715 17.604 1.00 58.84  ? 198 ILE A N    1 
ATOM   3115 C CA   . ILE A 1 195 ? 26.022 49.935 17.449 1.00 61.88  ? 198 ILE A CA   1 
ATOM   3116 C C    . ILE A 1 195 ? 26.799 48.660 17.749 1.00 70.58  ? 198 ILE A C    1 
ATOM   3117 O O    . ILE A 1 195 ? 27.828 48.385 17.121 1.00 58.51  ? 198 ILE A O    1 
ATOM   3118 C CB   . ILE A 1 195 ? 26.472 51.104 18.344 1.00 55.50  ? 198 ILE A CB   1 
ATOM   3119 C CG1  . ILE A 1 195 ? 26.052 52.434 17.713 1.00 57.65  ? 198 ILE A CG1  1 
ATOM   3120 C CG2  . ILE A 1 195 ? 27.978 51.056 18.588 1.00 62.09  ? 198 ILE A CG2  1 
ATOM   3121 C CD1  . ILE A 1 195 ? 26.902 52.850 16.530 1.00 63.66  ? 198 ILE A CD1  1 
ATOM   3122 H H    . ILE A 1 195 ? 24.273 49.937 18.372 0.00 70.66  ? 198 ILE A H    1 
ATOM   3123 H HA   . ILE A 1 195 ? 26.202 50.176 16.527 0.00 74.31  ? 198 ILE A HA   1 
ATOM   3124 H HB   . ILE A 1 195 ? 26.035 51.021 19.206 0.00 66.66  ? 198 ILE A HB   1 
ATOM   3125 H HG12 . ILE A 1 195 ? 25.135 52.357 17.406 0.00 69.23  ? 198 ILE A HG12 1 
ATOM   3126 H HG13 . ILE A 1 195 ? 26.119 53.132 18.384 0.00 69.23  ? 198 ILE A HG13 1 
ATOM   3127 H HG21 . ILE A 1 195 ? 28.262 51.898 18.976 0.00 74.56  ? 198 ILE A HG21 1 
ATOM   3128 H HG22 . ILE A 1 195 ? 28.176 50.327 19.197 0.00 74.56  ? 198 ILE A HG22 1 
ATOM   3129 H HG23 . ILE A 1 195 ? 28.430 50.912 17.742 0.00 74.56  ? 198 ILE A HG23 1 
ATOM   3130 H HD11 . ILE A 1 195 ? 26.540 53.667 16.153 0.00 76.44  ? 198 ILE A HD11 1 
ATOM   3131 H HD12 . ILE A 1 195 ? 27.812 52.998 16.831 0.00 76.44  ? 198 ILE A HD12 1 
ATOM   3132 H HD13 . ILE A 1 195 ? 26.884 52.143 15.865 0.00 76.44  ? 198 ILE A HD13 1 
ATOM   3133 N N    . VAL A 1 196 ? 26.329 47.868 18.707 1.00 53.12  ? 199 VAL A N    1 
ATOM   3134 C CA   . VAL A 1 196 ? 26.948 46.587 19.034 1.00 56.59  ? 199 VAL A CA   1 
ATOM   3135 C C    . VAL A 1 196 ? 26.215 45.499 18.257 1.00 51.39  ? 199 VAL A C    1 
ATOM   3136 O O    . VAL A 1 196 ? 24.975 45.490 18.240 1.00 55.12  ? 199 VAL A O    1 
ATOM   3137 C CB   . VAL A 1 196 ? 26.909 46.324 20.548 1.00 57.02  ? 199 VAL A CB   1 
ATOM   3138 C CG1  . VAL A 1 196 ? 27.393 44.916 20.869 1.00 60.30  ? 199 VAL A CG1  1 
ATOM   3139 C CG2  . VAL A 1 196 ? 27.744 47.360 21.289 1.00 77.09  ? 199 VAL A CG2  1 
ATOM   3140 H H    . VAL A 1 196 ? 25.641 48.053 19.189 0.00 63.80  ? 199 VAL A H    1 
ATOM   3141 H HA   . VAL A 1 196 ? 27.878 46.592 18.759 0.00 67.96  ? 199 VAL A HA   1 
ATOM   3142 H HB   . VAL A 1 196 ? 25.990 46.397 20.851 0.00 68.48  ? 199 VAL A HB   1 
ATOM   3143 H HG11 . VAL A 1 196 ? 27.445 44.812 21.832 0.00 72.42  ? 199 VAL A HG11 1 
ATOM   3144 H HG12 . VAL A 1 196 ? 26.766 44.275 20.500 0.00 72.42  ? 199 VAL A HG12 1 
ATOM   3145 H HG13 . VAL A 1 196 ? 28.270 44.786 20.475 0.00 72.42  ? 199 VAL A HG13 1 
ATOM   3146 H HG21 . VAL A 1 196 ? 27.789 47.117 22.227 0.00 92.56  ? 199 VAL A HG21 1 
ATOM   3147 H HG22 . VAL A 1 196 ? 28.636 47.378 20.908 0.00 92.56  ? 199 VAL A HG22 1 
ATOM   3148 H HG23 . VAL A 1 196 ? 27.326 48.230 21.193 0.00 92.56  ? 199 VAL A HG23 1 
ATOM   3149 N N    . PRO A 1 197 ? 26.913 44.576 17.599 1.00 47.67  ? 200 PRO A N    1 
ATOM   3150 C CA   . PRO A 1 197 ? 26.212 43.508 16.879 1.00 48.37  ? 200 PRO A CA   1 
ATOM   3151 C C    . PRO A 1 197 ? 25.537 42.538 17.837 1.00 45.41  ? 200 PRO A C    1 
ATOM   3152 O O    . PRO A 1 197 ? 25.856 42.460 19.026 1.00 46.52  ? 200 PRO A O    1 
ATOM   3153 C CB   . PRO A 1 197 ? 27.315 42.819 16.069 1.00 57.81  ? 200 PRO A CB   1 
ATOM   3154 C CG   . PRO A 1 197 ? 28.599 43.243 16.670 1.00 60.82  ? 200 PRO A CG   1 
ATOM   3155 C CD   . PRO A 1 197 ? 28.376 44.510 17.431 1.00 49.94  ? 200 PRO A CD   1 
ATOM   3156 H HA   . PRO A 1 197 ? 25.554 43.880 16.271 0.00 58.10  ? 200 PRO A HA   1 
ATOM   3157 H HB2  . PRO A 1 197 ? 27.210 41.856 16.131 0.00 69.42  ? 200 PRO A HB2  1 
ATOM   3158 H HB3  . PRO A 1 197 ? 27.262 43.100 15.142 0.00 69.42  ? 200 PRO A HB3  1 
ATOM   3159 H HG2  . PRO A 1 197 ? 28.913 42.547 17.268 0.00 73.03  ? 200 PRO A HG2  1 
ATOM   3160 H HG3  . PRO A 1 197 ? 29.245 43.389 15.963 0.00 73.03  ? 200 PRO A HG3  1 
ATOM   3161 H HD2  . PRO A 1 197 ? 28.818 44.473 18.293 0.00 59.98  ? 200 PRO A HD2  1 
ATOM   3162 H HD3  . PRO A 1 197 ? 28.697 45.273 16.926 0.00 59.98  ? 200 PRO A HD3  1 
ATOM   3163 N N    . LEU A 1 198 ? 24.580 41.784 17.288 1.00 46.42  ? 201 LEU A N    1 
ATOM   3164 C CA   . LEU A 1 198 ? 23.751 40.915 18.117 1.00 52.53  ? 201 LEU A CA   1 
ATOM   3165 C C    . LEU A 1 198 ? 24.572 39.833 18.810 1.00 45.91  ? 201 LEU A C    1 
ATOM   3166 O O    . LEU A 1 198 ? 24.218 39.402 19.913 1.00 45.54  ? 201 LEU A O    1 
ATOM   3167 C CB   . LEU A 1 198 ? 22.646 40.285 17.264 1.00 44.79  ? 201 LEU A CB   1 
ATOM   3168 C CG   . LEU A 1 198 ? 21.945 39.033 17.806 1.00 51.71  ? 201 LEU A CG   1 
ATOM   3169 C CD1  . LEU A 1 198 ? 21.067 39.375 19.001 1.00 59.69  ? 201 LEU A CD1  1 
ATOM   3170 C CD2  . LEU A 1 198 ? 21.122 38.375 16.713 1.00 49.34  ? 201 LEU A CD2  1 
ATOM   3171 H H    . LEU A 1 198 ? 24.395 41.759 16.449 0.00 55.75  ? 201 LEU A H    1 
ATOM   3172 H HA   . LEU A 1 198 ? 23.333 41.451 18.809 0.00 63.09  ? 201 LEU A HA   1 
ATOM   3173 H HB2  . LEU A 1 198 ? 21.957 40.955 17.133 0.00 53.80  ? 201 LEU A HB2  1 
ATOM   3174 H HB3  . LEU A 1 198 ? 23.036 40.039 16.411 0.00 53.80  ? 201 LEU A HB3  1 
ATOM   3175 H HG   . LEU A 1 198 ? 22.618 38.402 18.105 0.00 62.10  ? 201 LEU A HG   1 
ATOM   3176 H HD11 . LEU A 1 198 ? 20.637 38.566 19.318 0.00 71.67  ? 201 LEU A HD11 1 
ATOM   3177 H HD12 . LEU A 1 198 ? 21.622 39.752 19.702 0.00 71.67  ? 201 LEU A HD12 1 
ATOM   3178 H HD13 . LEU A 1 198 ? 20.397 40.021 18.726 0.00 71.67  ? 201 LEU A HD13 1 
ATOM   3179 H HD21 . LEU A 1 198 ? 20.688 37.587 17.075 0.00 59.26  ? 201 LEU A HD21 1 
ATOM   3180 H HD22 . LEU A 1 198 ? 20.454 39.005 16.398 0.00 59.26  ? 201 LEU A HD22 1 
ATOM   3181 H HD23 . LEU A 1 198 ? 21.709 38.124 15.983 0.00 59.26  ? 201 LEU A HD23 1 
ATOM   3182 N N    . ASN A 1 199 ? 25.659 39.375 18.186 1.00 43.69  ? 202 ASN A N    1 
ATOM   3183 C CA   . ASN A 1 199 ? 26.439 38.299 18.789 1.00 49.54  ? 202 ASN A CA   1 
ATOM   3184 C C    . ASN A 1 199 ? 27.207 38.778 20.015 1.00 52.30  ? 202 ASN A C    1 
ATOM   3185 O O    . ASN A 1 199 ? 27.390 38.009 20.966 1.00 46.70  ? 202 ASN A O    1 
ATOM   3186 C CB   . ASN A 1 199 ? 27.393 37.694 17.757 1.00 42.07  ? 202 ASN A CB   1 
ATOM   3187 C CG   . ASN A 1 199 ? 28.477 38.660 17.323 1.00 55.24  ? 202 ASN A CG   1 
ATOM   3188 O OD1  . ASN A 1 199 ? 28.193 39.728 16.782 1.00 73.43  ? 202 ASN A OD1  1 
ATOM   3189 N ND2  . ASN A 1 199 ? 29.730 38.280 17.544 1.00 82.42  ? 202 ASN A ND2  1 
ATOM   3190 H H    . ASN A 1 199 ? 25.957 39.663 17.432 1.00 52.47  ? 202 ASN A H    1 
ATOM   3191 H HA   . ASN A 1 199 ? 25.832 37.598 19.075 1.00 59.50  ? 202 ASN A HA   1 
ATOM   3192 H HB2  . ASN A 1 199 ? 27.823 36.915 18.143 1.00 50.54  ? 202 ASN A HB2  1 
ATOM   3193 H HB3  . ASN A 1 199 ? 26.887 37.438 16.971 1.00 50.54  ? 202 ASN A HB3  1 
ATOM   3194 H HD21 . ASN A 1 199 ? 29.890 37.522 17.916 1.00 98.96  ? 202 ASN A HD21 1 
ATOM   3195 H HD22 . ASN A 1 199 ? 30.381 38.793 17.315 1.00 98.96  ? 202 ASN A HD22 1 
ATOM   3196 N N    . ILE A 1 200 ? 27.655 40.034 20.020 1.00 45.36  ? 203 ILE A N    1 
ATOM   3197 C CA   . ILE A 1 200 ? 28.337 40.564 21.196 1.00 46.02  ? 203 ILE A CA   1 
ATOM   3198 C C    . ILE A 1 200 ? 27.331 40.935 22.275 1.00 38.76  ? 203 ILE A C    1 
ATOM   3199 O O    . ILE A 1 200 ? 27.592 40.756 23.470 1.00 42.45  ? 203 ILE A O    1 
ATOM   3200 C CB   . ILE A 1 200 ? 29.220 41.763 20.802 1.00 54.30  ? 203 ILE A CB   1 
ATOM   3201 C CG1  . ILE A 1 200 ? 30.317 41.320 19.828 1.00 51.36  ? 203 ILE A CG1  1 
ATOM   3202 C CG2  . ILE A 1 200 ? 29.834 42.410 22.041 1.00 51.29  ? 203 ILE A CG2  1 
ATOM   3203 C CD1  . ILE A 1 200 ? 31.298 40.311 20.404 1.00 52.21  ? 203 ILE A CD1  1 
ATOM   3204 H H    . ILE A 1 200 ? 27.577 40.589 19.368 0.00 54.49  ? 203 ILE A H    1 
ATOM   3205 H HA   . ILE A 1 200 ? 28.918 39.874 21.554 0.00 55.27  ? 203 ILE A HA   1 
ATOM   3206 H HB   . ILE A 1 200 ? 28.660 42.420 20.360 0.00 65.21  ? 203 ILE A HB   1 
ATOM   3207 H HG12 . ILE A 1 200 ? 29.898 40.913 19.054 0.00 61.68  ? 203 ILE A HG12 1 
ATOM   3208 H HG13 . ILE A 1 200 ? 30.825 42.101 19.558 0.00 61.68  ? 203 ILE A HG13 1 
ATOM   3209 H HG21 . ILE A 1 200 ? 30.527 43.030 21.762 0.00 61.60  ? 203 ILE A HG21 1 
ATOM   3210 H HG22 . ILE A 1 200 ? 29.141 42.885 22.526 0.00 61.60  ? 203 ILE A HG22 1 
ATOM   3211 H HG23 . ILE A 1 200 ? 30.217 41.718 22.602 0.00 61.60  ? 203 ILE A HG23 1 
ATOM   3212 H HD11 . ILE A 1 200 ? 31.976 40.114 19.739 0.00 62.71  ? 203 ILE A HD11 1 
ATOM   3213 H HD12 . ILE A 1 200 ? 31.712 40.690 21.196 0.00 62.71  ? 203 ILE A HD12 1 
ATOM   3214 H HD13 . ILE A 1 200 ? 30.818 39.501 20.637 0.00 62.71  ? 203 ILE A HD13 1 
ATOM   3215 N N    . GLU A 1 201 ? 26.167 41.456 21.879 1.00 46.92  ? 204 GLU A N    1 
ATOM   3216 C CA   . GLU A 1 201 ? 25.122 41.745 22.855 1.00 44.65  ? 204 GLU A CA   1 
ATOM   3217 C C    . GLU A 1 201 ? 24.686 40.479 23.581 1.00 43.52  ? 204 GLU A C    1 
ATOM   3218 O O    . GLU A 1 201 ? 24.489 40.490 24.802 1.00 45.07  ? 204 GLU A O    1 
ATOM   3219 C CB   . GLU A 1 201 ? 23.928 42.404 22.166 1.00 41.93  ? 204 GLU A CB   1 
ATOM   3220 C CG   . GLU A 1 201 ? 22.687 42.486 23.036 1.00 55.63  ? 204 GLU A CG   1 
ATOM   3221 C CD   . GLU A 1 201 ? 21.542 43.193 22.354 1.00 61.50  ? 204 GLU A CD   1 
ATOM   3222 O OE1  . GLU A 1 201 ? 21.492 43.192 21.106 1.00 56.34  ? 204 GLU A OE1  1 
ATOM   3223 O OE2  . GLU A 1 201 ? 20.688 43.750 23.071 1.00 45.03  ? 204 GLU A OE2  1 
ATOM   3224 H H    . GLU A 1 201 ? 25.963 41.648 21.066 0.00 56.35  ? 204 GLU A H    1 
ATOM   3225 H HA   . GLU A 1 201 ? 25.470 42.367 23.513 0.00 53.63  ? 204 GLU A HA   1 
ATOM   3226 H HB2  . GLU A 1 201 ? 24.173 43.309 21.915 0.00 50.37  ? 204 GLU A HB2  1 
ATOM   3227 H HB3  . GLU A 1 201 ? 23.702 41.890 21.375 0.00 50.37  ? 204 GLU A HB3  1 
ATOM   3228 H HG2  . GLU A 1 201 ? 22.395 41.587 23.256 0.00 66.81  ? 204 GLU A HG2  1 
ATOM   3229 H HG3  . GLU A 1 201 ? 22.900 42.973 23.847 0.00 66.81  ? 204 GLU A HG3  1 
ATOM   3230 N N    . THR A 1 202 ? 24.520 39.377 22.845 1.00 35.66  ? 205 THR A N    1 
ATOM   3231 C CA   . THR A 1 202 ? 24.138 38.120 23.479 1.00 44.45  ? 205 THR A CA   1 
ATOM   3232 C C    . THR A 1 202 ? 25.186 37.685 24.496 1.00 41.03  ? 205 THR A C    1 
ATOM   3233 O O    . THR A 1 202 ? 24.851 37.125 25.546 1.00 36.70  ? 205 THR A O    1 
ATOM   3234 C CB   . THR A 1 202 ? 23.933 37.038 22.417 1.00 48.36  ? 205 THR A CB   1 
ATOM   3235 O OG1  . THR A 1 202 ? 22.947 37.474 21.471 1.00 43.11  ? 205 THR A OG1  1 
ATOM   3236 C CG2  . THR A 1 202 ? 23.468 35.736 23.052 1.00 40.33  ? 205 THR A CG2  1 
ATOM   3237 H H    . THR A 1 202 ? 24.622 39.333 21.992 0.00 42.85  ? 205 THR A H    1 
ATOM   3238 H HA   . THR A 1 202 ? 23.296 38.242 23.945 0.00 53.39  ? 205 THR A HA   1 
ATOM   3239 H HB   . THR A 1 202 ? 24.775 36.875 21.963 0.00 58.09  ? 205 THR A HB   1 
ATOM   3240 H HG1  . THR A 1 202 ? 23.197 38.186 21.103 0.00 51.78  ? 205 THR A HG1  1 
ATOM   3241 H HG21 . THR A 1 202 ? 23.276 35.081 22.364 0.00 48.45  ? 205 THR A HG21 1 
ATOM   3242 H HG22 . THR A 1 202 ? 24.160 35.386 23.636 0.00 48.45  ? 205 THR A HG22 1 
ATOM   3243 H HG23 . THR A 1 202 ? 22.665 35.890 23.574 0.00 48.45  ? 205 THR A HG23 1 
ATOM   3244 N N    . LEU A 1 203 ? 26.463 37.942 24.202 1.00 41.38  ? 206 LEU A N    1 
ATOM   3245 C CA   . LEU A 1 203 ? 27.523 37.640 25.159 1.00 47.76  ? 206 LEU A CA   1 
ATOM   3246 C C    . LEU A 1 203 ? 27.405 38.507 26.407 1.00 35.15  ? 206 LEU A C    1 
ATOM   3247 O O    . LEU A 1 203 ? 27.605 38.024 27.528 1.00 43.37  ? 206 LEU A O    1 
ATOM   3248 C CB   . LEU A 1 203 ? 28.888 37.831 24.494 1.00 47.40  ? 206 LEU A CB   1 
ATOM   3249 C CG   . LEU A 1 203 ? 30.119 37.821 25.404 1.00 40.83  ? 206 LEU A CG   1 
ATOM   3250 C CD1  . LEU A 1 203 ? 30.205 36.536 26.213 1.00 42.12  ? 206 LEU A CD1  1 
ATOM   3251 C CD2  . LEU A 1 203 ? 31.374 38.011 24.570 1.00 49.31  ? 206 LEU A CD2  1 
ATOM   3252 H H    . LEU A 1 203 ? 26.737 38.286 23.463 0.00 49.71  ? 206 LEU A H    1 
ATOM   3253 H HA   . LEU A 1 203 ? 27.447 36.713 25.433 0.00 57.36  ? 206 LEU A HA   1 
ATOM   3254 H HB2  . LEU A 1 203 ? 29.008 37.116 23.850 0.00 56.93  ? 206 LEU A HB2  1 
ATOM   3255 H HB3  . LEU A 1 203 ? 28.880 38.689 24.041 0.00 56.93  ? 206 LEU A HB3  1 
ATOM   3256 H HG   . LEU A 1 203 ? 30.047 38.552 26.038 0.00 49.05  ? 206 LEU A HG   1 
ATOM   3257 H HD11 . LEU A 1 203 ? 31.018 36.549 26.741 0.00 50.60  ? 206 LEU A HD11 1 
ATOM   3258 H HD12 . LEU A 1 203 ? 29.432 36.478 26.796 0.00 50.60  ? 206 LEU A HD12 1 
ATOM   3259 H HD13 . LEU A 1 203 ? 30.217 35.780 25.604 0.00 50.60  ? 206 LEU A HD13 1 
ATOM   3260 H HD21 . LEU A 1 203 ? 32.136 38.105 25.162 0.00 59.22  ? 206 LEU A HD21 1 
ATOM   3261 H HD22 . LEU A 1 203 ? 31.493 37.236 23.998 0.00 59.22  ? 206 LEU A HD22 1 
ATOM   3262 H HD23 . LEU A 1 203 ? 31.275 38.809 24.028 0.00 59.22  ? 206 LEU A HD23 1 
ATOM   3263 N N    . LEU A 1 204 ? 27.081 39.790 26.236 1.00 47.22  ? 207 LEU A N    1 
ATOM   3264 C CA   . LEU A 1 204 ? 26.975 40.677 27.390 1.00 38.98  ? 207 LEU A CA   1 
ATOM   3265 C C    . LEU A 1 204 ? 25.803 40.288 28.283 1.00 49.41  ? 207 LEU A C    1 
ATOM   3266 O O    . LEU A 1 204 ? 25.943 40.240 29.511 1.00 43.92  ? 207 LEU A O    1 
ATOM   3267 C CB   . LEU A 1 204 ? 26.837 42.127 26.928 1.00 47.78  ? 207 LEU A CB   1 
ATOM   3268 C CG   . LEU A 1 204 ? 28.046 42.721 26.199 1.00 41.60  ? 207 LEU A CG   1 
ATOM   3269 C CD1  . LEU A 1 204 ? 27.728 44.117 25.690 1.00 54.06  ? 207 LEU A CD1  1 
ATOM   3270 C CD2  . LEU A 1 204 ? 29.271 42.752 27.103 1.00 42.81  ? 207 LEU A CD2  1 
ATOM   3271 H H    . LEU A 1 204 ? 26.920 40.163 25.478 0.00 56.72  ? 207 LEU A H    1 
ATOM   3272 H HA   . LEU A 1 204 ? 27.789 40.601 27.913 0.00 46.83  ? 207 LEU A HA   1 
ATOM   3273 H HB2  . LEU A 1 204 ? 26.083 42.180 26.321 0.00 57.39  ? 207 LEU A HB2  1 
ATOM   3274 H HB3  . LEU A 1 204 ? 26.674 42.679 27.709 0.00 57.39  ? 207 LEU A HB3  1 
ATOM   3275 H HG   . LEU A 1 204 ? 28.255 42.157 25.438 0.00 49.97  ? 207 LEU A HG   1 
ATOM   3276 H HD11 . LEU A 1 204 ? 28.510 44.476 25.241 0.00 64.92  ? 207 LEU A HD11 1 
ATOM   3277 H HD12 . LEU A 1 204 ? 26.985 44.065 25.069 0.00 64.92  ? 207 LEU A HD12 1 
ATOM   3278 H HD13 . LEU A 1 204 ? 27.491 44.682 26.442 0.00 64.92  ? 207 LEU A HD13 1 
ATOM   3279 H HD21 . LEU A 1 204 ? 29.980 43.240 26.656 0.00 51.42  ? 207 LEU A HD21 1 
ATOM   3280 H HD22 . LEU A 1 204 ? 29.038 43.193 27.935 0.00 51.42  ? 207 LEU A HD22 1 
ATOM   3281 H HD23 . LEU A 1 204 ? 29.556 41.842 27.279 0.00 51.42  ? 207 LEU A HD23 1 
ATOM   3282 N N    . PHE A 1 205 ? 24.639 40.010 27.689 1.00 44.55  ? 208 PHE A N    1 
ATOM   3283 C CA   . PHE A 1 205 ? 23.482 39.625 28.493 1.00 41.00  ? 208 PHE A CA   1 
ATOM   3284 C C    . PHE A 1 205 ? 23.724 38.307 29.215 1.00 41.75  ? 208 PHE A C    1 
ATOM   3285 O O    . PHE A 1 205 ? 23.276 38.124 30.353 1.00 48.54  ? 208 PHE A O    1 
ATOM   3286 C CB   . PHE A 1 205 ? 22.232 39.518 27.617 1.00 42.34  ? 208 PHE A CB   1 
ATOM   3287 C CG   . PHE A 1 205 ? 21.547 40.833 27.354 1.00 52.54  ? 208 PHE A CG   1 
ATOM   3288 C CD1  . PHE A 1 205 ? 21.291 41.722 28.386 1.00 48.91  ? 208 PHE A CD1  1 
ATOM   3289 C CD2  . PHE A 1 205 ? 21.123 41.162 26.076 1.00 50.46  ? 208 PHE A CD2  1 
ATOM   3290 C CE1  . PHE A 1 205 ? 20.654 42.923 28.145 1.00 46.12  ? 208 PHE A CE1  1 
ATOM   3291 C CE2  . PHE A 1 205 ? 20.481 42.361 25.831 1.00 42.09  ? 208 PHE A CE2  1 
ATOM   3292 C CZ   . PHE A 1 205 ? 20.246 43.242 26.867 1.00 40.94  ? 208 PHE A CZ   1 
ATOM   3293 H H    . PHE A 1 205 ? 24.497 40.037 26.842 0.00 53.52  ? 208 PHE A H    1 
ATOM   3294 H HA   . PHE A 1 205 ? 23.330 40.317 29.155 0.00 49.25  ? 208 PHE A HA   1 
ATOM   3295 H HB2  . PHE A 1 205 ? 22.485 39.142 26.759 0.00 50.86  ? 208 PHE A HB2  1 
ATOM   3296 H HB3  . PHE A 1 205 ? 21.593 38.937 28.058 0.00 50.86  ? 208 PHE A HB3  1 
ATOM   3297 H HD1  . PHE A 1 205 ? 21.553 41.507 29.252 0.00 58.74  ? 208 PHE A HD1  1 
ATOM   3298 H HD2  . PHE A 1 205 ? 21.272 40.569 25.376 0.00 60.61  ? 208 PHE A HD2  1 
ATOM   3299 H HE1  . PHE A 1 205 ? 20.499 43.517 28.844 0.00 55.39  ? 208 PHE A HE1  1 
ATOM   3300 H HE2  . PHE A 1 205 ? 20.208 42.575 24.968 0.00 50.56  ? 208 PHE A HE2  1 
ATOM   3301 H HZ   . PHE A 1 205 ? 19.813 44.048 26.703 0.00 49.18  ? 208 PHE A HZ   1 
ATOM   3302 N N    . MET A 1 206 ? 24.427 37.373 28.571 1.00 39.45  ? 209 MET A N    1 
ATOM   3303 C CA   . MET A 1 206 ? 24.666 36.079 29.201 1.00 44.29  ? 209 MET A CA   1 
ATOM   3304 C C    . MET A 1 206 ? 25.563 36.225 30.424 1.00 37.55  ? 209 MET A C    1 
ATOM   3305 O O    . MET A 1 206 ? 25.323 35.589 31.457 1.00 43.86  ? 209 MET A O    1 
ATOM   3306 C CB   . MET A 1 206 ? 25.275 35.108 28.189 1.00 43.10  ? 209 MET A CB   1 
ATOM   3307 C CG   . MET A 1 206 ? 25.499 33.700 28.724 1.00 38.65  ? 209 MET A CG   1 
ATOM   3308 S SD   . MET A 1 206 ? 27.152 33.457 29.397 1.00 65.78  ? 209 MET A SD   1 
ATOM   3309 C CE   . MET A 1 206 ? 28.035 32.983 27.913 1.00 46.87  ? 209 MET A CE   1 
ATOM   3310 H H    . MET A 1 206 ? 24.768 37.462 27.787 0.00 47.39  ? 209 MET A H    1 
ATOM   3311 H HA   . MET A 1 206 ? 23.816 35.707 29.485 0.00 53.20  ? 209 MET A HA   1 
ATOM   3312 H HB2  . MET A 1 206 ? 24.678 35.041 27.427 0.00 51.77  ? 209 MET A HB2  1 
ATOM   3313 H HB3  . MET A 1 206 ? 26.135 35.455 27.906 0.00 51.77  ? 209 MET A HB3  1 
ATOM   3314 H HG2  . MET A 1 206 ? 24.859 33.527 29.432 0.00 46.43  ? 209 MET A HG2  1 
ATOM   3315 H HG3  . MET A 1 206 ? 25.374 33.065 28.001 0.00 46.43  ? 209 MET A HG3  1 
ATOM   3316 H HE1  . MET A 1 206 ? 28.969 32.841 28.133 0.00 56.29  ? 209 MET A HE1  1 
ATOM   3317 H HE2  . MET A 1 206 ? 27.649 32.164 27.565 0.00 56.29  ? 209 MET A HE2  1 
ATOM   3318 H HE3  . MET A 1 206 ? 27.953 33.692 27.257 0.00 56.29  ? 209 MET A HE3  1 
ATOM   3319 N N    . VAL A 1 207 ? 26.594 37.066 30.333 1.00 37.10  ? 210 VAL A N    1 
ATOM   3320 C CA   . VAL A 1 207 ? 27.446 37.318 31.492 1.00 34.98  ? 210 VAL A CA   1 
ATOM   3321 C C    . VAL A 1 207 ? 26.639 37.977 32.605 1.00 44.96  ? 210 VAL A C    1 
ATOM   3322 O O    . VAL A 1 207 ? 26.741 37.600 33.779 1.00 39.81  ? 210 VAL A O    1 
ATOM   3323 C CB   . VAL A 1 207 ? 28.660 38.173 31.082 1.00 38.03  ? 210 VAL A CB   1 
ATOM   3324 C CG1  . VAL A 1 207 ? 29.319 38.810 32.304 1.00 55.15  ? 210 VAL A CG1  1 
ATOM   3325 C CG2  . VAL A 1 207 ? 29.658 37.327 30.305 1.00 37.50  ? 210 VAL A CG2  1 
ATOM   3326 H H    . VAL A 1 207 ? 26.817 37.496 29.623 0.00 44.57  ? 210 VAL A H    1 
ATOM   3327 H HA   . VAL A 1 207 ? 27.780 36.470 31.826 0.00 42.03  ? 210 VAL A HA   1 
ATOM   3328 H HB   . VAL A 1 207 ? 28.356 38.893 30.508 0.00 45.69  ? 210 VAL A HB   1 
ATOM   3329 H HG11 . VAL A 1 207 ? 30.176 39.181 32.042 0.00 66.23  ? 210 VAL A HG11 1 
ATOM   3330 H HG12 . VAL A 1 207 ? 28.744 39.513 32.643 0.00 66.23  ? 210 VAL A HG12 1 
ATOM   3331 H HG13 . VAL A 1 207 ? 29.447 38.130 32.984 0.00 66.23  ? 210 VAL A HG13 1 
ATOM   3332 H HG21 . VAL A 1 207 ? 30.411 37.882 30.049 0.00 45.06  ? 210 VAL A HG21 1 
ATOM   3333 H HG22 . VAL A 1 207 ? 29.961 36.598 30.869 0.00 45.06  ? 210 VAL A HG22 1 
ATOM   3334 H HG23 . VAL A 1 207 ? 29.223 36.974 29.513 0.00 45.06  ? 210 VAL A HG23 1 
ATOM   3335 N N    . LEU A 1 208 ? 25.818 38.969 32.252 1.00 39.25  ? 211 LEU A N    1 
ATOM   3336 C CA   . LEU A 1 208 ? 24.993 39.636 33.255 1.00 38.45  ? 211 LEU A CA   1 
ATOM   3337 C C    . LEU A 1 208 ? 23.976 38.677 33.864 1.00 47.59  ? 211 LEU A C    1 
ATOM   3338 O O    . LEU A 1 208 ? 23.749 38.693 35.080 1.00 39.71  ? 211 LEU A O    1 
ATOM   3339 C CB   . LEU A 1 208 ? 24.281 40.841 32.638 1.00 46.14  ? 211 LEU A CB   1 
ATOM   3340 C CG   . LEU A 1 208 ? 25.151 42.015 32.186 1.00 47.23  ? 211 LEU A CG   1 
ATOM   3341 C CD1  . LEU A 1 208 ? 24.340 42.937 31.292 1.00 46.91  ? 211 LEU A CD1  1 
ATOM   3342 C CD2  . LEU A 1 208 ? 25.717 42.772 33.380 1.00 47.31  ? 211 LEU A CD2  1 
ATOM   3343 H H    . LEU A 1 208 ? 25.723 39.269 31.452 0.00 47.15  ? 211 LEU A H    1 
ATOM   3344 H HA   . LEU A 1 208 ? 25.571 39.956 33.966 0.00 46.19  ? 211 LEU A HA   1 
ATOM   3345 H HB2  . LEU A 1 208 ? 23.797 40.531 31.856 0.00 55.41  ? 211 LEU A HB2  1 
ATOM   3346 H HB3  . LEU A 1 208 ? 23.659 41.188 33.297 0.00 55.41  ? 211 LEU A HB3  1 
ATOM   3347 H HG   . LEU A 1 208 ? 25.907 41.677 31.680 0.00 56.73  ? 211 LEU A HG   1 
ATOM   3348 H HD11 . LEU A 1 208 ? 24.897 43.682 31.018 0.00 56.35  ? 211 LEU A HD11 1 
ATOM   3349 H HD12 . LEU A 1 208 ? 24.044 42.441 30.513 0.00 56.35  ? 211 LEU A HD12 1 
ATOM   3350 H HD13 . LEU A 1 208 ? 23.573 43.263 31.788 0.00 56.35  ? 211 LEU A HD13 1 
ATOM   3351 H HD21 . LEU A 1 208 ? 26.244 43.520 33.058 0.00 56.82  ? 211 LEU A HD21 1 
ATOM   3352 H HD22 . LEU A 1 208 ? 24.983 43.095 33.925 0.00 56.82  ? 211 LEU A HD22 1 
ATOM   3353 H HD23 . LEU A 1 208 ? 26.276 42.172 33.898 0.00 56.82  ? 211 LEU A HD23 1 
ATOM   3354 N N    . ASP A 1 209 ? 23.348 37.836 33.037 1.00 36.70  ? 212 ASP A N    1 
ATOM   3355 C CA   . ASP A 1 209 ? 22.307 36.946 33.546 1.00 45.01  ? 212 ASP A CA   1 
ATOM   3356 C C    . ASP A 1 209 ? 22.871 35.947 34.548 1.00 44.28  ? 212 ASP A C    1 
ATOM   3357 O O    . ASP A 1 209 ? 22.268 35.703 35.599 1.00 39.60  ? 212 ASP A O    1 
ATOM   3358 C CB   . ASP A 1 209 ? 21.630 36.205 32.391 1.00 32.81  ? 212 ASP A CB   1 
ATOM   3359 C CG   . ASP A 1 209 ? 20.663 37.081 31.617 1.00 52.88  ? 212 ASP A CG   1 
ATOM   3360 O OD1  . ASP A 1 209 ? 20.286 38.154 32.131 1.00 41.75  ? 212 ASP A OD1  1 
ATOM   3361 O OD2  . ASP A 1 209 ? 20.274 36.690 30.497 1.00 39.80  ? 212 ASP A OD2  1 
ATOM   3362 H H    . ASP A 1 209 ? 23.503 37.764 32.194 0.00 44.09  ? 212 ASP A H    1 
ATOM   3363 H HA   . ASP A 1 209 ? 21.637 37.485 33.995 0.00 54.06  ? 212 ASP A HA   1 
ATOM   3364 H HB2  . ASP A 1 209 ? 22.310 35.892 31.774 0.00 39.42  ? 212 ASP A HB2  1 
ATOM   3365 H HB3  . ASP A 1 209 ? 21.133 35.452 32.747 0.00 39.42  ? 212 ASP A HB3  1 
ATOM   3366 N N    . VAL A 1 210 ? 24.023 35.352 34.237 1.00 39.87  ? 213 VAL A N    1 
ATOM   3367 C CA   . VAL A 1 210 ? 24.583 34.327 35.110 1.00 48.06  ? 213 VAL A CA   1 
ATOM   3368 C C    . VAL A 1 210 ? 25.065 34.942 36.418 1.00 44.34  ? 213 VAL A C    1 
ATOM   3369 O O    . VAL A 1 210 ? 24.901 34.352 37.493 1.00 42.66  ? 213 VAL A O    1 
ATOM   3370 C CB   . VAL A 1 210 ? 25.712 33.573 34.382 1.00 39.44  ? 213 VAL A CB   1 
ATOM   3371 C CG1  . VAL A 1 210 ? 26.330 32.514 35.286 1.00 55.55  ? 213 VAL A CG1  1 
ATOM   3372 C CG2  . VAL A 1 210 ? 25.178 32.924 33.114 1.00 40.13  ? 213 VAL A CG2  1 
ATOM   3373 H H    . VAL A 1 210 ? 24.492 35.523 33.537 0.00 47.89  ? 213 VAL A H    1 
ATOM   3374 H HA   . VAL A 1 210 ? 23.886 33.688 35.326 0.00 57.73  ? 213 VAL A HA   1 
ATOM   3375 H HB   . VAL A 1 210 ? 26.403 34.210 34.144 0.00 47.37  ? 213 VAL A HB   1 
ATOM   3376 H HG11 . VAL A 1 210 ? 27.034 32.056 34.800 0.00 66.71  ? 213 VAL A HG11 1 
ATOM   3377 H HG12 . VAL A 1 210 ? 26.699 32.946 36.072 0.00 66.71  ? 213 VAL A HG12 1 
ATOM   3378 H HG13 . VAL A 1 210 ? 25.643 31.882 35.547 0.00 66.71  ? 213 VAL A HG13 1 
ATOM   3379 H HG21 . VAL A 1 210 ? 25.905 32.466 32.664 0.00 48.20  ? 213 VAL A HG21 1 
ATOM   3380 H HG22 . VAL A 1 210 ? 24.484 32.290 33.352 0.00 48.20  ? 213 VAL A HG22 1 
ATOM   3381 H HG23 . VAL A 1 210 ? 24.813 33.613 32.537 0.00 48.20  ? 213 VAL A HG23 1 
ATOM   3382 N N    . SER A 1 211 ? 25.663 36.133 36.353 1.00 38.67  ? 214 SER A N    1 
ATOM   3383 C CA   . SER A 1 211 ? 26.167 36.769 37.565 1.00 32.97  ? 214 SER A CA   1 
ATOM   3384 C C    . SER A 1 211 ? 25.026 37.236 38.460 1.00 41.62  ? 214 SER A C    1 
ATOM   3385 O O    . SER A 1 211 ? 25.123 37.157 39.690 1.00 38.31  ? 214 SER A O    1 
ATOM   3386 C CB   . SER A 1 211 ? 27.071 37.946 37.200 1.00 42.73  ? 214 SER A CB   1 
ATOM   3387 O OG   . SER A 1 211 ? 28.190 37.513 36.447 1.00 53.05  ? 214 SER A OG   1 
ATOM   3388 H H    . SER A 1 211 ? 25.786 36.584 35.631 0.00 46.45  ? 214 SER A H    1 
ATOM   3389 H HA   . SER A 1 211 ? 26.694 36.123 38.060 0.00 39.62  ? 214 SER A HA   1 
ATOM   3390 H HB2  . SER A 1 211 ? 26.563 38.581 36.672 0.00 51.33  ? 214 SER A HB2  1 
ATOM   3391 H HB3  . SER A 1 211 ? 27.384 38.368 38.016 0.00 51.33  ? 214 SER A HB3  1 
ATOM   3392 H HG   . SER A 1 211 ? 27.935 37.181 35.719 0.00 63.71  ? 214 SER A HG   1 
ATOM   3393 N N    . ALA A 1 212 ? 23.939 37.715 37.865 1.00 40.00  ? 215 ALA A N    1 
ATOM   3394 C CA   . ALA A 1 212 ? 22.841 38.298 38.626 1.00 41.62  ? 215 ALA A CA   1 
ATOM   3395 C C    . ALA A 1 212 ? 21.889 37.236 39.176 1.00 45.08  ? 215 ALA A C    1 
ATOM   3396 O O    . ALA A 1 212 ? 21.087 37.522 40.065 1.00 45.25  ? 215 ALA A O    1 
ATOM   3397 C CB   . ALA A 1 212 ? 22.078 39.285 37.760 1.00 38.82  ? 215 ALA A CB   1 
ATOM   3398 H H    . ALA A 1 212 ? 23.813 37.715 37.015 0.00 48.05  ? 215 ALA A H    1 
ATOM   3399 H HA   . ALA A 1 212 ? 23.215 38.768 39.388 0.00 49.99  ? 215 ALA A HA   1 
ATOM   3400 H HB1  . ALA A 1 212 ? 21.349 39.661 38.277 0.00 46.63  ? 215 ALA A HB1  1 
ATOM   3401 H HB2  . ALA A 1 212 ? 22.681 39.990 37.478 0.00 46.63  ? 215 ALA A HB2  1 
ATOM   3402 H HB3  . ALA A 1 212 ? 21.728 38.820 36.984 0.00 46.63  ? 215 ALA A HB3  1 
ATOM   3403 N N    . LYS A 1 213 ? 21.979 36.017 38.648 1.00 43.01  ? 216 LYS A N    1 
ATOM   3404 C CA   . LYS A 1 213 ? 21.070 34.916 39.075 1.00 42.72  ? 216 LYS A CA   1 
ATOM   3405 C C    . LYS A 1 213 ? 21.868 33.851 39.838 1.00 47.60  ? 216 LYS A C    1 
ATOM   3406 O O    . LYS A 1 213 ? 21.525 33.637 41.026 1.00 51.28  ? 216 LYS A O    1 
ATOM   3407 C CB   . LYS A 1 213 ? 20.351 34.308 37.868 1.00 45.47  ? 216 LYS A CB   1 
ATOM   3408 C CG   . LYS A 1 213 ? 19.424 35.282 37.149 1.00 36.77  ? 216 LYS A CG   1 
ATOM   3409 C CD   . LYS A 1 213 ? 18.674 34.676 35.970 1.00 40.99  ? 216 LYS A CD   1 
ATOM   3410 C CE   . LYS A 1 213 ? 17.778 35.688 35.280 1.00 45.51  ? 216 LYS A CE   1 
ATOM   3411 N NZ   . LYS A 1 213 ? 18.515 36.902 34.943 1.00 52.57  ? 216 LYS A NZ   1 
ATOM   3412 H HA   . LYS A 1 213 ? 20.430 35.323 39.694 1.00 51.32  ? 216 LYS A HA   1 
ATOM   3413 H HB2  . LYS A 1 213 ? 21.023 33.964 37.244 1.00 54.61  ? 216 LYS A HB2  1 
ATOM   3414 H HB3  . LYS A 1 213 ? 19.846 33.524 38.166 1.00 54.61  ? 216 LYS A HB3  1 
ATOM   3415 H HG2  . LYS A 1 213 ? 18.760 35.645 37.770 1.00 44.17  ? 216 LYS A HG2  1 
ATOM   3416 H HG3  . LYS A 1 213 ? 19.928 36.053 36.817 1.00 44.17  ? 216 LYS A HG3  1 
ATOM   3417 H HD2  . LYS A 1 213 ? 19.316 34.311 35.328 1.00 49.23  ? 216 LYS A HD2  1 
ATOM   3418 H HD3  . LYS A 1 213 ? 18.138 33.918 36.280 1.00 49.23  ? 216 LYS A HD3  1 
ATOM   3419 H HE2  . LYS A 1 213 ? 17.436 35.323 34.439 1.00 54.67  ? 216 LYS A HE2  1 
ATOM   3420 H HE3  . LYS A 1 213 ? 17.048 35.957 35.875 1.00 54.67  ? 216 LYS A HE3  1 
ATOM   3421 H HZ2  . LYS A 1 213 ? 19.324 36.800 34.605 1.00 63.14  ? 216 LYS A HZ2  1 
ATOM   3422 N N    . VAL A 1 214 ? 22.918 33.316 39.221 1.00 58.67  ? 217 VAL A N    1 
ATOM   3423 C CA   . VAL A 1 214 ? 23.722 32.275 39.856 1.00 40.44  ? 217 VAL A CA   1 
ATOM   3424 C C    . VAL A 1 214 ? 24.702 32.878 40.859 1.00 46.17  ? 217 VAL A C    1 
ATOM   3425 O O    . VAL A 1 214 ? 24.818 32.393 41.984 1.00 44.91  ? 217 VAL A O    1 
ATOM   3426 C CB   . VAL A 1 214 ? 24.473 31.427 38.811 1.00 41.26  ? 217 VAL A CB   1 
ATOM   3427 C CG1  . VAL A 1 214 ? 24.910 30.108 39.426 1.00 42.59  ? 217 VAL A CG1  1 
ATOM   3428 C CG2  . VAL A 1 214 ? 23.590 31.167 37.598 1.00 52.68  ? 217 VAL A CG2  1 
ATOM   3429 H H    . VAL A 1 214 ? 23.185 33.538 38.435 0.00 70.45  ? 217 VAL A H    1 
ATOM   3430 H HA   . VAL A 1 214 ? 23.122 31.689 40.342 0.00 48.58  ? 217 VAL A HA   1 
ATOM   3431 H HB   . VAL A 1 214 ? 25.259 31.915 38.518 0.00 49.57  ? 217 VAL A HB   1 
ATOM   3432 H HG11 . VAL A 1 214 ? 25.383 29.589 38.756 0.00 51.16  ? 217 VAL A HG11 1 
ATOM   3433 H HG12 . VAL A 1 214 ? 25.494 30.288 40.178 0.00 51.16  ? 217 VAL A HG12 1 
ATOM   3434 H HG13 . VAL A 1 214 ? 24.124 29.624 39.725 0.00 51.16  ? 217 VAL A HG13 1 
ATOM   3435 H HG21 . VAL A 1 214 ? 24.024 30.515 37.026 0.00 63.26  ? 217 VAL A HG21 1 
ATOM   3436 H HG22 . VAL A 1 214 ? 22.733 30.824 37.899 0.00 63.26  ? 217 VAL A HG22 1 
ATOM   3437 H HG23 . VAL A 1 214 ? 23.462 31.999 37.116 0.00 63.26  ? 217 VAL A HG23 1 
ATOM   3438 N N    . GLY A 1 215 ? 25.411 33.933 40.453 1.00 46.60  ? 218 GLY A N    1 
ATOM   3439 C CA   . GLY A 1 215 ? 26.308 34.602 41.383 1.00 55.15  ? 218 GLY A CA   1 
ATOM   3440 C C    . GLY A 1 215 ? 25.570 35.180 42.574 1.00 50.00  ? 218 GLY A C    1 
ATOM   3441 O O    . GLY A 1 215 ? 26.046 35.107 43.710 1.00 49.71  ? 218 GLY A O    1 
ATOM   3442 H H    . GLY A 1 215 ? 25.389 34.271 39.662 0.00 55.98  ? 218 GLY A H    1 
ATOM   3443 H HA2  . GLY A 1 215 ? 26.966 33.967 41.708 0.00 66.23  ? 218 GLY A HA2  1 
ATOM   3444 H HA3  . GLY A 1 215 ? 26.766 35.324 40.925 0.00 66.23  ? 218 GLY A HA3  1 
ATOM   3445 N N    . PHE A 1 216 ? 24.396 35.762 42.327 1.00 41.14  ? 219 PHE A N    1 
ATOM   3446 C CA   . PHE A 1 216 ? 23.563 36.277 43.408 1.00 44.40  ? 219 PHE A CA   1 
ATOM   3447 C C    . PHE A 1 216 ? 23.157 35.165 44.369 1.00 51.70  ? 219 PHE A C    1 
ATOM   3448 O O    . PHE A 1 216 ? 23.155 35.358 45.590 1.00 41.78  ? 219 PHE A O    1 
ATOM   3449 C CB   . PHE A 1 216 ? 22.333 36.956 42.803 1.00 57.67  ? 219 PHE A CB   1 
ATOM   3450 C CG   . PHE A 1 216 ? 21.377 37.534 43.811 1.00 42.80  ? 219 PHE A CG   1 
ATOM   3451 C CD1  . PHE A 1 216 ? 20.419 36.737 44.416 1.00 48.73  ? 219 PHE A CD1  1 
ATOM   3452 C CD2  . PHE A 1 216 ? 21.404 38.886 44.115 1.00 41.65  ? 219 PHE A CD2  1 
ATOM   3453 C CE1  . PHE A 1 216 ? 19.529 37.269 45.329 1.00 52.82  ? 219 PHE A CE1  1 
ATOM   3454 C CE2  . PHE A 1 216 ? 20.513 39.424 45.025 1.00 45.79  ? 219 PHE A CE2  1 
ATOM   3455 C CZ   . PHE A 1 216 ? 19.574 38.614 45.631 1.00 37.27  ? 219 PHE A CZ   1 
ATOM   3456 H H    . PHE A 1 216 ? 24.060 35.870 41.543 0.00 49.42  ? 219 PHE A H    1 
ATOM   3457 H HA   . PHE A 1 216 ? 24.059 36.935 43.921 0.00 53.33  ? 219 PHE A HA   1 
ATOM   3458 H HB2  . PHE A 1 216 ? 22.630 37.681 42.232 0.00 69.25  ? 219 PHE A HB2  1 
ATOM   3459 H HB3  . PHE A 1 216 ? 21.845 36.301 42.280 0.00 69.25  ? 219 PHE A HB3  1 
ATOM   3460 H HD1  . PHE A 1 216 ? 20.375 35.832 44.205 0.00 58.52  ? 219 PHE A HD1  1 
ATOM   3461 H HD2  . PHE A 1 216 ? 22.028 39.438 43.702 0.00 50.03  ? 219 PHE A HD2  1 
ATOM   3462 H HE1  . PHE A 1 216 ? 18.899 36.721 45.739 0.00 63.44  ? 219 PHE A HE1  1 
ATOM   3463 H HE2  . PHE A 1 216 ? 20.546 40.331 45.228 0.00 55.00  ? 219 PHE A HE2  1 
ATOM   3464 H HZ   . PHE A 1 216 ? 18.973 38.975 46.243 0.00 44.77  ? 219 PHE A HZ   1 
ATOM   3465 N N    . GLY A 1 217 ? 22.813 33.991 43.835 1.00 39.94  ? 220 GLY A N    1 
ATOM   3466 C CA   . GLY A 1 217 ? 22.356 32.907 44.690 1.00 41.13  ? 220 GLY A CA   1 
ATOM   3467 C C    . GLY A 1 217 ? 23.479 32.269 45.484 1.00 46.34  ? 220 GLY A C    1 
ATOM   3468 O O    . GLY A 1 217 ? 23.282 31.852 46.629 1.00 45.44  ? 220 GLY A O    1 
ATOM   3469 H H    . GLY A 1 217 ? 22.836 33.803 42.996 0.00 47.98  ? 220 GLY A H    1 
ATOM   3470 H HA2  . GLY A 1 217 ? 21.698 33.250 45.316 0.00 49.40  ? 220 GLY A HA2  1 
ATOM   3471 H HA3  . GLY A 1 217 ? 21.943 32.221 44.142 0.00 49.40  ? 220 GLY A HA3  1 
ATOM   3472 N N    . LEU A 1 218 ? 24.670 32.175 44.889 1.00 35.61  ? 221 LEU A N    1 
ATOM   3473 C CA   . LEU A 1 218 ? 25.803 31.605 45.607 1.00 40.78  ? 221 LEU A CA   1 
ATOM   3474 C C    . LEU A 1 218 ? 26.164 32.442 46.828 1.00 49.68  ? 221 LEU A C    1 
ATOM   3475 O O    . LEU A 1 218 ? 26.576 31.894 47.857 1.00 45.68  ? 221 LEU A O    1 
ATOM   3476 C CB   . LEU A 1 218 ? 27.003 31.478 44.668 1.00 37.17  ? 221 LEU A CB   1 
ATOM   3477 C CG   . LEU A 1 218 ? 26.926 30.318 43.670 1.00 58.64  ? 221 LEU A CG   1 
ATOM   3478 C CD1  . LEU A 1 218 ? 28.023 30.426 42.620 1.00 59.21  ? 221 LEU A CD1  1 
ATOM   3479 C CD2  . LEU A 1 218 ? 27.005 28.975 44.386 1.00 54.89  ? 221 LEU A CD2  1 
ATOM   3480 H H    . LEU A 1 218 ? 24.842 32.429 44.085 0.00 42.78  ? 221 LEU A H    1 
ATOM   3481 H HA   . LEU A 1 218 ? 25.570 30.715 45.915 0.00 48.98  ? 221 LEU A HA   1 
ATOM   3482 H HB2  . LEU A 1 218 ? 27.079 32.298 44.155 0.00 44.65  ? 221 LEU A HB2  1 
ATOM   3483 H HB3  . LEU A 1 218 ? 27.800 31.347 45.205 0.00 44.65  ? 221 LEU A HB3  1 
ATOM   3484 H HG   . LEU A 1 218 ? 26.071 30.365 43.214 0.00 70.42  ? 221 LEU A HG   1 
ATOM   3485 H HD11 . LEU A 1 218 ? 27.923 29.702 41.983 0.00 71.11  ? 221 LEU A HD11 1 
ATOM   3486 H HD12 . LEU A 1 218 ? 27.943 31.280 42.166 0.00 71.11  ? 221 LEU A HD12 1 
ATOM   3487 H HD13 . LEU A 1 218 ? 28.886 30.365 43.058 0.00 71.11  ? 221 LEU A HD13 1 
ATOM   3488 H HD21 . LEU A 1 218 ? 27.122 28.273 43.728 0.00 65.92  ? 221 LEU A HD21 1 
ATOM   3489 H HD22 . LEU A 1 218 ? 27.760 28.986 44.996 0.00 65.92  ? 221 LEU A HD22 1 
ATOM   3490 H HD23 . LEU A 1 218 ? 26.183 28.833 44.880 0.00 65.92  ? 221 LEU A HD23 1 
ATOM   3491 N N    . ILE A 1 219 ? 26.009 33.763 46.737 1.00 42.92  ? 222 ILE A N    1 
ATOM   3492 C CA   . ILE A 1 219 ? 26.295 34.625 47.880 1.00 38.27  ? 222 ILE A CA   1 
ATOM   3493 C C    . ILE A 1 219 ? 25.219 34.472 48.948 1.00 53.58  ? 222 ILE A C    1 
ATOM   3494 O O    . ILE A 1 219 ? 25.517 34.436 50.148 1.00 45.32  ? 222 ILE A O    1 
ATOM   3495 C CB   . ILE A 1 219 ? 26.425 36.088 47.417 1.00 49.37  ? 222 ILE A CB   1 
ATOM   3496 C CG1  . ILE A 1 219 ? 27.629 36.253 46.485 1.00 44.35  ? 222 ILE A CG1  1 
ATOM   3497 C CG2  . ILE A 1 219 ? 26.553 37.017 48.618 1.00 46.91  ? 222 ILE A CG2  1 
ATOM   3498 C CD1  . ILE A 1 219 ? 27.620 37.548 45.693 1.00 47.00  ? 222 ILE A CD1  1 
ATOM   3499 H H    . ILE A 1 219 ? 25.741 34.180 46.034 0.00 51.56  ? 222 ILE A H    1 
ATOM   3500 H HA   . ILE A 1 219 ? 27.142 34.352 48.267 0.00 45.98  ? 222 ILE A HA   1 
ATOM   3501 H HB   . ILE A 1 219 ? 25.622 36.324 46.927 0.00 59.29  ? 222 ILE A HB   1 
ATOM   3502 H HG12 . ILE A 1 219 ? 28.440 36.237 47.017 0.00 53.27  ? 222 ILE A HG12 1 
ATOM   3503 H HG13 . ILE A 1 219 ? 27.634 35.519 45.850 0.00 53.27  ? 222 ILE A HG13 1 
ATOM   3504 H HG21 . ILE A 1 219 ? 26.903 37.871 48.321 0.00 56.34  ? 222 ILE A HG21 1 
ATOM   3505 H HG22 . ILE A 1 219 ? 25.677 37.139 49.018 0.00 56.34  ? 222 ILE A HG22 1 
ATOM   3506 H HG23 . ILE A 1 219 ? 27.158 36.618 49.263 0.00 56.34  ? 222 ILE A HG23 1 
ATOM   3507 H HD11 . ILE A 1 219 ? 28.355 37.537 45.061 0.00 56.46  ? 222 ILE A HD11 1 
ATOM   3508 H HD12 . ILE A 1 219 ? 26.777 37.623 45.220 0.00 56.46  ? 222 ILE A HD12 1 
ATOM   3509 H HD13 . ILE A 1 219 ? 27.722 38.293 46.306 0.00 56.46  ? 222 ILE A HD13 1 
ATOM   3510 N N    . LEU A 1 220 ? 23.955 34.373 48.532 1.00 42.44  ? 223 LEU A N    1 
ATOM   3511 C CA   . LEU A 1 220 ? 22.851 34.349 49.488 1.00 41.77  ? 223 LEU A CA   1 
ATOM   3512 C C    . LEU A 1 220 ? 22.813 33.039 50.266 1.00 43.69  ? 223 LEU A C    1 
ATOM   3513 O O    . LEU A 1 220 ? 22.685 33.041 51.496 1.00 44.68  ? 223 LEU A O    1 
ATOM   3514 C CB   . LEU A 1 220 ? 21.525 34.571 48.758 1.00 38.55  ? 223 LEU A CB   1 
ATOM   3515 C CG   . LEU A 1 220 ? 20.260 34.616 49.623 1.00 43.39  ? 223 LEU A CG   1 
ATOM   3516 C CD1  . LEU A 1 220 ? 20.340 35.691 50.701 1.00 40.86  ? 223 LEU A CD1  1 
ATOM   3517 C CD2  . LEU A 1 220 ? 19.029 34.823 48.755 1.00 43.60  ? 223 LEU A CD2  1 
ATOM   3518 H H    . LEU A 1 220 ? 23.712 34.319 47.708 0.00 50.98  ? 223 LEU A H    1 
ATOM   3519 H HA   . LEU A 1 220 ? 22.980 35.071 50.123 0.00 50.18  ? 223 LEU A HA   1 
ATOM   3520 H HB2  . LEU A 1 220 ? 21.579 35.418 48.289 0.00 46.31  ? 223 LEU A HB2  1 
ATOM   3521 H HB3  . LEU A 1 220 ? 21.409 33.847 48.122 0.00 46.31  ? 223 LEU A HB3  1 
ATOM   3522 H HG   . LEU A 1 220 ? 20.180 33.763 50.078 0.00 52.12  ? 223 LEU A HG   1 
ATOM   3523 H HD11 . LEU A 1 220 ? 19.546 35.641 51.255 0.00 49.09  ? 223 LEU A HD11 1 
ATOM   3524 H HD12 . LEU A 1 220 ? 21.131 35.538 51.241 0.00 49.09  ? 223 LEU A HD12 1 
ATOM   3525 H HD13 . LEU A 1 220 ? 20.393 36.561 50.275 0.00 49.09  ? 223 LEU A HD13 1 
ATOM   3526 H HD21 . LEU A 1 220 ? 18.244 34.864 49.324 0.00 52.37  ? 223 LEU A HD21 1 
ATOM   3527 H HD22 . LEU A 1 220 ? 19.125 35.654 48.263 0.00 52.37  ? 223 LEU A HD22 1 
ATOM   3528 H HD23 . LEU A 1 220 ? 18.950 34.080 48.136 0.00 52.37  ? 223 LEU A HD23 1 
ATOM   3529 N N    . LEU A 1 221 ? 22.917 31.908 49.567 1.00 41.73  ? 224 LEU A N    1 
ATOM   3530 C CA   . LEU A 1 221 ? 22.656 30.611 50.177 1.00 38.21  ? 224 LEU A CA   1 
ATOM   3531 C C    . LEU A 1 221 ? 23.845 30.049 50.943 1.00 44.26  ? 224 LEU A C    1 
ATOM   3532 O O    . LEU A 1 221 ? 23.704 29.000 51.581 1.00 54.22  ? 224 LEU A O    1 
ATOM   3533 C CB   . LEU A 1 221 ? 22.216 29.618 49.100 1.00 42.18  ? 224 LEU A CB   1 
ATOM   3534 C CG   . LEU A 1 221 ? 20.956 30.046 48.344 1.00 42.61  ? 224 LEU A CG   1 
ATOM   3535 C CD1  . LEU A 1 221 ? 20.644 29.075 47.219 1.00 49.22  ? 224 LEU A CD1  1 
ATOM   3536 C CD2  . LEU A 1 221 ? 19.773 30.166 49.297 1.00 46.69  ? 224 LEU A CD2  1 
ATOM   3537 H H    . LEU A 1 221 ? 23.138 31.869 48.737 0.00 50.13  ? 224 LEU A H    1 
ATOM   3538 H HA   . LEU A 1 221 ? 21.930 30.709 50.813 0.00 45.91  ? 224 LEU A HA   1 
ATOM   3539 H HB2  . LEU A 1 221 ? 22.932 29.523 48.453 0.00 50.66  ? 224 LEU A HB2  1 
ATOM   3540 H HB3  . LEU A 1 221 ? 22.034 28.763 49.521 0.00 50.66  ? 224 LEU A HB3  1 
ATOM   3541 H HG   . LEU A 1 221 ? 21.111 30.918 47.949 0.00 51.18  ? 224 LEU A HG   1 
ATOM   3542 H HD11 . LEU A 1 221 ? 19.801 29.326 46.810 0.00 59.12  ? 224 LEU A HD11 1 
ATOM   3543 H HD12 . LEU A 1 221 ? 21.356 29.116 46.561 0.00 59.12  ? 224 LEU A HD12 1 
ATOM   3544 H HD13 . LEU A 1 221 ? 20.582 28.178 47.583 0.00 59.12  ? 224 LEU A HD13 1 
ATOM   3545 H HD21 . LEU A 1 221 ? 18.958 30.259 48.778 0.00 56.07  ? 224 LEU A HD21 1 
ATOM   3546 H HD22 . LEU A 1 221 ? 19.726 29.367 49.845 0.00 56.07  ? 224 LEU A HD22 1 
ATOM   3547 H HD23 . LEU A 1 221 ? 19.898 30.946 49.859 0.00 56.07  ? 224 LEU A HD23 1 
ATOM   3548 N N    . ARG A 1 222 ? 25.001 30.702 50.896 1.00 62.19  ? 225 ARG A N    1 
ATOM   3549 C CA   . ARG A 1 222 ? 26.118 30.354 51.764 1.00 66.17  ? 225 ARG A CA   1 
ATOM   3550 C C    . ARG A 1 222 ? 26.134 31.181 53.042 1.00 70.97  ? 225 ARG A C    1 
ATOM   3551 O O    . ARG A 1 222 ? 26.969 30.930 53.918 1.00 67.41  ? 225 ARG A O    1 
ATOM   3552 C CB   . ARG A 1 222 ? 27.444 30.529 51.017 1.00 61.51  ? 225 ARG A CB   1 
ATOM   3553 C CG   . ARG A 1 222 ? 27.738 29.408 50.031 1.00 89.70  ? 225 ARG A CG   1 
ATOM   3554 C CD   . ARG A 1 222 ? 28.762 29.824 48.987 1.00 95.04  ? 225 ARG A CD   1 
ATOM   3555 N NE   . ARG A 1 222 ? 29.812 30.667 49.549 1.00 102.43 ? 225 ARG A NE   1 
ATOM   3556 C CZ   . ARG A 1 222 ? 30.952 30.215 50.054 1.00 109.71 ? 225 ARG A CZ   1 
ATOM   3557 N NH1  . ARG A 1 222 ? 31.232 28.921 50.085 1.00 116.95 ? 225 ARG A NH1  1 
ATOM   3558 N NH2  . ARG A 1 222 ? 31.834 31.083 50.542 1.00 110.89 ? 225 ARG A NH2  1 
ATOM   3559 H H    . ARG A 1 222 ? 25.164 31.358 50.364 1.00 74.68  ? 225 ARG A H    1 
ATOM   3560 H HA   . ARG A 1 222 ? 26.045 29.419 52.011 1.00 79.46  ? 225 ARG A HA   1 
ATOM   3561 H HB2  . ARG A 1 222 ? 27.416 31.362 50.520 1.00 73.86  ? 225 ARG A HB2  1 
ATOM   3562 H HB3  . ARG A 1 222 ? 28.167 30.553 51.664 1.00 73.86  ? 225 ARG A HB3  1 
ATOM   3563 H HG2  . ARG A 1 222 ? 28.090 28.643 50.513 1.00 107.69 ? 225 ARG A HG2  1 
ATOM   3564 H HG3  . ARG A 1 222 ? 26.920 29.163 49.572 1.00 107.69 ? 225 ARG A HG3  1 
ATOM   3565 H HD2  . ARG A 1 222 ? 29.178 29.031 48.615 1.00 114.09 ? 225 ARG A HD2  1 
ATOM   3566 H HD3  . ARG A 1 222 ? 28.316 30.324 48.286 1.00 114.09 ? 225 ARG A HD3  1 
ATOM   3567 H HE   . ARG A 1 222 ? 29.682 31.517 49.553 1.00 122.97 ? 225 ARG A HE   1 
ATOM   3568 H HH11 . ARG A 1 222 ? 30.669 28.352 49.772 1.00 140.39 ? 225 ARG A HH11 1 
ATOM   3569 H HH12 . ARG A 1 222 ? 31.978 28.651 50.417 1.00 140.39 ? 225 ARG A HH12 1 
ATOM   3570 H HH21 . ARG A 1 222 ? 31.661 31.925 50.527 1.00 133.12 ? 225 ARG A HH21 1 
ATOM   3571 H HH22 . ARG A 1 222 ? 32.576 30.802 50.872 1.00 133.12 ? 225 ARG A HH22 1 
ATOM   3572 N N    . SER A 1 223 ? 25.229 32.146 53.172 1.00 55.62  ? 226 SER A N    1 
ATOM   3573 C CA   . SER A 1 223 ? 25.181 33.026 54.328 1.00 62.26  ? 226 SER A CA   1 
ATOM   3574 C C    . SER A 1 223 ? 24.313 32.427 55.426 1.00 55.04  ? 226 SER A C    1 
ATOM   3575 O O    . SER A 1 223 ? 23.357 31.694 55.162 1.00 58.42  ? 226 SER A O    1 
ATOM   3576 C CB   . SER A 1 223 ? 24.632 34.398 53.933 1.00 57.50  ? 226 SER A CB   1 
ATOM   3577 O OG   . SER A 1 223 ? 24.088 35.068 55.056 1.00 84.12  ? 226 SER A OG   1 
ATOM   3578 H H    . SER A 1 223 ? 24.619 32.313 52.589 0.00 66.80  ? 226 SER A H    1 
ATOM   3579 H HA   . SER A 1 223 ? 26.078 33.141 54.679 0.00 74.77  ? 226 SER A HA   1 
ATOM   3580 H HB2  . SER A 1 223 ? 25.353 34.933 53.566 0.00 69.05  ? 226 SER A HB2  1 
ATOM   3581 H HB3  . SER A 1 223 ? 23.936 34.279 53.269 0.00 69.05  ? 226 SER A HB3  1 
ATOM   3582 H HG   . SER A 1 223 ? 23.557 35.668 54.803 0.00 101.00 ? 226 SER A HG   1 
ATOM   3583 N N    . ARG A 1 224 ? 24.661 32.749 56.672 1.00 73.83  ? 227 ARG A N    1 
ATOM   3584 C CA   . ARG A 1 224 ? 23.849 32.358 57.816 1.00 64.46  ? 227 ARG A CA   1 
ATOM   3585 C C    . ARG A 1 224 ? 22.632 33.252 58.007 1.00 48.87  ? 227 ARG A C    1 
ATOM   3586 O O    . ARG A 1 224 ? 21.779 32.938 58.845 1.00 52.29  ? 227 ARG A O    1 
ATOM   3587 C CB   . ARG A 1 224 ? 24.698 32.375 59.091 1.00 72.20  ? 227 ARG A CB   1 
ATOM   3588 C CG   . ARG A 1 224 ? 24.215 31.419 60.174 1.00 73.60  ? 227 ARG A CG   1 
ATOM   3589 C CD   . ARG A 1 224 ? 24.977 30.102 60.153 1.00 83.03  ? 227 ARG A CD   1 
ATOM   3590 N NE   . ARG A 1 224 ? 24.631 29.263 61.297 1.00 103.35 ? 227 ARG A NE   1 
ATOM   3591 C CZ   . ARG A 1 224 ? 24.473 27.945 61.256 1.00 82.53  ? 227 ARG A CZ   1 
ATOM   3592 N NH1  . ARG A 1 224 ? 24.623 27.260 60.133 1.00 93.04  ? 227 ARG A NH1  1 
ATOM   3593 N NH2  . ARG A 1 224 ? 24.154 27.297 62.372 1.00 100.51 ? 227 ARG A NH2  1 
ATOM   3594 H H    . ARG A 1 224 ? 25.366 33.196 56.879 0.00 88.65  ? 227 ARG A H    1 
ATOM   3595 H HA   . ARG A 1 224 ? 23.535 31.450 57.679 0.00 77.40  ? 227 ARG A HA   1 
ATOM   3596 H HB2  . ARG A 1 224 ? 25.607 32.125 58.862 0.00 86.70  ? 227 ARG A HB2  1 
ATOM   3597 H HB3  . ARG A 1 224 ? 24.683 33.271 59.462 0.00 86.70  ? 227 ARG A HB3  1 
ATOM   3598 H HG2  . ARG A 1 224 ? 24.345 31.830 61.043 0.00 88.37  ? 227 ARG A HG2  1 
ATOM   3599 H HG3  . ARG A 1 224 ? 23.275 31.227 60.034 0.00 88.37  ? 227 ARG A HG3  1 
ATOM   3600 H HD2  . ARG A 1 224 ? 24.757 29.617 59.342 0.00 99.69  ? 227 ARG A HD2  1 
ATOM   3601 H HD3  . ARG A 1 224 ? 25.929 30.282 60.185 0.00 99.69  ? 227 ARG A HD3  1 
ATOM   3602 H HE   . ARG A 1 224 ? 24.522 29.652 62.056 0.00 124.07 ? 227 ARG A HE   1 
ATOM   3603 H HH11 . ARG A 1 224 ? 24.828 27.668 59.404 0.00 111.70 ? 227 ARG A HH11 1 
ATOM   3604 H HH12 . ARG A 1 224 ? 24.515 26.407 60.132 0.00 111.70 ? 227 ARG A HH12 1 
ATOM   3605 H HH21 . ARG A 1 224 ? 24.054 27.731 63.108 0.00 120.66 ? 227 ARG A HH21 1 
ATOM   3606 H HH22 . ARG A 1 224 ? 24.049 26.443 62.359 0.00 120.66 ? 227 ARG A HH22 1 
ATOM   3607 N N    . ALA A 1 225 ? 22.527 34.349 57.253 1.00 54.04  ? 228 ALA A N    1 
ATOM   3608 C CA   . ALA A 1 225 ? 21.397 35.256 57.403 1.00 58.10  ? 228 ALA A CA   1 
ATOM   3609 C C    . ALA A 1 225 ? 20.076 34.614 56.999 1.00 53.15  ? 228 ALA A C    1 
ATOM   3610 O O    . ALA A 1 225 ? 19.019 35.086 57.430 1.00 51.55  ? 228 ALA A O    1 
ATOM   3611 C CB   . ALA A 1 225 ? 21.628 36.520 56.574 1.00 57.79  ? 228 ALA A CB   1 
ATOM   3612 H H    . ALA A 1 225 ? 23.096 34.586 56.653 0.00 64.91  ? 228 ALA A H    1 
ATOM   3613 H HA   . ALA A 1 225 ? 21.330 35.511 58.336 0.00 69.78  ? 228 ALA A HA   1 
ATOM   3614 H HB1  . ALA A 1 225 ? 20.871 37.115 56.689 0.00 69.40  ? 228 ALA A HB1  1 
ATOM   3615 H HB2  . ALA A 1 225 ? 22.440 36.954 56.880 0.00 69.40  ? 228 ALA A HB2  1 
ATOM   3616 H HB3  . ALA A 1 225 ? 21.717 36.274 55.640 0.00 69.40  ? 228 ALA A HB3  1 
ATOM   3617 N N    . ILE A 1 226 ? 20.107 33.555 56.183 1.00 42.46  ? 229 ILE A N    1 
ATOM   3618 C CA   . ILE A 1 226 ? 18.869 32.920 55.732 1.00 47.34  ? 229 ILE A CA   1 
ATOM   3619 C C    . ILE A 1 226 ? 18.265 31.990 56.772 1.00 63.25  ? 229 ILE A C    1 
ATOM   3620 O O    . ILE A 1 226 ? 17.129 31.532 56.590 1.00 42.70  ? 229 ILE A O    1 
ATOM   3621 C CB   . ILE A 1 226 ? 19.089 32.127 54.429 1.00 48.93  ? 229 ILE A CB   1 
ATOM   3622 C CG1  . ILE A 1 226 ? 20.110 31.003 54.635 1.00 53.48  ? 229 ILE A CG1  1 
ATOM   3623 C CG2  . ILE A 1 226 ? 19.549 33.056 53.317 1.00 41.21  ? 229 ILE A CG2  1 
ATOM   3624 C CD1  . ILE A 1 226 ? 20.152 30.008 53.499 1.00 64.85  ? 229 ILE A CD1  1 
ATOM   3625 H H    . ILE A 1 226 ? 20.825 33.191 55.881 0.00 51.00  ? 229 ILE A H    1 
ATOM   3626 H HA   . ILE A 1 226 ? 18.231 33.629 55.557 0.00 56.85  ? 229 ILE A HA   1 
ATOM   3627 H HB   . ILE A 1 226 ? 18.242 31.725 54.178 0.00 58.77  ? 229 ILE A HB   1 
ATOM   3628 H HG12 . ILE A 1 226 ? 20.993 31.396 54.719 0.00 64.22  ? 229 ILE A HG12 1 
ATOM   3629 H HG13 . ILE A 1 226 ? 19.884 30.520 55.445 0.00 64.22  ? 229 ILE A HG13 1 
ATOM   3630 H HG21 . ILE A 1 226 ? 19.581 32.560 52.484 0.00 49.51  ? 229 ILE A HG21 1 
ATOM   3631 H HG22 . ILE A 1 226 ? 18.921 33.791 53.239 0.00 49.51  ? 229 ILE A HG22 1 
ATOM   3632 H HG23 . ILE A 1 226 ? 20.431 33.396 53.534 0.00 49.51  ? 229 ILE A HG23 1 
ATOM   3633 H HD11 . ILE A 1 226 ? 20.753 29.285 53.735 0.00 77.88  ? 229 ILE A HD11 1 
ATOM   3634 H HD12 . ILE A 1 226 ? 19.259 29.661 53.351 0.00 77.88  ? 229 ILE A HD12 1 
ATOM   3635 H HD13 . ILE A 1 226 ? 20.470 30.455 52.699 0.00 77.88  ? 229 ILE A HD13 1 
ATOM   3636 N N    . PHE A 1 227 ? 18.985 31.694 57.850 1.00 60.28  ? 230 PHE A N    1 
ATOM   3637 C CA   . PHE A 1 227 ? 18.494 30.817 58.903 1.00 62.44  ? 230 PHE A CA   1 
ATOM   3638 C C    . PHE A 1 227 ? 17.978 31.641 60.073 1.00 56.35  ? 230 PHE A C    1 
ATOM   3639 O O    . PHE A 1 227 ? 18.546 32.683 60.413 1.00 59.42  ? 230 PHE A O    1 
ATOM   3640 C CB   . PHE A 1 227 ? 19.593 29.869 59.390 1.00 55.28  ? 230 PHE A CB   1 
ATOM   3641 C CG   . PHE A 1 227 ? 20.011 28.849 58.371 1.00 61.74  ? 230 PHE A CG   1 
ATOM   3642 C CD1  . PHE A 1 227 ? 19.349 27.637 58.280 1.00 63.43  ? 230 PHE A CD1  1 
ATOM   3643 C CD2  . PHE A 1 227 ? 21.069 29.097 57.514 1.00 48.32  ? 230 PHE A CD2  1 
ATOM   3644 C CE1  . PHE A 1 227 ? 19.730 26.693 57.348 1.00 62.90  ? 230 PHE A CE1  1 
ATOM   3645 C CE2  . PHE A 1 227 ? 21.455 28.157 56.579 1.00 68.55  ? 230 PHE A CE2  1 
ATOM   3646 C CZ   . PHE A 1 227 ? 20.785 26.952 56.496 1.00 75.87  ? 230 PHE A CZ   1 
ATOM   3647 H H    . PHE A 1 227 ? 19.777 31.996 57.995 0.00 72.39  ? 230 PHE A H    1 
ATOM   3648 H HA   . PHE A 1 227 ? 17.763 30.283 58.554 0.00 74.98  ? 230 PHE A HA   1 
ATOM   3649 H HB2  . PHE A 1 227 ? 20.375 30.393 59.622 0.00 66.39  ? 230 PHE A HB2  1 
ATOM   3650 H HB3  . PHE A 1 227 ? 19.269 29.392 60.170 0.00 66.39  ? 230 PHE A HB3  1 
ATOM   3651 H HD1  . PHE A 1 227 ? 18.640 27.456 58.853 0.00 76.17  ? 230 PHE A HD1  1 
ATOM   3652 H HD2  . PHE A 1 227 ? 21.525 29.906 57.569 0.00 58.03  ? 230 PHE A HD2  1 
ATOM   3653 H HE1  . PHE A 1 227 ? 19.276 25.883 57.294 0.00 75.54  ? 230 PHE A HE1  1 
ATOM   3654 H HE2  . PHE A 1 227 ? 22.166 28.334 56.006 0.00 82.31  ? 230 PHE A HE2  1 
ATOM   3655 H HZ   . PHE A 1 227 ? 21.043 26.317 55.868 0.00 91.09  ? 230 PHE A HZ   1 
ATOM   3656 N N    . GLY A 1 228 ? 16.898 31.167 60.686 1.00 59.67  ? 231 GLY A N    1 
ATOM   3657 C CA   . GLY A 1 228 ? 16.388 31.820 61.877 1.00 68.17  ? 231 GLY A CA   1 
ATOM   3658 C C    . GLY A 1 228 ? 17.335 31.631 63.049 1.00 69.38  ? 231 GLY A C    1 
ATOM   3659 O O    . GLY A 1 228 ? 17.953 30.579 63.215 1.00 67.00  ? 231 GLY A O    1 
ATOM   3660 H H    . GLY A 1 228 ? 16.449 30.478 60.433 0.00 71.66  ? 231 GLY A H    1 
ATOM   3661 H HA2  . GLY A 1 228 ? 16.286 32.770 61.710 0.00 81.86  ? 231 GLY A HA2  1 
ATOM   3662 H HA3  . GLY A 1 228 ? 15.525 31.445 62.110 0.00 81.86  ? 231 GLY A HA3  1 
ATOM   3663 N N    . GLU A 1 229 ? 17.452 32.673 63.869 1.00 74.49  ? 232 GLU A N    1 
ATOM   3664 C CA   . GLU A 1 229 ? 18.301 32.595 65.050 1.00 52.37  ? 232 GLU A CA   1 
ATOM   3665 C C    . GLU A 1 229 ? 17.776 31.523 65.994 1.00 77.27  ? 232 GLU A C    1 
ATOM   3666 O O    . GLU A 1 229 ? 16.664 31.635 66.520 1.00 81.06  ? 232 GLU A O    1 
ATOM   3667 C CB   . GLU A 1 229 ? 18.354 33.949 65.754 1.00 70.89  ? 232 GLU A CB   1 
ATOM   3668 C CG   . GLU A 1 229 ? 19.695 34.244 66.406 1.00 93.64  ? 232 GLU A CG   1 
ATOM   3669 C CD   . GLU A 1 229 ? 19.783 35.655 66.952 1.00 77.99  ? 232 GLU A CD   1 
ATOM   3670 O OE1  . GLU A 1 229 ? 18.767 36.379 66.900 1.00 74.84  ? 232 GLU A OE1  1 
ATOM   3671 O OE2  . GLU A 1 229 ? 20.869 36.039 67.437 1.00 79.03  ? 232 GLU A OE2  1 
ATOM   3672 H H    . GLU A 1 229 ? 17.054 33.428 63.763 0.00 89.44  ? 232 GLU A H    1 
ATOM   3673 H HA   . GLU A 1 229 ? 19.205 32.362 64.783 0.00 62.89  ? 232 GLU A HA   1 
ATOM   3674 H HB2  . GLU A 1 229 ? 18.181 34.647 65.103 0.00 85.11  ? 232 GLU A HB2  1 
ATOM   3675 H HB3  . GLU A 1 229 ? 17.677 33.967 66.448 0.00 85.11  ? 232 GLU A HB3  1 
ATOM   3676 H HG2  . GLU A 1 229 ? 19.831 33.628 67.142 0.00 112.42 ? 232 GLU A HG2  1 
ATOM   3677 H HG3  . GLU A 1 229 ? 20.398 34.133 65.746 0.00 112.42 ? 232 GLU A HG3  1 
ATOM   3678 N N    . ALA A 1 230 ? 18.577 30.482 66.207 1.00 69.26  ? 233 ALA A N    1 
ATOM   3679 C CA   . ALA A 1 230 ? 18.172 29.352 67.027 1.00 65.65  ? 233 ALA A CA   1 
ATOM   3680 C C    . ALA A 1 230 ? 19.351 28.883 67.865 1.00 53.81  ? 233 ALA A C    1 
ATOM   3681 O O    . ALA A 1 230 ? 20.511 29.178 67.567 1.00 86.16  ? 233 ALA A O    1 
ATOM   3682 C CB   . ALA A 1 230 ? 17.640 28.197 66.167 1.00 75.43  ? 233 ALA A CB   1 
ATOM   3683 H H    . ALA A 1 230 ? 19.370 30.408 65.881 0.00 83.16  ? 233 ALA A H    1 
ATOM   3684 H HA   . ALA A 1 230 ? 17.468 29.632 67.633 0.00 78.83  ? 233 ALA A HA   1 
ATOM   3685 H HB1  . ALA A 1 230 ? 17.388 27.462 66.747 0.00 90.57  ? 233 ALA A HB1  1 
ATOM   3686 H HB2  . ALA A 1 230 ? 16.868 28.505 65.668 0.00 90.57  ? 233 ALA A HB2  1 
ATOM   3687 H HB3  . ALA A 1 230 ? 18.337 27.912 65.556 0.00 90.57  ? 233 ALA A HB3  1 
ATOM   3688 N N    . GLU A 1 231 ? 19.035 28.145 68.924 1.00 67.56  ? 234 GLU A N    1 
ATOM   3689 C CA   . GLU A 1 231 ? 20.050 27.583 69.806 1.00 72.15  ? 234 GLU A CA   1 
ATOM   3690 C C    . GLU A 1 231 ? 20.524 26.232 69.282 1.00 86.96  ? 234 GLU A C    1 
ATOM   3691 O O    . GLU A 1 231 ? 19.731 25.442 68.769 1.00 83.47  ? 234 GLU A O    1 
ATOM   3692 C CB   . GLU A 1 231 ? 19.499 27.434 71.226 1.00 64.64  ? 234 GLU A CB   1 
ATOM   3693 C CG   . GLU A 1 231 ? 20.558 27.219 72.300 1.00 58.23  ? 234 GLU A CG   1 
ATOM   3694 C CD   . GLU A 1 231 ? 21.526 28.379 72.418 1.00 60.45  ? 234 GLU A CD   1 
ATOM   3695 O OE1  . GLU A 1 231 ? 21.075 29.541 72.359 1.00 70.36  ? 234 GLU A OE1  1 
ATOM   3696 O OE2  . GLU A 1 231 ? 22.736 28.126 72.584 1.00 79.89  ? 234 GLU A OE2  1 
ATOM   3697 H H    . GLU A 1 231 ? 18.229 27.954 69.156 0.00 81.12  ? 234 GLU A H    1 
ATOM   3698 H HA   . GLU A 1 231 ? 20.813 28.181 69.842 0.00 86.63  ? 234 GLU A HA   1 
ATOM   3699 H HB2  . GLU A 1 231 ? 19.012 28.242 71.453 0.00 77.62  ? 234 GLU A HB2  1 
ATOM   3700 H HB3  . GLU A 1 231 ? 18.903 26.670 71.246 0.00 77.62  ? 234 GLU A HB3  1 
ATOM   3701 H HG2  . GLU A 1 231 ? 20.119 27.108 73.158 0.00 69.93  ? 234 GLU A HG2  1 
ATOM   3702 H HG3  . GLU A 1 231 ? 21.070 26.424 72.083 0.00 69.93  ? 234 GLU A HG3  1 
HETATM 3703 C C46  . LI1 B 2 .   ? 4.837  61.615 20.116 1.00 73.59  ? 301 LI1 A C46  1 
HETATM 3704 C C47  . LI1 B 2 .   ? 4.149  61.566 21.475 1.00 81.57  ? 301 LI1 A C47  1 
HETATM 3705 C C48  . LI1 B 2 .   ? 5.059  61.218 22.646 1.00 76.47  ? 301 LI1 A C48  1 
HETATM 3706 C C49  . LI1 B 2 .   ? 5.592  59.812 22.438 1.00 91.45  ? 301 LI1 A C49  1 
HETATM 3707 C C50  . LI1 B 2 .   ? 4.137  61.210 23.862 1.00 69.20  ? 301 LI1 A C50  1 
HETATM 3708 C C51  . LI1 B 2 .   ? 4.782  60.735 25.158 1.00 82.72  ? 301 LI1 A C51  1 
HETATM 3709 C C52  . LI1 B 2 .   ? 4.036  61.171 26.409 1.00 77.28  ? 301 LI1 A C52  1 
HETATM 3710 C C53  . LI1 B 2 .   ? 4.931  61.362 27.623 1.00 71.27  ? 301 LI1 A C53  1 
HETATM 3711 C C55  . LI1 B 2 .   ? 6.062  60.351 27.718 1.00 74.54  ? 301 LI1 A C55  1 
HETATM 3712 C C56  . LI1 B 2 .   ? 6.919  60.499 28.964 1.00 65.19  ? 301 LI1 A C56  1 
HETATM 3713 C C57  . LI1 B 2 .   ? 8.263  59.787 28.870 1.00 69.20  ? 301 LI1 A C57  1 
HETATM 3714 C C58  . LI1 B 2 .   ? 9.214  60.018 30.034 1.00 86.62  ? 301 LI1 A C58  1 
HETATM 3715 C C59  . LI1 B 2 .   ? 9.023  61.395 30.645 1.00 98.61  ? 301 LI1 A C59  1 
HETATM 3716 C C60  . LI1 B 2 .   ? 9.080  58.939 31.094 1.00 75.59  ? 301 LI1 A C60  1 
HETATM 3717 H H461 . LI1 B 2 .   ? 5.738  61.961 20.213 1.00 88.36  ? 301 LI1 A H461 1 
HETATM 3718 H H462 . LI1 B 2 .   ? 4.903  60.712 19.768 1.00 88.36  ? 301 LI1 A H462 1 
HETATM 3719 H H471 . LI1 B 2 .   ? 3.737  62.429 21.633 1.00 97.94  ? 301 LI1 A H471 1 
HETATM 3720 H H472 . LI1 B 2 .   ? 3.429  60.917 21.423 1.00 97.94  ? 301 LI1 A H472 1 
HETATM 3721 H H48  . LI1 B 2 .   ? 5.799  61.839 22.741 1.00 91.82  ? 301 LI1 A H48  1 
HETATM 3722 C C50  . LI1 C 2 .   ? 24.325 21.897 24.679 1.00 76.44  ? 302 LI1 A C50  1 
HETATM 3723 C C51  . LI1 C 2 .   ? 23.197 22.613 25.413 1.00 81.96  ? 302 LI1 A C51  1 
HETATM 3724 C C52  . LI1 C 2 .   ? 23.350 22.608 26.926 1.00 57.77  ? 302 LI1 A C52  1 
HETATM 3725 C C53  . LI1 C 2 .   ? 22.705 21.412 27.609 1.00 56.52  ? 302 LI1 A C53  1 
HETATM 3726 C C55  . LI1 C 2 .   ? 22.233 21.697 29.025 1.00 79.50  ? 302 LI1 A C55  1 
HETATM 3727 C C56  . LI1 C 2 .   ? 22.274 20.487 29.944 1.00 64.52  ? 302 LI1 A C56  1 
HETATM 3728 C C57  . LI1 C 2 .   ? 23.675 20.132 30.429 1.00 88.58  ? 302 LI1 A C57  1 
HETATM 3729 C C58  . LI1 C 2 .   ? 24.157 20.872 31.668 1.00 54.68  ? 302 LI1 A C58  1 
HETATM 3730 C C45  . LI1 D 2 .   ? -2.815 31.164 18.277 1.00 83.78  ? 303 LI1 A C45  1 
HETATM 3731 C C46  . LI1 D 2 .   ? -1.505 30.962 19.029 1.00 76.85  ? 303 LI1 A C46  1 
HETATM 3732 C C47  . LI1 D 2 .   ? -1.694 30.268 20.372 1.00 60.89  ? 303 LI1 A C47  1 
HETATM 3733 C C48  . LI1 D 2 .   ? -2.349 31.123 21.458 1.00 65.67  ? 303 LI1 A C48  1 
HETATM 3734 C C50  . LI1 D 2 .   ? -1.400 31.323 22.641 1.00 46.37  ? 303 LI1 A C50  1 
HETATM 3735 C C51  . LI1 D 2 .   ? -2.062 31.806 23.925 1.00 58.99  ? 303 LI1 A C51  1 
HETATM 3736 C C52  . LI1 D 2 .   ? -1.408 31.274 25.190 1.00 80.93  ? 303 LI1 A C52  1 
HETATM 3737 C C53  . LI1 D 2 .   ? -2.395 30.939 26.296 1.00 67.12  ? 303 LI1 A C53  1 
HETATM 3738 C C55  . LI1 D 2 .   ? -1.759 30.795 27.668 1.00 85.02  ? 303 LI1 A C55  1 
HETATM 3739 C C56  . LI1 D 2 .   ? -1.794 32.066 28.501 1.00 89.10  ? 303 LI1 A C56  1 
HETATM 3740 C C57  . LI1 D 2 .   ? -3.191 32.445 28.979 1.00 84.01  ? 303 LI1 A C57  1 
HETATM 3741 C C58  . LI1 D 2 .   ? -3.320 33.816 29.627 1.00 100.71 ? 303 LI1 A C58  1 
HETATM 3742 H H451 . LI1 D 2 .   ? -2.665 31.746 17.516 1.00 100.59 ? 303 LI1 A H451 1 
HETATM 3743 H H452 . LI1 D 2 .   ? -3.100 30.308 17.920 1.00 100.59 ? 303 LI1 A H452 1 
HETATM 3744 H H461 . LI1 D 2 .   ? -1.094 31.830 19.166 1.00 92.27  ? 303 LI1 A H461 1 
HETATM 3745 H H462 . LI1 D 2 .   ? -0.910 30.436 18.472 1.00 92.27  ? 303 LI1 A H462 1 
HETATM 3746 C C45  . LI1 E 2 .   ? 26.465 59.971 53.636 1.00 89.49  ? 304 LI1 A C45  1 
HETATM 3747 C C46  . LI1 E 2 .   ? 25.424 60.304 52.573 1.00 71.25  ? 304 LI1 A C46  1 
HETATM 3748 C C47  . LI1 E 2 .   ? 24.703 59.071 52.040 1.00 74.70  ? 304 LI1 A C47  1 
HETATM 3749 C C48  . LI1 E 2 .   ? 23.782 59.324 50.844 1.00 80.98  ? 304 LI1 A C48  1 
HETATM 3750 C C50  . LI1 E 2 .   ? 24.598 59.607 49.581 1.00 65.78  ? 304 LI1 A C50  1 
HETATM 3751 C C51  . LI1 E 2 .   ? 23.797 60.117 48.388 1.00 77.54  ? 304 LI1 A C51  1 
HETATM 3752 C C52  . LI1 E 2 .   ? 23.297 59.014 47.468 1.00 90.69  ? 304 LI1 A C52  1 
HETATM 3753 C C53  . LI1 E 2 .   ? 22.801 59.513 46.119 1.00 90.58  ? 304 LI1 A C53  1 
HETATM 3754 C C55  . LI1 E 2 .   ? 23.885 60.143 45.258 1.00 80.74  ? 304 LI1 A C55  1 
HETATM 3755 C C56  . LI1 E 2 .   ? 23.354 60.881 44.039 1.00 78.05  ? 304 LI1 A C56  1 
HETATM 3756 C C57  . LI1 E 2 .   ? 23.495 60.099 42.738 1.00 86.66  ? 304 LI1 A C57  1 
HETATM 3757 C C58  . LI1 E 2 .   ? 23.004 60.807 41.483 1.00 94.51  ? 304 LI1 A C58  1 
HETATM 3758 C C59  . LI1 E 2 .   ? 23.049 59.895 40.268 1.00 76.31  ? 304 LI1 A C59  1 
HETATM 3759 H H451 . LI1 E 2 .   ? 26.067 59.395 54.307 1.00 107.44 ? 304 LI1 A H451 1 
HETATM 3760 H H452 . LI1 E 2 .   ? 27.178 59.462 53.219 1.00 107.44 ? 304 LI1 A H452 1 
HETATM 3761 H H461 . LI1 E 2 .   ? 24.779 60.917 52.957 1.00 85.55  ? 304 LI1 A H461 1 
HETATM 3762 H H462 . LI1 E 2 .   ? 25.868 60.761 51.842 1.00 85.55  ? 304 LI1 A H462 1 
HETATM 3763 H H471 . LI1 E 2 .   ? 24.188 58.689 52.768 1.00 89.69  ? 304 LI1 A H471 1 
HETATM 3764 H H472 . LI1 E 2 .   ? 25.374 58.414 51.797 1.00 89.69  ? 304 LI1 A H472 1 
HETATM 3765 C C46  . LI1 F 2 .   ? 28.344 49.329 44.097 1.00 113.77 ? 305 LI1 A C46  1 
HETATM 3766 C C47  . LI1 F 2 .   ? 27.602 50.520 43.503 1.00 133.31 ? 305 LI1 A C47  1 
HETATM 3767 C C48  . LI1 F 2 .   ? 28.472 51.497 42.709 1.00 143.71 ? 305 LI1 A C48  1 
HETATM 3768 C C50  . LI1 F 2 .   ? 27.666 52.181 41.603 1.00 121.19 ? 305 LI1 A C50  1 
HETATM 3769 C C51  . LI1 F 2 .   ? 27.754 51.518 40.233 1.00 117.16 ? 305 LI1 A C51  1 
HETATM 3770 C C52  . LI1 F 2 .   ? 26.962 52.239 39.155 1.00 118.79 ? 305 LI1 A C52  1 
HETATM 3771 C C53  . LI1 F 2 .   ? 26.742 51.414 37.897 1.00 102.28 ? 305 LI1 A C53  1 
HETATM 3772 C C55  . LI1 F 2 .   ? 28.000 50.741 37.373 1.00 96.00  ? 305 LI1 A C55  1 
HETATM 3773 C C56  . LI1 F 2 .   ? 27.860 50.205 35.959 1.00 88.26  ? 305 LI1 A C56  1 
HETATM 3774 C C57  . LI1 F 2 .   ? 27.168 51.177 35.013 1.00 89.88  ? 305 LI1 A C57  1 
HETATM 3775 C C58  . LI1 F 2 .   ? 26.808 50.622 33.645 1.00 87.54  ? 305 LI1 A C58  1 
HETATM 3776 C C59  . LI1 F 2 .   ? 27.088 49.134 33.562 1.00 88.94  ? 305 LI1 A C59  1 
HETATM 3777 C C60  . LI1 F 2 .   ? 27.527 51.364 32.532 1.00 122.71 ? 305 LI1 A C60  1 
HETATM 3778 H H461 . LI1 F 2 .   ? 29.299 49.421 43.951 1.00 136.57 ? 305 LI1 A H461 1 
HETATM 3779 H H462 . LI1 F 2 .   ? 28.190 49.312 45.054 1.00 136.57 ? 305 LI1 A H462 1 
HETATM 3780 H H471 . LI1 F 2 .   ? 27.167 50.994 44.229 1.00 160.02 ? 305 LI1 A H471 1 
HETATM 3781 H H472 . LI1 F 2 .   ? 26.898 50.178 42.930 1.00 160.02 ? 305 LI1 A H472 1 
HETATM 3782 C C18  . OLC G 3 .   ? 20.367 19.327 32.837 1.00 100.53 ? 306 OLC A C18  1 
HETATM 3783 C C10  . OLC G 3 .   ? 12.893 20.937 35.892 1.00 77.64  ? 306 OLC A C10  1 
HETATM 3784 C C9   . OLC G 3 .   ? 12.298 21.061 37.091 1.00 71.35  ? 306 OLC A C9   1 
HETATM 3785 C C17  . OLC G 3 .   ? 19.573 19.966 33.996 1.00 88.13  ? 306 OLC A C17  1 
HETATM 3786 C C11  . OLC G 3 .   ? 13.304 22.067 34.913 1.00 70.33  ? 306 OLC A C11  1 
HETATM 3787 C C8   . OLC G 3 .   ? 11.648 21.860 38.258 1.00 77.18  ? 306 OLC A C8   1 
HETATM 3788 C C24  . OLC G 3 .   ? 11.268 23.106 49.411 1.00 74.73  ? 306 OLC A C24  1 
HETATM 3789 C C16  . OLC G 3 .   ? 18.678 21.096 33.432 1.00 92.14  ? 306 OLC A C16  1 
HETATM 3790 C C12  . OLC G 3 .   ? 14.776 22.461 35.216 1.00 89.97  ? 306 OLC A C12  1 
HETATM 3791 C C7   . OLC G 3 .   ? 12.092 21.199 39.590 1.00 79.91  ? 306 OLC A C7   1 
HETATM 3792 C C15  . OLC G 3 .   ? 18.187 22.027 34.572 1.00 71.83  ? 306 OLC A C15  1 
HETATM 3793 C C13  . OLC G 3 .   ? 15.733 21.391 34.618 1.00 85.68  ? 306 OLC A C13  1 
HETATM 3794 C C6   . OLC G 3 .   ? 11.647 22.008 40.845 1.00 74.24  ? 306 OLC A C6   1 
HETATM 3795 C C14  . OLC G 3 .   ? 17.070 21.349 35.411 1.00 77.63  ? 306 OLC A C14  1 
HETATM 3796 C C5   . OLC G 3 .   ? 12.106 23.494 40.832 1.00 41.26  ? 306 OLC A C5   1 
HETATM 3797 C C4   . OLC G 3 .   ? 11.597 24.129 42.156 1.00 62.21  ? 306 OLC A C4   1 
HETATM 3798 C C3   . OLC G 3 .   ? 12.755 24.148 43.192 1.00 53.53  ? 306 OLC A C3   1 
HETATM 3799 C C2   . OLC G 3 .   ? 12.206 24.701 44.535 1.00 57.16  ? 306 OLC A C2   1 
HETATM 3800 C C21  . OLC G 3 .   ? 13.245 23.897 48.095 1.00 68.02  ? 306 OLC A C21  1 
HETATM 3801 C C1   . OLC G 3 .   ? 13.009 24.148 45.736 1.00 56.96  ? 306 OLC A C1   1 
HETATM 3802 C C22  . OLC G 3 .   ? 12.368 24.171 49.325 1.00 59.87  ? 306 OLC A C22  1 
HETATM 3803 O O19  . OLC G 3 .   ? 13.777 23.253 45.590 1.00 66.13  ? 306 OLC A O19  1 
HETATM 3804 O O25  . OLC G 3 .   ? 10.448 23.362 50.529 1.00 65.51  ? 306 OLC A O25  1 
HETATM 3805 O O23  . OLC G 3 .   ? 13.145 24.128 50.483 1.00 67.55  ? 306 OLC A O23  1 
HETATM 3806 O O20  . OLC G 3 .   ? 12.812 24.710 47.020 1.00 61.64  ? 306 OLC A O20  1 
HETATM 3807 H H18  . OLC G 3 .   ? 20.970 20.088 32.346 0.00 120.69 ? 306 OLC A H18  1 
HETATM 3808 H H18A . OLC G 3 .   ? 21.017 18.547 33.229 0.00 120.69 ? 306 OLC A H18A 1 
HETATM 3809 H H18B . OLC G 3 .   ? 19.674 18.894 32.119 0.00 120.69 ? 306 OLC A H18B 1 
HETATM 3810 H H10  . OLC G 3 .   ? 13.957 20.766 36.030 0.00 93.22  ? 306 OLC A H10  1 
HETATM 3811 H H9   . OLC G 3 .   ? 12.590 22.108 37.068 0.00 85.68  ? 306 OLC A H9   1 
HETATM 3812 H H17  . OLC G 3 .   ? 20.266 20.381 34.728 0.00 105.81 ? 306 OLC A H17  1 
HETATM 3813 H H17A . OLC G 3 .   ? 18.951 19.211 34.473 0.00 105.81 ? 306 OLC A H17A 1 
HETATM 3814 H H11  . OLC G 3 .   ? 13.221 21.713 33.884 0.00 84.45  ? 306 OLC A H11  1 
HETATM 3815 H H11A . OLC G 3 .   ? 12.654 22.932 35.053 0.00 84.45  ? 306 OLC A H11A 1 
HETATM 3816 H H8   . OLC G 3 .   ? 10.562 21.826 38.172 0.00 92.66  ? 306 OLC A H8   1 
HETATM 3817 H H8A  . OLC G 3 .   ? 11.982 22.897 38.230 0.00 92.66  ? 306 OLC A H8A  1 
HETATM 3818 H H24  . OLC G 3 .   ? 11.724 22.122 49.513 0.00 89.72  ? 306 OLC A H24  1 
HETATM 3819 H H24A . OLC G 3 .   ? 10.665 23.134 48.504 0.00 89.72  ? 306 OLC A H24A 1 
HETATM 3820 H H16  . OLC G 3 .   ? 19.250 21.681 32.713 0.00 110.61 ? 306 OLC A H16  1 
HETATM 3821 H H16A . OLC G 3 .   ? 17.814 20.653 32.935 0.00 110.61 ? 306 OLC A H16A 1 
HETATM 3822 H H12  . OLC G 3 .   ? 14.992 23.431 34.769 0.00 108.02 ? 306 OLC A H12  1 
HETATM 3823 H H12A . OLC G 3 .   ? 14.923 22.518 36.293 0.00 108.02 ? 306 OLC A H12A 1 
HETATM 3824 H H7   . OLC G 3 .   ? 11.656 20.201 39.645 0.00 95.94  ? 306 OLC A H7   1 
HETATM 3825 H H7A  . OLC G 3 .   ? 13.179 21.121 39.593 0.00 95.94  ? 306 OLC A H7A  1 
HETATM 3826 H H15  . OLC G 3 .   ? 17.795 22.945 34.136 0.00 86.25  ? 306 OLC A H15  1 
HETATM 3827 H H15A . OLC G 3 .   ? 19.027 22.264 35.223 0.00 86.25  ? 306 OLC A H15A 1 
HETATM 3828 H H13  . OLC G 3 .   ? 15.941 21.637 33.578 0.00 102.87 ? 306 OLC A H13  1 
HETATM 3829 H H13A . OLC G 3 .   ? 15.254 20.414 34.671 0.00 102.87 ? 306 OLC A H13A 1 
HETATM 3830 H H6   . OLC G 3 .   ? 10.559 21.985 40.900 0.00 89.14  ? 306 OLC A H6   1 
HETATM 3831 H H6A  . OLC G 3 .   ? 12.065 21.527 41.729 0.00 89.14  ? 306 OLC A H6A  1 
HETATM 3832 H H14  . OLC G 3 .   ? 16.950 21.881 36.355 0.00 93.21  ? 306 OLC A H14  1 
HETATM 3833 H H14A . OLC G 3 .   ? 17.343 20.313 35.611 0.00 93.21  ? 306 OLC A H14A 1 
HETATM 3834 H H5   . OLC G 3 .   ? 11.675 24.014 39.976 0.00 49.57  ? 306 OLC A H5   1 
HETATM 3835 H H5A  . OLC G 3 .   ? 13.194 23.552 40.781 0.00 49.57  ? 306 OLC A H5A  1 
HETATM 3836 H H4   . OLC G 3 .   ? 11.261 25.148 41.966 0.00 74.70  ? 306 OLC A H4   1 
HETATM 3837 H H4A  . OLC G 3 .   ? 10.768 23.539 42.547 0.00 74.70  ? 306 OLC A H4A  1 
HETATM 3838 H H3   . OLC G 3 .   ? 13.134 23.137 43.339 0.00 64.29  ? 306 OLC A H3   1 
HETATM 3839 H H3A  . OLC G 3 .   ? 13.559 24.789 42.832 0.00 64.29  ? 306 OLC A H3A  1 
HETATM 3840 H H2   . OLC G 3 .   ? 12.278 25.787 44.528 0.00 68.64  ? 306 OLC A H2   1 
HETATM 3841 H H2A  . OLC G 3 .   ? 11.162 24.407 44.640 0.00 68.64  ? 306 OLC A H2A  1 
HETATM 3842 H H21  . OLC G 3 .   ? 14.284 24.127 48.330 0.00 81.68  ? 306 OLC A H21  1 
HETATM 3843 H H21A . OLC G 3 .   ? 13.160 22.847 47.815 0.00 81.68  ? 306 OLC A H21A 1 
HETATM 3844 H H22  . OLC G 3 .   ? 11.919 25.160 49.232 0.00 71.89  ? 306 OLC A H22  1 
HETATM 3845 H HO25 . OLC G 3 .   ? 10.006 22.565 50.784 0.00 78.66  ? 306 OLC A HO25 1 
HETATM 3846 H HO23 . OLC G 3 .   ? 12.577 24.101 51.242 0.00 81.11  ? 306 OLC A HO23 1 
HETATM 3847 C C18  . OLC H 3 .   ? 6.238  32.449 41.765 1.00 76.48  ? 307 OLC A C18  1 
HETATM 3848 C C10  . OLC H 3 .   ? 7.970  29.276 32.515 1.00 70.74  ? 307 OLC A C10  1 
HETATM 3849 C C9   . OLC H 3 .   ? 7.945  29.093 31.183 1.00 71.33  ? 307 OLC A C9   1 
HETATM 3850 C C17  . OLC H 3 .   ? 5.807  32.560 40.288 1.00 76.22  ? 307 OLC A C17  1 
HETATM 3851 C C11  . OLC H 3 .   ? 6.751  29.497 33.450 1.00 63.61  ? 307 OLC A C11  1 
HETATM 3852 C C8   . OLC H 3 .   ? 7.226  28.950 29.809 1.00 77.07  ? 307 OLC A C8   1 
HETATM 3853 C C24  . OLC H 3 .   ? 4.616  32.562 19.138 1.00 98.63  ? 307 OLC A C24  1 
HETATM 3854 C C16  . OLC H 3 .   ? 6.332  31.339 39.495 1.00 62.70  ? 307 OLC A C16  1 
HETATM 3855 C C12  . OLC H 3 .   ? 7.244  29.849 34.883 1.00 57.98  ? 307 OLC A C12  1 
HETATM 3856 C C7   . OLC H 3 .   ? 7.016  30.338 29.151 1.00 74.11  ? 307 OLC A C7   1 
HETATM 3857 C C15  . OLC H 3 .   ? 6.034  31.558 37.991 1.00 80.30  ? 307 OLC A C15  1 
HETATM 3858 C C13  . OLC H 3 .   ? 6.109  30.552 35.676 1.00 68.81  ? 307 OLC A C13  1 
HETATM 3859 C C6   . OLC H 3 .   ? 6.096  30.150 27.909 1.00 89.27  ? 307 OLC A C6   1 
HETATM 3860 C C14  . OLC H 3 .   ? 6.288  30.254 37.192 1.00 76.95  ? 307 OLC A C14  1 
HETATM 3861 C C5   . OLC H 3 .   ? 5.436  31.498 27.499 1.00 89.30  ? 307 OLC A C5   1 
HETATM 3862 C C4   . OLC H 3 .   ? 4.301  31.204 26.474 1.00 81.83  ? 307 OLC A C4   1 
HETATM 3863 C C3   . OLC H 3 .   ? 4.473  32.042 25.177 1.00 79.82  ? 307 OLC A C3   1 
HETATM 3864 C C2   . OLC H 3 .   ? 3.726  31.313 24.027 1.00 80.43  ? 307 OLC A C2   1 
HETATM 3865 C C21  . OLC H 3 .   ? 2.776  33.069 20.792 1.00 81.57  ? 307 OLC A C21  1 
HETATM 3866 C C1   . OLC H 3 .   ? 3.131  32.334 23.031 1.00 73.32  ? 307 OLC A C1   1 
HETATM 3867 C C22  . OLC H 3 .   ? 3.099  32.648 19.350 1.00 84.03  ? 307 OLC A C22  1 
HETATM 3868 O O19  . OLC H 3 .   ? 2.276  33.083 23.381 1.00 79.43  ? 307 OLC A O19  1 
HETATM 3869 O O25  . OLC H 3 .   ? 5.179  33.852 19.212 1.00 96.63  ? 307 OLC A O25  1 
HETATM 3870 O O23  . OLC H 3 .   ? 2.528  31.399 19.099 1.00 107.14 ? 307 OLC A O23  1 
HETATM 3871 O O20  . OLC H 3 .   ? 3.602  32.360 21.697 1.00 79.87  ? 307 OLC A O20  1 
HETATM 3872 H H18  . OLC H 3 .   ? 5.905  33.331 42.308 0.00 91.82  ? 307 OLC A H18  1 
HETATM 3873 H H18A . OLC H 3 .   ? 5.792  31.560 42.207 0.00 91.82  ? 307 OLC A H18A 1 
HETATM 3874 H H18B . OLC H 3 .   ? 7.322  32.376 41.822 0.00 91.82  ? 307 OLC A H18B 1 
HETATM 3875 H H10  . OLC H 3 .   ? 8.097  28.319 33.014 0.00 84.94  ? 307 OLC A H10  1 
HETATM 3876 H H9   . OLC H 3 .   ? 6.941  29.508 31.211 0.00 85.64  ? 307 OLC A H9   1 
HETATM 3877 H H17  . OLC H 3 .   ? 4.720  32.589 40.230 0.00 91.51  ? 307 OLC A H17  1 
HETATM 3878 H H17A . OLC H 3 .   ? 6.218  33.473 39.860 0.00 91.51  ? 307 OLC A H17A 1 
HETATM 3879 H H11  . OLC H 3 .   ? 6.142  30.316 33.064 0.00 76.39  ? 307 OLC A H11  1 
HETATM 3880 H H11A . OLC H 3 .   ? 6.152  28.585 33.486 0.00 76.39  ? 307 OLC A H11A 1 
HETATM 3881 H H8   . OLC H 3 .   ? 6.256  28.476 29.960 0.00 92.53  ? 307 OLC A H8   1 
HETATM 3882 H H8A  . OLC H 3 .   ? 7.834  28.330 29.150 0.00 92.53  ? 307 OLC A H8A  1 
HETATM 3883 H H24  . OLC H 3 .   ? 4.821  32.133 18.158 0.00 118.40 ? 307 OLC A H24  1 
HETATM 3884 H H24A . OLC H 3 .   ? 5.055  31.931 19.910 0.00 118.40 ? 307 OLC A H24A 1 
HETATM 3885 H H16  . OLC H 3 .   ? 7.407  31.238 39.646 0.00 75.29  ? 307 OLC A H16  1 
HETATM 3886 H H16A . OLC H 3 .   ? 5.830  30.435 39.840 0.00 75.29  ? 307 OLC A H16A 1 
HETATM 3887 H H12  . OLC H 3 .   ? 7.532  28.935 35.400 0.00 69.62  ? 307 OLC A H12  1 
HETATM 3888 H H12A . OLC H 3 .   ? 8.103  30.514 34.816 0.00 69.62  ? 307 OLC A H12A 1 
HETATM 3889 H H7   . OLC H 3 .   ? 6.544  31.017 29.861 0.00 88.98  ? 307 OLC A H7   1 
HETATM 3890 H H7A  . OLC H 3 .   ? 7.977  30.749 28.840 0.00 88.98  ? 307 OLC A H7A  1 
HETATM 3891 H H15  . OLC H 3 .   ? 6.683  32.345 37.608 0.00 96.41  ? 307 OLC A H15  1 
HETATM 3892 H H15A . OLC H 3 .   ? 4.994  31.856 37.871 0.00 96.41  ? 307 OLC A H15A 1 
HETATM 3893 H H13  . OLC H 3 .   ? 5.143  30.175 35.341 0.00 82.63  ? 307 OLC A H13  1 
HETATM 3894 H H13A . OLC H 3 .   ? 6.158  31.626 35.507 0.00 82.63  ? 307 OLC A H13A 1 
HETATM 3895 H H6   . OLC H 3 .   ? 6.692  29.776 27.077 0.00 107.17 ? 307 OLC A H6   1 
HETATM 3896 H H6A  . OLC H 3 .   ? 5.315  29.428 28.150 0.00 107.17 ? 307 OLC A H6A  1 
HETATM 3897 H H14  . OLC H 3 .   ? 5.574  29.490 37.502 0.00 92.39  ? 307 OLC A H14  1 
HETATM 3898 H H14A . OLC H 3 .   ? 7.302  29.900 37.379 0.00 92.39  ? 307 OLC A H14A 1 
HETATM 3899 H H5   . OLC H 3 .   ? 5.019  31.985 28.380 0.00 107.21 ? 307 OLC A H5   1 
HETATM 3900 H H5A  . OLC H 3 .   ? 6.183  32.148 27.044 0.00 107.21 ? 307 OLC A H5A  1 
HETATM 3901 H H4   . OLC H 3 .   ? 4.322  30.145 26.217 0.00 98.25  ? 307 OLC A H4   1 
HETATM 3902 H H4A  . OLC H 3 .   ? 3.341  31.448 26.929 0.00 98.25  ? 307 OLC A H4A  1 
HETATM 3903 H H3   . OLC H 3 .   ? 4.049  33.036 25.320 0.00 95.83  ? 307 OLC A H3   1 
HETATM 3904 H H3A  . OLC H 3 .   ? 5.531  32.131 24.932 0.00 95.83  ? 307 OLC A H3A  1 
HETATM 3905 H H2   . OLC H 3 .   ? 4.426  30.665 23.501 0.00 96.57  ? 307 OLC A H2   1 
HETATM 3906 H H2A  . OLC H 3 .   ? 2.921  30.712 24.448 0.00 96.57  ? 307 OLC A H2A  1 
HETATM 3907 H H21  . OLC H 3 .   ? 2.952  34.139 20.904 0.00 97.93  ? 307 OLC A H21  1 
HETATM 3908 H H21A . OLC H 3 .   ? 1.731  32.848 21.008 0.00 97.93  ? 307 OLC A H21A 1 
HETATM 3909 H H22  . OLC H 3 .   ? 2.691  33.393 18.667 0.00 100.89 ? 307 OLC A H22  1 
HETATM 3910 H HO25 . OLC H 3 .   ? 5.831  33.948 18.533 0.00 116.01 ? 307 OLC A HO25 1 
HETATM 3911 H HO23 . OLC H 3 .   ? 2.292  30.986 19.921 0.00 128.62 ? 307 OLC A HO23 1 
HETATM 3912 C C18  . OLC I 3 .   ? 34.972 36.034 35.849 1.00 79.27  ? 308 OLC A C18  1 
HETATM 3913 C C10  . OLC I 3 .   ? 32.686 40.045 28.168 1.00 70.63  ? 308 OLC A C10  1 
HETATM 3914 C C9   . OLC I 3 .   ? 33.015 41.091 27.392 1.00 80.30  ? 308 OLC A C9   1 
HETATM 3915 C C17  . OLC I 3 .   ? 35.925 35.493 34.761 1.00 94.35  ? 308 OLC A C17  1 
HETATM 3916 C C11  . OLC I 3 .   ? 32.900 39.907 29.698 1.00 82.32  ? 308 OLC A C11  1 
HETATM 3917 C C8   . OLC I 3 .   ? 33.108 41.839 26.029 1.00 85.79  ? 308 OLC A C8   1 
HETATM 3918 C C24  . OLC I 3 .   ? 35.850 45.802 14.479 1.00 118.03 ? 308 OLC A C24  1 
HETATM 3919 C C16  . OLC I 3 .   ? 35.271 35.682 33.371 1.00 91.51  ? 308 OLC A C16  1 
HETATM 3920 C C12  . OLC I 3 .   ? 34.295 39.275 29.974 1.00 97.18  ? 308 OLC A C12  1 
HETATM 3921 C C7   . OLC I 3 .   ? 34.079 41.134 25.041 1.00 82.20  ? 308 OLC A C7   1 
HETATM 3922 C C15  . OLC I 3 .   ? 35.707 37.038 32.760 1.00 81.49  ? 308 OLC A C15  1 
HETATM 3923 C C13  . OLC I 3 .   ? 34.364 38.769 31.444 1.00 111.23 ? 308 OLC A C13  1 
HETATM 3924 C C6   . OLC I 3 .   ? 33.463 41.184 23.612 1.00 81.29  ? 308 OLC A C6   1 
HETATM 3925 C C14  . OLC I 3 .   ? 34.885 37.302 31.469 1.00 99.01  ? 308 OLC A C14  1 
HETATM 3926 C C5   . OLC I 3 .   ? 34.530 40.767 22.557 1.00 77.22  ? 308 OLC A C5   1 
HETATM 3927 C C4   . OLC I 3 .   ? 35.106 41.997 21.790 1.00 81.16  ? 308 OLC A C4   1 
HETATM 3928 C C3   . OLC I 3 .   ? 34.665 41.961 20.297 1.00 80.34  ? 308 OLC A C3   1 
HETATM 3929 C C2   . OLC I 3 .   ? 34.693 43.396 19.705 1.00 100.25 ? 308 OLC A C2   1 
HETATM 3930 C C21  . OLC I 3 .   ? 35.777 43.907 16.102 1.00 96.23  ? 308 OLC A C21  1 
HETATM 3931 C C1   . OLC I 3 .   ? 35.469 43.388 18.368 1.00 103.81 ? 308 OLC A C1   1 
HETATM 3932 C C22  . OLC I 3 .   ? 35.119 44.507 14.855 1.00 114.22 ? 308 OLC A C22  1 
HETATM 3933 O O19  . OLC I 3 .   ? 36.620 43.095 18.362 1.00 97.46  ? 308 OLC A O19  1 
HETATM 3934 O O25  . OLC I 3 .   ? 35.524 46.812 15.407 1.00 100.67 ? 308 OLC A O25  1 
HETATM 3935 O O23  . OLC I 3 .   ? 35.211 43.597 13.800 1.00 112.61 ? 308 OLC A O23  1 
HETATM 3936 O O20  . OLC I 3 .   ? 34.839 43.733 17.148 1.00 103.39 ? 308 OLC A O20  1 
HETATM 3937 H H18  . OLC I 3 .   ? 35.396 35.838 36.832 0.00 95.18  ? 308 OLC A H18  1 
HETATM 3938 H H18A . OLC I 3 .   ? 34.843 37.106 35.718 0.00 95.18  ? 308 OLC A H18A 1 
HETATM 3939 H H18B . OLC I 3 .   ? 34.007 35.538 35.765 0.00 95.18  ? 308 OLC A H18B 1 
HETATM 3940 H H10  . OLC I 3 .   ? 33.431 39.261 28.060 0.00 84.81  ? 308 OLC A H10  1 
HETATM 3941 H H9   . OLC I 3 .   ? 32.325 40.678 26.660 0.00 96.41  ? 308 OLC A H9   1 
HETATM 3942 H H17  . OLC I 3 .   ? 36.866 36.039 34.797 0.00 113.27 ? 308 OLC A H17  1 
HETATM 3943 H H17A . OLC I 3 .   ? 36.112 34.434 34.934 0.00 113.27 ? 308 OLC A H17A 1 
HETATM 3944 H H11  . OLC I 3 .   ? 32.850 40.892 30.162 0.00 98.83  ? 308 OLC A H11  1 
HETATM 3945 H H11A . OLC I 3 .   ? 32.122 39.267 30.117 0.00 98.83  ? 308 OLC A H11A 1 
HETATM 3946 H H8   . OLC I 3 .   ? 33.463 42.854 26.208 0.00 103.00 ? 308 OLC A H8   1 
HETATM 3947 H H8A  . OLC I 3 .   ? 32.115 41.876 25.580 0.00 103.00 ? 308 OLC A H8A  1 
HETATM 3948 H H24  . OLC I 3 .   ? 35.545 46.114 13.481 0.00 141.69 ? 308 OLC A H24  1 
HETATM 3949 H H24A . OLC I 3 .   ? 36.925 45.629 14.493 0.00 141.69 ? 308 OLC A H24A 1 
HETATM 3950 H H16  . OLC I 3 .   ? 35.583 34.872 32.712 0.00 109.86 ? 308 OLC A H16  1 
HETATM 3951 H H16A . OLC I 3 .   ? 34.186 35.666 33.477 0.00 109.86 ? 308 OLC A H16A 1 
HETATM 3952 H H12  . OLC I 3 .   ? 34.453 38.437 29.296 0.00 116.67 ? 308 OLC A H12  1 
HETATM 3953 H H12A . OLC I 3 .   ? 35.069 40.023 29.813 0.00 116.67 ? 308 OLC A H12A 1 
HETATM 3954 H H7   . OLC I 3 .   ? 35.041 41.647 25.045 0.00 98.69  ? 308 OLC A H7   1 
HETATM 3955 H H7A  . OLC I 3 .   ? 34.220 40.096 25.344 0.00 98.69  ? 308 OLC A H7A  1 
HETATM 3956 H H15  . OLC I 3 .   ? 36.768 37.004 32.516 0.00 97.84  ? 308 OLC A H15  1 
HETATM 3957 H H15A . OLC I 3 .   ? 35.526 37.837 33.478 0.00 97.84  ? 308 OLC A H15A 1 
HETATM 3958 H H13  . OLC I 3 .   ? 33.370 38.809 31.888 0.00 133.52 ? 308 OLC A H13  1 
HETATM 3959 H H13A . OLC I 3 .   ? 35.041 39.404 32.014 0.00 133.52 ? 308 OLC A H13A 1 
HETATM 3960 H H6   . OLC I 3 .   ? 32.616 40.500 23.560 0.00 97.60  ? 308 OLC A H6   1 
HETATM 3961 H H6A  . OLC I 3 .   ? 33.125 42.199 23.401 0.00 97.60  ? 308 OLC A H6A  1 
HETATM 3962 H H14  . OLC I 3 .   ? 34.036 36.619 31.440 0.00 118.86 ? 308 OLC A H14  1 
HETATM 3963 H H14A . OLC I 3 .   ? 35.519 37.131 30.599 0.00 118.86 ? 308 OLC A H14A 1 
HETATM 3964 H H5   . OLC I 3 .   ? 34.068 40.089 21.838 0.00 92.72  ? 308 OLC A H5   1 
HETATM 3965 H H5A  . OLC I 3 .   ? 35.347 40.255 23.065 0.00 92.72  ? 308 OLC A H5A  1 
HETATM 3966 H H4   . OLC I 3 .   ? 34.737 42.912 22.252 0.00 97.45  ? 308 OLC A H4   1 
HETATM 3967 H H4A  . OLC I 3 .   ? 36.194 41.976 21.844 0.00 97.45  ? 308 OLC A H4A  1 
HETATM 3968 H H3   . OLC I 3 .   ? 35.348 41.324 19.734 0.00 96.46  ? 308 OLC A H3   1 
HETATM 3969 H H3A  . OLC I 3 .   ? 33.654 41.560 20.228 0.00 96.46  ? 308 OLC A H3A  1 
HETATM 3970 H H2   . OLC I 3 .   ? 33.673 43.737 19.531 0.00 120.35 ? 308 OLC A H2   1 
HETATM 3971 H H2A  . OLC I 3 .   ? 35.185 44.069 20.406 0.00 120.35 ? 308 OLC A H2A  1 
HETATM 3972 H H21  . OLC I 3 .   ? 36.206 42.938 15.845 0.00 115.52 ? 308 OLC A H21  1 
HETATM 3973 H H21A . OLC I 3 .   ? 36.568 44.575 16.442 0.00 115.52 ? 308 OLC A H21A 1 
HETATM 3974 H H22  . OLC I 3 .   ? 34.069 44.722 15.056 0.00 137.11 ? 308 OLC A H22  1 
HETATM 3975 H HO25 . OLC I 3 .   ? 35.636 46.484 16.287 0.00 120.85 ? 308 OLC A HO25 1 
HETATM 3976 H HO23 . OLC I 3 .   ? 36.119 43.348 13.674 0.00 135.19 ? 308 OLC A HO23 1 
HETATM 3977 C C18  . OLC J 3 .   ? 5.130  39.106 37.015 1.00 80.29  ? 309 OLC A C18  1 
HETATM 3978 C C10  . OLC J 3 .   ? 3.574  38.103 45.322 1.00 119.54 ? 309 OLC A C10  1 
HETATM 3979 C C9   . OLC J 3 .   ? 3.500  39.010 46.311 1.00 103.95 ? 309 OLC A C9   1 
HETATM 3980 C C17  . OLC J 3 .   ? 4.010  39.154 38.078 1.00 88.80  ? 309 OLC A C17  1 
HETATM 3981 C C11  . OLC J 3 .   ? 4.785  37.766 44.417 1.00 112.81 ? 309 OLC A C11  1 
HETATM 3982 C C8   . OLC J 3 .   ? 4.063  40.099 47.265 1.00 88.41  ? 309 OLC A C8   1 
HETATM 3983 C C24  . OLC J 3 .   ? 5.068  35.220 56.196 1.00 131.89 ? 309 OLC A C24  1 
HETATM 3984 C C16  . OLC J 3 .   ? 3.987  37.836 38.896 1.00 101.60 ? 309 OLC A C16  1 
HETATM 3985 C C12  . OLC J 3 .   ? 4.893  38.861 43.322 1.00 115.95 ? 309 OLC A C12  1 
HETATM 3986 C C7   . OLC J 3 .   ? 3.000  40.343 48.372 1.00 92.48  ? 309 OLC A C7   1 
HETATM 3987 C C15  . OLC J 3 .   ? 5.249  37.686 39.790 1.00 97.30  ? 309 OLC A C15  1 
HETATM 3988 C C13  . OLC J 3 .   ? 5.856  38.397 42.191 1.00 101.51 ? 309 OLC A C13  1 
HETATM 3989 C C6   . OLC J 3 .   ? 3.622  40.407 49.799 1.00 81.09  ? 309 OLC A C6   1 
HETATM 3990 C C14  . OLC J 3 .   ? 5.329  38.868 40.798 1.00 95.57  ? 309 OLC A C14  1 
HETATM 3991 C C5   . OLC J 3 .   ? 4.308  39.073 50.226 1.00 83.60  ? 309 OLC A C5   1 
HETATM 3992 C C4   . OLC J 3 .   ? 5.354  39.401 51.331 1.00 101.43 ? 309 OLC A C4   1 
HETATM 3993 C C3   . OLC J 3 .   ? 5.036  38.642 52.645 1.00 110.18 ? 309 OLC A C3   1 
HETATM 3994 C C2   . OLC J 3 .   ? 6.295  38.658 53.554 1.00 111.79 ? 309 OLC A C2   1 
HETATM 3995 C C21  . OLC J 3 .   ? 4.252  37.545 55.740 1.00 121.86 ? 309 OLC A C21  1 
HETATM 3996 C C1   . OLC J 3 .   ? 5.890  39.059 54.992 1.00 125.62 ? 309 OLC A C1   1 
HETATM 3997 C C22  . OLC J 3 .   ? 4.329  36.114 55.194 1.00 128.00 ? 309 OLC A C22  1 
HETATM 3998 O O19  . OLC J 3 .   ? 5.854  40.203 55.314 1.00 113.72 ? 309 OLC A O19  1 
HETATM 3999 O O25  . OLC J 3 .   ? 4.441  35.312 57.455 1.00 150.41 ? 309 OLC A O25  1 
HETATM 4000 O O23  . OLC J 3 .   ? 3.038  35.626 54.984 1.00 130.58 ? 309 OLC A O23  1 
HETATM 4001 O O20  . OLC J 3 .   ? 5.566  38.039 55.913 1.00 124.73 ? 309 OLC A O20  1 
HETATM 4002 H H18  . OLC J 3 .   ? 6.099  39.085 37.511 0.00 96.40  ? 309 OLC A H18  1 
HETATM 4003 H H18A . OLC J 3 .   ? 5.015  38.211 36.407 0.00 96.40  ? 309 OLC A H18A 1 
HETATM 4004 H H18B . OLC J 3 .   ? 5.066  39.986 36.380 0.00 96.40  ? 309 OLC A H18B 1 
HETATM 4005 H H10  . OLC J 3 .   ? 3.111  38.506 44.426 0.00 143.50 ? 309 OLC A H10  1 
HETATM 4006 H H9   . OLC J 3 .   ? 4.413  39.449 45.917 0.00 124.79 ? 309 OLC A H9   1 
HETATM 4007 H H17  . OLC J 3 .   ? 3.050  39.286 37.581 0.00 106.61 ? 309 OLC A H17  1 
HETATM 4008 H H17A . OLC J 3 .   ? 4.189  39.992 38.750 0.00 106.61 ? 309 OLC A H17A 1 
HETATM 4009 H H11  . OLC J 3 .   ? 5.698  37.749 45.014 0.00 135.43 ? 309 OLC A H11  1 
HETATM 4010 H H11A . OLC J 3 .   ? 4.637  36.791 43.951 0.00 135.43 ? 309 OLC A H11A 1 
HETATM 4011 H H8   . OLC J 3 .   ? 4.243  41.022 46.713 0.00 106.14 ? 309 OLC A H8   1 
HETATM 4012 H H8A  . OLC J 3 .   ? 4.996  39.756 47.713 0.00 106.14 ? 309 OLC A H8A  1 
HETATM 4013 H H24  . OLC J 3 .   ? 6.103  35.548 56.281 0.00 158.32 ? 309 OLC A H24  1 
HETATM 4014 H H24A . OLC J 3 .   ? 5.042  34.188 55.851 0.00 158.32 ? 309 OLC A H24A 1 
HETATM 4015 H H16  . OLC J 3 .   ? 3.102  37.832 39.533 0.00 121.97 ? 309 OLC A H16  1 
HETATM 4016 H H16A . OLC J 3 .   ? 3.942  36.994 38.206 0.00 121.97 ? 309 OLC A H16A 1 
HETATM 4017 H H12  . OLC J 3 .   ? 3.906  39.046 42.901 0.00 139.19 ? 309 OLC A H12  1 
HETATM 4018 H H12A . OLC J 3 .   ? 5.276  39.778 43.767 0.00 139.19 ? 309 OLC A H12A 1 
HETATM 4019 H H7   . OLC J 3 .   ? 2.495  41.287 48.169 0.00 111.03 ? 309 OLC A H7   1 
HETATM 4020 H H7A  . OLC J 3 .   ? 2.275  39.529 48.344 0.00 111.03 ? 309 OLC A H7A  1 
HETATM 4021 H H15  . OLC J 3 .   ? 6.138  37.687 39.162 0.00 116.81 ? 309 OLC A H15  1 
HETATM 4022 H H15A . OLC J 3 .   ? 5.193  36.747 40.339 0.00 116.81 ? 309 OLC A H15A 1 
HETATM 4023 H H13  . OLC J 3 .   ? 5.922  37.310 42.200 0.00 121.86 ? 309 OLC A H13  1 
HETATM 4024 H H13A . OLC J 3 .   ? 6.843  38.823 42.364 0.00 121.86 ? 309 OLC A H13A 1 
HETATM 4025 H H6   . OLC J 3 .   ? 4.367  41.203 49.818 0.00 97.36  ? 309 OLC A H6   1 
HETATM 4026 H H6A  . OLC J 3 .   ? 2.830  40.634 50.513 0.00 97.36  ? 309 OLC A H6A  1 
HETATM 4027 H H14  . OLC J 3 .   ? 4.335  39.297 40.922 0.00 114.73 ? 309 OLC A H14  1 
HETATM 4028 H H14A . OLC J 3 .   ? 6.005  39.626 40.402 0.00 114.73 ? 309 OLC A H14A 1 
HETATM 4029 H H5   . OLC J 3 .   ? 3.562  38.382 50.618 0.00 100.37 ? 309 OLC A H5   1 
HETATM 4030 H H5A  . OLC J 3 .   ? 4.806  38.622 49.368 0.00 100.37 ? 309 OLC A H5A  1 
HETATM 4031 H H4   . OLC J 3 .   ? 6.344  39.109 50.981 0.00 121.77 ? 309 OLC A H4   1 
HETATM 4032 H H4A  . OLC J 3 .   ? 5.340  40.474 51.527 0.00 121.77 ? 309 OLC A H4A  1 
HETATM 4033 H H3   . OLC J 3 .   ? 4.208  39.130 53.158 0.00 132.27 ? 309 OLC A H3   1 
HETATM 4034 H H3A  . OLC J 3 .   ? 4.765  37.612 52.415 0.00 132.27 ? 309 OLC A H3A  1 
HETATM 4035 H H2   . OLC J 3 .   ? 6.746  37.667 53.568 0.00 134.20 ? 309 OLC A H2   1 
HETATM 4036 H H2A  . OLC J 3 .   ? 7.014  39.379 53.166 0.00 134.20 ? 309 OLC A H2A  1 
HETATM 4037 H H21  . OLC J 3 .   ? 3.713  38.177 55.034 0.00 146.28 ? 309 OLC A H21  1 
HETATM 4038 H H21A . OLC J 3 .   ? 3.732  37.544 56.698 0.00 146.28 ? 309 OLC A H21A 1 
HETATM 4039 H H22  . OLC J 3 .   ? 4.871  36.113 54.248 0.00 153.65 ? 309 OLC A H22  1 
HETATM 4040 H HO25 . OLC J 3 .   ? 3.507  35.400 57.334 0.00 180.55 ? 309 OLC A HO25 1 
HETATM 4041 H HO23 . OLC J 3 .   ? 2.464  36.345 54.752 0.00 156.74 ? 309 OLC A HO23 1 
HETATM 4042 C C18  . OLC K 3 .   ? 21.822 55.126 37.549 1.00 65.42  ? 310 OLC A C18  1 
HETATM 4043 C C10  . OLC K 3 .   ? 23.191 56.823 29.487 1.00 64.26  ? 310 OLC A C10  1 
HETATM 4044 C C9   . OLC K 3 .   ? 23.396 57.381 28.282 1.00 96.21  ? 310 OLC A C9   1 
HETATM 4045 C C17  . OLC K 3 .   ? 22.368 53.879 36.819 1.00 68.19  ? 310 OLC A C17  1 
HETATM 4046 C C11  . OLC K 3 .   ? 21.831 56.519 30.166 1.00 82.25  ? 310 OLC A C11  1 
HETATM 4047 C C8   . OLC K 3 .   ? 22.925 58.002 26.936 1.00 109.37 ? 310 OLC A C8   1 
HETATM 4048 C C24  . OLC K 3 .   ? 28.435 56.104 15.589 1.00 91.92  ? 310 OLC A C24  1 
HETATM 4049 C C16  . OLC K 3 .   ? 21.500 53.547 35.578 1.00 77.48  ? 310 OLC A C16  1 
HETATM 4050 C C12  . OLC K 3 .   ? 22.119 55.859 31.544 1.00 86.89  ? 310 OLC A C12  1 
HETATM 4051 C C7   . OLC K 3 .   ? 24.077 57.951 25.899 1.00 114.29 ? 310 OLC A C7   1 
HETATM 4052 C C15  . OLC K 3 .   ? 21.557 54.716 34.561 1.00 82.20  ? 310 OLC A C15  1 
HETATM 4053 C C13  . OLC K 3 .   ? 20.793 55.512 32.281 1.00 82.87  ? 310 OLC A C13  1 
HETATM 4054 C C6   . OLC K 3 .   ? 23.466 57.794 24.477 1.00 129.18 ? 310 OLC A C6   1 
HETATM 4055 C C14  . OLC K 3 .   ? 21.002 54.260 33.184 1.00 80.20  ? 310 OLC A C14  1 
HETATM 4056 C C5   . OLC K 3 .   ? 24.597 57.590 23.431 1.00 132.92 ? 310 OLC A C5   1 
HETATM 4057 C C4   . OLC K 3 .   ? 23.997 56.926 22.157 1.00 104.82 ? 310 OLC A C4   1 
HETATM 4058 C C3   . OLC K 3 .   ? 24.527 57.644 20.886 1.00 103.85 ? 310 OLC A C3   1 
HETATM 4059 C C2   . OLC K 3 .   ? 24.564 56.629 19.713 1.00 108.17 ? 310 OLC A C2   1 
HETATM 4060 C C21  . OLC K 3 .   ? 26.277 56.632 16.776 1.00 101.29 ? 310 OLC A C21  1 
HETATM 4061 C C1   . OLC K 3 .   ? 24.690 57.388 18.373 1.00 100.50 ? 310 OLC A C1   1 
HETATM 4062 C C22  . OLC K 3 .   ? 27.728 56.164 16.949 1.00 96.62  ? 310 OLC A C22  1 
HETATM 4063 O O19  . OLC K 3 .   ? 23.729 57.823 17.826 1.00 93.96  ? 310 OLC A O19  1 
HETATM 4064 O O25  . OLC K 3 .   ? 29.443 55.119 15.626 1.00 90.40  ? 310 OLC A O25  1 
HETATM 4065 O O23  . OLC K 3 .   ? 28.398 57.054 17.789 1.00 111.73 ? 310 OLC A O23  1 
HETATM 4066 O O20  . OLC K 3 .   ? 25.976 57.548 17.811 1.00 97.94  ? 310 OLC A O20  1 
HETATM 4067 H H18  . OLC K 3 .   ? 22.393 55.292 38.461 0.00 78.55  ? 310 OLC A H18  1 
HETATM 4068 H H18A . OLC K 3 .   ? 21.914 55.995 36.901 0.00 78.55  ? 310 OLC A H18A 1 
HETATM 4069 H H18B . OLC K 3 .   ? 20.775 54.970 37.800 0.00 78.55  ? 310 OLC A H18B 1 
HETATM 4070 H H10  . OLC K 3 .   ? 23.319 55.746 29.416 0.00 77.17  ? 310 OLC A H10  1 
HETATM 4071 H H9   . OLC K 3 .   ? 22.368 57.728 28.339 0.00 115.50 ? 310 OLC A H9   1 
HETATM 4072 H H17  . OLC K 3 .   ? 22.355 53.031 37.501 0.00 81.88  ? 310 OLC A H17  1 
HETATM 4073 H H17A . OLC K 3 .   ? 23.391 54.072 36.498 0.00 81.88  ? 310 OLC A H17A 1 
HETATM 4074 H H11  . OLC K 3 .   ? 21.251 55.837 29.543 0.00 98.75  ? 310 OLC A H11  1 
HETATM 4075 H H11A . OLC K 3 .   ? 21.273 57.445 30.309 0.00 98.75  ? 310 OLC A H11A 1 
HETATM 4076 H H8   . OLC K 3 .   ? 22.632 59.039 27.099 0.00 131.30 ? 310 OLC A H8   1 
HETATM 4077 H H8A  . OLC K 3 .   ? 22.073 57.439 26.556 0.00 131.30 ? 310 OLC A H8A  1 
HETATM 4078 H H24  . OLC K 3 .   ? 28.881 57.072 15.369 0.00 110.36 ? 310 OLC A H24  1 
HETATM 4079 H H24A . OLC K 3 .   ? 27.711 55.853 14.815 0.00 110.36 ? 310 OLC A H24A 1 
HETATM 4080 H H16  . OLC K 3 .   ? 20.467 53.392 35.891 0.00 93.03  ? 310 OLC A H16  1 
HETATM 4081 H H16A . OLC K 3 .   ? 21.876 52.639 35.107 0.00 93.03  ? 310 OLC A H16A 1 
HETATM 4082 H H12  . OLC K 3 .   ? 22.690 54.945 31.389 0.00 104.32 ? 310 OLC A H12  1 
HETATM 4083 H H12A . OLC K 3 .   ? 22.697 56.549 32.156 0.00 104.32 ? 310 OLC A H12A 1 
HETATM 4084 H H7   . OLC K 3 .   ? 24.657 58.873 25.950 0.00 137.20 ? 310 OLC A H7   1 
HETATM 4085 H H7A  . OLC K 3 .   ? 24.727 57.102 26.115 0.00 137.20 ? 310 OLC A H7A  1 
HETATM 4086 H H15  . OLC K 3 .   ? 22.591 55.038 34.442 0.00 98.69  ? 310 OLC A H15  1 
HETATM 4087 H H15A . OLC K 3 .   ? 20.959 55.546 34.933 0.00 98.69  ? 310 OLC A H15A 1 
HETATM 4088 H H13  . OLC K 3 .   ? 20.016 55.303 31.548 0.00 99.50  ? 310 OLC A H13  1 
HETATM 4089 H H13A . OLC K 3 .   ? 20.492 56.356 32.899 0.00 99.50  ? 310 OLC A H13A 1 
HETATM 4090 H H6   . OLC K 3 .   ? 22.801 56.931 24.463 0.00 155.06 ? 310 OLC A H6   1 
HETATM 4091 H H6A  . OLC K 3 .   ? 22.901 58.692 24.226 0.00 155.06 ? 310 OLC A H6A  1 
HETATM 4092 H H14  . OLC K 3 .   ? 20.049 53.749 33.325 0.00 96.29  ? 310 OLC A H14  1 
HETATM 4093 H H14A . OLC K 3 .   ? 21.711 53.582 32.709 0.00 96.29  ? 310 OLC A H14A 1 
HETATM 4094 H H5   . OLC K 3 .   ? 25.370 56.944 23.850 0.00 159.55 ? 310 OLC A H5   1 
HETATM 4095 H H5A  . OLC K 3 .   ? 25.033 58.554 23.170 0.00 159.55 ? 310 OLC A H5A  1 
HETATM 4096 H H4   . OLC K 3 .   ? 24.287 55.875 22.126 0.00 125.83 ? 310 OLC A H4   1 
HETATM 4097 H H4A  . OLC K 3 .   ? 22.910 57.002 22.189 0.00 125.83 ? 310 OLC A H4A  1 
HETATM 4098 H H3   . OLC K 3 .   ? 23.867 58.473 20.632 0.00 124.67 ? 310 OLC A H3   1 
HETATM 4099 H H3A  . OLC K 3 .   ? 25.532 58.024 21.073 0.00 124.67 ? 310 OLC A H3A  1 
HETATM 4100 H H2   . OLC K 3 .   ? 25.418 55.965 19.835 0.00 129.85 ? 310 OLC A H2   1 
HETATM 4101 H H2A  . OLC K 3 .   ? 23.646 56.044 19.712 0.00 129.85 ? 310 OLC A H2A  1 
HETATM 4102 H H21  . OLC K 3 .   ? 26.160 57.119 15.808 0.00 121.60 ? 310 OLC A H21  1 
HETATM 4103 H H21A . OLC K 3 .   ? 25.604 55.776 16.836 0.00 121.60 ? 310 OLC A H21A 1 
HETATM 4104 H H22  . OLC K 3 .   ? 27.733 55.166 17.388 0.00 116.00 ? 310 OLC A H22  1 
HETATM 4105 H HO25 . OLC K 3 .   ? 29.093 54.319 15.987 0.00 108.53 ? 310 OLC A HO25 1 
HETATM 4106 H HO23 . OLC K 3 .   ? 28.061 56.966 18.672 0.00 134.13 ? 310 OLC A HO23 1 
HETATM 4107 C C45  . LI1 L 2 .   ? 31.036 33.856 46.684 1.00 88.20  ? 311 LI1 A C45  1 
HETATM 4108 C C46  . LI1 L 2 .   ? 30.444 33.577 45.308 1.00 69.48  ? 311 LI1 A C46  1 
HETATM 4109 C C47  . LI1 L 2 .   ? 31.468 33.696 44.186 1.00 87.04  ? 311 LI1 A C47  1 
HETATM 4110 C C48  . LI1 L 2 .   ? 31.548 35.073 43.527 1.00 80.17  ? 311 LI1 A C48  1 
HETATM 4111 C C50  . LI1 L 2 .   ? 30.920 35.048 42.132 1.00 88.06  ? 311 LI1 A C50  1 
HETATM 4112 C C51  . LI1 L 2 .   ? 29.728 35.978 41.939 1.00 81.33  ? 311 LI1 A C51  1 
HETATM 4113 C C52  . LI1 L 2 .   ? 30.000 37.414 42.358 1.00 84.09  ? 311 LI1 A C52  1 
HETATM 4114 C C53  . LI1 L 2 .   ? 29.395 38.454 41.428 1.00 60.71  ? 311 LI1 A C53  1 
HETATM 4115 C C55  . LI1 L 2 .   ? 29.873 38.344 39.989 1.00 84.99  ? 311 LI1 A C55  1 
HETATM 4116 C C56  . LI1 L 2 .   ? 29.937 39.675 39.258 1.00 68.52  ? 311 LI1 A C56  1 
HETATM 4117 H H451 . LI1 L 2 .   ? 30.320 34.045 47.311 1.00 105.89 ? 311 LI1 A H451 1 
HETATM 4118 H H452 . LI1 L 2 .   ? 31.576 34.659 46.628 1.00 105.89 ? 311 LI1 A H452 1 
HETATM 4119 H H461 . LI1 L 2 .   ? 30.069 32.682 45.311 1.00 83.43  ? 311 LI1 A H461 1 
HETATM 4120 H H462 . LI1 L 2 .   ? 29.719 34.202 45.154 1.00 83.43  ? 311 LI1 A H462 1 
HETATM 4121 H H471 . LI1 L 2 .   ? 31.254 33.029 43.515 1.00 104.50 ? 311 LI1 A H471 1 
HETATM 4122 H H472 . LI1 L 2 .   ? 32.337 33.461 44.549 1.00 104.50 ? 311 LI1 A H472 1 
HETATM 4123 C C45  . LI1 M 2 .   ? 31.019 27.936 46.123 1.00 104.54 ? 312 LI1 A C45  1 
HETATM 4124 C C46  . LI1 M 2 .   ? 31.023 26.578 45.431 1.00 99.56  ? 312 LI1 A C46  1 
HETATM 4125 C C47  . LI1 M 2 .   ? 31.079 26.682 43.911 1.00 87.12  ? 312 LI1 A C47  1 
HETATM 4126 C C48  . LI1 M 2 .   ? 29.720 26.789 43.216 1.00 94.50  ? 312 LI1 A C48  1 
HETATM 4127 C C50  . LI1 M 2 .   ? 29.878 26.723 41.695 1.00 82.67  ? 312 LI1 A C50  1 
HETATM 4128 C C51  . LI1 M 2 .   ? 28.698 26.117 40.945 1.00 72.49  ? 312 LI1 A C51  1 
HETATM 4129 C C52  . LI1 M 2 .   ? 28.885 26.092 39.436 1.00 81.02  ? 312 LI1 A C52  1 
HETATM 4130 C C53  . LI1 M 2 .   ? 27.933 27.006 38.682 1.00 88.09  ? 312 LI1 A C53  1 
HETATM 4131 C C55  . LI1 M 2 .   ? 27.954 28.448 39.163 1.00 88.18  ? 312 LI1 A C55  1 
HETATM 4132 C C56  . LI1 M 2 .   ? 28.838 29.364 38.332 1.00 74.30  ? 312 LI1 A C56  1 
HETATM 4133 C C57  . LI1 M 2 .   ? 28.867 30.802 38.837 1.00 81.82  ? 312 LI1 A C57  1 
HETATM 4134 C C58  . LI1 M 2 .   ? 29.788 31.750 38.084 1.00 87.12  ? 312 LI1 A C58  1 
HETATM 4135 C C59  . LI1 M 2 .   ? 29.706 33.163 38.637 1.00 71.02  ? 312 LI1 A C59  1 
HETATM 4136 H H451 . LI1 M 2 .   ? 30.231 28.433 45.853 1.00 125.50 ? 312 LI1 A H451 1 
HETATM 4137 H H452 . LI1 M 2 .   ? 31.786 28.442 45.811 1.00 125.50 ? 312 LI1 A H452 1 
HETATM 4138 H H461 . LI1 M 2 .   ? 30.223 26.098 45.694 1.00 119.52 ? 312 LI1 A H461 1 
HETATM 4139 H H462 . LI1 M 2 .   ? 31.789 26.075 45.750 1.00 119.52 ? 312 LI1 A H462 1 
HETATM 4140 H H471 . LI1 M 2 .   ? 31.551 25.904 43.576 1.00 104.60 ? 312 LI1 A H471 1 
HETATM 4141 H H472 . LI1 M 2 .   ? 31.617 27.457 43.685 1.00 104.60 ? 312 LI1 A H472 1 
HETATM 4142 C C46  . LI1 N 2 .   ? 30.949 32.490 33.740 1.00 84.23  ? 313 LI1 A C46  1 
HETATM 4143 C C47  . LI1 N 2 .   ? 30.757 33.520 32.633 1.00 90.36  ? 313 LI1 A C47  1 
HETATM 4144 C C48  . LI1 N 2 .   ? 31.305 33.114 31.263 1.00 78.84  ? 313 LI1 A C48  1 
HETATM 4145 C C50  . LI1 N 2 .   ? 31.346 31.592 31.113 1.00 85.99  ? 313 LI1 A C50  1 
HETATM 4146 C C51  . LI1 N 2 .   ? 32.689 31.020 30.677 1.00 97.39  ? 313 LI1 A C51  1 
HETATM 4147 C C52  . LI1 N 2 .   ? 32.681 29.510 30.505 1.00 104.98 ? 313 LI1 A C52  1 
HETATM 4148 C C53  . LI1 N 2 .   ? 34.035 28.856 30.727 1.00 102.99 ? 313 LI1 A C53  1 
HETATM 4149 C C55  . LI1 N 2 .   ? 34.058 27.370 30.408 1.00 92.49  ? 313 LI1 A C55  1 
HETATM 4150 C C56  . LI1 N 2 .   ? 33.840 27.054 28.937 1.00 98.46  ? 313 LI1 A C56  1 
HETATM 4151 C C57  . LI1 N 2 .   ? 33.875 25.564 28.620 1.00 85.89  ? 313 LI1 A C57  1 
HETATM 4152 C C58  . LI1 N 2 .   ? 34.098 25.208 27.159 1.00 80.45  ? 313 LI1 A C58  1 
HETATM 4153 C C59  . LI1 N 2 .   ? 34.479 26.427 26.337 1.00 94.10  ? 313 LI1 A C59  1 
HETATM 4154 C C60  . LI1 N 2 .   ? 32.890 24.511 26.557 1.00 106.60 ? 313 LI1 A C60  1 
HETATM 4155 C C45  . LI1 O 2 .   ? 9.252  59.345 45.922 1.00 76.51  ? 314 LI1 A C45  1 
HETATM 4156 C C46  . LI1 O 2 .   ? 10.077 58.341 45.127 1.00 86.12  ? 314 LI1 A C46  1 
HETATM 4157 C C47  . LI1 O 2 .   ? 11.464 58.862 44.770 1.00 76.67  ? 314 LI1 A C47  1 
HETATM 4158 C C48  . LI1 O 2 .   ? 11.520 59.760 43.534 1.00 78.81  ? 314 LI1 A C48  1 
HETATM 4159 C C50  . LI1 O 2 .   ? 12.958 59.908 43.033 1.00 88.28  ? 314 LI1 A C50  1 
HETATM 4160 C C51  . LI1 O 2 .   ? 13.406 58.852 42.029 1.00 79.55  ? 314 LI1 A C51  1 
HETATM 4161 C C52  . LI1 O 2 .   ? 14.804 59.084 41.480 1.00 74.76  ? 314 LI1 A C52  1 
HETATM 4162 C C53  . LI1 O 2 .   ? 15.863 58.178 42.086 1.00 85.23  ? 314 LI1 A C53  1 
HETATM 4163 C C55  . LI1 O 2 .   ? 17.193 58.210 41.350 1.00 68.78  ? 314 LI1 A C55  1 
HETATM 4164 C C56  . LI1 O 2 .   ? 17.992 56.922 41.464 1.00 85.70  ? 314 LI1 A C56  1 
HETATM 4165 C C57  . LI1 O 2 .   ? 18.653 56.729 42.824 1.00 75.20  ? 314 LI1 A C57  1 
HETATM 4166 C C58  . LI1 O 2 .   ? 19.641 55.577 42.919 1.00 85.27  ? 314 LI1 A C58  1 
HETATM 4167 C C59  . LI1 O 2 .   ? 20.602 55.758 44.081 1.00 78.03  ? 314 LI1 A C59  1 
HETATM 4168 H H451 . LI1 O 2 .   ? 9.664  59.487 46.789 1.00 91.86  ? 314 LI1 A H451 1 
HETATM 4169 H H452 . LI1 O 2 .   ? 9.279  60.197 45.458 1.00 91.86  ? 314 LI1 A H452 1 
HETATM 4170 H H461 . LI1 O 2 .   ? 9.594  58.122 44.315 1.00 103.39 ? 314 LI1 A H461 1 
HETATM 4171 H H462 . LI1 O 2 .   ? 10.160 57.529 45.651 1.00 103.39 ? 314 LI1 A H462 1 
HETATM 4172 H H471 . LI1 O 2 .   ? 12.046 58.097 44.639 1.00 92.06  ? 314 LI1 A H471 1 
HETATM 4173 H H472 . LI1 O 2 .   ? 11.807 59.347 45.537 1.00 92.06  ? 314 LI1 A H472 1 
HETATM 4174 C C52  . LI1 P 2 .   ? 26.924 18.701 43.343 1.00 61.15  ? 315 LI1 A C52  1 
HETATM 4175 C C53  . LI1 P 2 .   ? 25.799 17.831 42.796 1.00 62.47  ? 315 LI1 A C53  1 
HETATM 4176 C C55  . LI1 P 2 .   ? 25.077 18.460 41.611 1.00 57.19  ? 315 LI1 A C55  1 
HETATM 4177 C C56  . LI1 P 2 .   ? 25.903 19.468 40.807 1.00 75.82  ? 315 LI1 A C56  1 
HETATM 4178 C C57  . LI1 P 2 .   ? 25.522 19.434 39.325 1.00 76.04  ? 315 LI1 A C57  1 
HETATM 4179 C C58  . LI1 P 2 .   ? 25.435 18.043 38.709 1.00 59.57  ? 315 LI1 A C58  1 
HETATM 4180 C C46  . LI1 Q 2 .   ? 15.410 58.465 16.477 1.00 64.41  ? 316 LI1 A C46  1 
HETATM 4181 C C47  . LI1 Q 2 .   ? 15.287 59.570 17.519 1.00 76.53  ? 316 LI1 A C47  1 
HETATM 4182 C C48  . LI1 Q 2 .   ? 14.683 59.139 18.856 1.00 56.01  ? 316 LI1 A C48  1 
HETATM 4183 C C50  . LI1 Q 2 .   ? 15.174 60.034 19.995 1.00 58.70  ? 316 LI1 A C50  1 
HETATM 4184 C C51  . LI1 Q 2 .   ? 15.113 59.405 21.381 1.00 77.57  ? 316 LI1 A C51  1 
HETATM 4185 C C52  . LI1 Q 2 .   ? 14.829 60.402 22.493 1.00 71.36  ? 316 LI1 A C52  1 
HETATM 4186 C C53  . LI1 Q 2 .   ? 13.349 60.601 22.766 1.00 74.76  ? 316 LI1 A C53  1 
HETATM 4187 C C55  . LI1 Q 2 .   ? 12.655 59.366 23.316 1.00 85.45  ? 316 LI1 A C55  1 
HETATM 4188 C C56  . LI1 Q 2 .   ? 12.800 59.204 24.820 1.00 75.30  ? 316 LI1 A C56  1 
HETATM 4189 C C57  . LI1 Q 2 .   ? 12.778 60.527 25.575 1.00 86.96  ? 316 LI1 A C57  1 
HETATM 4190 C C58  . LI1 Q 2 .   ? 13.312 60.483 26.998 1.00 89.01  ? 316 LI1 A C58  1 
HETATM 4191 C C59  . LI1 Q 2 .   ? 14.655 59.778 27.059 1.00 76.68  ? 316 LI1 A C59  1 
HETATM 4192 C C60  . LI1 Q 2 .   ? 13.410 61.876 27.597 1.00 81.83  ? 316 LI1 A C60  1 
HETATM 4193 C C1   . RET R 4 .   ? 15.020 46.451 29.829 1.00 43.86  ? 317 RET A C1   1 
HETATM 4194 C C2   . RET R 4 .   ? 14.621 47.374 28.664 1.00 39.03  ? 317 RET A C2   1 
HETATM 4195 C C3   . RET R 4 .   ? 15.398 48.684 28.623 1.00 58.66  ? 317 RET A C3   1 
HETATM 4196 C C4   . RET R 4 .   ? 15.196 49.467 29.908 1.00 58.25  ? 317 RET A C4   1 
HETATM 4197 C C5   . RET R 4 .   ? 15.186 48.603 31.139 1.00 47.83  ? 317 RET A C5   1 
HETATM 4198 C C6   . RET R 4 .   ? 15.360 47.272 31.078 1.00 42.29  ? 317 RET A C6   1 
HETATM 4199 C C7   . RET R 4 .   ? 16.033 46.560 32.172 1.00 32.71  ? 317 RET A C7   1 
HETATM 4200 C C8   . RET R 4 .   ? 15.973 45.280 32.552 1.00 45.06  ? 317 RET A C8   1 
HETATM 4201 C C9   . RET R 4 .   ? 16.619 44.688 33.714 1.00 39.68  ? 317 RET A C9   1 
HETATM 4202 C C10  . RET R 4 .   ? 16.764 43.342 33.789 1.00 40.82  ? 317 RET A C10  1 
HETATM 4203 C C11  . RET R 4 .   ? 17.500 42.608 34.775 1.00 45.84  ? 317 RET A C11  1 
HETATM 4204 C C12  . RET R 4 .   ? 17.739 41.287 34.759 1.00 48.57  ? 317 RET A C12  1 
HETATM 4205 C C13  . RET R 4 .   ? 18.681 40.571 35.607 1.00 52.29  ? 317 RET A C13  1 
HETATM 4206 C C14  . RET R 4 .   ? 18.948 39.269 35.341 1.00 60.75  ? 317 RET A C14  1 
HETATM 4207 C C15  . RET R 4 .   ? 18.049 38.147 35.112 1.00 41.15  ? 317 RET A C15  1 
HETATM 4208 C C16  . RET R 4 .   ? 16.225 45.602 29.404 1.00 44.35  ? 317 RET A C16  1 
HETATM 4209 C C17  . RET R 4 .   ? 13.828 45.526 30.105 1.00 40.62  ? 317 RET A C17  1 
HETATM 4210 C C18  . RET R 4 .   ? 15.071 49.388 32.416 1.00 45.47  ? 317 RET A C18  1 
HETATM 4211 C C19  . RET R 4 .   ? 17.254 45.617 34.711 1.00 41.55  ? 317 RET A C19  1 
HETATM 4212 C C20  . RET R 4 .   ? 19.562 41.389 36.510 1.00 48.84  ? 317 RET A C20  1 
HETATM 4213 H H21  . RET R 4 .   ? 14.753 46.913 27.811 1.00 46.88  ? 317 RET A H21  1 
HETATM 4214 H H22  . RET R 4 .   ? 13.667 47.584 28.715 1.00 46.88  ? 317 RET A H22  1 
HETATM 4215 H H31  . RET R 4 .   ? 15.108 49.223 27.860 1.00 70.45  ? 317 RET A H31  1 
HETATM 4216 H H32  . RET R 4 .   ? 16.351 48.506 28.493 1.00 70.45  ? 317 RET A H32  1 
HETATM 4217 H H41  . RET R 4 .   ? 14.349 49.956 29.864 1.00 69.95  ? 317 RET A H41  1 
HETATM 4218 H H42  . RET R 4 .   ? 15.906 50.134 30.000 1.00 69.95  ? 317 RET A H42  1 
HETATM 4219 H H7   . RET R 4 .   ? 16.840 47.042 32.448 1.00 39.31  ? 317 RET A H7   1 
HETATM 4220 H H8   . RET R 4 .   ? 15.176 44.796 32.253 1.00 54.13  ? 317 RET A H8   1 
HETATM 4221 H H10  . RET R 4 .   ? 16.324 42.800 33.102 1.00 49.04  ? 317 RET A H10  1 
HETATM 4222 H H11  . RET R 4 .   ? 17.524 43.015 35.665 1.00 55.05  ? 317 RET A H11  1 
HETATM 4223 H H12  . RET R 4 .   ? 17.235 40.746 34.117 1.00 58.33  ? 317 RET A H12  1 
HETATM 4224 H H14  . RET R 4 .   ? 19.884 38.989 35.282 1.00 72.95  ? 317 RET A H14  1 
HETATM 4225 H H15  . RET R 4 .   ? 17.086 38.323 35.083 1.00 49.43  ? 317 RET A H15  1 
HETATM 4226 H H161 . RET R 4 .   ? 16.129 45.264 28.490 1.00 53.28  ? 317 RET A H161 1 
HETATM 4227 H H162 . RET R 4 .   ? 17.060 46.112 29.433 1.00 53.28  ? 317 RET A H162 1 
HETATM 4228 H H163 . RET R 4 .   ? 16.346 44.823 29.984 1.00 53.28  ? 317 RET A H163 1 
HETATM 4229 H H171 . RET R 4 .   ? 14.129 44.610 30.273 1.00 48.79  ? 317 RET A H171 1 
HETATM 4230 H H172 . RET R 4 .   ? 13.216 45.509 29.342 1.00 48.79  ? 317 RET A H172 1 
HETATM 4231 H H173 . RET R 4 .   ? 13.326 45.828 30.889 1.00 48.79  ? 317 RET A H173 1 
HETATM 4232 H H181 . RET R 4 .   ? 14.824 50.325 32.283 1.00 54.62  ? 317 RET A H181 1 
HETATM 4233 H H182 . RET R 4 .   ? 15.899 49.418 32.937 1.00 54.62  ? 317 RET A H182 1 
HETATM 4234 H H183 . RET R 4 .   ? 14.398 49.037 33.035 1.00 54.62  ? 317 RET A H183 1 
HETATM 4235 H H191 . RET R 4 .   ? 18.183 45.799 34.461 1.00 49.91  ? 317 RET A H191 1 
HETATM 4236 H H192 . RET R 4 .   ? 16.767 46.465 34.743 1.00 49.91  ? 317 RET A H192 1 
HETATM 4237 H H193 . RET R 4 .   ? 17.243 45.216 35.604 1.00 49.91  ? 317 RET A H193 1 
HETATM 4238 H H201 . RET R 4 .   ? 19.586 42.327 36.230 1.00 58.65  ? 317 RET A H201 1 
HETATM 4239 H H202 . RET R 4 .   ? 19.244 41.365 37.435 1.00 58.65  ? 317 RET A H202 1 
HETATM 4240 H H203 . RET R 4 .   ? 20.483 41.056 36.506 1.00 58.65  ? 317 RET A H203 1 
HETATM 4241 O O    . HOH S 5 .   ? 8.338  45.334 57.544 1.00 77.23  ? 401 HOH A O    1 
HETATM 4242 O O    . HOH S 5 .   ? 9.554  48.319 54.903 1.00 58.91  ? 402 HOH A O    1 
HETATM 4243 O O    . HOH S 5 .   ? 18.191 35.146 32.180 1.00 40.00  ? 403 HOH A O    1 
HETATM 4244 O O    . HOH S 5 .   ? 29.356 30.491 54.302 1.00 74.78  ? 404 HOH A O    1 
HETATM 4245 O O    . HOH S 5 .   ? 4.178  29.588 18.562 1.00 74.09  ? 405 HOH A O    1 
HETATM 4246 O O    . HOH S 5 .   ? 22.357 46.081 61.695 1.00 75.60  ? 406 HOH A O    1 
HETATM 4247 O O    . HOH S 5 .   ? 17.245 23.381 58.199 1.00 80.96  ? 407 HOH A O    1 
HETATM 4248 O O    . HOH S 5 .   ? 15.716 41.079 23.172 1.00 61.24  ? 408 HOH A O    1 
HETATM 4249 O O    . HOH S 5 .   ? 9.030  28.333 54.474 1.00 51.76  ? 409 HOH A O    1 
HETATM 4250 O O    . HOH S 5 .   ? 29.567 44.633 56.068 1.00 68.52  ? 410 HOH A O    1 
HETATM 4251 O O    . HOH S 5 .   ? 26.102 39.438 15.124 1.00 60.43  ? 411 HOH A O    1 
HETATM 4252 O O    . HOH S 5 .   ? 22.302 35.744 26.014 1.00 47.93  ? 412 HOH A O    1 
HETATM 4253 O O    . HOH S 5 .   ? 18.064 36.651 28.861 1.00 56.03  ? 413 HOH A O    1 
HETATM 4254 O O    . HOH S 5 .   ? 27.954 34.785 51.625 1.00 57.97  ? 414 HOH A O    1 
HETATM 4255 O O    . HOH S 5 .   ? 23.662 37.333 14.566 1.00 67.38  ? 415 HOH A O    1 
HETATM 4256 O O    . HOH S 5 .   ? 23.653 42.301 14.566 1.00 56.36  ? 416 HOH A O    1 
HETATM 4257 O O    . HOH S 5 .   ? 17.495 40.670 20.142 1.00 45.48  ? 417 HOH A O    1 
HETATM 4258 O O    . HOH S 5 .   ? 9.862  31.489 16.284 1.00 55.91  ? 418 HOH A O    1 
HETATM 4259 O O    . HOH S 5 .   ? 8.689  49.553 10.668 1.00 62.32  ? 419 HOH A O    1 
HETATM 4260 O O    . HOH S 5 .   ? 4.357  51.800 20.437 1.00 39.33  ? 420 HOH A O    1 
HETATM 4261 O O    . HOH S 5 .   ? 16.568 23.913 46.728 1.00 50.27  ? 421 HOH A O    1 
HETATM 4262 O O    . HOH S 5 .   ? 15.046 25.579 14.835 1.00 63.67  ? 422 HOH A O    1 
HETATM 4263 O O    . HOH S 5 .   ? 20.712 40.535 41.081 1.00 48.25  ? 423 HOH A O    1 
HETATM 4264 O O    . HOH S 5 .   ? 27.226 34.635 56.736 1.00 105.13 ? 424 HOH A O    1 
HETATM 4265 O O    . HOH S 5 .   ? 16.566 35.008 28.509 1.00 64.20  ? 425 HOH A O    1 
HETATM 4266 O O    . HOH S 5 .   ? 19.146 28.403 13.000 1.00 60.41  ? 426 HOH A O    1 
HETATM 4267 O O    . HOH S 5 .   ? 30.325 34.605 49.959 1.00 71.96  ? 427 HOH A O    1 
HETATM 4268 O O    . HOH S 5 .   ? 18.560 35.099 12.577 1.00 59.82  ? 428 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 1   ? 3.2923 2.2565 2.1049 -0.1611 0.2815  -0.1285 4   ALA A N   
2    C CA  . ALA A 1   ? 2.9738 2.0698 1.9007 -0.1259 0.2756  -0.1190 4   ALA A CA  
3    C C   . ALA A 1   ? 2.5707 1.7609 1.5233 -0.1839 0.2056  -0.1091 4   ALA A C   
4    O O   . ALA A 1   ? 2.9854 2.1540 1.8695 -0.2441 0.1724  -0.1030 4   ALA A O   
5    C CB  . ALA A 1   ? 2.8937 1.9837 1.8159 -0.0942 0.3181  -0.1128 4   ALA A CB  
6    N N   . THR A 2   ? 2.0939 1.4002 1.1725 -0.1644 0.1796  -0.0975 5   THR A N   
7    C CA  . THR A 2   ? 1.7012 1.1273 0.8591 -0.2081 0.1127  -0.0711 5   THR A CA  
8    C C   . THR A 2   ? 1.6257 1.1258 0.8371 -0.1949 0.1185  -0.0528 5   THR A C   
9    O O   . THR A 2   ? 1.6194 1.1401 0.8930 -0.1356 0.1625  -0.0551 5   THR A O   
10   C CB  . THR A 2   ? 1.5601 1.0868 0.8592 -0.1875 0.0840  -0.0591 5   THR A CB  
11   O OG1 . THR A 2   ? 1.7164 1.1940 0.9537 -0.2327 0.0531  -0.0638 5   THR A OG1 
12   C CG2 . THR A 2   ? 1.2461 0.9138 0.6760 -0.1907 0.0475  -0.0280 5   THR A CG2 
19   N N   . GLY A 3   ? 1.4770 1.0198 0.6694 -0.2487 0.0760  -0.0306 6   GLY A N   
20   C CA  . GLY A 3   ? 1.2525 0.8571 0.4824 -0.2407 0.0822  -0.0109 6   GLY A CA  
21   C C   . GLY A 3   ? 1.1042 0.8512 0.5151 -0.2032 0.0709  0.0136  6   GLY A C   
22   O O   . GLY A 3   ? 1.1761 0.9715 0.6326 -0.1837 0.0867  0.0271  6   GLY A O   
26   N N   . ARG A 4   ? 1.0312 0.8349 0.5339 -0.1950 0.0473  0.0188  7   ARG A N   
27   C CA  . ARG A 4   ? 0.9737 0.8967 0.6335 -0.1652 0.0381  0.0402  7   ARG A CA  
28   C C   . ARG A 4   ? 0.8432 0.7726 0.5704 -0.1041 0.0782  0.0220  7   ARG A C   
29   O O   . ARG A 4   ? 0.8059 0.6934 0.5211 -0.0859 0.0890  0.0028  7   ARG A O   
30   C CB  . ARG A 4   ? 0.8440 0.8159 0.5592 -0.1867 -0.0018 0.0567  7   ARG A CB  
31   C CG  . ARG A 4   ? 0.9225 0.9441 0.6337 -0.2398 -0.0442 0.0965  7   ARG A CG  
32   C CD  . ARG A 4   ? 0.9299 0.9964 0.6984 -0.2558 -0.0763 0.1169  7   ARG A CD  
33   N NE  . ARG A 4   ? 1.0516 1.0371 0.7373 -0.2752 -0.0841 0.0917  7   ARG A NE  
34   C CZ  . ARG A 4   ? 0.8875 0.8880 0.6162 -0.2735 -0.0983 0.0946  7   ARG A CZ  
35   N NH1 . ARG A 4   ? 0.6742 0.7440 0.5203 -0.2351 -0.0904 0.1042  7   ARG A NH1 
36   N NH2 . ARG A 4   ? 1.1086 1.0466 0.7545 -0.3126 -0.1187 0.0872  7   ARG A NH2 
50   N N   . PRO A 5   ? 0.7939 0.7794 0.5949 -0.0748 0.0986  0.0323  8   PRO A N   
51   C CA  . PRO A 5   ? 0.8133 0.8144 0.6806 -0.0240 0.1326  0.0229  8   PRO A CA  
52   C C   . PRO A 5   ? 0.6381 0.6858 0.5940 -0.0088 0.1167  0.0207  8   PRO A C   
53   O O   . PRO A 5   ? 0.7111 0.7567 0.6986 0.0249  0.1380  0.0128  8   PRO A O   
54   C CB  . PRO A 5   ? 0.8487 0.9127 0.7808 -0.0124 0.1446  0.0416  8   PRO A CB  
55   C CG  . PRO A 5   ? 0.7978 0.9077 0.7455 -0.0495 0.1094  0.0638  8   PRO A CG  
56   C CD  . PRO A 5   ? 0.8460 0.8903 0.6786 -0.0909 0.0881  0.0590  8   PRO A CD  
64   N N   . GLU A 6   ? 0.5351 0.6230 0.5267 -0.0336 0.0823  0.0318  9   GLU A N   
65   C CA  . GLU A 6   ? 0.4897 0.6134 0.5526 -0.0233 0.0685  0.0300  9   GLU A CA  
66   C C   . GLU A 6   ? 0.6332 0.7052 0.6474 -0.0276 0.0591  0.0144  9   GLU A C   
67   O O   . GLU A 6   ? 0.4849 0.5800 0.5471 -0.0211 0.0470  0.0129  9   GLU A O   
68   C CB  . GLU A 6   ? 0.5493 0.7311 0.6703 -0.0427 0.0460  0.0532  9   GLU A CB  
69   C CG  . GLU A 6   ? 0.3716 0.5457 0.4475 -0.0813 0.0178  0.0706  9   GLU A CG  
70   C CD  . GLU A 6   ? 0.6643 0.8446 0.7005 -0.1066 0.0130  0.0910  9   GLU A CD  
71   O OE1 . GLU A 6   ? 0.6289 0.7950 0.6449 -0.0926 0.0363  0.0828  9   GLU A OE1 
72   O OE2 . GLU A 6   ? 0.6442 0.8479 0.6711 -0.1415 -0.0144 0.1198  9   GLU A OE2 
79   N N   . TRP A 7   ? 0.6603 0.6549 0.5733 -0.0397 0.0669  0.0024  10  TRP A N   
80   C CA  . TRP A 7   ? 0.5740 0.5114 0.4335 -0.0492 0.0580  -0.0109 10  TRP A CA  
81   C C   . TRP A 7   ? 0.5317 0.4665 0.4319 -0.0080 0.0769  -0.0218 10  TRP A C   
82   O O   . TRP A 7   ? 0.5639 0.4887 0.4673 -0.0105 0.0625  -0.0263 10  TRP A O   
83   C CB  . TRP A 7   ? 0.6805 0.5170 0.4069 -0.0738 0.0686  -0.0237 10  TRP A CB  
84   C CG  . TRP A 7   ? 0.8787 0.6447 0.5555 -0.0361 0.1183  -0.0402 10  TRP A CG  
85   C CD1 . TRP A 7   ? 1.1467 0.8896 0.7906 -0.0215 0.1522  -0.0400 10  TRP A CD1 
86   C CD2 . TRP A 7   ? 0.8812 0.5907 0.5386 -0.0046 0.1452  -0.0531 10  TRP A CD2 
87   N NE1 . TRP A 7   ? 1.2006 0.8761 0.8087 0.0196  0.2019  -0.0501 10  TRP A NE1 
88   C CE2 . TRP A 7   ? 1.1340 0.7894 0.7518 0.0312  0.1985  -0.0568 10  TRP A CE2 
89   C CE3 . TRP A 7   ? 1.0023 0.7032 0.6749 -0.0008 0.1323  -0.0579 10  TRP A CE3 
90   C CZ2 . TRP A 7   ? 1.3385 0.9342 0.9369 0.0730  0.2412  -0.0611 10  TRP A CZ2 
91   C CZ3 . TRP A 7   ? 1.0601 0.7020 0.7103 0.0378  0.1706  -0.0648 10  TRP A CZ3 
92   C CH2 . TRP A 7   ? 1.1718 0.7629 0.7878 0.0753  0.2254  -0.0644 10  TRP A CH2 
103  N N   . ILE A 8   ? 0.5790 0.5281 0.5137 0.0290  0.1082  -0.0209 11  ILE A N   
104  C CA  . ILE A 8   ? 0.5460 0.5036 0.5247 0.0665  0.1243  -0.0213 11  ILE A CA  
105  C C   . ILE A 8   ? 0.4672 0.4937 0.5291 0.0634  0.0942  -0.0161 11  ILE A C   
106  O O   . ILE A 8   ? 0.5359 0.5579 0.6105 0.0762  0.0902  -0.0180 11  ILE A O   
107  C CB  . ILE A 8   ? 0.5466 0.5241 0.5613 0.1039  0.1617  -0.0102 11  ILE A CB  
108  C CG1 . ILE A 8   ? 0.9207 0.9229 0.9927 0.1412  0.1753  0.0011  11  ILE A CG1 
109  C CG2 . ILE A 8   ? 0.5312 0.5865 0.6184 0.0973  0.1520  0.0019  11  ILE A CG2 
110  C CD1 . ILE A 8   ? 0.8989 0.8319 0.9144 0.1501  0.1833  -0.0075 11  ILE A CD1 
122  N N   . TRP A 9   ? 0.4715 0.5552 0.5845 0.0464  0.0761  -0.0083 12  TRP A N   
123  C CA  . TRP A 9   ? 0.4254 0.5567 0.6012 0.0419  0.0549  -0.0052 12  TRP A CA  
124  C C   . TRP A 9   ? 0.4692 0.5801 0.6186 0.0198  0.0324  -0.0073 12  TRP A C   
125  O O   . TRP A 9   ? 0.4582 0.5815 0.6343 0.0225  0.0212  -0.0089 12  TRP A O   
126  C CB  . TRP A 9   ? 0.3520 0.5371 0.5856 0.0342  0.0530  0.0048  12  TRP A CB  
127  C CG  . TRP A 9   ? 0.4869 0.6939 0.7454 0.0509  0.0745  0.0108  12  TRP A CG  
128  C CD1 . TRP A 9   ? 0.3847 0.6039 0.6448 0.0454  0.0853  0.0190  12  TRP A CD1 
129  C CD2 . TRP A 9   ? 0.4878 0.7125 0.7780 0.0765  0.0891  0.0156  12  TRP A CD2 
130  N NE1 . TRP A 9   ? 0.3154 0.5552 0.6048 0.0665  0.1074  0.0259  12  TRP A NE1 
131  C CE2 . TRP A 9   ? 0.3788 0.6260 0.6910 0.0859  0.1101  0.0265  12  TRP A CE2 
132  C CE3 . TRP A 9   ? 0.4855 0.7159 0.7929 0.0927  0.0864  0.0178  12  TRP A CE3 
133  C CZ2 . TRP A 9   ? 0.4211 0.6936 0.7684 0.1085  0.1258  0.0399  12  TRP A CZ2 
134  C CZ3 . TRP A 9   ? 0.6248 0.8901 0.9773 0.1172  0.1034  0.0357  12  TRP A CZ3 
135  C CH2 . TRP A 9   ? 0.5193 0.7969 0.8791 0.1201  0.1180  0.0441  12  TRP A CH2 
146  N N   . LEU A 10  ? 0.4174 0.4990 0.5134 -0.0050 0.0244  -0.0040 13  LEU A N   
147  C CA  . LEU A 10  ? 0.4571 0.5228 0.5305 -0.0283 0.0024  0.0004  13  LEU A CA  
148  C C   . LEU A 10  ? 0.5152 0.5249 0.5415 -0.0198 0.0052  -0.0144 13  LEU A C   
149  O O   . LEU A 10  ? 0.5221 0.5321 0.5586 -0.0242 -0.0087 -0.0128 13  LEU A O   
150  C CB  . LEU A 10  ? 0.4124 0.4691 0.4417 -0.0649 -0.0124 0.0150  13  LEU A CB  
151  C CG  . LEU A 10  ? 0.5388 0.6516 0.6129 -0.0732 -0.0137 0.0369  13  LEU A CG  
152  C CD1 . LEU A 10  ? 0.5201 0.6301 0.5479 -0.1147 -0.0349 0.0590  13  LEU A CD1 
153  C CD2 . LEU A 10  ? 0.5588 0.7263 0.7167 -0.0629 -0.0146 0.0517  13  LEU A CD2 
165  N N   . ALA A 11  ? 0.5163 0.4728 0.4894 -0.0051 0.0282  -0.0265 14  ALA A N   
166  C CA  . ALA A 11  ? 0.5495 0.4458 0.4786 0.0089  0.0394  -0.0374 14  ALA A CA  
167  C C   . ALA A 11  ? 0.5796 0.5175 0.5770 0.0399  0.0406  -0.0341 14  ALA A C   
168  O O   . ALA A 11  ? 0.5312 0.4511 0.5210 0.0408  0.0318  -0.0358 14  ALA A O   
169  C CB  . ALA A 11  ? 0.5997 0.4229 0.4571 0.0248  0.0757  -0.0470 14  ALA A CB  
175  N N   A LEU A 12  ? 0.5553 0.5500 0.6173 0.0614  0.0492  -0.0270 15  LEU A N   
176  N N   B LEU A 12  ? 0.5570 0.5515 0.6189 0.0615  0.0493  -0.0270 15  LEU A N   
177  C CA  A LEU A 12  ? 0.4784 0.5179 0.6007 0.0815  0.0439  -0.0198 15  LEU A CA  
178  C CA  B LEU A 12  ? 0.4773 0.5166 0.5994 0.0814  0.0439  -0.0198 15  LEU A CA  
179  C C   A LEU A 12  ? 0.5108 0.5772 0.6580 0.0612  0.0161  -0.0206 15  LEU A C   
180  C C   B LEU A 12  ? 0.5122 0.5780 0.6588 0.0611  0.0161  -0.0207 15  LEU A C   
181  O O   A LEU A 12  ? 0.4232 0.4925 0.5802 0.0684  0.0074  -0.0191 15  LEU A O   
182  O O   B LEU A 12  ? 0.4231 0.4910 0.5787 0.0682  0.0074  -0.0193 15  LEU A O   
183  C CB  A LEU A 12  ? 0.4810 0.5788 0.6650 0.0975  0.0538  -0.0082 15  LEU A CB  
184  C CB  B LEU A 12  ? 0.4805 0.5785 0.6647 0.0974  0.0535  -0.0083 15  LEU A CB  
185  C CG  A LEU A 12  ? 0.4093 0.5611 0.6546 0.1119  0.0454  0.0059  15  LEU A CG  
186  C CG  B LEU A 12  ? 0.5090 0.5897 0.6853 0.1290  0.0888  0.0014  15  LEU A CG  
187  C CD1 A LEU A 12  ? 0.4902 0.6162 0.7209 0.1376  0.0561  0.0146  15  LEU A CD1 
188  C CD1 B LEU A 12  ? 0.5167 0.6572 0.7519 0.1354  0.0969  0.0148  15  LEU A CD1 
189  C CD2 A LEU A 12  ? 0.5551 0.7623 0.8571 0.1230  0.0564  0.0225  15  LEU A CD2 
190  C CD2 B LEU A 12  ? 0.5481 0.6254 0.7384 0.1598  0.1009  0.0156  15  LEU A CD2 
213  N N   . GLY A 13  ? 0.3957 0.4800 0.5524 0.0381  0.0058  -0.0193 16  GLY A N   
214  C CA  . GLY A 13  ? 0.4806 0.5809 0.6574 0.0236  -0.0101 -0.0159 16  GLY A CA  
215  C C   . GLY A 13  ? 0.4328 0.4960 0.5720 0.0145  -0.0201 -0.0160 16  GLY A C   
216  O O   . GLY A 13  ? 0.5460 0.6127 0.6966 0.0155  -0.0278 -0.0148 16  GLY A O   
220  N N   . THR A 14  ? 0.4754 0.4973 0.5625 0.0020  -0.0199 -0.0172 17  THR A N   
221  C CA  . THR A 14  ? 0.5871 0.5686 0.6337 -0.0121 -0.0305 -0.0162 17  THR A CA  
222  C C   . THR A 14  ? 0.5649 0.5209 0.6026 0.0121  -0.0236 -0.0242 17  THR A C   
223  O O   . THR A 14  ? 0.4945 0.4426 0.5311 0.0084  -0.0335 -0.0207 17  THR A O   
224  C CB  . THR A 14  ? 0.5525 0.4822 0.5287 -0.0377 -0.0321 -0.0181 17  THR A CB  
225  O OG1 . THR A 14  ? 0.5508 0.5151 0.5397 -0.0636 -0.0436 -0.0028 17  THR A OG1 
226  C CG2 . THR A 14  ? 0.6207 0.5031 0.5502 -0.0589 -0.0446 -0.0165 17  THR A CG2 
234  N N   . ALA A 15  ? 0.4917 0.4390 0.5281 0.0391  -0.0045 -0.0295 18  ALA A N   
235  C CA  . ALA A 15  ? 0.7898 0.7177 0.8229 0.0655  0.0050  -0.0281 18  ALA A CA  
236  C C   . ALA A 15  ? 0.5297 0.5128 0.6180 0.0738  -0.0097 -0.0205 18  ALA A C   
237  O O   . ALA A 15  ? 0.5530 0.5237 0.6349 0.0806  -0.0150 -0.0168 18  ALA A O   
238  C CB  . ALA A 15  ? 0.7065 0.6168 0.7326 0.0960  0.0352  -0.0255 18  ALA A CB  
244  N N   . LEU A 16  ? 0.4846 0.5223 0.6193 0.0702  -0.0160 -0.0181 19  LEU A N   
245  C CA  . LEU A 16  ? 0.4462 0.5235 0.6151 0.0693  -0.0306 -0.0133 19  LEU A CA  
246  C C   . LEU A 16  ? 0.4590 0.5217 0.6133 0.0513  -0.0419 -0.0164 19  LEU A C   
247  O O   . LEU A 16  ? 0.4510 0.5152 0.6032 0.0532  -0.0507 -0.0136 19  LEU A O   
248  C CB  . LEU A 16  ? 0.4120 0.5373 0.6218 0.0629  -0.0326 -0.0115 19  LEU A CB  
249  C CG  . LEU A 16  ? 0.5807 0.7352 0.8197 0.0825  -0.0211 -0.0003 19  LEU A CG  
250  C CD1 . LEU A 16  ? 0.3411 0.5391 0.6182 0.0694  -0.0237 0.0011  19  LEU A CD1 
251  C CD2 . LEU A 16  ? 0.5133 0.6916 0.7725 0.1012  -0.0258 0.0181  19  LEU A CD2 
263  N N   . MET A 17  ? 0.4191 0.4710 0.5653 0.0342  -0.0405 -0.0172 20  MET A N   
264  C CA  . MET A 17  ? 0.5550 0.5965 0.6955 0.0215  -0.0452 -0.0113 20  MET A CA  
265  C C   . MET A 17  ? 0.5613 0.5675 0.6703 0.0240  -0.0500 -0.0091 20  MET A C   
266  O O   . MET A 17  ? 0.4928 0.4930 0.5990 0.0236  -0.0533 -0.0044 20  MET A O   
267  C CB  . MET A 17  ? 0.4944 0.5442 0.6446 0.0040  -0.0425 -0.0007 20  MET A CB  
268  C CG  . MET A 17  ? 0.4372 0.5175 0.6210 0.0021  -0.0331 0.0010  20  MET A CG  
269  S SD  . MET A 17  ? 0.4564 0.5363 0.6509 0.0041  -0.0238 -0.0021 20  MET A SD  
270  C CE  . MET A 17  ? 0.5537 0.6556 0.7780 -0.0009 -0.0096 -0.0017 20  MET A CE  
280  N N   . GLY A 18  ? 0.4721 0.4459 0.5501 0.0262  -0.0469 -0.0127 21  GLY A N   
281  C CA  . GLY A 18  ? 0.5398 0.4687 0.5814 0.0270  -0.0481 -0.0114 21  GLY A CA  
282  C C   . GLY A 18  ? 0.5879 0.5191 0.6364 0.0520  -0.0461 -0.0099 21  GLY A C   
283  O O   . GLY A 18  ? 0.6662 0.5841 0.7055 0.0518  -0.0514 -0.0043 21  GLY A O   
287  N N   . LEU A 19  ? 0.5839 0.5381 0.6527 0.0732  -0.0389 -0.0094 22  LEU A N   
288  C CA  . LEU A 19  ? 0.5786 0.5511 0.6633 0.0945  -0.0411 0.0017  22  LEU A CA  
289  C C   . LEU A 19  ? 0.6241 0.6281 0.7233 0.0820  -0.0589 0.0037  22  LEU A C   
290  O O   . LEU A 19  ? 0.5269 0.5299 0.6193 0.0889  -0.0658 0.0127  22  LEU A O   
291  C CB  . LEU A 19  ? 0.5735 0.5808 0.6907 0.1166  -0.0314 0.0117  22  LEU A CB  
292  C CG  . LEU A 19  ? 0.7630 0.7250 0.8568 0.1391  -0.0024 0.0138  22  LEU A CG  
293  C CD1 . LEU A 19  ? 0.7555 0.7627 0.8935 0.1619  0.0112  0.0294  22  LEU A CD1 
294  C CD2 . LEU A 19  ? 0.8967 0.8097 0.9616 0.1592  0.0111  0.0234  22  LEU A CD2 
306  N N   . GLY A 20  ? 0.5959 0.6206 0.7083 0.0637  -0.0628 -0.0038 23  GLY A N   
307  C CA  . GLY A 20  ? 0.5321 0.5648 0.6405 0.0502  -0.0709 -0.0047 23  GLY A CA  
308  C C   . GLY A 20  ? 0.6276 0.6264 0.7114 0.0458  -0.0679 -0.0018 23  GLY A C   
309  O O   . GLY A 20  ? 0.5754 0.5671 0.6416 0.0440  -0.0721 0.0012  23  GLY A O   
313  N N   . THR A 21  ? 0.5696 0.5480 0.6494 0.0406  -0.0616 0.0005  24  THR A N   
314  C CA  . THR A 21  ? 0.5809 0.5344 0.6460 0.0346  -0.0598 0.0104  24  THR A CA  
315  C C   . THR A 21  ? 0.5577 0.4887 0.6007 0.0474  -0.0643 0.0140  24  THR A C   
316  O O   . THR A 21  ? 0.5425 0.4634 0.5736 0.0481  -0.0640 0.0212  24  THR A O   
317  C CB  . THR A 21  ? 0.4675 0.4112 0.5338 0.0187  -0.0593 0.0180  24  THR A CB  
318  O OG1 . THR A 21  ? 0.5230 0.4942 0.6155 0.0091  -0.0544 0.0208  24  THR A OG1 
319  C CG2 . THR A 21  ? 0.4713 0.3996 0.5326 0.0087  -0.0592 0.0360  24  THR A CG2 
327  N N   . LEU A 22  ? 0.5541 0.4726 0.5894 0.0601  -0.0635 0.0117  25  LEU A N   
328  C CA  . LEU A 22  ? 0.6521 0.5444 0.6685 0.0761  -0.0620 0.0196  25  LEU A CA  
329  C C   . LEU A 22  ? 0.6502 0.5735 0.6763 0.0889  -0.0706 0.0282  25  LEU A C   
330  O O   . LEU A 22  ? 0.6340 0.5431 0.6448 0.0955  -0.0728 0.0385  25  LEU A O   
331  C CB  . LEU A 22  ? 0.5850 0.4460 0.5869 0.0909  -0.0489 0.0179  25  LEU A CB  
332  C CG  . LEU A 22  ? 0.8812 0.6830 0.8429 0.0723  -0.0421 0.0115  25  LEU A CG  
333  C CD1 . LEU A 22  ? 0.8220 0.6409 0.7912 0.0406  -0.0530 0.0086  25  LEU A CD1 
334  C CD2 . LEU A 22  ? 1.0170 0.7768 0.9515 0.0861  -0.0214 0.0049  25  LEU A CD2 
346  N N   . TYR A 23  ? 0.5321 0.4987 0.5810 0.0887  -0.0778 0.0267  26  TYR A N   
347  C CA  . TYR A 23  ? 0.5672 0.5666 0.6185 0.0892  -0.0932 0.0379  26  TYR A CA  
348  C C   . TYR A 23  ? 0.6597 0.6407 0.6791 0.0716  -0.0970 0.0331  26  TYR A C   
349  O O   . TYR A 23  ? 0.5299 0.5065 0.5283 0.0744  -0.1045 0.0445  26  TYR A O   
350  C CB  . TYR A 23  ? 0.4983 0.5471 0.5777 0.0821  -0.1034 0.0386  26  TYR A CB  
351  C CG  . TYR A 23  ? 0.5560 0.6437 0.6338 0.0725  -0.1265 0.0548  26  TYR A CG  
352  C CD1 . TYR A 23  ? 0.6534 0.7640 0.7433 0.0917  -0.1343 0.0830  26  TYR A CD1 
353  C CD2 . TYR A 23  ? 0.6005 0.6981 0.6594 0.0412  -0.1403 0.0449  26  TYR A CD2 
354  C CE1 . TYR A 23  ? 0.7211 0.8762 0.8093 0.0769  -0.1615 0.1045  26  TYR A CE1 
355  C CE2 . TYR A 23  ? 0.5602 0.6888 0.6043 0.0217  -0.1668 0.0604  26  TYR A CE2 
356  C CZ  . TYR A 23  ? 0.7289 0.8924 0.7901 0.0381  -0.1806 0.0920  26  TYR A CZ  
357  O OH  . TYR A 23  ? 0.7610 0.9641 0.8075 0.0131  -0.2128 0.1139  26  TYR A OH  
367  N N   . PHE A 24  ? 0.6632 0.6308 0.6776 0.0556  -0.0874 0.0198  27  PHE A N   
368  C CA  . PHE A 24  ? 0.6024 0.5428 0.5839 0.0436  -0.0796 0.0179  27  PHE A CA  
369  C C   . PHE A 24  ? 0.6887 0.5997 0.6570 0.0526  -0.0716 0.0292  27  PHE A C   
370  O O   . PHE A 24  ? 0.6109 0.5014 0.5458 0.0507  -0.0685 0.0343  27  PHE A O   
371  C CB  . PHE A 24  ? 0.6870 0.6183 0.6757 0.0321  -0.0618 0.0090  27  PHE A CB  
372  C CG  . PHE A 24  ? 0.4818 0.4295 0.4708 0.0180  -0.0662 -0.0030 27  PHE A CG  
373  C CD1 . PHE A 24  ? 0.6358 0.5959 0.6008 0.0055  -0.0857 -0.0048 27  PHE A CD1 
374  C CD2 . PHE A 24  ? 0.5310 0.4846 0.5450 0.0135  -0.0529 -0.0087 27  PHE A CD2 
375  C CE1 . PHE A 24  ? 0.7541 0.7282 0.7177 -0.0146 -0.0925 -0.0140 27  PHE A CE1 
376  C CE2 . PHE A 24  ? 0.5225 0.4870 0.5363 -0.0011 -0.0555 -0.0192 27  PHE A CE2 
377  C CZ  . PHE A 24  ? 0.8189 0.7918 0.8064 -0.0168 -0.0756 -0.0229 27  PHE A CZ  
387  N N   . LEU A 25  ? 0.5424 0.4456 0.5296 0.0589  -0.0680 0.0336  28  LEU A N   
388  C CA  . LEU A 25  ? 0.7752 0.6496 0.7514 0.0616  -0.0621 0.0464  28  LEU A CA  
389  C C   . LEU A 25  ? 0.7484 0.6145 0.7053 0.0763  -0.0696 0.0553  28  LEU A C   
390  O O   . LEU A 25  ? 0.7142 0.5598 0.6516 0.0779  -0.0648 0.0662  28  LEU A O   
391  C CB  . LEU A 25  ? 0.6977 0.5593 0.6869 0.0549  -0.0608 0.0484  28  LEU A CB  
392  C CG  . LEU A 25  ? 0.9659 0.7966 0.9445 0.0485  -0.0580 0.0635  28  LEU A CG  
393  C CD1 . LEU A 25  ? 0.6870 0.5252 0.6790 0.0386  -0.0477 0.0804  28  LEU A CD1 
394  C CD2 . LEU A 25  ? 1.0312 0.8387 1.0036 0.0338  -0.0619 0.0613  28  LEU A CD2 
406  N N   . VAL A 26  ? 0.7042 0.5889 0.6705 0.0894  -0.0787 0.0562  29  VAL A N   
407  C CA  . VAL A 26  ? 0.6092 0.4951 0.5663 0.1068  -0.0845 0.0734  29  VAL A CA  
408  C C   . VAL A 26  ? 0.6790 0.5882 0.6155 0.0984  -0.0989 0.0792  29  VAL A C   
409  O O   . VAL A 26  ? 0.8551 0.7544 0.7684 0.1038  -0.1021 0.0939  29  VAL A O   
410  C CB  . VAL A 26  ? 0.5432 0.4448 0.5249 0.1282  -0.0830 0.0820  29  VAL A CB  
411  C CG1 . VAL A 26  ? 0.7889 0.7046 0.7724 0.1497  -0.0877 0.1095  29  VAL A CG1 
412  C CG2 . VAL A 26  ? 0.6878 0.5421 0.6644 0.1323  -0.0647 0.0737  29  VAL A CG2 
422  N N   . LYS A 27  ? 0.6455 0.5802 0.5820 0.0814  -0.1080 0.0680  30  LYS A N   
423  C CA  . LYS A 27  ? 0.6761 0.6192 0.5740 0.0627  -0.1230 0.0704  30  LYS A CA  
424  C C   . LYS A 27  ? 0.8689 0.7621 0.7179 0.0550  -0.1069 0.0656  30  LYS A C   
425  O O   . LYS A 27  ? 0.8708 0.7538 0.6741 0.0472  -0.1154 0.0744  30  LYS A O   
426  C CB  . LYS A 27  ? 0.7286 0.6931 0.6268 0.0396  -0.1321 0.0561  30  LYS A CB  
427  C CG  . LYS A 27  ? 0.9163 0.9024 0.7771 0.0135  -0.1594 0.0644  30  LYS A CG  
428  C CD  . LYS A 27  ? 0.8746 0.8930 0.7490 -0.0105 -0.1738 0.0564  30  LYS A CD  
429  C CE  . LYS A 27  ? 1.0295 1.0545 0.8466 -0.0513 -0.2030 0.0617  30  LYS A CE  
430  N NZ  . LYS A 27  ? 1.1022 1.1947 0.9576 -0.0713 -0.2326 0.0759  30  LYS A NZ  
444  N N   . GLY A 28  ? 0.8419 0.6182 0.7027 0.1124  -0.1444 0.0054  31  GLY A N   
445  C CA  . GLY A 28  ? 0.8454 0.6248 0.6967 0.0977  -0.1350 0.0265  31  GLY A CA  
446  C C   . GLY A 28  ? 1.1392 0.8744 0.9476 0.0932  -0.1427 0.0485  31  GLY A C   
447  O O   . GLY A 28  ? 0.9062 0.6440 0.7015 0.0837  -0.1357 0.0646  31  GLY A O   
451  N N   . MET A 29  ? 1.2380 0.9322 1.0241 0.0992  -0.1557 0.0492  32  MET A N   
452  C CA  . MET A 29  ? 1.3501 0.9950 1.0931 0.0944  -0.1616 0.0704  32  MET A CA  
453  C C   . MET A 29  ? 1.3641 1.0028 1.0762 0.1126  -0.1668 0.0754  32  MET A C   
454  O O   . MET A 29  ? 1.2859 0.9326 0.9945 0.1393  -0.1775 0.0586  32  MET A O   
455  C CB  . MET A 29  ? 1.3337 0.9345 1.0598 0.1011  -0.1751 0.0667  32  MET A CB  
456  C CG  . MET A 29  ? 1.5372 1.1263 1.2759 0.0762  -0.1697 0.0728  32  MET A CG  
457  S SD  . MET A 29  ? 2.2251 1.7580 1.9411 0.0822  -0.1851 0.0692  32  MET A SD  
458  C CE  . MET A 29  ? 2.0087 1.4841 1.6671 0.0955  -0.1940 0.0872  32  MET A CE  
468  N N   . GLY A 30  ? 1.2514 0.8784 0.9405 0.0981  -0.1589 0.0977  33  GLY A N   
469  C CA  . GLY A 30  ? 1.4096 1.0298 1.0652 0.1130  -0.1624 0.1060  33  GLY A CA  
470  C C   . GLY A 30  ? 1.3526 1.0271 1.0297 0.1145  -0.1525 0.0997  33  GLY A C   
471  O O   . GLY A 30  ? 1.4251 1.0983 1.0746 0.1204  -0.1518 0.1105  33  GLY A O   
475  N N   . VAL A 31  ? 0.9664 0.6876 0.6909 0.1096  -0.1442 0.0825  34  VAL A N   
476  C CA  . VAL A 31  ? 1.0484 0.8201 0.7964 0.1094  -0.1332 0.0754  34  VAL A CA  
477  C C   . VAL A 31  ? 0.8343 0.6058 0.5704 0.0863  -0.1210 0.0986  34  VAL A C   
478  O O   . VAL A 31  ? 1.2215 0.9887 0.9693 0.0624  -0.1123 0.1093  34  VAL A O   
479  C CB  . VAL A 31  ? 1.0647 0.8777 0.8641 0.1056  -0.1244 0.0552  34  VAL A CB  
480  C CG1 . VAL A 31  ? 0.9883 0.8495 0.8129 0.1023  -0.1108 0.0493  34  VAL A CG1 
481  C CG2 . VAL A 31  ? 0.9308 0.7485 0.7419 0.1279  -0.1351 0.0297  34  VAL A CG2 
491  N N   . SER A 32  ? 1.0450 0.8242 0.7576 0.0938  -0.1202 0.1053  35  SER A N   
492  C CA  . SER A 32  ? 1.0543 0.8323 0.7502 0.0728  -0.1090 0.1272  35  SER A CA  
493  C C   . SER A 32  ? 0.9511 0.7851 0.6758 0.0684  -0.0961 0.1200  35  SER A C   
494  O O   . SER A 32  ? 1.1241 0.9672 0.8476 0.0470  -0.0843 0.1346  35  SER A O   
495  C CB  . SER A 32  ? 1.0725 0.8103 0.7118 0.0818  -0.1163 0.1452  35  SER A CB  
496  O OG  . SER A 32  ? 1.3187 1.0592 0.9440 0.1144  -0.1300 0.1312  35  SER A OG  
502  N N   . ASP A 33  ? 0.9694 0.8415 0.7204 0.0873  -0.0976 0.0965  36  ASP A N   
503  C CA  . ASP A 33  ? 0.9079 0.8328 0.6904 0.0835  -0.0847 0.0866  36  ASP A CA  
504  C C   . ASP A 33  ? 0.8219 0.7629 0.6399 0.0603  -0.0711 0.0898  36  ASP A C   
505  O O   . ASP A 33  ? 0.7490 0.6871 0.5921 0.0594  -0.0715 0.0805  36  ASP A O   
506  C CB  . ASP A 33  ? 0.9622 0.9217 0.7714 0.1062  -0.0879 0.0571  36  ASP A CB  
507  C CG  . ASP A 33  ? 0.9447 0.9571 0.7895 0.1024  -0.0736 0.0441  36  ASP A CG  
508  O OD1 . ASP A 33  ? 1.0017 1.0321 0.8314 0.1032  -0.0704 0.0495  36  ASP A OD1 
509  O OD2 . ASP A 33  ? 0.7197 0.7542 0.6065 0.0988  -0.0650 0.0286  36  ASP A OD2 
514  N N   . PRO A 34  ? 0.8516 0.8116 0.6723 0.0425  -0.0592 0.1020  37  PRO A N   
515  C CA  . PRO A 34  ? 0.8904 0.8656 0.7424 0.0225  -0.0477 0.1054  37  PRO A CA  
516  C C   . PRO A 34  ? 0.7646 0.7724 0.6631 0.0301  -0.0414 0.0845  37  PRO A C   
517  O O   . PRO A 34  ? 0.7054 0.7112 0.6254 0.0215  -0.0376 0.0847  37  PRO A O   
518  C CB  . PRO A 34  ? 0.7297 0.7273 0.5761 0.0064  -0.0366 0.1181  37  PRO A CB  
519  C CG  . PRO A 34  ? 0.8248 0.8263 0.6433 0.0191  -0.0403 0.1183  37  PRO A CG  
520  C CD  . PRO A 34  ? 0.6874 0.6589 0.4830 0.0410  -0.0556 0.1119  37  PRO A CD  
528  N N   . ASP A 35  ? 0.7273 0.7648 0.6410 0.0458  -0.0393 0.0660  38  ASP A N   
529  C CA  . ASP A 35  ? 0.6507 0.7148 0.6075 0.0522  -0.0312 0.0451  38  ASP A CA  
530  C C   . ASP A 35  ? 0.6203 0.6612 0.5831 0.0597  -0.0387 0.0358  38  ASP A C   
531  O O   . ASP A 35  ? 0.7105 0.7544 0.7000 0.0541  -0.0317 0.0321  38  ASP A O   
532  C CB  . ASP A 35  ? 0.9156 1.0147 0.8859 0.0670  -0.0276 0.0244  38  ASP A CB  
533  C CG  . ASP A 35  ? 0.7621 0.8934 0.7387 0.0588  -0.0166 0.0291  38  ASP A CG  
534  O OD1 . ASP A 35  ? 0.9339 1.0702 0.9212 0.0425  -0.0077 0.0419  38  ASP A OD1 
535  O OD2 . ASP A 35  ? 0.9114 1.0659 0.8826 0.0694  -0.0172 0.0188  38  ASP A OD2 
540  N N   . ALA A 36  ? 0.6012 0.6191 0.5379 0.0735  -0.0532 0.0318  39  ALA A N   
541  C CA  . ALA A 36  ? 0.5838 0.5806 0.5247 0.0810  -0.0613 0.0218  39  ALA A CA  
542  C C   . ALA A 36  ? 0.5686 0.5368 0.5045 0.0649  -0.0622 0.0389  39  ALA A C   
543  O O   . ALA A 36  ? 0.6423 0.6054 0.5964 0.0652  -0.0620 0.0306  39  ALA A O   
544  C CB  . ALA A 36  ? 0.6695 0.6465 0.5796 0.1004  -0.0781 0.0156  39  ALA A CB  
550  N N   . LYS A 37  ? 0.5840 0.5353 0.4956 0.0501  -0.0625 0.0617  40  LYS A N   
551  C CA  . LYS A 37  ? 0.7299 0.6594 0.6392 0.0331  -0.0623 0.0759  40  LYS A CA  
552  C C   . LYS A 37  ? 0.6402 0.5969 0.5876 0.0245  -0.0498 0.0718  40  LYS A C   
553  O O   . LYS A 37  ? 0.6240 0.5693 0.5799 0.0193  -0.0510 0.0725  40  LYS A O   
554  C CB  . LYS A 37  ? 0.6783 0.5913 0.5584 0.0160  -0.0615 0.0985  40  LYS A CB  
555  C CG  . LYS A 37  ? 0.6790 0.5582 0.5153 0.0241  -0.0727 0.1067  40  LYS A CG  
556  C CD  . LYS A 37  ? 0.9840 0.8215 0.7891 0.0065  -0.0757 0.1271  40  LYS A CD  
557  C CE  . LYS A 37  ? 1.1088 0.9510 0.8949 -0.0105 -0.0666 0.1446  40  LYS A CE  
558  N NZ  . LYS A 37  ? 1.1494 0.9441 0.8980 -0.0264 -0.0691 0.1635  40  LYS A NZ  
572  N N   A LYS A 38  ? 0.6154 0.6076 0.5849 0.0243  -0.0377 0.0673  41  LYS A N   
573  N N   B LYS A 38  ? 0.6164 0.6086 0.5858 0.0241  -0.0377 0.0674  41  LYS A N   
574  C CA  A LYS A 38  ? 0.5524 0.5680 0.5558 0.0190  -0.0252 0.0643  41  LYS A CA  
575  C CA  B LYS A 38  ? 0.5506 0.5662 0.5541 0.0190  -0.0253 0.0643  41  LYS A CA  
576  C C   A LYS A 38  ? 0.5344 0.5475 0.5586 0.0298  -0.0246 0.0477  41  LYS A C   
577  C C   B LYS A 38  ? 0.5338 0.5464 0.5576 0.0298  -0.0248 0.0478  41  LYS A C   
578  O O   A LYS A 38  ? 0.5595 0.5700 0.5970 0.0246  -0.0209 0.0505  41  LYS A O   
579  O O   B LYS A 38  ? 0.5622 0.5715 0.5987 0.0246  -0.0215 0.0507  41  LYS A O   
580  C CB  A LYS A 38  ? 0.5780 0.6299 0.6007 0.0196  -0.0126 0.0602  41  LYS A CB  
581  C CB  B LYS A 38  ? 0.5769 0.6289 0.6001 0.0198  -0.0126 0.0598  41  LYS A CB  
582  C CG  A LYS A 38  ? 0.6013 0.6668 0.6194 0.0035  -0.0069 0.0770  41  LYS A CG  
583  C CG  B LYS A 38  ? 0.6728 0.7336 0.6777 0.0090  -0.0113 0.0741  41  LYS A CG  
584  C CD  A LYS A 38  ? 0.6981 0.7894 0.7148 0.0052  -0.0014 0.0747  41  LYS A CD  
585  C CD  B LYS A 38  ? 0.7367 0.8370 0.7664 0.0094  0.0021  0.0681  41  LYS A CD  
586  C CE  A LYS A 38  ? 0.6784 0.8044 0.7315 0.0122  0.0121  0.0605  41  LYS A CE  
587  C CE  B LYS A 38  ? 0.7831 0.8957 0.7928 0.0052  0.0022  0.0746  41  LYS A CE  
588  N NZ  A LYS A 38  ? 0.7219 0.8574 0.7994 0.0068  0.0210  0.0645  41  LYS A NZ  
589  N NZ  B LYS A 38  ? 0.6757 0.7738 0.6595 -0.0131 -0.0006 0.0954  41  LYS A NZ  
616  N N   . PHE A 39  ? 0.4495 0.4652 0.4761 0.0448  -0.0279 0.0294  42  PHE A N   
617  C CA  . PHE A 39  ? 0.6252 0.6421 0.6733 0.0536  -0.0250 0.0109  42  PHE A CA  
618  C C   . PHE A 39  ? 0.6760 0.6631 0.7096 0.0542  -0.0371 0.0123  42  PHE A C   
619  O O   . PHE A 39  ? 0.5066 0.4925 0.5573 0.0543  -0.0328 0.0051  42  PHE A O   
620  C CB  . PHE A 39  ? 0.6027 0.6369 0.6599 0.0686  -0.0244 -0.0125 42  PHE A CB  
621  C CG  . PHE A 39  ? 0.5401 0.6066 0.6201 0.0684  -0.0096 -0.0197 42  PHE A CG  
622  C CD1 . PHE A 39  ? 0.5742 0.6545 0.6864 0.0656  0.0069  -0.0271 42  PHE A CD1 
623  C CD2 . PHE A 39  ? 0.5825 0.6643 0.6506 0.0716  -0.0118 -0.0188 42  PHE A CD2 
624  C CE1 . PHE A 39  ? 0.6066 0.7140 0.7403 0.0659  0.0209  -0.0347 42  PHE A CE1 
625  C CE2 . PHE A 39  ? 0.4815 0.5947 0.5720 0.0715  0.0017  -0.0272 42  PHE A CE2 
626  C CZ  . PHE A 39  ? 0.5490 0.6744 0.6732 0.0686  0.0180  -0.0357 42  PHE A CZ  
636  N N   . TYR A 40  ? 0.4738 0.4355 0.4753 0.0547  -0.0517 0.0216  43  TYR A N   
637  C CA  . TYR A 40  ? 0.4872 0.4189 0.4746 0.0548  -0.0634 0.0230  43  TYR A CA  
638  C C   . TYR A 40  ? 0.5847 0.5107 0.5774 0.0385  -0.0592 0.0376  43  TYR A C   
639  O O   . TYR A 40  ? 0.6684 0.5859 0.6685 0.0386  -0.0614 0.0324  43  TYR A O   
640  C CB  . TYR A 40  ? 0.5830 0.4844 0.5326 0.0595  -0.0789 0.0309  43  TYR A CB  
641  C CG  . TYR A 40  ? 0.5637 0.4614 0.5053 0.0809  -0.0897 0.0119  43  TYR A CG  
642  C CD1 . TYR A 40  ? 0.5020 0.3834 0.4430 0.0898  -0.0995 -0.0008 43  TYR A CD1 
643  C CD2 . TYR A 40  ? 0.5994 0.5135 0.5343 0.0929  -0.0905 0.0051  43  TYR A CD2 
644  C CE1 . TYR A 40  ? 0.7285 0.6107 0.6633 0.1108  -0.1101 -0.0204 43  TYR A CE1 
645  C CE2 . TYR A 40  ? 0.5461 0.4618 0.4741 0.1143  -0.1013 -0.0143 43  TYR A CE2 
646  C CZ  . TYR A 40  ? 0.7778 0.6779 0.7061 0.1234  -0.1112 -0.0272 43  TYR A CZ  
647  O OH  . TYR A 40  ? 0.9308 0.8365 0.8532 0.1460  -0.1226 -0.0486 43  TYR A OH  
657  N N   . ALA A 41  ? 0.5030 0.4371 0.4925 0.0248  -0.0531 0.0545  44  ALA A N   
658  C CA  . ALA A 41  ? 0.5223 0.4564 0.5168 0.0099  -0.0498 0.0669  44  ALA A CA  
659  C C   . ALA A 41  ? 0.5539 0.5104 0.5791 0.0123  -0.0383 0.0602  44  ALA A C   
660  O O   . ALA A 41  ? 0.6613 0.6123 0.6911 0.0087  -0.0395 0.0614  44  ALA A O   
661  C CB  . ALA A 41  ? 0.5236 0.4668 0.5093 -0.0050 -0.0451 0.0836  44  ALA A CB  
667  N N   . ILE A 42  ? 0.5428 0.5238 0.5882 0.0187  -0.0265 0.0531  45  ILE A N   
668  C CA  . ILE A 42  ? 0.4661 0.4632 0.5383 0.0219  -0.0137 0.0477  45  ILE A CA  
669  C C   . ILE A 42  ? 0.5713 0.5560 0.6491 0.0302  -0.0159 0.0328  45  ILE A C   
670  O O   . ILE A 42  ? 0.5622 0.5465 0.6493 0.0289  -0.0113 0.0340  45  ILE A O   
671  C CB  . ILE A 42  ? 0.4452 0.4670 0.5375 0.0272  0.0003  0.0413  45  ILE A CB  
672  C CG1 . ILE A 42  ? 0.4408 0.4796 0.5305 0.0185  0.0038  0.0555  45  ILE A CG1 
673  C CG2 . ILE A 42  ? 0.3685 0.3990 0.4858 0.0319  0.0148  0.0351  45  ILE A CG2 
674  C CD1 . ILE A 42  ? 0.4525 0.5142 0.5571 0.0241  0.0143  0.0472  45  ILE A CD1 
686  N N   . THR A 43  ? 0.4532 0.4298 0.5246 0.0396  -0.0231 0.0179  46  THR A N   
687  C CA  . THR A 43  ? 0.4459 0.4172 0.5265 0.0480  -0.0236 -0.0006 46  THR A CA  
688  C C   . THR A 43  ? 0.5606 0.5091 0.6257 0.0459  -0.0367 0.0019  46  THR A C   
689  O O   . THR A 43  ? 0.5247 0.4715 0.5997 0.0489  -0.0345 -0.0092 46  THR A O   
690  C CB  . THR A 43  ? 0.4162 0.3929 0.4975 0.0602  -0.0271 -0.0207 46  THR A CB  
691  O OG1 . THR A 43  ? 0.4681 0.4677 0.5641 0.0615  -0.0150 -0.0241 46  THR A OG1 
692  C CG2 . THR A 43  ? 0.6209 0.5991 0.7169 0.0677  -0.0245 -0.0433 46  THR A CG2 
700  N N   . THR A 44  ? 0.4901 0.4206 0.5311 0.0399  -0.0494 0.0154  47  THR A N   
701  C CA  . THR A 44  ? 0.5693 0.4772 0.5965 0.0369  -0.0613 0.0171  47  THR A CA  
702  C C   . THR A 44  ? 0.5758 0.4900 0.6109 0.0255  -0.0556 0.0286  47  THR A C   
703  O O   . THR A 44  ? 0.5143 0.4191 0.5480 0.0246  -0.0610 0.0247  47  THR A O   
704  C CB  . THR A 44  ? 0.6945 0.5760 0.6916 0.0343  -0.0757 0.0265  47  THR A CB  
705  O OG1 . THR A 44  ? 0.5997 0.4765 0.5867 0.0483  -0.0821 0.0160  47  THR A OG1 
706  C CG2 . THR A 44  ? 0.6322 0.4878 0.6160 0.0317  -0.0879 0.0259  47  THR A CG2 
714  N N   . LEU A 45  ? 0.5222 0.4549 0.5656 0.0178  -0.0453 0.0417  48  LEU A N   
715  C CA  . LEU A 45  ? 0.5898 0.5335 0.6406 0.0096  -0.0403 0.0519  48  LEU A CA  
716  C C   . LEU A 45  ? 0.4320 0.3862 0.5015 0.0169  -0.0299 0.0438  48  LEU A C   
717  O O   . LEU A 45  ? 0.5798 0.5379 0.6511 0.0135  -0.0293 0.0486  48  LEU A O   
718  C CB  . LEU A 45  ? 0.5757 0.5400 0.6313 0.0019  -0.0321 0.0662  48  LEU A CB  
719  C CG  . LEU A 45  ? 0.7128 0.6716 0.7507 -0.0121 -0.0395 0.0788  48  LEU A CG  
720  C CD1 . LEU A 45  ? 0.6026 0.5878 0.6493 -0.0172 -0.0295 0.0884  48  LEU A CD1 
721  C CD2 . LEU A 45  ? 0.6540 0.6068 0.6853 -0.0222 -0.0464 0.0833  48  LEU A CD2 
733  N N   . VAL A 46  ? 0.4454 0.4047 0.5281 0.0263  -0.0209 0.0311  49  VAL A N   
734  C CA  . VAL A 46  ? 0.4326 0.3995 0.5326 0.0316  -0.0072 0.0241  49  VAL A CA  
735  C C   . VAL A 46  ? 0.4505 0.4059 0.5458 0.0326  -0.0141 0.0153  49  VAL A C   
736  O O   . VAL A 46  ? 0.4552 0.4150 0.5534 0.0310  -0.0089 0.0212  49  VAL A O   
737  C CB  . VAL A 46  ? 0.3562 0.3300 0.4720 0.0392  0.0046  0.0091  49  VAL A CB  
738  C CG1 . VAL A 46  ? 0.3589 0.3333 0.4895 0.0430  0.0185  -0.0020 49  VAL A CG1 
739  C CG2 . VAL A 46  ? 0.3747 0.3636 0.4993 0.0383  0.0150  0.0182  49  VAL A CG2 
749  N N   . PRO A 47  ? 0.4883 0.4303 0.5757 0.0366  -0.0260 0.0008  50  PRO A N   
750  C CA  . PRO A 47  ? 0.4492 0.3820 0.5328 0.0377  -0.0331 -0.0089 50  PRO A CA  
751  C C   . PRO A 47  ? 0.4750 0.3993 0.5439 0.0296  -0.0451 0.0032  50  PRO A C   
752  O O   . PRO A 47  ? 0.5117 0.4353 0.5808 0.0289  -0.0471 -0.0012 50  PRO A O   
753  C CB  . PRO A 47  ? 0.5336 0.4563 0.6123 0.0463  -0.0438 -0.0283 50  PRO A CB  
754  C CG  . PRO A 47  ? 0.5184 0.4380 0.5878 0.0473  -0.0489 -0.0217 50  PRO A CG  
755  C CD  . PRO A 47  ? 0.4357 0.3724 0.5173 0.0425  -0.0333 -0.0090 50  PRO A CD  
763  N N   . ALA A 48  ? 0.4421 0.3612 0.4988 0.0225  -0.0522 0.0169  51  ALA A N   
764  C CA  . ALA A 48  ? 0.4609 0.3732 0.5057 0.0125  -0.0619 0.0263  51  ALA A CA  
765  C C   . ALA A 48  ? 0.4976 0.4315 0.5520 0.0081  -0.0527 0.0362  51  ALA A C   
766  O O   . ALA A 48  ? 0.5142 0.4489 0.5653 0.0042  -0.0581 0.0355  51  ALA A O   
767  C CB  . ALA A 48  ? 0.5558 0.4573 0.5853 0.0038  -0.0690 0.0379  51  ALA A CB  
773  N N   . ILE A 49  ? 0.4371 0.3895 0.5028 0.0099  -0.0391 0.0449  52  ILE A N   
774  C CA  . ILE A 49  ? 0.4916 0.4646 0.5651 0.0100  -0.0299 0.0545  52  ILE A CA  
775  C C   . ILE A 49  ? 0.5869 0.5594 0.6658 0.0173  -0.0240 0.0456  52  ILE A C   
776  O O   . ILE A 49  ? 0.4646 0.4453 0.5406 0.0160  -0.0258 0.0486  52  ILE A O   
777  C CB  . ILE A 49  ? 0.4812 0.4709 0.5654 0.0133  -0.0164 0.0645  52  ILE A CB  
778  C CG1 . ILE A 49  ? 0.5807 0.5765 0.6591 0.0040  -0.0218 0.0741  52  ILE A CG1 
779  C CG2 . ILE A 49  ? 0.4481 0.4561 0.5390 0.0185  -0.0057 0.0736  52  ILE A CG2 
780  C CD1 . ILE A 49  ? 0.5933 0.6034 0.6821 0.0076  -0.0103 0.0799  52  ILE A CD1 
792  N N   . ALA A 50  ? 0.4407 0.4056 0.5274 0.0244  -0.0162 0.0333  53  ALA A N   
793  C CA  . ALA A 50  ? 0.5871 0.5516 0.6793 0.0295  -0.0079 0.0237  53  ALA A CA  
794  C C   . ALA A 50  ? 0.4276 0.3849 0.5109 0.0271  -0.0215 0.0139  53  ALA A C   
795  O O   . ALA A 50  ? 0.5002 0.4629 0.5843 0.0289  -0.0165 0.0112  53  ALA A O   
796  C CB  . ALA A 50  ? 0.5316 0.4907 0.6353 0.0351  0.0027  0.0083  53  ALA A CB  
802  N N   . PHE A 51  ? 0.4201 0.3642 0.4938 0.0236  -0.0382 0.0086  54  PHE A N   
803  C CA  . PHE A 51  ? 0.4668 0.4021 0.5323 0.0218  -0.0518 -0.0016 54  PHE A CA  
804  C C   . PHE A 51  ? 0.4840 0.4318 0.5452 0.0155  -0.0543 0.0086  54  PHE A C   
805  O O   . PHE A 51  ? 0.4796 0.4316 0.5402 0.0165  -0.0562 0.0007  54  PHE A O   
806  C CB  . PHE A 51  ? 0.4249 0.3386 0.4781 0.0201  -0.0686 -0.0066 54  PHE A CB  
807  C CG  . PHE A 51  ? 0.5287 0.4308 0.5717 0.0162  -0.0835 -0.0131 54  PHE A CG  
808  C CD1 . PHE A 51  ? 0.6113 0.5084 0.6557 0.0226  -0.0888 -0.0319 54  PHE A CD1 
809  C CD2 . PHE A 51  ? 0.5677 0.4651 0.6007 0.0053  -0.0915 -0.0021 54  PHE A CD2 
810  C CE1 . PHE A 51  ? 0.7618 0.6480 0.7976 0.0195  -0.1025 -0.0391 54  PHE A CE1 
811  C CE2 . PHE A 51  ? 0.7830 0.6685 0.8077 0.0008  -0.1043 -0.0096 54  PHE A CE2 
812  C CZ  . PHE A 51  ? 0.6019 0.4810 0.6278 0.0085  -0.1102 -0.0279 54  PHE A CZ  
822  N N   . THR A 52  ? 0.4550 0.4124 0.5138 0.0091  -0.0543 0.0246  55  THR A N   
823  C CA  . THR A 52  ? 0.5527 0.5271 0.6084 0.0033  -0.0576 0.0321  55  THR A CA  
824  C C   . THR A 52  ? 0.4732 0.4683 0.5345 0.0109  -0.0446 0.0374  55  THR A C   
825  O O   . THR A 52  ? 0.4595 0.4688 0.5175 0.0098  -0.0480 0.0373  55  THR A O   
826  C CB  . THR A 52  ? 0.5722 0.5561 0.6255 -0.0058 -0.0599 0.0456  55  THR A CB  
827  O OG1 . THR A 52  ? 0.5774 0.5754 0.6388 -0.0003 -0.0466 0.0570  55  THR A OG1 
828  C CG2 . THR A 52  ? 0.6090 0.5684 0.6531 -0.0138 -0.0707 0.0428  55  THR A CG2 
836  N N   . MET A 53  ? 0.4123 0.4086 0.4810 0.0188  -0.0292 0.0418  56  MET A N   
837  C CA  . MET A 53  ? 0.4584 0.4685 0.5291 0.0269  -0.0150 0.0491  56  MET A CA  
838  C C   . MET A 53  ? 0.5479 0.5503 0.6184 0.0305  -0.0103 0.0357  56  MET A C   
839  O O   . MET A 53  ? 0.4804 0.4943 0.5460 0.0342  -0.0053 0.0393  56  MET A O   
840  C CB  . MET A 53  ? 0.4725 0.4839 0.5507 0.0335  0.0013  0.0598  56  MET A CB  
841  C CG  . MET A 53  ? 0.5719 0.5973 0.6512 0.0310  -0.0016 0.0734  56  MET A CG  
842  S SD  . MET A 53  ? 0.6252 0.6816 0.6994 0.0358  -0.0011 0.0894  56  MET A SD  
843  C CE  . MET A 53  ? 0.6426 0.7070 0.7087 0.0247  -0.0205 0.0806  56  MET A CE  
853  N N   . TYR A 54  ? 0.4318 0.4173 0.5069 0.0299  -0.0118 0.0193  57  TYR A N   
854  C CA  . TYR A 54  ? 0.3822 0.3638 0.4579 0.0317  -0.0096 0.0030  57  TYR A CA  
855  C C   . TYR A 54  ? 0.4333 0.4210 0.5008 0.0279  -0.0249 -0.0028 57  TYR A C   
856  O O   . TYR A 54  ? 0.4332 0.4291 0.4982 0.0297  -0.0205 -0.0080 57  TYR A O   
857  C CB  . TYR A 54  ? 0.4485 0.4156 0.5316 0.0327  -0.0112 -0.0164 57  TYR A CB  
858  C CG  . TYR A 54  ? 0.4718 0.4373 0.5658 0.0363  0.0097  -0.0214 57  TYR A CG  
859  C CD1 . TYR A 54  ? 0.5344 0.4975 0.6357 0.0380  0.0198  -0.0137 57  TYR A CD1 
860  C CD2 . TYR A 54  ? 0.4731 0.4400 0.5705 0.0370  0.0207  -0.0348 57  TYR A CD2 
861  C CE1 . TYR A 54  ? 0.3855 0.3458 0.4981 0.0400  0.0403  -0.0201 57  TYR A CE1 
862  C CE2 . TYR A 54  ? 0.4317 0.3956 0.5395 0.0380  0.0421  -0.0407 57  TYR A CE2 
863  C CZ  . TYR A 54  ? 0.4810 0.4406 0.5967 0.0394  0.0519  -0.0335 57  TYR A CZ  
864  O OH  . TYR A 54  ? 0.5085 0.4637 0.6359 0.0392  0.0744  -0.0411 57  TYR A OH  
874  N N   . LEU A 55  ? 0.4770 0.4603 0.5397 0.0219  -0.0419 -0.0023 58  LEU A N   
875  C CA  . LEU A 55  ? 0.4232 0.4118 0.4792 0.0170  -0.0561 -0.0086 58  LEU A CA  
876  C C   . LEU A 55  ? 0.4435 0.4579 0.4960 0.0175  -0.0512 0.0037  58  LEU A C   
877  O O   . LEU A 55  ? 0.5156 0.5411 0.5645 0.0171  -0.0558 -0.0039 58  LEU A O   
878  C CB  . LEU A 55  ? 0.4836 0.4585 0.5344 0.0089  -0.0724 -0.0089 58  LEU A CB  
879  C CG  . LEU A 55  ? 0.6067 0.5830 0.6516 0.0021  -0.0872 -0.0174 58  LEU A CG  
880  C CD1 . LEU A 55  ? 0.5890 0.5566 0.6342 0.0066  -0.0929 -0.0383 58  LEU A CD1 
881  C CD2 . LEU A 55  ? 0.5031 0.4618 0.5415 -0.0078 -0.0996 -0.0149 58  LEU A CD2 
893  N N   . SER A 56  ? 0.4445 0.4709 0.4979 0.0197  -0.0424 0.0219  59  SER A N   
894  C CA  . SER A 56  ? 0.4607 0.5144 0.5094 0.0233  -0.0386 0.0339  59  SER A CA  
895  C C   . SER A 56  ? 0.4083 0.4669 0.4534 0.0329  -0.0240 0.0352  59  SER A C   
896  O O   . SER A 56  ? 0.4699 0.5490 0.5076 0.0362  -0.0247 0.0377  59  SER A O   
897  C CB  . SER A 56  ? 0.5499 0.6161 0.6005 0.0253  -0.0335 0.0519  59  SER A CB  
898  O OG  . SER A 56  ? 0.6484 0.7079 0.7019 0.0349  -0.0159 0.0614  59  SER A OG  
904  N N   . MET A 57  ? 0.4434 0.4841 0.4931 0.0369  -0.0100 0.0329  60  MET A N   
905  C CA  . MET A 57  ? 0.3876 0.4278 0.4333 0.0431  0.0058  0.0317  60  MET A CA  
906  C C   . MET A 57  ? 0.3878 0.4298 0.4315 0.0391  -0.0023 0.0123  60  MET A C   
907  O O   . MET A 57  ? 0.4463 0.5014 0.4814 0.0426  0.0033  0.0135  60  MET A O   
908  C CB  . MET A 57  ? 0.3706 0.3906 0.4244 0.0453  0.0234  0.0300  60  MET A CB  
909  C CG  . MET A 57  ? 0.4352 0.4529 0.4924 0.0499  0.0323  0.0474  60  MET A CG  
910  S SD  . MET A 57  ? 0.5958 0.5943 0.6586 0.0552  0.0606  0.0502  60  MET A SD  
911  C CE  . MET A 57  ? 0.6383 0.6219 0.7177 0.0476  0.0558  0.0280  60  MET A CE  
921  N N   . LEU A 58  ? 0.4632 0.4923 0.5136 0.0330  -0.0155 -0.0058 61  LEU A N   
922  C CA  . LEU A 58  ? 0.5223 0.5528 0.5723 0.0304  -0.0244 -0.0266 61  LEU A CA  
923  C C   . LEU A 58  ? 0.5166 0.5681 0.5586 0.0285  -0.0358 -0.0253 61  LEU A C   
924  O O   . LEU A 58  ? 0.3915 0.4547 0.4296 0.0295  -0.0347 -0.0351 61  LEU A O   
925  C CB  . LEU A 58  ? 0.4215 0.4332 0.4780 0.0269  -0.0391 -0.0442 61  LEU A CB  
926  C CG  . LEU A 58  ? 0.4668 0.4781 0.5236 0.0257  -0.0515 -0.0678 61  LEU A CG  
927  C CD1 . LEU A 58  ? 0.5203 0.5369 0.5812 0.0287  -0.0371 -0.0812 61  LEU A CD1 
928  C CD2 . LEU A 58  ? 0.5783 0.5682 0.6376 0.0250  -0.0682 -0.0811 61  LEU A CD2 
940  N N   . LEU A 59  ? 0.3933 0.4522 0.4335 0.0250  -0.0464 -0.0151 62  LEU A N   
941  C CA  . LEU A 59  ? 0.3740 0.4564 0.4090 0.0220  -0.0577 -0.0163 62  LEU A CA  
942  C C   . LEU A 59  ? 0.4518 0.5621 0.4783 0.0299  -0.0472 0.0002  62  LEU A C   
943  O O   . LEU A 59  ? 0.5674 0.7035 0.5893 0.0291  -0.0554 -0.0019 62  LEU A O   
944  C CB  . LEU A 59  ? 0.3804 0.4601 0.4179 0.0129  -0.0724 -0.0147 62  LEU A CB  
945  C CG  . LEU A 59  ? 0.4937 0.5426 0.5349 0.0062  -0.0844 -0.0287 62  LEU A CG  
946  C CD1 . LEU A 59  ? 0.5266 0.5702 0.5674 -0.0038 -0.0945 -0.0227 62  LEU A CD1 
947  C CD2 . LEU A 59  ? 0.5638 0.6083 0.6047 0.0048  -0.0950 -0.0510 62  LEU A CD2 
959  N N   . GLY A 60  ? 0.6600 0.5472 0.5017 -0.0232 0.0218  -0.1013 63  GLY A N   
960  C CA  . GLY A 60  ? 0.6968 0.6081 0.5356 -0.0341 0.0223  -0.0943 63  GLY A CA  
961  C C   . GLY A 60  ? 0.7220 0.6429 0.5610 -0.0475 0.0123  -0.0835 63  GLY A C   
962  O O   . GLY A 60  ? 0.6662 0.6072 0.5012 -0.0536 0.0100  -0.0772 63  GLY A O   
966  N N   . TYR A 61  ? 0.6068 0.5150 0.4491 -0.0521 0.0062  -0.0816 64  TYR A N   
967  C CA  . TYR A 61  ? 0.5836 0.5084 0.4294 -0.0659 -0.0022 -0.0740 64  TYR A CA  
968  C C   . TYR A 61  ? 0.5981 0.5522 0.4688 -0.0595 -0.0037 -0.0607 64  TYR A C   
969  O O   . TYR A 61  ? 0.6567 0.6351 0.5302 -0.0654 -0.0102 -0.0549 64  TYR A O   
970  C CB  . TYR A 61  ? 0.6715 0.5733 0.5110 -0.0757 -0.0060 -0.0765 64  TYR A CB  
971  C CG  . TYR A 61  ? 0.6459 0.5701 0.4894 -0.0933 -0.0132 -0.0725 64  TYR A CG  
972  C CD1 . TYR A 61  ? 0.7172 0.6447 0.5419 -0.1118 -0.0174 -0.0803 64  TYR A CD1 
973  C CD2 . TYR A 61  ? 0.6618 0.6078 0.5289 -0.0916 -0.0155 -0.0629 64  TYR A CD2 
974  C CE1 . TYR A 61  ? 0.7714 0.7279 0.6031 -0.1284 -0.0239 -0.0792 64  TYR A CE1 
975  C CE2 . TYR A 61  ? 0.7390 0.7124 0.6128 -0.1066 -0.0215 -0.0617 64  TYR A CE2 
976  C CZ  . TYR A 61  ? 0.7018 0.6827 0.5591 -0.1251 -0.0257 -0.0702 64  TYR A CZ  
977  O OH  . TYR A 61  ? 0.8754 0.8919 0.7425 -0.1406 -0.0316 -0.0715 64  TYR A OH  
987  N N   . GLY A 62  ? 0.5811 0.5336 0.4690 -0.0465 0.0016  -0.0569 65  GLY A N   
988  C CA  . GLY A 62  ? 0.5855 0.5591 0.4948 -0.0411 0.0008  -0.0454 65  GLY A CA  
989  C C   . GLY A 62  ? 0.5719 0.5572 0.4814 -0.0349 0.0061  -0.0405 65  GLY A C   
990  O O   . GLY A 62  ? 0.5361 0.5279 0.4608 -0.0278 0.0098  -0.0339 65  GLY A O   
994  N N   . LEU A 63  ? 0.6065 0.5918 0.4956 -0.0391 0.0069  -0.0438 66  LEU A N   
995  C CA  . LEU A 63  ? 0.5783 0.5685 0.4585 -0.0361 0.0128  -0.0391 66  LEU A CA  
996  C C   . LEU A 63  ? 0.7599 0.7599 0.6220 -0.0405 0.0040  -0.0330 66  LEU A C   
997  O O   . LEU A 63  ? 0.6636 0.6669 0.5151 -0.0482 -0.0035 -0.0386 66  LEU A O   
998  C CB  . LEU A 63  ? 0.7098 0.6905 0.5783 -0.0358 0.0241  -0.0505 66  LEU A CB  
999  C CG  . LEU A 63  ? 0.6595 0.6429 0.5104 -0.0380 0.0325  -0.0478 66  LEU A CG  
1000 C CD1 . LEU A 63  ? 0.8182 0.8054 0.6810 -0.0347 0.0387  -0.0383 66  LEU A CD1 
1001 C CD2 . LEU A 63  ? 0.6860 0.6649 0.5263 -0.0390 0.0440  -0.0628 66  LEU A CD2 
1013 N N   . THR A 64  ? 0.7039 0.7070 0.5600 -0.0356 0.0044  -0.0220 67  THR A N   
1014 C CA  . THR A 64  ? 0.6989 0.7089 0.5332 -0.0356 -0.0052 -0.0153 67  THR A CA  
1015 C C   . THR A 64  ? 0.6134 0.6096 0.4264 -0.0326 0.0021  -0.0066 67  THR A C   
1016 O O   . THR A 64  ? 0.7389 0.7253 0.5599 -0.0314 0.0137  -0.0047 67  THR A O   
1017 C CB  . THR A 64  ? 0.6241 0.6533 0.4725 -0.0300 -0.0193 -0.0085 67  THR A CB  
1018 O OG1 . THR A 64  ? 0.8436 0.8874 0.6736 -0.0313 -0.0319 -0.0083 67  THR A OG1 
1019 C CG2 . THR A 64  ? 0.5789 0.6036 0.4339 -0.0182 -0.0187 0.0040  67  THR A CG2 
1027 N N   . MET A 65  ? 0.6665 0.6615 0.4495 -0.0328 -0.0048 -0.0017 68  MET A N   
1028 C CA  . MET A 65  ? 0.6532 0.6285 0.4050 -0.0321 0.0014  0.0078  68  MET A CA  
1029 C C   . MET A 65  ? 0.8036 0.7753 0.5463 -0.0192 -0.0114 0.0231  68  MET A C   
1030 O O   . MET A 65  ? 0.8178 0.8076 0.5599 -0.0122 -0.0283 0.0246  68  MET A O   
1031 C CB  . MET A 65  ? 0.9506 0.9214 0.6672 -0.0404 0.0026  0.0029  68  MET A CB  
1032 C CG  . MET A 65  ? 0.9806 0.9539 0.7036 -0.0506 0.0146  -0.0144 68  MET A CG  
1033 S SD  . MET A 65  ? 0.9781 0.9432 0.7148 -0.0548 0.0379  -0.0216 68  MET A SD  
1034 C CE  . MET A 65  ? 1.0192 0.9641 0.7272 -0.0569 0.0452  -0.0053 68  MET A CE  
1044 N N   . VAL A 66  ? 0.7024 0.6517 0.4376 -0.0158 -0.0034 0.0330  69  VAL A N   
1045 C CA  . VAL A 66  ? 0.7130 0.6503 0.4369 -0.0008 -0.0143 0.0473  69  VAL A CA  
1046 C C   . VAL A 66  ? 0.8022 0.7022 0.4758 -0.0025 -0.0093 0.0590  69  VAL A C   
1047 O O   . VAL A 66  ? 0.8545 0.7323 0.5179 -0.0146 0.0090  0.0592  69  VAL A O   
1048 C CB  . VAL A 66  ? 0.8324 0.7678 0.5871 0.0046  -0.0098 0.0494  69  VAL A CB  
1049 C CG1 . VAL A 66  ? 0.8515 0.7683 0.5896 0.0219  -0.0202 0.0635  69  VAL A CG1 
1050 C CG2 . VAL A 66  ? 0.6339 0.6026 0.4324 0.0053  -0.0150 0.0391  69  VAL A CG2 
1060 N N   . PRO A 67  ? 0.9410 0.8332 0.5800 0.0083  -0.0247 0.0682  70  PRO A N   
1061 C CA  . PRO A 67  ? 0.9836 0.8312 0.5667 0.0075  -0.0207 0.0819  70  PRO A CA  
1062 C C   . PRO A 67  ? 0.9220 0.7343 0.4965 0.0158  -0.0171 0.0941  70  PRO A C   
1063 O O   . PRO A 67  ? 1.1776 0.9950 0.7660 0.0362  -0.0319 0.0992  70  PRO A O   
1064 C CB  . PRO A 67  ? 0.9763 0.8292 0.5286 0.0223  -0.0432 0.0882  70  PRO A CB  
1065 C CG  . PRO A 67  ? 1.1097 1.0140 0.7011 0.0237  -0.0549 0.0745  70  PRO A CG  
1066 C CD  . PRO A 67  ? 0.9418 0.8676 0.5862 0.0155  -0.0439 0.0630  70  PRO A CD  
1074 N N   . PHE A 68  ? 1.0009 0.7782 0.5516 -0.0011 0.0033  0.0972  71  PHE A N   
1075 C CA  . PHE A 68  ? 1.0001 0.7296 0.5233 0.0028  0.0078  0.1105  71  PHE A CA  
1076 C C   . PHE A 68  ? 1.2633 0.9581 0.7502 -0.0236 0.0321  0.1116  71  PHE A C   
1077 O O   . PHE A 68  ? 1.3891 1.1093 0.8983 -0.0436 0.0489  0.0975  71  PHE A O   
1078 C CB  . PHE A 68  ? 1.1649 0.9069 0.7350 0.0103  0.0086  0.1067  71  PHE A CB  
1079 C CG  . PHE A 68  ? 0.8082 0.5701 0.4170 -0.0105 0.0293  0.0930  71  PHE A CG  
1080 C CD1 . PHE A 68  ? 1.1843 0.9171 0.7729 -0.0315 0.0509  0.0932  71  PHE A CD1 
1081 C CD2 . PHE A 68  ? 0.7949 0.6048 0.4586 -0.0088 0.0266  0.0794  71  PHE A CD2 
1082 C CE1 . PHE A 68  ? 0.9952 0.7535 0.6221 -0.0480 0.0680  0.0787  71  PHE A CE1 
1083 C CE2 . PHE A 68  ? 0.9776 0.8055 0.6748 -0.0237 0.0429  0.0669  71  PHE A CE2 
1084 C CZ  . PHE A 68  ? 0.9013 0.7068 0.5824 -0.0420 0.0629  0.0660  71  PHE A CZ  
1094 N N   . GLY A 69  ? 1.3498 0.9858 0.7788 -0.0236 0.0339  0.1276  72  GLY A N   
1095 C CA  . GLY A 69  ? 1.4762 1.0757 0.8612 -0.0520 0.0575  0.1295  72  GLY A CA  
1096 C C   . GLY A 69  ? 1.4367 1.0409 0.7881 -0.0640 0.0608  0.1275  72  GLY A C   
1097 O O   . GLY A 69  ? 1.6704 1.2735 1.0098 -0.0919 0.0843  0.1195  72  GLY A O   
1101 N N   . GLY A 70  ? 1.4607 1.0736 0.7971 -0.0441 0.0380  0.1330  73  GLY A N   
1102 C CA  . GLY A 70  ? 1.2306 0.8485 0.5332 -0.0545 0.0393  0.1306  73  GLY A CA  
1103 C C   . GLY A 70  ? 1.3778 1.0493 0.7251 -0.0707 0.0522  0.1087  73  GLY A C   
1104 O O   . GLY A 70  ? 1.3679 1.0413 0.6861 -0.0850 0.0600  0.1038  73  GLY A O   
1108 N N   . GLU A 71  ? 1.3084 1.0208 0.7223 -0.0680 0.0545  0.0952  74  GLU A N   
1109 C CA  . GLU A 71  ? 1.1088 0.8667 0.5644 -0.0800 0.0661  0.0741  74  GLU A CA  
1110 C C   . GLU A 71  ? 1.0589 0.8586 0.5722 -0.0630 0.0499  0.0656  74  GLU A C   
1111 O O   . GLU A 71  ? 1.2859 1.0855 0.8234 -0.0487 0.0400  0.0718  74  GLU A O   
1112 C CB  . GLU A 71  ? 1.1355 0.8971 0.6103 -0.1011 0.0931  0.0634  74  GLU A CB  
1113 C CG  . GLU A 71  ? 1.4973 1.2096 0.9255 -0.1159 0.1075  0.0761  74  GLU A CG  
1114 C CD  . GLU A 71  ? 1.7283 1.4533 1.1739 -0.1416 0.1359  0.0618  74  GLU A CD  
1115 O OE1 . GLU A 71  ? 1.7511 1.5240 1.2448 -0.1442 0.1430  0.0420  74  GLU A OE1 
1116 O OE2 . GLU A 71  ? 1.8849 1.5717 1.2949 -0.1591 0.1508  0.0695  74  GLU A OE2 
1119 N N   . GLN A 72  ? 1.0734 0.9060 0.6053 -0.0657 0.0482  0.0510  75  GLN A N   
1120 C CA  . GLN A 72  ? 1.0303 0.8994 0.6142 -0.0555 0.0371  0.0406  75  GLN A CA  
1121 C C   . GLN A 72  ? 0.8042 0.6878 0.4318 -0.0620 0.0531  0.0288  75  GLN A C   
1122 O O   . GLN A 72  ? 1.1236 1.0157 0.7547 -0.0750 0.0703  0.0156  75  GLN A O   
1123 C CB  . GLN A 72  ? 1.0448 0.9363 0.6265 -0.0581 0.0303  0.0286  75  GLN A CB  
1124 C CG  . GLN A 72  ? 1.2019 1.1005 0.7679 -0.0454 0.0058  0.0360  75  GLN A CG  
1125 C CD  . GLN A 72  ? 1.4001 1.2667 0.9154 -0.0380 -0.0023 0.0548  75  GLN A CD  
1126 O OE1 . GLN A 72  ? 1.5577 1.4096 1.0739 -0.0244 -0.0101 0.0677  75  GLN A OE1 
1127 N NE2 . GLN A 72  ? 1.7399 1.5923 1.2073 -0.0461 -0.0008 0.0564  75  GLN A NE2 
1136 N N   . ASN A 73  ? 0.7856 0.6743 0.4463 -0.0518 0.0470  0.0327  76  ASN A N   
1137 C CA  . ASN A 73  ? 0.7294 0.6291 0.4277 -0.0564 0.0603  0.0238  76  ASN A CA  
1138 C C   . ASN A 73  ? 0.8134 0.7423 0.5562 -0.0485 0.0522  0.0129  76  ASN A C   
1139 O O   . ASN A 73  ? 0.7944 0.7307 0.5486 -0.0373 0.0355  0.0182  76  ASN A O   
1140 C CB  . ASN A 73  ? 0.8280 0.7066 0.5260 -0.0529 0.0616  0.0360  76  ASN A CB  
1141 C CG  . ASN A 73  ? 1.0986 0.9379 0.7451 -0.0621 0.0700  0.0481  76  ASN A CG  
1142 O OD1 . ASN A 73  ? 1.1391 0.9706 0.7744 -0.0802 0.0902  0.0430  76  ASN A OD1 
1143 N ND2 . ASN A 73  ? 0.8742 0.6886 0.4870 -0.0497 0.0546  0.0637  76  ASN A ND2 
1150 N N   . PRO A 74  ? 0.9035 0.8489 0.6701 -0.0538 0.0632  -0.0028 77  PRO A N   
1151 C CA  . PRO A 74  ? 0.6054 0.5695 0.4057 -0.0466 0.0552  -0.0124 77  PRO A CA  
1152 C C   . PRO A 74  ? 0.5602 0.5292 0.3929 -0.0396 0.0523  -0.0089 77  PRO A C   
1153 O O   . PRO A 74  ? 0.6784 0.6496 0.5258 -0.0425 0.0640  -0.0125 77  PRO A O   
1154 C CB  . PRO A 74  ? 0.6331 0.6074 0.4404 -0.0518 0.0684  -0.0303 77  PRO A CB  
1155 C CG  . PRO A 74  ? 0.9268 0.8977 0.7209 -0.0621 0.0862  -0.0313 77  PRO A CG  
1156 C CD  . PRO A 74  ? 0.9250 0.8728 0.6851 -0.0663 0.0835  -0.0135 77  PRO A CD  
1164 N N   . ILE A 75  ? 0.5923 0.5662 0.4364 -0.0316 0.0372  -0.0030 78  ILE A N   
1165 C CA  . ILE A 75  ? 0.5953 0.5740 0.4671 -0.0248 0.0333  0.0009  78  ILE A CA  
1166 C C   . ILE A 75  ? 0.6677 0.6595 0.5632 -0.0229 0.0272  -0.0081 78  ILE A C   
1167 O O   . ILE A 75  ? 0.5880 0.5853 0.4778 -0.0239 0.0174  -0.0100 78  ILE A O   
1168 C CB  . ILE A 75  ? 0.7580 0.7322 0.6222 -0.0167 0.0216  0.0146  78  ILE A CB  
1169 C CG1 . ILE A 75  ? 0.7487 0.6986 0.5829 -0.0175 0.0274  0.0253  78  ILE A CG1 
1170 C CG2 . ILE A 75  ? 0.7199 0.7027 0.6139 -0.0098 0.0173  0.0162  78  ILE A CG2 
1171 C CD1 . ILE A 75  ? 0.8043 0.7435 0.6348 -0.0290 0.0463  0.0209  78  ILE A CD1 
1183 N N   . TYR A 76  ? 0.4443 0.4395 0.3634 -0.0210 0.0329  -0.0140 79  TYR A N   
1184 C CA  . TYR A 76  ? 0.5480 0.5476 0.4846 -0.0185 0.0271  -0.0207 79  TYR A CA  
1185 C C   . TYR A 76  ? 0.5721 0.5776 0.5230 -0.0152 0.0181  -0.0125 79  TYR A C   
1186 O O   . TYR A 76  ? 0.5007 0.5078 0.4686 -0.0115 0.0206  -0.0102 79  TYR A O   
1187 C CB  . TYR A 76  ? 0.4835 0.4841 0.4358 -0.0152 0.0355  -0.0308 79  TYR A CB  
1188 C CG  . TYR A 76  ? 0.4968 0.4957 0.4385 -0.0160 0.0425  -0.0435 79  TYR A CG  
1189 C CD1 . TYR A 76  ? 0.4722 0.4618 0.4058 -0.0149 0.0372  -0.0516 79  TYR A CD1 
1190 C CD2 . TYR A 76  ? 0.5993 0.6049 0.5372 -0.0189 0.0554  -0.0486 79  TYR A CD2 
1191 C CE1 . TYR A 76  ? 0.4547 0.4410 0.3775 -0.0135 0.0437  -0.0647 79  TYR A CE1 
1192 C CE2 . TYR A 76  ? 0.6141 0.6222 0.5436 -0.0188 0.0627  -0.0623 79  TYR A CE2 
1193 C CZ  . TYR A 76  ? 0.6771 0.6752 0.5994 -0.0145 0.0564  -0.0705 79  TYR A CZ  
1194 O OH  . TYR A 76  ? 0.6421 0.6411 0.5550 -0.0123 0.0638  -0.0855 79  TYR A OH  
1204 N N   . TRP A 77  ? 0.4138 0.4260 0.3582 -0.0172 0.0077  -0.0096 80  TRP A N   
1205 C CA  . TRP A 77  ? 0.4797 0.5041 0.4386 -0.0142 -0.0004 -0.0040 80  TRP A CA  
1206 C C   . TRP A 77  ? 0.4809 0.5057 0.4562 -0.0170 -0.0009 -0.0090 80  TRP A C   
1207 O O   . TRP A 77  ? 0.4825 0.5167 0.4727 -0.0147 -0.0040 -0.0053 80  TRP A O   
1208 C CB  . TRP A 77  ? 0.6519 0.6916 0.6015 -0.0160 -0.0115 -0.0023 80  TRP A CB  
1209 C CG  . TRP A 77  ? 0.5292 0.5703 0.4690 -0.0269 -0.0148 -0.0114 80  TRP A CG  
1210 C CD1 . TRP A 77  ? 0.5676 0.6027 0.4855 -0.0316 -0.0145 -0.0156 80  TRP A CD1 
1211 C CD2 . TRP A 77  ? 0.4602 0.5055 0.4076 -0.0366 -0.0180 -0.0179 80  TRP A CD2 
1212 N NE1 . TRP A 77  ? 0.5384 0.5731 0.4507 -0.0431 -0.0177 -0.0251 80  TRP A NE1 
1213 C CE2 . TRP A 77  ? 0.4863 0.5254 0.4151 -0.0471 -0.0197 -0.0262 80  TRP A CE2 
1214 C CE3 . TRP A 77  ? 0.4967 0.5479 0.4614 -0.0389 -0.0189 -0.0177 80  TRP A CE3 
1215 C CZ2 . TRP A 77  ? 0.6803 0.7151 0.6056 -0.0610 -0.0219 -0.0341 80  TRP A CZ2 
1216 C CZ3 . TRP A 77  ? 0.5679 0.6161 0.5285 -0.0530 -0.0209 -0.0248 80  TRP A CZ3 
1217 C CH2 . TRP A 77  ? 0.6652 0.7034 0.6054 -0.0644 -0.0223 -0.0328 80  TRP A CH2 
1228 N N   . ALA A 78  ? 0.5012 0.5132 0.4710 -0.0210 0.0018  -0.0175 81  ALA A N   
1229 C CA  . ALA A 78  ? 0.4692 0.4732 0.4464 -0.0231 0.0004  -0.0211 81  ALA A CA  
1230 C C   . ALA A 78  ? 0.4398 0.4437 0.4345 -0.0153 0.0042  -0.0186 81  ALA A C   
1231 O O   . ALA A 78  ? 0.4462 0.4456 0.4468 -0.0165 0.0017  -0.0189 81  ALA A O   
1232 C CB  . ALA A 78  ? 0.5940 0.5768 0.5560 -0.0254 0.0019  -0.0308 81  ALA A CB  
1238 N N   . ARG A 79  ? 0.4723 0.4801 0.4728 -0.0094 0.0106  -0.0167 82  ARG A N   
1239 C CA  . ARG A 79  ? 0.5562 0.5669 0.5735 -0.0040 0.0142  -0.0156 82  ARG A CA  
1240 C C   . ARG A 79  ? 0.5229 0.5419 0.5505 -0.0042 0.0097  -0.0086 82  ARG A C   
1241 O O   . ARG A 79  ? 0.4770 0.4963 0.5159 -0.0023 0.0094  -0.0091 82  ARG A O   
1242 C CB  . ARG A 79  ? 0.5737 0.5874 0.5924 -0.0024 0.0232  -0.0156 82  ARG A CB  
1243 C CG  . ARG A 79  ? 0.5092 0.5216 0.5227 -0.0019 0.0300  -0.0254 82  ARG A CG  
1244 C CD  . ARG A 79  ? 0.6338 0.6537 0.6525 -0.0037 0.0410  -0.0275 82  ARG A CD  
1245 N NE  . ARG A 79  ? 0.6973 0.7232 0.7129 -0.0040 0.0491  -0.0391 82  ARG A NE  
1246 C CZ  . ARG A 79  ? 0.4930 0.5293 0.5229 0.0032  0.0508  -0.0511 82  ARG A CZ  
1247 N NH1 . ARG A 79  ? 0.6033 0.6403 0.6472 0.0110  0.0437  -0.0519 82  ARG A NH1 
1248 N NH2 . ARG A 79  ? 0.6869 0.7340 0.7155 0.0036  0.0594  -0.0632 82  ARG A NH2 
1262 N N   . TYR A 80  ? 0.4713 0.4990 0.4947 -0.0052 0.0057  -0.0031 83  TYR A N   
1263 C CA  . TYR A 80  ? 0.4255 0.4655 0.4600 -0.0028 0.0018  0.0016  83  TYR A CA  
1264 C C   . TYR A 80  ? 0.4155 0.4644 0.4537 -0.0101 -0.0035 -0.0013 83  TYR A C   
1265 O O   . TYR A 80  ? 0.4352 0.4930 0.4852 -0.0097 -0.0041 -0.0003 83  TYR A O   
1266 C CB  . TYR A 80  ? 0.4238 0.4705 0.4515 0.0029  -0.0017 0.0076  83  TYR A CB  
1267 C CG  . TYR A 80  ? 0.4821 0.5128 0.4976 0.0063  0.0048  0.0112  83  TYR A CG  
1268 C CD1 . TYR A 80  ? 0.4330 0.4559 0.4316 0.0022  0.0074  0.0095  83  TYR A CD1 
1269 C CD2 . TYR A 80  ? 0.4805 0.5020 0.4989 0.0111  0.0098  0.0152  83  TYR A CD2 
1270 C CE1 . TYR A 80  ? 0.4139 0.4221 0.3985 0.0018  0.0153  0.0123  83  TYR A CE1 
1271 C CE2 . TYR A 80  ? 0.5298 0.5336 0.5332 0.0097  0.0175  0.0181  83  TYR A CE2 
1272 C CZ  . TYR A 80  ? 0.5654 0.5635 0.5519 0.0045  0.0207  0.0167  83  TYR A CZ  
1273 O OH  . TYR A 80  ? 0.6130 0.5936 0.5817 -0.0001 0.0302  0.0191  83  TYR A OH  
1283 N N   . ALA A 81  ? 0.3800 0.4251 0.4061 -0.0187 -0.0063 -0.0057 84  ALA A N   
1284 C CA  . ALA A 81  ? 0.3236 0.3700 0.3478 -0.0302 -0.0092 -0.0092 84  ALA A CA  
1285 C C   . ALA A 81  ? 0.3918 0.4179 0.4155 -0.0299 -0.0062 -0.0103 84  ALA A C   
1286 O O   . ALA A 81  ? 0.4591 0.4871 0.4850 -0.0365 -0.0069 -0.0100 84  ALA A O   
1287 C CB  . ALA A 81  ? 0.5453 0.5859 0.5519 -0.0415 -0.0120 -0.0146 84  ALA A CB  
1293 N N   . ASP A 82  ? 0.4163 0.4247 0.4361 -0.0220 -0.0032 -0.0123 85  ASP A N   
1294 C CA  . ASP A 82  ? 0.3993 0.3929 0.4208 -0.0164 -0.0022 -0.0136 85  ASP A CA  
1295 C C   . ASP A 82  ? 0.4574 0.4653 0.4961 -0.0127 -0.0008 -0.0094 85  ASP A C   
1296 O O   . ASP A 82  ? 0.4666 0.4707 0.5045 -0.0163 -0.0024 -0.0084 85  ASP A O   
1297 C CB  . ASP A 82  ? 0.5832 0.5679 0.6038 -0.0060 0.0009  -0.0186 85  ASP A CB  
1298 C CG  . ASP A 82  ? 0.6101 0.5873 0.6361 0.0037  0.0004  -0.0214 85  ASP A CG  
1299 O OD1 . ASP A 82  ? 0.5445 0.5225 0.5750 0.0026  -0.0017 -0.0179 85  ASP A OD1 
1300 O OD2 . ASP A 82  ? 0.5177 0.4911 0.5436 0.0132  0.0020  -0.0283 85  ASP A OD2 
1305 N N   . TRP A 83  ? 0.4728 0.4938 0.5236 -0.0064 0.0028  -0.0072 86  TRP A N   
1306 C CA  . TRP A 83  ? 0.4384 0.4677 0.5032 -0.0022 0.0051  -0.0049 86  TRP A CA  
1307 C C   . TRP A 83  ? 0.4695 0.5122 0.5397 -0.0063 0.0028  -0.0021 86  TRP A C   
1308 O O   . TRP A 83  ? 0.5103 0.5566 0.5886 -0.0050 0.0040  -0.0018 86  TRP A O   
1309 C CB  . TRP A 83  ? 0.3876 0.4208 0.4576 0.0029  0.0103  -0.0033 86  TRP A CB  
1310 C CG  . TRP A 83  ? 0.3509 0.3785 0.4197 0.0051  0.0151  -0.0084 86  TRP A CG  
1311 C CD1 . TRP A 83  ? 0.3759 0.3993 0.4458 0.0082  0.0142  -0.0149 86  TRP A CD1 
1312 C CD2 . TRP A 83  ? 0.3934 0.4205 0.4584 0.0048  0.0217  -0.0085 86  TRP A CD2 
1313 N NE1 . TRP A 83  ? 0.4986 0.5257 0.5704 0.0105  0.0202  -0.0208 86  TRP A NE1 
1314 C CE2 . TRP A 83  ? 0.4254 0.4543 0.4934 0.0062  0.0259  -0.0169 86  TRP A CE2 
1315 C CE3 . TRP A 83  ? 0.4692 0.4931 0.5259 0.0038  0.0243  -0.0024 86  TRP A CE3 
1316 C CZ2 . TRP A 83  ? 0.4922 0.5238 0.5570 0.0032  0.0346  -0.0204 86  TRP A CZ2 
1317 C CZ3 . TRP A 83  ? 0.5779 0.5966 0.6260 0.0006  0.0323  -0.0038 86  TRP A CZ3 
1318 C CH2 . TRP A 83  ? 0.4774 0.5019 0.5306 -0.0014 0.0384  -0.0132 86  TRP A CH2 
1329 N N   . LEU A 84  ? 0.4017 0.4556 0.4682 -0.0114 -0.0004 -0.0015 87  LEU A N   
1330 C CA  . LEU A 84  ? 0.3715 0.4465 0.4463 -0.0151 -0.0022 -0.0016 87  LEU A CA  
1331 C C   . LEU A 84  ? 0.5859 0.6560 0.6574 -0.0248 -0.0013 -0.0036 87  LEU A C   
1332 O O   . LEU A 84  ? 0.5323 0.6164 0.6132 -0.0253 0.0003  -0.0041 87  LEU A O   
1333 C CB  . LEU A 84  ? 0.4166 0.5098 0.4884 -0.0204 -0.0067 -0.0033 87  LEU A CB  
1334 C CG  . LEU A 84  ? 0.3504 0.4758 0.4339 -0.0243 -0.0087 -0.0064 87  LEU A CG  
1335 C CD1 . LEU A 84  ? 0.7271 0.8664 0.8246 -0.0080 -0.0088 -0.0044 87  LEU A CD1 
1336 C CD2 . LEU A 84  ? 0.4411 0.5882 0.5213 -0.0330 -0.0138 -0.0107 87  LEU A CD2 
1348 N N   . PHE A 85  ? 0.5330 0.5802 0.5879 -0.0320 -0.0023 -0.0048 88  PHE A N   
1349 C CA  . PHE A 85  ? 0.6825 0.7164 0.7249 -0.0429 -0.0022 -0.0055 88  PHE A CA  
1350 C C   . PHE A 85  ? 0.6021 0.6139 0.6395 -0.0346 -0.0026 -0.0041 88  PHE A C   
1351 O O   . PHE A 85  ? 0.5848 0.5895 0.6143 -0.0403 -0.0023 -0.0032 88  PHE A O   
1352 C CB  . PHE A 85  ? 0.6552 0.6707 0.6748 -0.0574 -0.0039 -0.0078 88  PHE A CB  
1353 C CG  . PHE A 85  ? 0.5130 0.5557 0.5369 -0.0698 -0.0041 -0.0111 88  PHE A CG  
1354 C CD1 . PHE A 85  ? 0.5398 0.6086 0.5705 -0.0824 -0.0018 -0.0137 88  PHE A CD1 
1355 C CD2 . PHE A 85  ? 0.5689 0.6154 0.5906 -0.0689 -0.0068 -0.0131 88  PHE A CD2 
1356 C CE1 . PHE A 85  ? 0.5777 0.6800 0.6158 -0.0932 -0.0027 -0.0192 88  PHE A CE1 
1357 C CE2 . PHE A 85  ? 0.6316 0.7080 0.6580 -0.0795 -0.0086 -0.0174 88  PHE A CE2 
1358 C CZ  . PHE A 85  ? 0.7286 0.8350 0.7647 -0.0913 -0.0070 -0.0209 88  PHE A CZ  
1368 N N   . THR A 86  ? 0.3990 0.4025 0.4401 -0.0218 -0.0032 -0.0049 89  THR A N   
1369 C CA  . THR A 86  ? 0.3961 0.3856 0.4350 -0.0123 -0.0050 -0.0059 89  THR A CA  
1370 C C   . THR A 86  ? 0.5464 0.5540 0.6045 -0.0062 -0.0023 -0.0059 89  THR A C   
1371 O O   . THR A 86  ? 0.4780 0.4797 0.5332 -0.0032 -0.0045 -0.0064 89  THR A O   
1372 C CB  . THR A 86  ? 0.4293 0.4075 0.4652 -0.0017 -0.0065 -0.0100 89  THR A CB  
1373 O OG1 . THR A 86  ? 0.4916 0.4878 0.5424 0.0013  -0.0019 -0.0110 89  THR A OG1 
1374 C CG2 . THR A 86  ? 0.4125 0.3638 0.4238 -0.0063 -0.0099 -0.0113 89  THR A CG2 
1382 N N   . THR A 87  ? 0.3991 0.4252 0.4730 -0.0042 0.0020  -0.0054 90  THR A N   
1383 C CA  . THR A 87  ? 0.4861 0.5230 0.5743 0.0005  0.0053  -0.0063 90  THR A CA  
1384 C C   . THR A 87  ? 0.4106 0.4551 0.5005 -0.0041 0.0058  -0.0054 90  THR A C   
1385 O O   . THR A 87  ? 0.4575 0.5031 0.5516 -0.0017 0.0066  -0.0074 90  THR A O   
1386 C CB  . THR A 87  ? 0.3943 0.4393 0.4916 0.0039  0.0099  -0.0053 90  THR A CB  
1387 O OG1 . THR A 87  ? 0.5157 0.5686 0.6114 0.0018  0.0088  -0.0022 90  THR A OG1 
1388 C CG2 . THR A 87  ? 0.4806 0.5201 0.5762 0.0069  0.0118  -0.0076 90  THR A CG2 
1396 N N   . PRO A 88  ? 0.4211 0.4744 0.5083 -0.0116 0.0060  -0.0041 91  PRO A N   
1397 C CA  . PRO A 88  ? 0.4954 0.5587 0.5836 -0.0173 0.0078  -0.0052 91  PRO A CA  
1398 C C   . PRO A 88  ? 0.4502 0.4954 0.5206 -0.0237 0.0054  -0.0045 91  PRO A C   
1399 O O   . PRO A 88  ? 0.4846 0.5333 0.5543 -0.0256 0.0070  -0.0057 91  PRO A O   
1400 C CB  . PRO A 88  ? 0.6052 0.6880 0.6959 -0.0251 0.0088  -0.0061 91  PRO A CB  
1401 C CG  . PRO A 88  ? 0.4743 0.5504 0.5586 -0.0265 0.0057  -0.0047 91  PRO A CG  
1402 C CD  . PRO A 88  ? 0.4776 0.5385 0.5631 -0.0156 0.0049  -0.0032 91  PRO A CD  
1410 N N   . LEU A 89  ? 0.4404 0.4631 0.4929 -0.0261 0.0011  -0.0028 92  LEU A N   
1411 C CA  . LEU A 89  ? 0.5124 0.5093 0.5412 -0.0289 -0.0031 -0.0011 92  LEU A CA  
1412 C C   . LEU A 89  ? 0.5236 0.5183 0.5577 -0.0157 -0.0066 -0.0028 92  LEU A C   
1413 O O   . LEU A 89  ? 0.4654 0.4510 0.4865 -0.0170 -0.0092 -0.0019 92  LEU A O   
1414 C CB  . LEU A 89  ? 0.5745 0.5424 0.5806 -0.0310 -0.0075 0.0003  92  LEU A CB  
1415 C CG  . LEU A 89  ? 0.5462 0.5098 0.5377 -0.0498 -0.0047 0.0010  92  LEU A CG  
1416 C CD1 . LEU A 89  ? 0.6322 0.5624 0.6000 -0.0504 -0.0089 0.0012  92  LEU A CD1 
1417 C CD2 . LEU A 89  ? 0.5870 0.5447 0.5600 -0.0665 -0.0017 0.0026  92  LEU A CD2 
1429 N N   . LEU A 90  ? 0.4436 0.4479 0.4954 -0.0044 -0.0066 -0.0059 93  LEU A N   
1430 C CA  . LEU A 90  ? 0.4072 0.4176 0.4681 0.0058  -0.0092 -0.0101 93  LEU A CA  
1431 C C   . LEU A 90  ? 0.4487 0.4750 0.5201 0.0022  -0.0050 -0.0117 93  LEU A C   
1432 O O   . LEU A 90  ? 0.4483 0.4748 0.5164 0.0055  -0.0087 -0.0141 93  LEU A O   
1433 C CB  . LEU A 90  ? 0.4853 0.5070 0.5634 0.0137  -0.0070 -0.0148 93  LEU A CB  
1434 C CG  . LEU A 90  ? 0.5697 0.5781 0.6387 0.0211  -0.0115 -0.0165 93  LEU A CG  
1435 C CD1 . LEU A 90  ? 0.6012 0.6243 0.6866 0.0239  -0.0058 -0.0209 93  LEU A CD1 
1436 C CD2 . LEU A 90  ? 0.5077 0.5067 0.5669 0.0332  -0.0207 -0.0203 93  LEU A CD2 
1448 N N   . LEU A 91  ? 0.3897 0.4294 0.4727 -0.0030 0.0020  -0.0110 94  LEU A N   
1449 C CA  . LEU A 91  ? 0.4937 0.5460 0.5850 -0.0051 0.0065  -0.0137 94  LEU A CA  
1450 C C   . LEU A 91  ? 0.4017 0.4503 0.4773 -0.0131 0.0056  -0.0125 94  LEU A C   
1451 O O   . LEU A 91  ? 0.5600 0.6136 0.6357 -0.0136 0.0066  -0.0158 94  LEU A O   
1452 C CB  . LEU A 91  ? 0.4242 0.4888 0.5284 -0.0049 0.0128  -0.0137 94  LEU A CB  
1453 C CG  . LEU A 91  ? 0.4130 0.4769 0.5276 0.0015  0.0153  -0.0143 94  LEU A CG  
1454 C CD1 . LEU A 91  ? 0.5617 0.6323 0.6821 0.0045  0.0189  -0.0127 94  LEU A CD1 
1455 C CD2 . LEU A 91  ? 0.4978 0.5614 0.6188 0.0033  0.0178  -0.0195 94  LEU A CD2 
1467 N N   . LEU A 92  ? 0.4077 0.4463 0.4669 -0.0215 0.0044  -0.0084 95  LEU A N   
1468 C CA  . LEU A 92  ? 0.4529 0.4837 0.4910 -0.0329 0.0048  -0.0069 95  LEU A CA  
1469 C C   . LEU A 92  ? 0.6574 0.6660 0.6748 -0.0281 -0.0032 -0.0052 95  LEU A C   
1470 O O   . LEU A 92  ? 0.5105 0.5165 0.5139 -0.0339 -0.0027 -0.0053 95  LEU A O   
1471 C CB  . LEU A 92  ? 0.4234 0.4453 0.4452 -0.0465 0.0062  -0.0036 95  LEU A CB  
1472 C CG  . LEU A 92  ? 0.7041 0.7208 0.7026 -0.0648 0.0103  -0.0027 95  LEU A CG  
1473 C CD1 . LEU A 92  ? 0.6658 0.7174 0.6831 -0.0694 0.0191  -0.0090 95  LEU A CD1 
1474 C CD2 . LEU A 92  ? 0.8265 0.8307 0.8068 -0.0806 0.0117  -0.0005 95  LEU A CD2 
1486 N N   . ASP A 93  ? 0.5152 0.5096 0.5297 -0.0165 -0.0109 -0.0044 96  ASP A N   
1487 C CA  . ASP A 93  ? 0.4982 0.4770 0.4963 -0.0067 -0.0208 -0.0045 96  ASP A CA  
1488 C C   . ASP A 93  ? 0.5645 0.5652 0.5779 -0.0031 -0.0201 -0.0103 96  ASP A C   
1489 O O   . ASP A 93  ? 0.5971 0.5896 0.5919 -0.0031 -0.0253 -0.0099 96  ASP A O   
1490 C CB  . ASP A 93  ? 0.5528 0.5233 0.5537 0.0087  -0.0285 -0.0062 96  ASP A CB  
1491 C CG  . ASP A 93  ? 0.5305 0.4616 0.4962 0.0107  -0.0361 -0.0006 96  ASP A CG  
1492 O OD1 . ASP A 93  ? 0.6083 0.5143 0.5423 0.0005  -0.0373 0.0053  96  ASP A OD1 
1493 O OD2 . ASP A 93  ? 0.5549 0.4774 0.5218 0.0218  -0.0403 -0.0025 96  ASP A OD2 
1498 N N   . LEU A 94  ? 0.5237 0.5490 0.5673 -0.0010 -0.0137 -0.0160 97  LEU A N   
1499 C CA  . LEU A 94  ? 0.5711 0.6143 0.6278 0.0000  -0.0118 -0.0230 97  LEU A CA  
1500 C C   . LEU A 94  ? 0.4837 0.5307 0.5336 -0.0105 -0.0054 -0.0231 97  LEU A C   
1501 O O   . LEU A 94  ? 0.5029 0.5531 0.5457 -0.0114 -0.0076 -0.0268 97  LEU A O   
1502 C CB  . LEU A 94  ? 0.5174 0.5775 0.6015 0.0023  -0.0052 -0.0285 97  LEU A CB  
1503 C CG  . LEU A 94  ? 0.4728 0.5373 0.5672 0.0109  -0.0093 -0.0318 97  LEU A CG  
1504 C CD1 . LEU A 94  ? 0.6910 0.7659 0.8054 0.0083  0.0000  -0.0353 97  LEU A CD1 
1505 C CD2 . LEU A 94  ? 0.6153 0.6899 0.7097 0.0180  -0.0181 -0.0390 97  LEU A CD2 
1517 N N   . ALA A 95  ? 0.3833 0.4336 0.4359 -0.0181 0.0025  -0.0206 98  ALA A N   
1518 C CA  . ALA A 95  ? 0.5665 0.6277 0.6173 -0.0268 0.0102  -0.0235 98  ALA A CA  
1519 C C   . ALA A 95  ? 0.6750 0.7225 0.6953 -0.0362 0.0074  -0.0203 98  ALA A C   
1520 O O   . ALA A 95  ? 0.6822 0.7368 0.6964 -0.0411 0.0108  -0.0245 98  ALA A O   
1521 C CB  . ALA A 95  ? 0.5630 0.6373 0.6258 -0.0308 0.0179  -0.0233 98  ALA A CB  
1527 N N   . LEU A 96  ? 0.4796 0.5038 0.4765 -0.0394 0.0016  -0.0128 99  LEU A N   
1528 C CA  . LEU A 96  ? 0.5540 0.5558 0.5134 -0.0494 -0.0013 -0.0080 99  LEU A CA  
1529 C C   . LEU A 96  ? 0.6864 0.6773 0.6316 -0.0390 -0.0122 -0.0084 99  LEU A C   
1530 O O   . LEU A 96  ? 0.6023 0.5816 0.5193 -0.0462 -0.0134 -0.0067 99  LEU A O   
1531 C CB  . LEU A 96  ? 0.6195 0.5911 0.5526 -0.0559 -0.0045 0.0001  99  LEU A CB  
1532 C CG  . LEU A 96  ? 0.7622 0.7459 0.7018 -0.0719 0.0061  -0.0003 99  LEU A CG  
1533 C CD1 . LEU A 96  ? 0.8102 0.7582 0.7181 -0.0810 0.0027  0.0069  99  LEU A CD1 
1534 C CD2 . LEU A 96  ? 0.8738 0.8789 0.8113 -0.0888 0.0176  -0.0049 99  LEU A CD2 
1546 N N   . LEU A 97  ? 0.6452 0.6424 0.6090 -0.0227 -0.0200 -0.0116 100 LEU A N   
1547 C CA  . LEU A 97  ? 0.7196 0.7166 0.6760 -0.0115 -0.0313 -0.0149 100 LEU A CA  
1548 C C   . LEU A 97  ? 0.5900 0.6076 0.5533 -0.0175 -0.0262 -0.0224 100 LEU A C   
1549 O O   . LEU A 97  ? 0.7143 0.7269 0.6574 -0.0149 -0.0346 -0.0234 100 LEU A O   
1550 C CB  . LEU A 97  ? 0.5420 0.5531 0.5246 0.0044  -0.0377 -0.0203 100 LEU A CB  
1551 C CG  . LEU A 97  ? 0.7074 0.7219 0.6838 0.0199  -0.0528 -0.0248 100 LEU A CG  
1552 C CD1 . LEU A 97  ? 0.8459 0.8232 0.7808 0.0284  -0.0661 -0.0159 100 LEU A CD1 
1553 C CD2 . LEU A 97  ? 0.6789 0.7177 0.6883 0.0314  -0.0546 -0.0333 100 LEU A CD2 
1565 N N   . VAL A 98  ? 0.7394 0.5474 0.5449 0.1018  -0.1913 -0.1041 101 VAL A N   
1566 C CA  . VAL A 98  ? 0.8431 0.6340 0.6233 0.1076  -0.1888 -0.1103 101 VAL A CA  
1567 C C   . VAL A 98  ? 0.7657 0.5430 0.5157 0.1161  -0.1723 -0.0935 101 VAL A C   
1568 O O   . VAL A 98  ? 0.9219 0.6795 0.6440 0.1230  -0.1667 -0.0962 101 VAL A O   
1569 C CB  . VAL A 98  ? 0.9764 0.7731 0.7768 0.0997  -0.1825 -0.1209 101 VAL A CB  
1570 C CG1 . VAL A 98  ? 1.0979 0.9043 0.9241 0.0932  -0.2001 -0.1387 101 VAL A CG1 
1571 C CG2 . VAL A 98  ? 0.8000 0.6139 0.6245 0.0931  -0.1642 -0.1089 101 VAL A CG2 
1581 N N   . ASP A 99  ? 0.8099 0.5956 0.5637 0.1158  -0.1638 -0.0754 102 ASP A N   
1582 C CA  . ASP A 99  ? 0.8387 0.6159 0.5694 0.1239  -0.1469 -0.0558 102 ASP A CA  
1583 C C   . ASP A 99  ? 0.8992 0.6805 0.6338 0.1233  -0.1276 -0.0494 102 ASP A C   
1584 O O   . ASP A 99  ? 0.8201 0.5838 0.5255 0.1345  -0.1149 -0.0420 102 ASP A O   
1585 C CB  . ASP A 99  ? 0.9716 0.7208 0.6590 0.1390  -0.1517 -0.0570 102 ASP A CB  
1586 C CG  . ASP A 99  ? 1.0604 0.8021 0.7269 0.1486  -0.1355 -0.0336 102 ASP A CG  
1587 O OD1 . ASP A 99  ? 1.2954 1.0558 0.9839 0.1413  -0.1276 -0.0172 102 ASP A OD1 
1588 O OD2 . ASP A 99  ? 1.3759 1.0916 1.0031 0.1632  -0.1308 -0.0311 102 ASP A OD2 
1593 N N   . ALA A 100 ? 0.8868 0.6896 0.6555 0.1118  -0.1240 -0.0514 103 ALA A N   
1594 C CA  . ALA A 100 ? 0.8184 0.6271 0.5931 0.1119  -0.1050 -0.0450 103 ALA A CA  
1595 C C   . ALA A 100 ? 0.7385 0.5528 0.5043 0.1183  -0.0860 -0.0186 103 ALA A C   
1596 O O   . ALA A 100 ? 0.7905 0.6131 0.5594 0.1166  -0.0877 -0.0044 103 ALA A O   
1597 C CB  . ALA A 100 ? 0.7908 0.6233 0.6041 0.0992  -0.1046 -0.0496 103 ALA A CB  
1603 N N   . ASP A 101 ? 0.7660 0.5753 0.5212 0.1259  -0.0667 -0.0110 104 ASP A N   
1604 C CA  . ASP A 101 ? 0.9799 0.7979 0.7301 0.1336  -0.0460 0.0166  104 ASP A CA  
1605 C C   . ASP A 101 ? 0.8487 0.7042 0.6384 0.1215  -0.0408 0.0318  104 ASP A C   
1606 O O   . ASP A 101 ? 0.8307 0.7006 0.6462 0.1104  -0.0473 0.0205  104 ASP A O   
1607 C CB  . ASP A 101 ? 0.9053 0.7035 0.6287 0.1477  -0.0252 0.0206  104 ASP A CB  
1608 C CG  . ASP A 101 ? 0.9932 0.8015 0.7361 0.1424  -0.0166 0.0133  104 ASP A CG  
1609 O OD1 . ASP A 101 ? 1.1534 0.9463 0.8934 0.1380  -0.0270 -0.0111 104 ASP A OD1 
1610 O OD2 . ASP A 101 ? 1.1229 0.9554 0.8849 0.1429  0.0006  0.0328  104 ASP A OD2 
1615 N N   . GLN A 102 ? 0.8022 0.6735 0.5960 0.1241  -0.0288 0.0588  105 GLN A N   
1616 C CA  . GLN A 102 ? 0.7457 0.6532 0.5756 0.1105  -0.0280 0.0746  105 GLN A CA  
1617 C C   . GLN A 102 ? 0.8280 0.7540 0.6773 0.1086  -0.0165 0.0758  105 GLN A C   
1618 O O   . GLN A 102 ? 0.7704 0.7179 0.6474 0.0948  -0.0244 0.0729  105 GLN A O   
1619 C CB  . GLN A 102 ? 0.8981 0.8206 0.7303 0.1135  -0.0164 0.1054  105 GLN A CB  
1620 C CG  . GLN A 102 ? 1.0438 0.9478 0.8568 0.1163  -0.0250 0.1071  105 GLN A CG  
1621 C CD  . GLN A 102 ? 1.3682 1.2380 1.1397 0.1373  -0.0155 0.1054  105 GLN A CD  
1622 O OE1 . GLN A 102 ? 1.2240 1.0722 0.9752 0.1456  -0.0141 0.0879  105 GLN A OE1 
1623 N NE2 . GLN A 102 ? 1.6097 1.4723 1.3666 0.1455  -0.0089 0.1236  105 GLN A NE2 
1632 N N   . GLY A 103 ? 0.6653 0.5802 0.4973 0.1234  0.0030  0.0805  106 GLY A N   
1633 C CA  . GLY A 103 ? 0.5586 0.4887 0.4065 0.1237  0.0163  0.0825  106 GLY A CA  
1634 C C   . GLY A 103 ? 0.6851 0.6102 0.5452 0.1138  0.0031  0.0552  106 GLY A C   
1635 O O   . GLY A 103 ? 0.6763 0.6234 0.5615 0.1070  0.0060  0.0567  106 GLY A O   
1639 N N   . THR A 104 ? 0.6628 0.5597 0.5060 0.1133  -0.0114 0.0309  107 THR A N   
1640 C CA  . THR A 104 ? 0.7155 0.6085 0.5731 0.1044  -0.0235 0.0061  107 THR A CA  
1641 C C   . THR A 104 ? 0.6098 0.5247 0.4962 0.0896  -0.0394 0.0042  107 THR A C   
1642 O O   . THR A 104 ? 0.6019 0.5279 0.5100 0.0827  -0.0404 -0.0037 107 THR A O   
1643 C CB  . THR A 104 ? 0.7889 0.6499 0.6232 0.1072  -0.0366 -0.0170 107 THR A CB  
1644 O OG1 . THR A 104 ? 0.8086 0.6436 0.6121 0.1197  -0.0216 -0.0180 107 THR A OG1 
1645 C CG2 . THR A 104 ? 0.9264 0.7875 0.7811 0.0971  -0.0505 -0.0406 107 THR A CG2 
1653 N N   . ILE A 105 ? 0.6072 0.5251 0.4913 0.0852  -0.0509 0.0117  108 ILE A N   
1654 C CA  . ILE A 105 ? 0.6798 0.6120 0.5848 0.0711  -0.0655 0.0102  108 ILE A CA  
1655 C C   . ILE A 105 ? 0.6607 0.6216 0.5885 0.0639  -0.0572 0.0262  108 ILE A C   
1656 O O   . ILE A 105 ? 0.6966 0.6660 0.6418 0.0541  -0.0647 0.0189  108 ILE A O   
1657 C CB  . ILE A 105 ? 0.7219 0.6483 0.6161 0.0685  -0.0766 0.0173  108 ILE A CB  
1658 C CG1 . ILE A 105 ? 0.8634 0.7618 0.7319 0.0781  -0.0846 0.0027  108 ILE A CG1 
1659 C CG2 . ILE A 105 ? 0.7255 0.6592 0.6355 0.0539  -0.0915 0.0140  108 ILE A CG2 
1660 C CD1 . ILE A 105 ? 0.7041 0.5936 0.5560 0.0805  -0.0901 0.0128  108 ILE A CD1 
1672 N N   . LEU A 106 ? 0.4932 0.4695 0.4204 0.0696  -0.0413 0.0492  109 LEU A N   
1673 C CA  . LEU A 106 ? 0.5806 0.5880 0.5302 0.0635  -0.0339 0.0663  109 LEU A CA  
1674 C C   . LEU A 106 ? 0.5708 0.5802 0.5296 0.0667  -0.0254 0.0552  109 LEU A C   
1675 O O   . LEU A 106 ? 0.5432 0.5704 0.5206 0.0581  -0.0286 0.0567  109 LEU A O   
1676 C CB  . LEU A 106 ? 0.7587 0.7843 0.7075 0.0715  -0.0169 0.0954  109 LEU A CB  
1677 C CG  . LEU A 106 ? 0.9317 0.9965 0.9061 0.0640  -0.0118 0.1189  109 LEU A CG  
1678 C CD1 . LEU A 106 ? 0.7775 0.8535 0.7676 0.0435  -0.0327 0.1155  109 LEU A CD1 
1679 C CD2 . LEU A 106 ? 1.0671 1.1511 1.0433 0.0708  0.0021  0.1500  109 LEU A CD2 
1691 N N   . ALA A 107 ? 0.6009 0.5898 0.5448 0.0790  -0.0143 0.0440  110 ALA A N   
1692 C CA  . ALA A 107 ? 0.6181 0.6048 0.5701 0.0819  -0.0050 0.0323  110 ALA A CA  
1693 C C   . ALA A 107 ? 0.4440 0.4259 0.4101 0.0713  -0.0213 0.0112  110 ALA A C   
1694 O O   . ALA A 107 ? 0.5655 0.5584 0.5478 0.0687  -0.0170 0.0089  110 ALA A O   
1695 C CB  . ALA A 107 ? 0.6959 0.6550 0.6255 0.0947  0.0078  0.0221  110 ALA A CB  
1701 N N   . LEU A 108 ? 0.4991 0.4643 0.4584 0.0666  -0.0389 -0.0033 111 LEU A N   
1702 C CA  . LEU A 108 ? 0.4680 0.4276 0.4404 0.0588  -0.0528 -0.0219 111 LEU A CA  
1703 C C   . LEU A 108 ? 0.6421 0.6185 0.6278 0.0480  -0.0605 -0.0133 111 LEU A C   
1704 O O   . LEU A 108 ? 0.5351 0.5150 0.5345 0.0447  -0.0605 -0.0202 111 LEU A O   
1705 C CB  . LEU A 108 ? 0.5319 0.4714 0.4930 0.0584  -0.0691 -0.0366 111 LEU A CB  
1706 C CG  . LEU A 108 ? 0.7087 0.6282 0.6615 0.0648  -0.0688 -0.0547 111 LEU A CG  
1707 C CD1 . LEU A 108 ? 0.7266 0.6309 0.6666 0.0649  -0.0867 -0.0650 111 LEU A CD1 
1708 C CD2 . LEU A 108 ? 0.6716 0.5915 0.6453 0.0622  -0.0665 -0.0695 111 LEU A CD2 
1720 N N   . VAL A 109 ? 0.5752 0.5598 0.5556 0.0422  -0.0671 0.0019  112 VAL A N   
1721 C CA  . VAL A 109 ? 0.5686 0.5652 0.5575 0.0294  -0.0765 0.0097  112 VAL A CA  
1722 C C   . VAL A 109 ? 0.4906 0.5109 0.4928 0.0285  -0.0657 0.0224  112 VAL A C   
1723 O O   . VAL A 109 ? 0.4956 0.5201 0.5050 0.0206  -0.0715 0.0202  112 VAL A O   
1724 C CB  . VAL A 109 ? 0.4394 0.4391 0.4202 0.0221  -0.0850 0.0244  112 VAL A CB  
1725 C CG1 . VAL A 109 ? 0.6329 0.6463 0.6213 0.0067  -0.0937 0.0353  112 VAL A CG1 
1726 C CG2 . VAL A 109 ? 0.4539 0.4287 0.4205 0.0232  -0.0972 0.0110  112 VAL A CG2 
1736 N N   . GLY A 110 ? 0.4383 0.4728 0.4415 0.0377  -0.0490 0.0365  113 GLY A N   
1737 C CA  . GLY A 110 ? 0.3708 0.4304 0.3867 0.0390  -0.0376 0.0508  113 GLY A CA  
1738 C C   . GLY A 110 ? 0.6211 0.6734 0.6432 0.0443  -0.0301 0.0356  113 GLY A C   
1739 O O   . GLY A 110 ? 0.4831 0.5491 0.5146 0.0404  -0.0301 0.0398  113 GLY A O   
1743 N N   . ALA A 111 ? 0.4801 0.5102 0.4966 0.0530  -0.0237 0.0181  114 ALA A N   
1744 C CA  . ALA A 111 ? 0.4315 0.4528 0.4564 0.0570  -0.0167 0.0027  114 ALA A CA  
1745 C C   . ALA A 111 ? 0.5482 0.5609 0.5793 0.0479  -0.0324 -0.0106 114 ALA A C   
1746 O O   . ALA A 111 ? 0.4325 0.4461 0.4726 0.0490  -0.0274 -0.0154 114 ALA A O   
1747 C CB  . ALA A 111 ? 0.4821 0.4809 0.5003 0.0655  -0.0085 -0.0130 114 ALA A CB  
1753 N N   . ASP A 112 ? 0.4184 0.4205 0.4427 0.0403  -0.0498 -0.0158 115 ASP A N   
1754 C CA  . ASP A 112 ? 0.4315 0.4227 0.4576 0.0328  -0.0634 -0.0260 115 ASP A CA  
1755 C C   . ASP A 112 ? 0.5749 0.5792 0.6014 0.0249  -0.0666 -0.0139 115 ASP A C   
1756 O O   . ASP A 112 ? 0.5331 0.5294 0.5619 0.0238  -0.0681 -0.0214 115 ASP A O   
1757 C CB  . ASP A 112 ? 0.4053 0.3824 0.4208 0.0276  -0.0796 -0.0309 115 ASP A CB  
1758 C CG  . ASP A 112 ? 0.5067 0.4669 0.5219 0.0233  -0.0911 -0.0431 115 ASP A CG  
1759 O OD1 . ASP A 112 ? 0.5503 0.5096 0.5591 0.0146  -0.0982 -0.0368 115 ASP A OD1 
1760 O OD2 . ASP A 112 ? 0.5987 0.5456 0.6190 0.0287  -0.0930 -0.0583 115 ASP A OD2 
1765 N N   . GLY A 113 ? 0.4510 0.4752 0.4750 0.0192  -0.0680 0.0056  116 GLY A N   
1766 C CA  . GLY A 113 ? 0.3877 0.4269 0.4122 0.0096  -0.0736 0.0180  116 GLY A CA  
1767 C C   . GLY A 113 ? 0.5160 0.5675 0.5489 0.0175  -0.0599 0.0207  116 GLY A C   
1768 O O   . GLY A 113 ? 0.4906 0.5407 0.5205 0.0126  -0.0652 0.0200  116 GLY A O   
1772 N N   . ILE A 114 ? 0.4902 0.5510 0.5304 0.0304  -0.0413 0.0239  117 ILE A N   
1773 C CA  . ILE A 114 ? 0.4140 0.4829 0.4613 0.0403  -0.0253 0.0251  117 ILE A CA  
1774 C C   . ILE A 114 ? 0.3952 0.4398 0.4434 0.0432  -0.0251 0.0046  117 ILE A C   
1775 O O   . ILE A 114 ? 0.4823 0.5287 0.5313 0.0455  -0.0211 0.0051  117 ILE A O   
1776 C CB  . ILE A 114 ? 0.6362 0.7118 0.6872 0.0544  -0.0036 0.0308  117 ILE A CB  
1777 C CG1 . ILE A 114 ? 0.5508 0.6533 0.6022 0.0546  0.0000  0.0555  117 ILE A CG1 
1778 C CG2 . ILE A 114 ? 0.5143 0.5930 0.5715 0.0660  0.0152  0.0301  117 ILE A CG2 
1779 C CD1 . ILE A 114 ? 0.5592 0.6932 0.6173 0.0482  -0.0050 0.0764  117 ILE A CD1 
1791 N N   . MET A 115 ? 0.3940 0.4163 0.4423 0.0439  -0.0291 -0.0127 118 MET A N   
1792 C CA  . MET A 115 ? 0.4110 0.4125 0.4645 0.0473  -0.0279 -0.0306 118 MET A CA  
1793 C C   . MET A 115 ? 0.5482 0.5415 0.5932 0.0405  -0.0397 -0.0310 118 MET A C   
1794 O O   . MET A 115 ? 0.4468 0.4336 0.4937 0.0460  -0.0319 -0.0349 118 MET A O   
1795 C CB  . MET A 115 ? 0.4091 0.3929 0.4652 0.0472  -0.0346 -0.0460 118 MET A CB  
1796 C CG  . MET A 115 ? 0.5285 0.4932 0.5908 0.0482  -0.0387 -0.0612 118 MET A CG  
1797 S SD  . MET A 115 ? 0.5542 0.5058 0.6297 0.0519  -0.0400 -0.0791 118 MET A SD  
1798 C CE  . MET A 115 ? 0.6123 0.5585 0.6730 0.0441  -0.0615 -0.0783 118 MET A CE  
1808 N N   . ILE A 116 ? 0.5011 0.4907 0.5337 0.0287  -0.0576 -0.0272 119 ILE A N   
1809 C CA  . ILE A 116 ? 0.4894 0.4636 0.5076 0.0212  -0.0695 -0.0290 119 ILE A CA  
1810 C C   . ILE A 116 ? 0.5080 0.4984 0.5193 0.0167  -0.0701 -0.0148 119 ILE A C   
1811 O O   . ILE A 116 ? 0.4804 0.4571 0.4802 0.0167  -0.0719 -0.0178 119 ILE A O   
1812 C CB  . ILE A 116 ? 0.6067 0.5679 0.6114 0.0096  -0.0876 -0.0298 119 ILE A CB  
1813 C CG1 . ILE A 116 ? 0.5641 0.5102 0.5750 0.0156  -0.0881 -0.0437 119 ILE A CG1 
1814 C CG2 . ILE A 116 ? 0.5510 0.4906 0.5348 0.0011  -0.0993 -0.0313 119 ILE A CG2 
1815 C CD1 . ILE A 116 ? 0.4426 0.3711 0.4617 0.0256  -0.0807 -0.0584 119 ILE A CD1 
1827 N N   . GLY A 117 ? 0.4419 0.4616 0.4593 0.0138  -0.0683 0.0019  120 GLY A N   
1828 C CA  . GLY A 117 ? 0.5627 0.6036 0.5764 0.0087  -0.0710 0.0178  120 GLY A CA  
1829 C C   . GLY A 117 ? 0.5674 0.6125 0.5852 0.0223  -0.0547 0.0172  120 GLY A C   
1830 O O   . GLY A 117 ? 0.4529 0.4983 0.4593 0.0194  -0.0600 0.0216  120 GLY A O   
1834 N N   . THR A 118 ? 0.3761 0.4223 0.4081 0.0372  -0.0347 0.0117  121 THR A N   
1835 C CA  . THR A 118 ? 0.4594 0.5058 0.4953 0.0511  -0.0168 0.0104  121 THR A CA  
1836 C C   . THR A 118 ? 0.6422 0.6569 0.6714 0.0549  -0.0165 -0.0066 121 THR A C   
1837 O O   . THR A 118 ? 0.4781 0.4890 0.5027 0.0634  -0.0073 -0.0060 121 THR A O   
1838 C CB  . THR A 118 ? 0.4354 0.4891 0.4866 0.0648  0.0058  0.0099  121 THR A CB  
1839 O OG1 . THR A 118 ? 0.4593 0.4927 0.5163 0.0649  0.0056  -0.0064 121 THR A OG1 
1840 C CG2 . THR A 118 ? 0.4227 0.5076 0.4781 0.0652  0.0102  0.0304  121 THR A CG2 
1848 N N   . GLY A 119 ? 0.4298 0.4216 0.4578 0.0503  -0.0255 -0.0205 122 GLY A N   
1849 C CA  . GLY A 119 ? 0.4170 0.3790 0.4381 0.0544  -0.0254 -0.0338 122 GLY A CA  
1850 C C   . GLY A 119 ? 0.5495 0.4988 0.5444 0.0470  -0.0391 -0.0296 122 GLY A C   
1851 O O   . GLY A 119 ? 0.5286 0.4568 0.5131 0.0549  -0.0330 -0.0352 122 GLY A O   
1855 N N   . LEU A 120 ? 0.5211 0.4808 0.5033 0.0314  -0.0574 -0.0196 123 LEU A N   
1856 C CA  . LEU A 120 ? 0.6467 0.5946 0.6011 0.0213  -0.0724 -0.0148 123 LEU A CA  
1857 C C   . LEU A 120 ? 0.5413 0.5061 0.4924 0.0278  -0.0650 -0.0045 123 LEU A C   
1858 O O   . LEU A 120 ? 0.5616 0.5048 0.4893 0.0300  -0.0675 -0.0072 123 LEU A O   
1859 C CB  . LEU A 120 ? 0.5458 0.5039 0.4917 0.0010  -0.0937 -0.0053 123 LEU A CB  
1860 C CG  . LEU A 120 ? 0.5325 0.4814 0.4493 -0.0143 -0.1126 0.0013  123 LEU A CG  
1861 C CD1 . LEU A 120 ? 0.5789 0.4790 0.4652 -0.0128 -0.1166 -0.0128 123 LEU A CD1 
1862 C CD2 . LEU A 120 ? 0.6926 0.6563 0.6081 -0.0355 -0.1317 0.0123  123 LEU A CD2 
1874 N N   . VAL A 121 ? 0.4326 0.4340 0.4039 0.0325  -0.0550 0.0080  124 VAL A N   
1875 C CA  . VAL A 121 ? 0.5180 0.5386 0.4875 0.0411  -0.0462 0.0195  124 VAL A CA  
1876 C C   . VAL A 121 ? 0.5668 0.5641 0.5343 0.0600  -0.0264 0.0083  124 VAL A C   
1877 O O   . VAL A 121 ? 0.4876 0.4785 0.4375 0.0658  -0.0250 0.0115  124 VAL A O   
1878 C CB  . VAL A 121 ? 0.5351 0.5978 0.5280 0.0457  -0.0351 0.0359  124 VAL A CB  
1879 C CG1 . VAL A 121 ? 0.5712 0.6506 0.5657 0.0614  -0.0182 0.0456  124 VAL A CG1 
1880 C CG2 . VAL A 121 ? 0.7981 0.8884 0.7920 0.0275  -0.0548 0.0523  124 VAL A CG2 
1890 N N   . GLY A 122 ? 0.5078 0.4917 0.4930 0.0697  -0.0111 -0.0045 125 GLY A N   
1891 C CA  . GLY A 122 ? 0.5950 0.5581 0.5834 0.0870  0.0093  -0.0142 125 GLY A CA  
1892 C C   . GLY A 122 ? 0.5447 0.4706 0.5088 0.0877  0.0026  -0.0235 125 GLY A C   
1893 O O   . GLY A 122 ? 0.5469 0.4572 0.5030 0.1018  0.0166  -0.0254 125 GLY A O   
1897 N N   . ALA A 123 ? 0.5227 0.4311 0.4724 0.0740  -0.0172 -0.0287 126 ALA A N   
1898 C CA  . ALA A 123 ? 0.6441 0.5117 0.5658 0.0755  -0.0225 -0.0369 126 ALA A CA  
1899 C C   . ALA A 123 ? 0.5967 0.4554 0.4823 0.0712  -0.0337 -0.0293 126 ALA A C   
1900 O O   . ALA A 123 ? 0.6227 0.4450 0.4811 0.0790  -0.0309 -0.0349 126 ALA A O   
1901 C CB  . ALA A 123 ? 0.4870 0.3363 0.4015 0.0629  -0.0389 -0.0440 126 ALA A CB  
1907 N N   . LEU A 124 ? 0.5328 0.4233 0.4166 0.0594  -0.0464 -0.0159 127 LEU A N   
1908 C CA  . LEU A 124 ? 0.5651 0.4518 0.4155 0.0518  -0.0617 -0.0076 127 LEU A CA  
1909 C C   . LEU A 124 ? 0.6362 0.5482 0.4915 0.0655  -0.0486 0.0034  127 LEU A C   
1910 O O   . LEU A 124 ? 0.6031 0.5160 0.4316 0.0608  -0.0613 0.0114  127 LEU A O   
1911 C CB  . LEU A 124 ? 0.6864 0.5933 0.5318 0.0266  -0.0884 0.0021  127 LEU A CB  
1912 C CG  . LEU A 124 ? 0.7849 0.6645 0.6195 0.0117  -0.1031 -0.0072 127 LEU A CG  
1913 C CD1 . LEU A 124 ? 0.7139 0.6173 0.5485 -0.0130 -0.1267 0.0043  127 LEU A CD1 
1914 C CD2 . LEU A 124 ? 0.6683 0.4925 0.4604 0.0130  -0.1081 -0.0186 127 LEU A CD2 
1926 N N   . THR A 125 ? 0.5546 0.4855 0.4417 0.0821  -0.0237 0.0039  128 THR A N   
1927 C CA  . THR A 125 ? 0.5448 0.5008 0.4382 0.0968  -0.0081 0.0156  128 THR A CA  
1928 C C   . THR A 125 ? 0.5675 0.4902 0.4358 0.1142  0.0043  0.0100  128 THR A C   
1929 O O   . THR A 125 ? 0.6457 0.5340 0.5138 0.1243  0.0175  -0.0035 128 THR A O   
1930 C CB  . THR A 125 ? 0.4396 0.4194 0.3711 0.1086  0.0160  0.0170  128 THR A CB  
1931 O OG1 . THR A 125 ? 0.5376 0.5544 0.4867 0.0958  0.0061  0.0285  128 THR A OG1 
1932 C CG2 . THR A 125 ? 0.4742 0.4649 0.4096 0.1299  0.0404  0.0247  128 THR A CG2 
1940 N N   . LYS A 126 ? 0.5725 0.5064 0.4201 0.1184  0.0004  0.0216  129 LYS A N   
1941 C CA  . LYS A 126 ? 0.6838 0.5838 0.5004 0.1351  0.0102  0.0177  129 LYS A CA  
1942 C C   . LYS A 126 ? 0.7541 0.6601 0.5899 0.1614  0.0442  0.0198  129 LYS A C   
1943 O O   . LYS A 126 ? 0.7881 0.6590 0.6075 0.1788  0.0605  0.0129  129 LYS A O   
1944 C CB  . LYS A 126 ? 0.7423 0.6472 0.5214 0.1268  -0.0127 0.0285  129 LYS A CB  
1945 C CG  . LYS A 126 ? 0.8531 0.7740 0.6248 0.0971  -0.0469 0.0338  129 LYS A CG  
1946 C CD  . LYS A 126 ? 1.0667 0.9743 0.7918 0.0864  -0.0727 0.0388  129 LYS A CD  
1947 C CE  . LYS A 126 ? 1.1370 1.1010 0.8737 0.0776  -0.0868 0.0600  129 LYS A CE  
1948 N NZ  . LYS A 126 ? 1.5092 1.4627 1.2011 0.0633  -0.1164 0.0650  129 LYS A NZ  
1962 N N   . VAL A 127 ? 0.5969 0.5438 0.4652 0.1654  0.0569  0.0299  130 VAL A N   
1963 C CA  . VAL A 127 ? 0.6374 0.5877 0.5244 0.1894  0.0910  0.0316  130 VAL A CA  
1964 C C   . VAL A 127 ? 0.7591 0.6892 0.6739 0.1926  0.1085  0.0161  130 VAL A C   
1965 O O   . VAL A 127 ? 0.6690 0.6152 0.6091 0.1810  0.1044  0.0134  130 VAL A O   
1966 C CB  . VAL A 127 ? 0.6946 0.6926 0.6015 0.1935  0.0994  0.0492  130 VAL A CB  
1967 C CG1 . VAL A 127 ? 0.6582 0.6540 0.5827 0.2178  0.1369  0.0498  130 VAL A CG1 
1968 C CG2 . VAL A 127 ? 0.7110 0.7332 0.5932 0.1904  0.0808  0.0663  130 VAL A CG2 
1978 N N   . TYR A 128 ? 0.3942 0.5698 0.4152 0.0584  -0.0165 0.0454  131 TYR A N   
1979 C CA  . TYR A 128 ? 0.4381 0.6452 0.4628 0.0387  -0.0085 0.0409  131 TYR A CA  
1980 C C   . TYR A 128 ? 0.4647 0.6201 0.4811 0.0092  0.0024  0.0554  131 TYR A C   
1981 O O   . TYR A 128 ? 0.4293 0.5826 0.4607 0.0005  0.0017  0.0455  131 TYR A O   
1982 C CB  . TYR A 128 ? 0.3770 0.6473 0.3834 0.0315  -0.0005 0.0494  131 TYR A CB  
1983 C CG  . TYR A 128 ? 0.4862 0.8025 0.4989 0.0114  0.0072  0.0500  131 TYR A CG  
1984 C CD1 . TYR A 128 ? 0.5819 0.9413 0.6181 0.0272  0.0012  0.0278  131 TYR A CD1 
1985 C CD2 . TYR A 128 ? 0.5745 0.8923 0.5714 -0.0242 0.0196  0.0752  131 TYR A CD2 
1986 C CE1 . TYR A 128 ? 0.5529 0.9612 0.5974 0.0094  0.0087  0.0322  131 TYR A CE1 
1987 C CE2 . TYR A 128 ? 0.4551 0.8204 0.4604 -0.0455 0.0245  0.0796  131 TYR A CE2 
1988 C CZ  . TYR A 128 ? 0.5667 0.9801 0.5963 -0.0278 0.0197  0.0588  131 TYR A CZ  
1989 O OH  . TYR A 128 ? 0.7140 1.1812 0.7546 -0.0480 0.0249  0.0666  131 TYR A OH  
1999 N N   A SER A 129 ? 0.4004 0.5114 0.3907 -0.0058 0.0123  0.0789  132 SER A N   
2000 N N   B SER A 129 ? 0.4016 0.5129 0.3919 -0.0059 0.0123  0.0789  132 SER A N   
2001 C CA  A SER A 129 ? 0.5603 0.6141 0.5338 -0.0344 0.0222  0.0910  132 SER A CA  
2002 C CA  B SER A 129 ? 0.5601 0.6136 0.5335 -0.0342 0.0222  0.0911  132 SER A CA  
2003 C C   A SER A 129 ? 0.5399 0.5407 0.5257 -0.0233 0.0186  0.0807  132 SER A C   
2004 C C   B SER A 129 ? 0.5399 0.5418 0.5262 -0.0231 0.0184  0.0803  132 SER A C   
2005 O O   A SER A 129 ? 0.6240 0.5935 0.6014 -0.0435 0.0229  0.0793  132 SER A O   
2006 O O   B SER A 129 ? 0.6189 0.5923 0.5980 -0.0432 0.0224  0.0783  132 SER A O   
2007 C CB  A SER A 129 ? 0.6336 0.6426 0.5761 -0.0475 0.0334  0.1183  132 SER A CB  
2008 C CB  B SER A 129 ? 0.6331 0.6400 0.5758 -0.0462 0.0333  0.1182  132 SER A CB  
2009 O OG  A SER A 129 ? 0.8212 0.7872 0.7633 -0.0223 0.0325  0.1246  132 SER A OG  
2010 O OG  B SER A 129 ? 0.6354 0.6920 0.5670 -0.0611 0.0382  0.1330  132 SER A OG  
2021 N N   . TYR A 130 ? 0.4767 0.4684 0.4819 0.0081  0.0098  0.0749  133 TYR A N   
2022 C CA  . TYR A 130 ? 0.4025 0.3504 0.4233 0.0214  0.0070  0.0701  133 TYR A CA  
2023 C C   . TYR A 130 ? 0.4841 0.4661 0.5339 0.0224  -0.0008 0.0489  133 TYR A C   
2024 O O   . TYR A 130 ? 0.4648 0.4134 0.5217 0.0243  0.0005  0.0468  133 TYR A O   
2025 C CB  . TYR A 130 ? 0.5509 0.4875 0.5906 0.0527  -0.0024 0.0749  133 TYR A CB  
2026 C CG  . TYR A 130 ? 0.6484 0.5418 0.6632 0.0559  0.0070  0.1006  133 TYR A CG  
2027 C CD1 . TYR A 130 ? 0.7739 0.6212 0.7512 0.0340  0.0244  0.1174  133 TYR A CD1 
2028 C CD2 . TYR A 130 ? 0.5961 0.4942 0.6254 0.0801  -0.0027 0.1095  133 TYR A CD2 
2029 C CE1 . TYR A 130 ? 0.7755 0.5824 0.7314 0.0393  0.0344  0.1429  133 TYR A CE1 
2030 C CE2 . TYR A 130 ? 0.6429 0.5068 0.6520 0.0844  0.0068  0.1364  133 TYR A CE2 
2031 C CZ  . TYR A 130 ? 0.8774 0.6956 0.8501 0.0654  0.0266  0.1533  133 TYR A CZ  
2032 O OH  . TYR A 130 ? 0.9544 0.7372 0.9078 0.0717  0.0376  0.1818  133 TYR A OH  
2042 N N   . ARG A 131 ? 0.5178 0.5667 0.5834 0.0237  -0.0077 0.0345  134 ARG A N   
2043 C CA  . ARG A 131 ? 0.4543 0.5391 0.5490 0.0260  -0.0137 0.0167  134 ARG A CA  
2044 C C   . ARG A 131 ? 0.4651 0.5324 0.5466 -0.0028 -0.0048 0.0204  134 ARG A C   
2045 O O   . ARG A 131 ? 0.4568 0.5263 0.5601 0.0008  -0.0082 0.0112  134 ARG A O   
2046 C CB  . ARG A 131 ? 0.3817 0.5404 0.4873 0.0319  -0.0183 0.0040  134 ARG A CB  
2047 C CG  . ARG A 131 ? 0.4991 0.6747 0.6142 0.0620  -0.0307 -0.0057 134 ARG A CG  
2048 C CD  . ARG A 131 ? 0.4410 0.6854 0.5544 0.0695  -0.0318 -0.0175 134 ARG A CD  
2049 N NE  . ARG A 131 ? 0.4246 0.7072 0.5670 0.0775  -0.0355 -0.0345 134 ARG A NE  
2050 C CZ  . ARG A 131 ? 0.3279 0.6134 0.4999 0.1046  -0.0501 -0.0538 134 ARG A CZ  
2051 N NH1 . ARG A 131 ? 0.4163 0.6703 0.5940 0.1243  -0.0649 -0.0590 134 ARG A NH1 
2052 N NH2 . ARG A 131 ? 0.3259 0.6444 0.5222 0.1100  -0.0504 -0.0655 134 ARG A NH2 
2066 N N   . PHE A 132 ? 0.4320 0.4816 0.4781 -0.0327 0.0054  0.0347  135 PHE A N   
2067 C CA  . PHE A 132 ? 0.4914 0.5202 0.5193 -0.0650 0.0106  0.0377  135 PHE A CA  
2068 C C   . PHE A 132 ? 0.5579 0.5025 0.5635 -0.0648 0.0155  0.0420  135 PHE A C   
2069 O O   . PHE A 132 ? 0.5462 0.4688 0.5387 -0.0843 0.0166  0.0385  135 PHE A O   
2070 C CB  . PHE A 132 ? 0.5117 0.5543 0.5118 -0.1000 0.0168  0.0530  135 PHE A CB  
2071 C CG  . PHE A 132 ? 0.4410 0.5727 0.4603 -0.0991 0.0147  0.0522  135 PHE A CG  
2072 C CD1 . PHE A 132 ? 0.7060 0.8984 0.7475 -0.1079 0.0116  0.0447  135 PHE A CD1 
2073 C CD2 . PHE A 132 ? 0.5416 0.6991 0.5556 -0.0867 0.0169  0.0602  135 PHE A CD2 
2074 C CE1 . PHE A 132 ? 0.6223 0.8981 0.6798 -0.1022 0.0121  0.0458  135 PHE A CE1 
2075 C CE2 . PHE A 132 ? 0.7090 0.9492 0.7361 -0.0811 0.0167  0.0594  135 PHE A CE2 
2076 C CZ  . PHE A 132 ? 0.6506 0.9493 0.6993 -0.0877 0.0151  0.0524  135 PHE A CZ  
2086 N N   . VAL A 133 ? 0.5562 0.4550 0.5552 -0.0418 0.0185  0.0506  136 VAL A N   
2087 C CA  . VAL A 133 ? 0.5233 0.3480 0.5053 -0.0315 0.0246  0.0556  136 VAL A CA  
2088 C C   . VAL A 133 ? 0.5697 0.4109 0.5868 -0.0104 0.0176  0.0433  136 VAL A C   
2089 O O   . VAL A 133 ? 0.5982 0.4015 0.6008 -0.0139 0.0218  0.0412  136 VAL A O   
2090 C CB  . VAL A 133 ? 0.7502 0.5331 0.7227 -0.0089 0.0301  0.0725  136 VAL A CB  
2091 C CG1 . VAL A 133 ? 0.6697 0.3850 0.6305 0.0107  0.0377  0.0800  136 VAL A CG1 
2092 C CG2 . VAL A 133 ? 0.6438 0.4038 0.5793 -0.0312 0.0390  0.0881  136 VAL A CG2 
2102 N N   . TRP A 134 ? 0.4626 0.3593 0.5251 0.0123  0.0063  0.0352  137 TRP A N   
2103 C CA  . TRP A 134 ? 0.5975 0.5138 0.6998 0.0323  -0.0015 0.0263  137 TRP A CA  
2104 C C   . TRP A 134 ? 0.5947 0.5507 0.7048 0.0124  -0.0030 0.0136  137 TRP A C   
2105 O O   . TRP A 134 ? 0.4706 0.4235 0.5960 0.0193  -0.0040 0.0103  137 TRP A O   
2106 C CB  . TRP A 134 ? 0.4327 0.3902 0.5796 0.0600  -0.0156 0.0213  137 TRP A CB  
2107 C CG  . TRP A 134 ? 0.4459 0.3685 0.5906 0.0800  -0.0169 0.0366  137 TRP A CG  
2108 C CD1 . TRP A 134 ? 0.4803 0.4126 0.6169 0.0834  -0.0206 0.0406  137 TRP A CD1 
2109 C CD2 . TRP A 134 ? 0.5546 0.4471 0.6690 0.0871  -0.0127 0.0428  137 TRP A CD2 
2110 N NE1 . TRP A 134 ? 0.4833 0.3854 0.6061 0.0966  -0.0202 0.0536  137 TRP A NE1 
2111 C CE2 . TRP A 134 ? 0.4399 0.3247 0.5362 0.0939  -0.0158 0.0495  137 TRP A CE2 
2112 C CE3 . TRP A 134 ? 0.6199 0.5017 0.7130 0.0860  -0.0095 0.0395  137 TRP A CE3 
2113 C CZ2 . TRP A 134 ? 0.5203 0.3888 0.5852 0.0975  -0.0183 0.0505  137 TRP A CZ2 
2114 C CZ3 . TRP A 134 ? 0.6463 0.5151 0.7153 0.0909  -0.0114 0.0429  137 TRP A CZ3 
2115 C CH2 . TRP A 134 ? 0.7180 0.5837 0.7860 0.0950  -0.0138 0.0507  137 TRP A CH2 
2126 N N   . TRP A 135 ? 0.4354 0.4337 0.5367 -0.0117 -0.0029 0.0095  138 TRP A N   
2127 C CA  . TRP A 135 ? 0.4577 0.4954 0.5630 -0.0352 -0.0035 0.0027  138 TRP A CA  
2128 C C   . TRP A 135 ? 0.5299 0.5124 0.5971 -0.0590 0.0024  0.0064  138 TRP A C   
2129 O O   . TRP A 135 ? 0.4542 0.4524 0.5314 -0.0650 0.0000  0.0002  138 TRP A O   
2130 C CB  . TRP A 135 ? 0.4759 0.5679 0.5750 -0.0576 -0.0028 0.0046  138 TRP A CB  
2131 C CG  . TRP A 135 ? 0.3881 0.5252 0.4904 -0.0861 -0.0034 0.0034  138 TRP A CG  
2132 C CD1 . TRP A 135 ? 0.3718 0.5822 0.5125 -0.0785 -0.0076 -0.0039 138 TRP A CD1 
2133 C CD2 . TRP A 135 ? 0.4588 0.5705 0.5241 -0.1276 -0.0008 0.0114  138 TRP A CD2 
2134 N NE1 . TRP A 135 ? 0.4156 0.6546 0.5482 -0.1127 -0.0071 0.0015  138 TRP A NE1 
2135 C CE2 . TRP A 135 ? 0.5177 0.6960 0.6035 -0.1451 -0.0046 0.0102  138 TRP A CE2 
2136 C CE3 . TRP A 135 ? 0.7141 0.7506 0.7302 -0.1519 0.0035  0.0201  138 TRP A CE3 
2137 C CZ2 . TRP A 135 ? 0.5446 0.7197 0.6041 -0.1889 -0.0067 0.0176  138 TRP A CZ2 
2138 C CZ3 . TRP A 135 ? 0.6502 0.6758 0.6375 -0.1949 0.0012  0.0248  138 TRP A CZ3 
2139 C CH2 . TRP A 135 ? 0.6769 0.7729 0.6862 -0.2146 -0.0051 0.0238  138 TRP A CH2 
2150 N N   . ALA A 136 ? 0.4571 0.3728 0.4782 -0.0721 0.0100  0.0162  139 ALA A N   
2151 C CA  . ALA A 136 ? 0.5509 0.4036 0.5261 -0.0957 0.0147  0.0170  139 ALA A CA  
2152 C C   . ALA A 136 ? 0.6794 0.4910 0.6558 -0.0681 0.0175  0.0139  139 ALA A C   
2153 O O   . ALA A 136 ? 0.6082 0.4015 0.5649 -0.0808 0.0172  0.0075  139 ALA A O   
2154 C CB  . ALA A 136 ? 0.5985 0.3845 0.5239 -0.1138 0.0225  0.0289  139 ALA A CB  
2160 N N   . ILE A 137 ? 0.5978 0.3977 0.5971 -0.0303 0.0196  0.0203  140 ILE A N   
2161 C CA  . ILE A 137 ? 0.6098 0.3809 0.6173 -0.0005 0.0229  0.0228  140 ILE A CA  
2162 C C   . ILE A 137 ? 0.5391 0.3725 0.5916 0.0060  0.0142  0.0133  140 ILE A C   
2163 O O   . ILE A 137 ? 0.5430 0.3595 0.5863 0.0106  0.0169  0.0115  140 ILE A O   
2164 C CB  . ILE A 137 ? 0.6628 0.4185 0.6924 0.0363  0.0248  0.0370  140 ILE A CB  
2165 C CG1 . ILE A 137 ? 0.7073 0.4127 0.6900 0.0306  0.0305  0.0466  140 ILE A CG1 
2166 C CG2 . ILE A 137 ? 0.6373 0.4182 0.6758 0.0600  0.0148  0.0352  140 ILE A CG2 
2167 C CD1 . ILE A 137 ? 0.8177 0.5524 0.8193 0.0500  0.0198  0.0537  140 ILE A CD1 
2179 N N   . SER A 138 ? 0.4388 0.3446 0.5390 0.0084  0.0044  0.0076  141 SER A N   
2180 C CA  . SER A 138 ? 0.4747 0.4418 0.6202 0.0147  -0.0031 0.0002  141 SER A CA  
2181 C C   . SER A 138 ? 0.5011 0.4800 0.6214 -0.0182 -0.0021 -0.0064 141 SER A C   
2182 O O   . SER A 138 ? 0.4405 0.4350 0.5750 -0.0125 -0.0033 -0.0083 141 SER A O   
2183 C CB  . SER A 138 ? 0.4374 0.4726 0.6297 0.0229  -0.0126 -0.0060 141 SER A CB  
2184 O OG  . SER A 138 ? 0.3878 0.4814 0.6242 0.0294  -0.0187 -0.0120 141 SER A OG  
2190 N N   . THR A 139 ? 0.4769 0.4514 0.5607 -0.0541 -0.0009 -0.0077 142 THR A N   
2191 C CA  . THR A 139 ? 0.4590 0.4476 0.5192 -0.0910 -0.0034 -0.0118 142 THR A CA  
2192 C C   . THR A 139 ? 0.6631 0.5789 0.6737 -0.0971 0.0006  -0.0139 142 THR A C   
2193 O O   . THR A 139 ? 0.5659 0.4981 0.5685 -0.1142 -0.0036 -0.0191 142 THR A O   
2194 C CB  . THR A 139 ? 0.6450 0.6447 0.6799 -0.1294 -0.0045 -0.0079 142 THR A CB  
2195 O OG1 . THR A 139 ? 0.4683 0.5458 0.5475 -0.1210 -0.0073 -0.0068 142 THR A OG1 
2196 C CG2 . THR A 139 ? 0.6681 0.6757 0.6749 -0.1731 -0.0100 -0.0090 142 THR A CG2 
2204 N N   . ALA A 140 ? 0.5823 0.4182 0.5570 -0.0820 0.0091  -0.0094 143 ALA A N   
2205 C CA  . ALA A 140 ? 0.6245 0.3860 0.5479 -0.0794 0.0151  -0.0122 143 ALA A CA  
2206 C C   . ALA A 140 ? 0.5845 0.3712 0.5407 -0.0458 0.0158  -0.0122 143 ALA A C   
2207 O O   . ALA A 140 ? 0.7061 0.4723 0.6317 -0.0517 0.0161  -0.0184 143 ALA A O   
2208 C CB  . ALA A 140 ? 0.6805 0.3541 0.5616 -0.0642 0.0267  -0.0043 143 ALA A CB  
2214 N N   . ALA A 141 ? 0.6103 0.4418 0.6284 -0.0111 0.0148  -0.0044 144 ALA A N   
2215 C CA  . ALA A 141 ? 0.6520 0.5161 0.7113 0.0200  0.0142  0.0000  144 ALA A CA  
2216 C C   . ALA A 141 ? 0.5943 0.5266 0.6773 0.0008  0.0059  -0.0080 144 ALA A C   
2217 O O   . ALA A 141 ? 0.5429 0.4825 0.6265 0.0111  0.0070  -0.0072 144 ALA A O   
2218 C CB  . ALA A 141 ? 0.4078 0.3064 0.5321 0.0553  0.0108  0.0110  144 ALA A CB  
2224 N N   . MET A 142 ? 0.4975 0.4843 0.6003 -0.0253 -0.0016 -0.0134 145 MET A N   
2225 C CA  . MET A 142 ? 0.4865 0.5434 0.6127 -0.0444 -0.0086 -0.0174 145 MET A CA  
2226 C C   . MET A 142 ? 0.4883 0.5121 0.5543 -0.0769 -0.0095 -0.0236 145 MET A C   
2227 O O   . MET A 142 ? 0.5473 0.6077 0.6238 -0.0790 -0.0129 -0.0245 145 MET A O   
2228 C CB  . MET A 142 ? 0.6793 0.7991 0.8324 -0.0646 -0.0140 -0.0188 145 MET A CB  
2229 C CG  . MET A 142 ? 0.4462 0.6526 0.6382 -0.0758 -0.0198 -0.0184 145 MET A CG  
2230 S SD  . MET A 142 ? 0.4430 0.7217 0.6515 -0.1040 -0.0233 -0.0165 145 MET A SD  
2231 C CE  . MET A 142 ? 0.4153 0.6423 0.5481 -0.1580 -0.0252 -0.0158 145 MET A CE  
2241 N N   . LEU A 143 ? 0.4413 0.3942 0.4428 -0.1033 -0.0077 -0.0278 146 LEU A N   
2242 C CA  . LEU A 143 ? 0.5540 0.4654 0.4917 -0.1385 -0.0120 -0.0361 146 LEU A CA  
2243 C C   . LEU A 143 ? 0.6394 0.5027 0.5469 -0.1123 -0.0062 -0.0398 146 LEU A C   
2244 O O   . LEU A 143 ? 0.6259 0.4866 0.4998 -0.1325 -0.0122 -0.0476 146 LEU A O   
2245 C CB  . LEU A 143 ? 0.7619 0.5990 0.6382 -0.1707 -0.0120 -0.0385 146 LEU A CB  
2246 C CG  . LEU A 143 ? 0.8768 0.7648 0.7701 -0.2086 -0.0196 -0.0329 146 LEU A CG  
2247 C CD1 . LEU A 143 ? 0.8758 0.6901 0.7226 -0.2268 -0.0162 -0.0298 146 LEU A CD1 
2248 C CD2 . LEU A 143 ? 0.6540 0.5896 0.5397 -0.2538 -0.0331 -0.0344 146 LEU A CD2 
2260 N N   . TYR A 144 ? 0.6719 0.5001 0.5897 -0.0671 0.0053  -0.0327 147 TYR A N   
2261 C CA  . TYR A 144 ? 0.7530 0.5514 0.6524 -0.0345 0.0129  -0.0312 147 TYR A CA  
2262 C C   . TYR A 144 ? 0.7097 0.5963 0.6666 -0.0225 0.0076  -0.0267 147 TYR A C   
2263 O O   . TYR A 144 ? 0.6752 0.5560 0.6052 -0.0174 0.0084  -0.0300 147 TYR A O   
2264 C CB  . TYR A 144 ? 0.7829 0.5407 0.6939 0.0126  0.0261  -0.0176 147 TYR A CB  
2265 C CG  . TYR A 144 ? 0.6098 0.3562 0.5168 0.0530  0.0353  -0.0096 147 TYR A CG  
2266 C CD1 . TYR A 144 ? 0.7778 0.4488 0.6039 0.0544  0.0428  -0.0186 147 TYR A CD1 
2267 C CD2 . TYR A 144 ? 0.6206 0.4327 0.6037 0.0895  0.0358  0.0074  147 TYR A CD2 
2268 C CE1 . TYR A 144 ? 0.9224 0.5875 0.7420 0.0949  0.0529  -0.0097 147 TYR A CE1 
2269 C CE2 . TYR A 144 ? 0.7496 0.5591 0.7329 0.1272  0.0447  0.0193  147 TYR A CE2 
2270 C CZ  . TYR A 144 ? 0.8619 0.6005 0.7627 0.1312  0.0543  0.0111  147 TYR A CZ  
2271 O OH  . TYR A 144 ? 0.9800 0.7233 0.8794 0.1702  0.0641  0.0241  147 TYR A OH  
2281 N N   . ILE A 145 ? 0.4783 0.4459 0.5128 -0.0161 0.0024  -0.0191 148 ILE A N   
2282 C CA  . ILE A 145 ? 0.3999 0.4528 0.4952 -0.0034 -0.0022 -0.0125 148 ILE A CA  
2283 C C   . ILE A 145 ? 0.5265 0.6177 0.6001 -0.0444 -0.0114 -0.0211 148 ILE A C   
2284 O O   . ILE A 145 ? 0.3866 0.5086 0.4637 -0.0386 -0.0127 -0.0189 148 ILE A O   
2285 C CB  . ILE A 145 ? 0.5718 0.6918 0.7499 0.0134  -0.0061 -0.0042 148 ILE A CB  
2286 C CG1 . ILE A 145 ? 0.5646 0.6564 0.7725 0.0566  -0.0005 0.0079  148 ILE A CG1 
2287 C CG2 . ILE A 145 ? 0.4063 0.6175 0.6454 0.0178  -0.0117 0.0017  148 ILE A CG2 
2288 C CD1 . ILE A 145 ? 0.4468 0.5681 0.6933 0.0631  -0.0063 0.0098  148 ILE A CD1 
2300 N N   . LEU A 146 ? 0.4723 0.5672 0.5251 -0.0868 -0.0184 -0.0280 149 LEU A N   
2301 C CA  . LEU A 146 ? 0.4909 0.6271 0.5256 -0.1302 -0.0294 -0.0322 149 LEU A CA  
2302 C C   . LEU A 146 ? 0.7402 0.8114 0.6968 -0.1453 -0.0319 -0.0431 149 LEU A C   
2303 O O   . LEU A 146 ? 0.6870 0.7999 0.6380 -0.1624 -0.0400 -0.0443 149 LEU A O   
2304 C CB  . LEU A 146 ? 0.4873 0.6347 0.5121 -0.1729 -0.0362 -0.0332 149 LEU A CB  
2305 C CG  . LEU A 146 ? 0.5812 0.7941 0.6738 -0.1596 -0.0339 -0.0246 149 LEU A CG  
2306 C CD1 . LEU A 146 ? 0.6631 0.9018 0.7435 -0.2044 -0.0405 -0.0217 149 LEU A CD1 
2307 C CD2 . LEU A 146 ? 0.6024 0.9076 0.7702 -0.1335 -0.0338 -0.0161 149 LEU A CD2 
2319 N N   . TYR A 147 ? 0.5095 0.4772 0.4024 -0.1380 -0.0251 -0.0512 150 TYR A N   
2320 C CA  . TYR A 147 ? 0.8100 0.7027 0.6200 -0.1459 -0.0262 -0.0643 150 TYR A CA  
2321 C C   . TYR A 147 ? 0.9448 0.8696 0.7711 -0.1087 -0.0209 -0.0599 150 TYR A C   
2322 O O   . TYR A 147 ? 0.6466 0.5780 0.4352 -0.1266 -0.0292 -0.0681 150 TYR A O   
2323 C CB  . TYR A 147 ? 0.8166 0.5928 0.5630 -0.1327 -0.0155 -0.0707 150 TYR A CB  
2324 C CG  . TYR A 147 ? 0.9051 0.5895 0.5567 -0.1359 -0.0151 -0.0867 150 TYR A CG  
2325 C CD1 . TYR A 147 ? 1.0225 0.6631 0.6050 -0.1898 -0.0310 -0.1030 150 TYR A CD1 
2326 C CD2 . TYR A 147 ? 1.0869 0.7283 0.7166 -0.0844 0.0005  -0.0847 150 TYR A CD2 
2327 C CE1 . TYR A 147 ? 1.2887 0.8370 0.7774 -0.1921 -0.0324 -0.1212 150 TYR A CE1 
2328 C CE2 . TYR A 147 ? 1.2522 0.8066 0.7888 -0.0823 0.0024  -0.1010 150 TYR A CE2 
2329 C CZ  . TYR A 147 ? 1.2897 0.7939 0.7533 -0.1362 -0.0146 -0.1215 150 TYR A CZ  
2330 O OH  . TYR A 147 ? 1.4515 0.8608 0.8154 -0.1337 -0.0144 -0.1411 150 TYR A OH  
2340 N N   . VAL A 148 ? 0.7224 0.6696 0.6055 -0.0573 -0.0084 -0.0452 151 VAL A N   
2341 C CA  . VAL A 148 ? 0.6662 0.6473 0.5711 -0.0184 -0.0021 -0.0356 151 VAL A CA  
2342 C C   . VAL A 148 ? 0.8054 0.8888 0.7569 -0.0361 -0.0131 -0.0310 151 VAL A C   
2343 O O   . VAL A 148 ? 0.6709 0.7725 0.6037 -0.0286 -0.0139 -0.0309 151 VAL A O   
2344 C CB  . VAL A 148 ? 0.8796 0.8754 0.8498 0.0350  0.0102  -0.0155 151 VAL A CB  
2345 C CG1 . VAL A 148 ? 0.7043 0.7564 0.7161 0.0730  0.0150  0.0008  151 VAL A CG1 
2346 C CG2 . VAL A 148 ? 0.7344 0.6302 0.6526 0.0569  0.0229  -0.0163 151 VAL A CG2 
2356 N N   . LEU A 149 ? 0.6499 0.8037 0.6614 -0.0576 -0.0208 -0.0258 152 LEU A N   
2357 C CA  . LEU A 149 ? 0.6137 0.8710 0.6772 -0.0703 -0.0290 -0.0173 152 LEU A CA  
2358 C C   . LEU A 149 ? 0.7550 1.0139 0.7576 -0.1172 -0.0420 -0.0286 152 LEU A C   
2359 O O   . LEU A 149 ? 0.6564 0.9930 0.6874 -0.1220 -0.0476 -0.0205 152 LEU A O   
2360 C CB  . LEU A 149 ? 0.5147 0.8412 0.6493 -0.0802 -0.0325 -0.0094 152 LEU A CB  
2361 C CG  . LEU A 149 ? 0.6828 1.0265 0.8900 -0.0359 -0.0243 0.0022  152 LEU A CG  
2362 C CD1 . LEU A 149 ? 0.4298 0.7886 0.6693 -0.0417 -0.0258 0.0046  152 LEU A CD1 
2363 C CD2 . LEU A 149 ? 0.4957 0.8592 0.7440 0.0064  -0.0184 0.0166  152 LEU A CD2 
2375 N N   A PHE A 150 ? 0.8635 1.0396 0.7851 -0.1534 -0.0484 -0.0457 153 PHE A N   
2376 N N   B PHE A 150 ? 0.8648 1.0392 0.7843 -0.1523 -0.0482 -0.0460 153 PHE A N   
2377 C CA  A PHE A 150 ? 0.8593 1.0236 0.7154 -0.2044 -0.0650 -0.0579 153 PHE A CA  
2378 C CA  B PHE A 150 ? 0.8570 1.0270 0.7158 -0.2030 -0.0650 -0.0572 153 PHE A CA  
2379 C C   A PHE A 150 ? 0.9345 1.0137 0.7016 -0.1951 -0.0643 -0.0744 153 PHE A C   
2380 C C   B PHE A 150 ? 0.9378 1.0117 0.6991 -0.1999 -0.0656 -0.0758 153 PHE A C   
2381 O O   A PHE A 150 ? 0.9932 1.0974 0.7299 -0.2136 -0.0755 -0.0793 153 PHE A O   
2382 O O   B PHE A 150 ? 1.0130 1.0988 0.7318 -0.2283 -0.0794 -0.0837 153 PHE A O   
2383 C CB  A PHE A 150 ? 0.9730 1.0961 0.7928 -0.2557 -0.0757 -0.0654 153 PHE A CB  
2384 C CB  B PHE A 150 ? 0.9464 1.1020 0.7854 -0.2574 -0.0771 -0.0613 153 PHE A CB  
2385 C CG  A PHE A 150 ? 0.8987 1.1224 0.7808 -0.2880 -0.0847 -0.0507 153 PHE A CG  
2386 C CG  B PHE A 150 ? 0.8562 1.1010 0.7155 -0.3053 -0.0945 -0.0531 153 PHE A CG  
2387 C CD1 A PHE A 150 ? 0.8245 1.1104 0.7122 -0.3145 -0.0943 -0.0416 153 PHE A CD1 
2388 C CD1 B PHE A 150 ? 0.9056 1.1420 0.7121 -0.3322 -0.1071 -0.0595 153 PHE A CD1 
2389 C CD2 A PHE A 150 ? 0.7442 0.9904 0.6772 -0.2800 -0.0774 -0.0415 153 PHE A CD2 
2390 C CD2 B PHE A 150 ? 0.8689 1.1869 0.8008 -0.2996 -0.0869 -0.0318 153 PHE A CD2 
2391 C CE1 A PHE A 150 ? 0.8537 1.2031 0.7916 -0.3140 -0.0876 -0.0195 153 PHE A CE1 
2392 C CE1 B PHE A 150 ? 0.9368 1.2382 0.7711 -0.3521 -0.1095 -0.0407 153 PHE A CE1 
2393 C CE2 A PHE A 150 ? 0.6500 0.9626 0.6296 -0.2818 -0.0738 -0.0227 153 PHE A CE2 
2394 C CE2 B PHE A 150 ? 0.8051 1.1758 0.7507 -0.3133 -0.0874 -0.0149 153 PHE A CE2 
2395 C CZ  A PHE A 150 ? 0.8200 1.1779 0.7981 -0.2954 -0.0775 -0.0114 153 PHE A CZ  
2396 C CZ  B PHE A 150 ? 0.8906 1.2581 0.7915 -0.3423 -0.0989 -0.0179 153 PHE A CZ  
2415 N N   . PHE A 151 ? 0.8691 0.8485 0.5911 -0.1656 -0.0511 -0.0825 154 PHE A N   
2416 C CA  . PHE A 151 ? 1.1474 1.0294 0.7726 -0.1541 -0.0482 -0.1002 154 PHE A CA  
2417 C C   . PHE A 151 ? 1.2912 1.1752 0.9338 -0.0869 -0.0285 -0.0893 154 PHE A C   
2418 O O   . PHE A 151 ? 1.2693 1.0633 0.8359 -0.0618 -0.0189 -0.1003 154 PHE A O   
2419 C CB  . PHE A 151 ? 1.1625 0.9207 0.7120 -0.1706 -0.0469 -0.1161 154 PHE A CB  
2420 C CG  . PHE A 151 ? 1.0450 0.7946 0.5724 -0.2386 -0.0673 -0.1240 154 PHE A CG  
2421 C CD1 . PHE A 151 ? 1.1108 0.9257 0.7108 -0.2574 -0.0696 -0.1090 154 PHE A CD1 
2422 C CD2 . PHE A 151 ? 1.2348 0.9113 0.6680 -0.2835 -0.0850 -0.1452 154 PHE A CD2 
2423 C CE1 . PHE A 151 ? 1.1538 0.9683 0.7370 -0.3185 -0.0874 -0.1111 154 PHE A CE1 
2424 C CE2 . PHE A 151 ? 1.3265 1.0088 0.7629 -0.3379 -0.1009 -0.1410 154 PHE A CE2 
2425 C CZ  . PHE A 151 ? 1.2192 0.9718 0.7296 -0.3544 -0.1011 -0.1226 154 PHE A CZ  
2435 N N   . GLY A 152 ? 1.7680 1.1748 0.8940 0.2400  0.0127  -0.1932 155 GLY A N   
2436 C CA  . GLY A 152 ? 1.7575 1.2831 0.8898 0.2768  0.0718  -0.2001 155 GLY A CA  
2437 C C   . GLY A 152 ? 1.7121 1.2950 0.8832 0.2124  0.0802  -0.1891 155 GLY A C   
2438 O O   . GLY A 152 ? 1.7595 1.3371 0.8605 0.2365  0.1074  -0.1965 155 GLY A O   
2442 N N   . PHE A 153 ? 1.5534 1.1914 0.8331 0.1352  0.0587  -0.1691 156 PHE A N   
2443 C CA  . PHE A 153 ? 1.5775 1.2676 0.9035 0.0695  0.0634  -0.1561 156 PHE A CA  
2444 C C   . PHE A 153 ? 1.7638 1.2976 0.9977 0.0263  0.0203  -0.1570 156 PHE A C   
2445 O O   . PHE A 153 ? 1.7078 1.2303 0.8955 0.0122  0.0315  -0.1585 156 PHE A O   
2446 C CB  . PHE A 153 ? 1.3185 1.1248 0.7906 0.0112  0.0571  -0.1361 156 PHE A CB  
2447 C CG  . PHE A 153 ? 1.2314 1.2110 0.8085 0.0327  0.0954  -0.1320 156 PHE A CG  
2448 C CD1 . PHE A 153 ? 1.2875 1.3208 0.8412 0.1058  0.1339  -0.1386 156 PHE A CD1 
2449 C CD2 . PHE A 153 ? 1.1014 1.1872 0.8012 -0.0192 0.0889  -0.1190 156 PHE A CD2 
2450 C CE1 . PHE A 153 ? 1.2079 1.4059 0.8716 0.1200  0.1627  -0.1263 156 PHE A CE1 
2451 C CE2 . PHE A 153 ? 1.0318 1.2682 0.8316 -0.0051 0.1118  -0.1140 156 PHE A CE2 
2452 C CZ  . PHE A 153 ? 1.0811 1.3779 0.8694 0.0612  0.1475  -0.1147 156 PHE A CZ  
2462 N N   . THR A 154 ? 1.7847 1.2017 0.9972 0.0039  -0.0315 -0.1504 157 THR A N   
2463 C CA  . THR A 154 ? 1.9791 1.2489 1.1196 -0.0453 -0.0827 -0.1432 157 THR A CA  
2464 C C   . THR A 154 ? 2.1252 1.2756 1.1076 -0.0018 -0.0859 -0.1726 157 THR A C   
2465 O O   . THR A 154 ? 2.0935 1.1722 1.0201 -0.0421 -0.1094 -0.1701 157 THR A O   
2466 C CB  . THR A 154 ? 1.8212 0.9841 0.9657 -0.0637 -0.1393 -0.1238 157 THR A CB  
2467 O OG1 . THR A 154 ? 1.5354 0.8077 0.8166 -0.1024 -0.1350 -0.0920 157 THR A OG1 
2468 C CG2 . THR A 154 ? 1.8290 0.8303 0.8992 -0.1139 -0.2015 -0.1114 157 THR A CG2 
2476 N N   . SER A 155 ? 2.9973 2.1227 1.8996 0.0848  -0.0627 -0.1999 158 SER A N   
2477 C CA  . SER A 155 ? 3.1435 2.1472 1.8760 0.1422  -0.0636 -0.2311 158 SER A CA  
2478 C C   . SER A 155 ? 3.1529 2.2550 1.8783 0.1455  -0.0124 -0.2292 158 SER A C   
2479 O O   . SER A 155 ? 3.3012 2.2973 1.8922 0.1622  -0.0246 -0.2460 158 SER A O   
2480 C CB  . SER A 155 ? 3.2875 2.2569 1.9422 0.2437  -0.0417 -0.2573 158 SER A CB  
2481 O OG  . SER A 155 ? 3.1453 2.3064 1.8940 0.2847  0.0302  -0.2480 158 SER A OG  
2484 N N   . LYS A 156 ? 2.5018 1.8026 1.3692 0.1306  0.0411  -0.2067 159 LYS A N   
2485 C CA  . LYS A 156 ? 2.3704 1.7841 1.2541 0.1344  0.0924  -0.1945 159 LYS A CA  
2486 C C   . LYS A 156 ? 2.2117 1.6517 1.1647 0.0386  0.0728  -0.1714 159 LYS A C   
2487 O O   . LYS A 156 ? 2.0649 1.5124 0.9697 0.0354  0.0910  -0.1658 159 LYS A O   
2488 C CB  . LYS A 156 ? 2.1122 1.7281 1.1222 0.1673  0.1548  -0.1761 159 LYS A CB  
2489 C CG  . LYS A 156 ? 2.3514 2.0633 1.3320 0.2261  0.2189  -0.1637 159 LYS A CG  
2490 C CD  . LYS A 156 ? 1.9725 1.8831 1.0914 0.2574  0.2718  -0.1374 159 LYS A CD  
2491 C CE  . LYS A 156 ? 1.8601 1.9331 1.0516 0.2613  0.3276  -0.0979 159 LYS A CE  
2492 N NZ  . LYS A 156 ? 1.7916 1.8642 1.0113 0.1814  0.3117  -0.0836 159 LYS A NZ  
2506 N N   . ALA A 157 ? 2.0453 1.5013 1.1076 -0.0344 0.0386  -0.1549 160 ALA A N   
2507 C CA  . ALA A 157 ? 1.6343 1.1074 0.7608 -0.1225 0.0190  -0.1307 160 ALA A CA  
2508 C C   . ALA A 157 ? 1.9491 1.2594 0.9438 -0.1433 -0.0246 -0.1370 160 ALA A C   
2509 O O   . ALA A 157 ? 1.7248 1.0567 0.7236 -0.1854 -0.0197 -0.1221 160 ALA A O   
2510 C CB  . ALA A 157 ? 1.6162 1.1136 0.8600 -0.1813 -0.0116 -0.1112 160 ALA A CB  
2516 N N   . GLU A 158 ? 2.2708 1.4133 1.1483 -0.1154 -0.0726 -0.1577 161 GLU A N   
2517 C CA  . GLU A 158 ? 2.5120 1.4802 1.2584 -0.1370 -0.1296 -0.1653 161 GLU A CA  
2518 C C   . GLU A 158 ? 2.5347 1.4852 1.1558 -0.0908 -0.1003 -0.1845 161 GLU A C   
2519 O O   . GLU A 158 ? 2.6689 1.4965 1.1884 -0.1167 -0.1445 -0.1882 161 GLU A O   
2520 C CB  . GLU A 158 ? 2.8877 1.6758 1.5331 -0.1072 -0.1908 -0.1854 161 GLU A CB  
2521 C CG  . GLU A 158 ? 2.9075 1.6554 1.6477 -0.1774 -0.2475 -0.1512 161 GLU A CG  
2522 C CD  . GLU A 158 ? 3.2725 1.8338 1.9185 -0.1545 -0.3166 -0.1629 161 GLU A CD  
2523 O OE1 . GLU A 158 ? 3.5826 2.0255 2.0729 -0.0853 -0.3263 -0.2049 161 GLU A OE1 
2524 O OE2 . GLU A 158 ? 3.1425 1.6746 1.8700 -0.2026 -0.3616 -0.1270 161 GLU A OE2 
2531 N N   . SER A 159 ? 2.3775 1.4513 1.0048 -0.0215 -0.0281 -0.1915 162 SER A N   
2532 C CA  . SER A 159 ? 2.3648 1.4455 0.8793 0.0354  0.0118  -0.2005 162 SER A CA  
2533 C C   . SER A 159 ? 2.2491 1.5197 0.8908 -0.0017 0.0681  -0.1625 162 SER A C   
2534 O O   . SER A 159 ? 2.1544 1.5012 0.7535 0.0580  0.1251  -0.1559 162 SER A O   
2535 C CB  . SER A 159 ? 2.5897 1.6687 1.0079 0.1536  0.0558  -0.2265 162 SER A CB  
2536 O OG  . SER A 159 ? 2.3439 1.6061 0.9128 0.1703  0.1118  -0.2064 162 SER A OG  
2542 N N   . MET A 160 ? 1.9310 1.2791 0.7281 -0.0952 0.0535  -0.1335 163 MET A N   
2543 C CA  . MET A 160 ? 1.7925 1.3100 0.7223 -0.1395 0.0970  -0.0966 163 MET A CA  
2544 C C   . MET A 160 ? 1.7494 1.2209 0.7023 -0.2311 0.0564  -0.0765 163 MET A C   
2545 O O   . MET A 160 ? 1.8439 1.1538 0.6966 -0.2548 -0.0032 -0.0887 163 MET A O   
2546 C CB  . MET A 160 ? 1.6397 1.3178 0.7516 -0.1584 0.1241  -0.0794 163 MET A CB  
2547 C CG  . MET A 160 ? 1.7859 1.5447 0.9000 -0.0728 0.1713  -0.0876 163 MET A CG  
2548 S SD  . MET A 160 ? 1.5818 1.5683 0.9203 -0.1029 0.2096  -0.0539 163 MET A SD  
2549 C CE  . MET A 160 ? 1.5295 1.6146 0.8345 0.0075  0.2774  -0.0462 163 MET A CE  
2559 N N   . ARG A 161 ? 1.6097 1.2256 0.7011 -0.2830 0.0865  -0.0419 164 ARG A N   
2560 C CA  . ARG A 161 ? 1.5969 1.1915 0.7281 -0.3687 0.0566  -0.0168 164 ARG A CA  
2561 C C   . ARG A 161 ? 1.5227 1.0136 0.6743 -0.4237 -0.0062 -0.0182 164 ARG A C   
2562 O O   . ARG A 161 ? 1.4510 0.9718 0.6764 -0.4195 -0.0096 -0.0236 164 ARG A O   
2563 C CB  . ARG A 161 ? 1.4748 1.2453 0.7770 -0.4164 0.0955  0.0202  164 ARG A CB  
2564 C CG  . ARG A 161 ? 1.4976 1.4281 0.8695 -0.3630 0.1594  0.0310  164 ARG A CG  
2565 C CD  . ARG A 161 ? 1.3175 1.3796 0.7887 -0.3992 0.1945  0.0741  164 ARG A CD  
2566 N NE  . ARG A 161 ? 1.2557 1.3490 0.8564 -0.4899 0.1686  0.0943  164 ARG A NE  
2567 C CZ  . ARG A 161 ? 1.1174 1.3159 0.8733 -0.5208 0.1719  0.1045  164 ARG A CZ  
2568 N NH1 . ARG A 161 ? 1.3180 1.6086 1.1329 -0.4761 0.1965  0.0993  164 ARG A NH1 
2569 N NH2 . ARG A 161 ? 1.0227 1.2128 0.8779 -0.5452 0.1316  0.1077  164 ARG A NH2 
2583 N N   . PRO A 162 ? 0.7175 0.6918 0.7000 0.0420  -0.1356 0.0093  165 PRO A N   
2584 C CA  . PRO A 162 ? 0.8801 0.8688 0.8565 0.0120  -0.1356 0.0027  165 PRO A CA  
2585 C C   . PRO A 162 ? 0.7398 0.7550 0.7478 0.0140  -0.1294 0.0039  165 PRO A C   
2586 O O   . PRO A 162 ? 0.6804 0.6869 0.6766 -0.0058 -0.1282 0.0001  165 PRO A O   
2587 C CB  . PRO A 162 ? 0.6468 0.6825 0.6312 -0.0004 -0.1401 0.0007  165 PRO A CB  
2588 C CG  . PRO A 162 ? 0.7429 0.7656 0.7193 0.0174  -0.1438 0.0032  165 PRO A CG  
2589 C CD  . PRO A 162 ? 0.8497 0.8487 0.8387 0.0488  -0.1400 0.0102  165 PRO A CD  
2597 N N   . GLU A 163 ? 0.8548 0.8982 0.8989 0.0374  -0.1249 0.0094  166 GLU A N   
2598 C CA  . GLU A 163 ? 0.7107 0.7717 0.7779 0.0405  -0.1180 0.0104  166 GLU A CA  
2599 C C   . GLU A 163 ? 0.5879 0.6081 0.6425 0.0397  -0.1157 0.0101  166 GLU A C   
2600 O O   . GLU A 163 ? 0.7119 0.7372 0.7725 0.0314  -0.1116 0.0081  166 GLU A O   
2601 C CB  . GLU A 163 ? 0.6998 0.7884 0.7980 0.0658  -0.1121 0.0163  166 GLU A CB  
2602 C CG  . GLU A 163 ? 0.8504 0.9128 0.9502 0.0862  -0.1122 0.0215  166 GLU A CG  
2603 C CD  . GLU A 163 ? 0.9081 0.9816 1.0099 0.0982  -0.1165 0.0245  166 GLU A CD  
2604 O OE1 . GLU A 163 ? 0.8752 0.9421 0.9565 0.0860  -0.1232 0.0210  166 GLU A OE1 
2605 O OE2 . GLU A 163 ? 0.9135 0.9994 1.0343 0.1190  -0.1127 0.0302  166 GLU A OE2 
2612 N N   . VAL A 164 ? 0.6168 0.6006 0.6533 0.0498  -0.1178 0.0134  167 VAL A N   
2613 C CA  . VAL A 164 ? 0.6873 0.6397 0.7099 0.0504  -0.1151 0.0153  167 VAL A CA  
2614 C C   . VAL A 164 ? 0.7534 0.6784 0.7433 0.0294  -0.1157 0.0099  167 VAL A C   
2615 O O   . VAL A 164 ? 0.9000 0.8156 0.8869 0.0225  -0.1118 0.0088  167 VAL A O   
2616 C CB  . VAL A 164 ? 0.6774 0.6085 0.6895 0.0706  -0.1163 0.0239  167 VAL A CB  
2617 C CG1 . VAL A 164 ? 0.7514 0.6556 0.7432 0.0716  -0.1131 0.0279  167 VAL A CG1 
2618 C CG2 . VAL A 164 ? 0.7518 0.7079 0.7952 0.0877  -0.1149 0.0298  167 VAL A CG2 
2628 N N   . ALA A 165 ? 0.7354 0.6447 0.6973 0.0177  -0.1201 0.0062  168 ALA A N   
2629 C CA  . ALA A 165 ? 0.7968 0.6719 0.7193 -0.0054 -0.1200 0.0007  168 ALA A CA  
2630 C C   . ALA A 165 ? 0.8131 0.7204 0.7522 -0.0288 -0.1194 -0.0046 168 ALA A C   
2631 O O   . ALA A 165 ? 0.7310 0.6174 0.6528 -0.0425 -0.1163 -0.0071 168 ALA A O   
2632 C CB  . ALA A 165 ? 0.8791 0.7253 0.7612 -0.0159 -0.1249 -0.0025 168 ALA A CB  
2638 N N   . SER A 166 ? 0.6758 0.6365 0.6471 -0.0314 -0.1213 -0.0050 169 SER A N   
2639 C CA  . SER A 166 ? 0.6621 0.6620 0.6489 -0.0504 -0.1203 -0.0073 169 SER A CA  
2640 C C   . SER A 166 ? 0.6448 0.6506 0.6542 -0.0399 -0.1137 -0.0056 169 SER A C   
2641 O O   . SER A 166 ? 0.6435 0.6522 0.6487 -0.0563 -0.1120 -0.0080 169 SER A O   
2642 C CB  . SER A 166 ? 0.6948 0.7563 0.7086 -0.0495 -0.1222 -0.0050 169 SER A CB  
2643 O OG  . SER A 166 ? 0.7762 0.8746 0.7873 -0.0771 -0.1244 -0.0065 169 SER A OG  
2649 N N   . THR A 167 ? 0.5727 0.5793 0.6036 -0.0144 -0.1100 -0.0015 170 THR A N   
2650 C CA  . THR A 167 ? 0.6181 0.6265 0.6655 -0.0067 -0.1038 -0.0005 170 THR A CA  
2651 C C   . THR A 167 ? 0.7470 0.7150 0.7717 -0.0127 -0.1024 -0.0015 170 THR A C   
2652 O O   . THR A 167 ? 0.5964 0.5669 0.6246 -0.0205 -0.0988 -0.0034 170 THR A O   
2653 C CB  . THR A 167 ? 0.6001 0.6140 0.6684 0.0174  -0.1002 0.0042  170 THR A CB  
2654 O OG1 . THR A 167 ? 0.6413 0.6918 0.7278 0.0263  -0.0995 0.0062  170 THR A OG1 
2655 C CG2 . THR A 167 ? 0.5017 0.5133 0.5807 0.0216  -0.0936 0.0043  170 THR A CG2 
2663 N N   . PHE A 168 ? 0.5989 0.5311 0.5986 -0.0066 -0.1043 0.0008  171 PHE A N   
2664 C CA  . PHE A 168 ? 0.7294 0.6248 0.7023 -0.0085 -0.1012 0.0020  171 PHE A CA  
2665 C C   . PHE A 168 ? 0.6916 0.5738 0.6422 -0.0326 -0.1006 -0.0037 171 PHE A C   
2666 O O   . PHE A 168 ? 0.6860 0.5588 0.6321 -0.0370 -0.0960 -0.0041 171 PHE A O   
2667 C CB  . PHE A 168 ? 0.6938 0.5539 0.6367 0.0057  -0.1020 0.0076  171 PHE A CB  
2668 C CG  . PHE A 168 ? 0.7950 0.6152 0.7009 0.0067  -0.0968 0.0104  171 PHE A CG  
2669 C CD1 . PHE A 168 ? 0.7513 0.5768 0.6655 0.0177  -0.0917 0.0164  171 PHE A CD1 
2670 C CD2 . PHE A 168 ? 0.7337 0.5103 0.5927 -0.0042 -0.0961 0.0076  171 PHE A CD2 
2671 C CE1 . PHE A 168 ? 0.8469 0.6408 0.7265 0.0219  -0.0854 0.0207  171 PHE A CE1 
2672 C CE2 . PHE A 168 ? 0.8632 0.5985 0.6825 0.0003  -0.0888 0.0113  171 PHE A CE2 
2673 C CZ  . PHE A 168 ? 0.8957 0.6427 0.7272 0.0152  -0.0831 0.0185  171 PHE A CZ  
2683 N N   . LYS A 169 ? 0.7068 0.5890 0.6413 -0.0503 -0.1053 -0.0078 172 LYS A N   
2684 C CA  . LYS A 169 ? 0.7290 0.5964 0.6366 -0.0782 -0.1053 -0.0128 172 LYS A CA  
2685 C C   . LYS A 169 ? 0.7354 0.6420 0.6726 -0.0877 -0.1032 -0.0141 172 LYS A C   
2686 O O   . LYS A 169 ? 0.7497 0.6394 0.6698 -0.1027 -0.1003 -0.0161 172 LYS A O   
2687 C CB  . LYS A 169 ? 0.9257 0.7960 0.8128 -0.1004 -0.1119 -0.0165 172 LYS A CB  
2688 C CG  . LYS A 169 ? 0.9914 0.7966 0.8210 -0.1047 -0.1121 -0.0179 172 LYS A CG  
2689 C CD  . LYS A 169 ? 1.2373 1.0510 1.0533 -0.1197 -0.1195 -0.0210 172 LYS A CD  
2690 C CE  . LYS A 169 ? 1.4430 1.1849 1.1986 -0.1169 -0.1188 -0.0218 172 LYS A CE  
2691 N NZ  . LYS A 169 ? 1.7724 1.4601 1.4665 -0.1500 -0.1171 -0.0275 172 LYS A NZ  
2694 N N   . VAL A 170 ? 0.6007 0.5573 0.5790 -0.0773 -0.1035 -0.0122 173 VAL A N   
2695 C CA  . VAL A 170 ? 0.6628 0.6558 0.6659 -0.0817 -0.1004 -0.0122 173 VAL A CA  
2696 C C   . VAL A 170 ? 0.6172 0.5907 0.6258 -0.0692 -0.0943 -0.0117 173 VAL A C   
2697 O O   . VAL A 170 ? 0.5639 0.5392 0.5713 -0.0796 -0.0915 -0.0131 173 VAL A O   
2698 C CB  . VAL A 170 ? 0.5692 0.6158 0.6062 -0.0694 -0.1001 -0.0089 173 VAL A CB  
2699 C CG1 . VAL A 170 ? 0.6195 0.6984 0.6778 -0.0665 -0.0948 -0.0073 173 VAL A CG1 
2700 C CG2 . VAL A 170 ? 0.6526 0.7308 0.6850 -0.0849 -0.1060 -0.0083 173 VAL A CG2 
2710 N N   . LEU A 171 ? 0.5114 0.4698 0.5257 -0.0483 -0.0924 -0.0089 174 LEU A N   
2711 C CA  . LEU A 171 ? 0.5344 0.4810 0.5532 -0.0392 -0.0872 -0.0075 174 LEU A CA  
2712 C C   . LEU A 171 ? 0.6335 0.5437 0.6215 -0.0454 -0.0849 -0.0071 174 LEU A C   
2713 O O   . LEU A 171 ? 0.5530 0.4606 0.5427 -0.0451 -0.0802 -0.0068 174 LEU A O   
2714 C CB  . LEU A 171 ? 0.5604 0.5054 0.5904 -0.0195 -0.0865 -0.0032 174 LEU A CB  
2715 C CG  . LEU A 171 ? 0.6434 0.6165 0.6994 -0.0098 -0.0855 -0.0030 174 LEU A CG  
2716 C CD1 . LEU A 171 ? 0.5610 0.5259 0.6216 0.0058  -0.0852 0.0017  174 LEU A CD1 
2717 C CD2 . LEU A 171 ? 0.4831 0.4728 0.5528 -0.0115 -0.0800 -0.0053 174 LEU A CD2 
2729 N N   A ARG A 172 ? 0.5836 0.4630 0.5396 -0.0496 -0.0871 -0.0067 175 ARG A N   
2730 N N   B ARG A 172 ? 0.5894 0.4688 0.5453 -0.0498 -0.0870 -0.0067 175 ARG A N   
2731 C CA  A ARG A 172 ? 0.7449 0.5819 0.6618 -0.0536 -0.0825 -0.0056 175 ARG A CA  
2732 C CA  B ARG A 172 ? 0.7420 0.5794 0.6594 -0.0534 -0.0824 -0.0055 175 ARG A CA  
2733 C C   A ARG A 172 ? 0.7096 0.5472 0.6193 -0.0766 -0.0809 -0.0105 175 ARG A C   
2734 C C   B ARG A 172 ? 0.7105 0.5478 0.6199 -0.0767 -0.0809 -0.0105 175 ARG A C   
2735 O O   A ARG A 172 ? 0.6290 0.4502 0.5264 -0.0764 -0.0747 -0.0093 175 ARG A O   
2736 O O   B ARG A 172 ? 0.6345 0.4545 0.5305 -0.0768 -0.0747 -0.0094 175 ARG A O   
2737 C CB  A ARG A 172 ? 0.8587 0.6547 0.7344 -0.0523 -0.0841 -0.0042 175 ARG A CB  
2738 C CB  B ARG A 172 ? 0.8552 0.6507 0.7311 -0.0508 -0.0836 -0.0038 175 ARG A CB  
2739 C CG  A ARG A 172 ? 0.9063 0.6464 0.7278 -0.0570 -0.0775 -0.0032 175 ARG A CG  
2740 C CG  B ARG A 172 ? 0.8924 0.6351 0.7187 -0.0474 -0.0758 -0.0004 175 ARG A CG  
2741 C CD  A ARG A 172 ? 1.0097 0.7056 0.7840 -0.0670 -0.0798 -0.0056 175 ARG A CD  
2742 C CD  B ARG A 172 ? 0.9881 0.6909 0.7698 -0.0727 -0.0760 -0.0063 175 ARG A CD  
2743 N NE  A ARG A 172 ? 1.0780 0.7868 0.8519 -0.1003 -0.0860 -0.0138 175 ARG A NE  
2744 N NE  B ARG A 172 ? 1.0009 0.6780 0.7544 -0.0740 -0.0806 -0.0073 175 ARG A NE  
2745 C CZ  A ARG A 172 ? 1.0791 0.7599 0.8161 -0.1184 -0.0901 -0.0177 175 ARG A CZ  
2746 C CZ  B ARG A 172 ? 1.0349 0.7231 0.7874 -0.0988 -0.0882 -0.0139 175 ARG A CZ  
2747 N NH1 A ARG A 172 ? 1.0372 0.6683 0.7317 -0.1043 -0.0883 -0.0151 175 ARG A NH1 
2748 N NH1 B ARG A 172 ? 0.9462 0.6747 0.7242 -0.1241 -0.0922 -0.0188 175 ARG A NH1 
2749 N NH2 A ARG A 172 ? 0.8849 0.5905 0.6253 -0.1519 -0.0962 -0.0236 175 ARG A NH2 
2750 N NH2 B ARG A 172 ? 1.0269 0.6892 0.7509 -0.0979 -0.0918 -0.0144 175 ARG A NH2 
2777 N N   . ASN A 173 ? 0.7301 0.5914 0.6474 -0.0965 -0.0863 -0.0147 176 ASN A N   
2778 C CA  . ASN A 173 ? 0.7189 0.5870 0.6290 -0.1213 -0.0858 -0.0178 176 ASN A CA  
2779 C C   . ASN A 173 ? 0.5839 0.4858 0.5281 -0.1153 -0.0823 -0.0172 176 ASN A C   
2780 O O   . ASN A 173 ? 0.7472 0.6393 0.6811 -0.1255 -0.0783 -0.0180 176 ASN A O   
2781 C CB  . ASN A 173 ? 0.8059 0.7045 0.7182 -0.1446 -0.0931 -0.0199 176 ASN A CB  
2782 C CG  . ASN A 173 ? 0.7855 0.6417 0.6520 -0.1597 -0.0964 -0.0222 176 ASN A CG  
2783 O OD1 . ASN A 173 ? 1.0419 0.8395 0.8699 -0.1511 -0.0920 -0.0218 176 ASN A OD1 
2784 N ND2 . ASN A 173 ? 0.9016 0.7881 0.7684 -0.1816 -0.1036 -0.0236 176 ASN A ND2 
2791 N N   . VAL A 174 ? 0.5145 0.4522 0.4955 -0.0987 -0.0828 -0.0158 177 VAL A N   
2792 C CA  . VAL A 174 ? 0.6103 0.5719 0.6171 -0.0912 -0.0785 -0.0156 177 VAL A CA  
2793 C C   . VAL A 174 ? 0.6119 0.5445 0.6075 -0.0827 -0.0727 -0.0147 177 VAL A C   
2794 O O   . VAL A 174 ? 0.6777 0.6147 0.6762 -0.0875 -0.0688 -0.0156 177 VAL A O   
2795 C CB  . VAL A 174 ? 0.5026 0.4938 0.5391 -0.0735 -0.0784 -0.0142 177 VAL A CB  
2796 C CG1 . VAL A 174 ? 0.5805 0.5807 0.6331 -0.0640 -0.0727 -0.0146 177 VAL A CG1 
2797 C CG2 . VAL A 174 ? 0.6261 0.6579 0.6755 -0.0791 -0.0818 -0.0130 177 VAL A CG2 
2807 N N   . THR A 175 ? 0.6297 0.5371 0.6120 -0.0691 -0.0719 -0.0116 178 THR A N   
2808 C CA  . THR A 175 ? 0.5700 0.4614 0.5430 -0.0583 -0.0659 -0.0079 178 THR A CA  
2809 C C   . THR A 175 ? 0.6129 0.4774 0.5565 -0.0675 -0.0607 -0.0077 178 THR A C   
2810 O O   . THR A 175 ? 0.6836 0.5529 0.6308 -0.0655 -0.0552 -0.0068 178 THR A O   
2811 C CB  . THR A 175 ? 0.6293 0.5052 0.5905 -0.0414 -0.0661 -0.0017 178 THR A CB  
2812 O OG1 . THR A 175 ? 0.5672 0.4672 0.5557 -0.0335 -0.0699 -0.0014 178 THR A OG1 
2813 C CG2 . THR A 175 ? 0.6344 0.5017 0.5820 -0.0297 -0.0594 0.0052  178 THR A CG2 
2821 N N   . VAL A 176 ? 0.5588 0.3918 0.4693 -0.0783 -0.0617 -0.0087 179 VAL A N   
2822 C CA  . VAL A 176 ? 0.6259 0.4204 0.4973 -0.0861 -0.0548 -0.0079 179 VAL A CA  
2823 C C   . VAL A 176 ? 0.7314 0.5462 0.6166 -0.1050 -0.0543 -0.0120 179 VAL A C   
2824 O O   . VAL A 176 ? 0.7704 0.5698 0.6408 -0.1051 -0.0468 -0.0105 179 VAL A O   
2825 C CB  . VAL A 176 ? 0.7839 0.5304 0.6076 -0.0959 -0.0555 -0.0086 179 VAL A CB  
2826 C CG1 . VAL A 176 ? 0.9781 0.6756 0.7529 -0.1072 -0.0471 -0.0084 179 VAL A CG1 
2827 C CG2 . VAL A 176 ? 0.8642 0.5895 0.6713 -0.0720 -0.0545 -0.0026 179 VAL A CG2 
2837 N N   . VAL A 177 ? 0.6870 0.5401 0.6001 -0.1193 -0.0616 -0.0158 180 VAL A N   
2838 C CA  . VAL A 177 ? 0.7834 0.6631 0.7104 -0.1358 -0.0615 -0.0177 180 VAL A CA  
2839 C C   . VAL A 177 ? 0.5864 0.4914 0.5435 -0.1207 -0.0572 -0.0169 180 VAL A C   
2840 O O   . VAL A 177 ? 0.6105 0.5183 0.5669 -0.1270 -0.0530 -0.0170 180 VAL A O   
2841 C CB  . VAL A 177 ? 0.6505 0.5727 0.5974 -0.1517 -0.0697 -0.0189 180 VAL A CB  
2842 C CG1 . VAL A 177 ? 0.7272 0.6878 0.6926 -0.1646 -0.0696 -0.0182 180 VAL A CG1 
2843 C CG2 . VAL A 177 ? 0.7228 0.6200 0.6346 -0.1734 -0.0743 -0.0202 180 VAL A CG2 
2853 N N   . LEU A 178 ? 0.4691 0.3908 0.4501 -0.1021 -0.0580 -0.0163 181 LEU A N   
2854 C CA  . LEU A 178 ? 0.4753 0.4186 0.4803 -0.0914 -0.0543 -0.0165 181 LEU A CA  
2855 C C   . LEU A 178 ? 0.6268 0.5500 0.6175 -0.0814 -0.0475 -0.0135 181 LEU A C   
2856 O O   . LEU A 178 ? 0.6100 0.5443 0.6088 -0.0809 -0.0430 -0.0139 181 LEU A O   
2857 C CB  . LEU A 178 ? 0.5702 0.5342 0.5991 -0.0791 -0.0570 -0.0171 181 LEU A CB  
2858 C CG  . LEU A 178 ? 0.6119 0.6045 0.6567 -0.0826 -0.0615 -0.0179 181 LEU A CG  
2859 C CD1 . LEU A 178 ? 0.6565 0.6624 0.7194 -0.0667 -0.0605 -0.0180 181 LEU A CD1 
2860 C CD2 . LEU A 178 ? 0.5757 0.5943 0.6276 -0.0945 -0.0611 -0.0180 181 LEU A CD2 
2872 N N   . TRP A 179 ? 0.5356 0.4333 0.5045 -0.0718 -0.0461 -0.0091 182 TRP A N   
2873 C CA  . TRP A 179 ? 0.7088 0.5965 0.6628 -0.0590 -0.0385 -0.0031 182 TRP A CA  
2874 C C   . TRP A 179 ? 0.7371 0.6021 0.6648 -0.0641 -0.0309 -0.0018 182 TRP A C   
2875 O O   . TRP A 179 ? 0.5693 0.4416 0.4959 -0.0562 -0.0237 0.0018  182 TRP A O   
2876 C CB  . TRP A 179 ? 0.5360 0.4058 0.4696 -0.0440 -0.0379 0.0040  182 TRP A CB  
2877 C CG  . TRP A 179 ? 0.6084 0.5023 0.5662 -0.0368 -0.0434 0.0051  182 TRP A CG  
2878 C CD1 . TRP A 179 ? 0.6152 0.5273 0.5999 -0.0430 -0.0500 -0.0010 182 TRP A CD1 
2879 C CD2 . TRP A 179 ? 0.6128 0.5158 0.5668 -0.0221 -0.0419 0.0141  182 TRP A CD2 
2880 N NE1 . TRP A 179 ? 0.6366 0.5609 0.6320 -0.0344 -0.0523 0.0024  182 TRP A NE1 
2881 C CE2 . TRP A 179 ? 0.5293 0.4514 0.5079 -0.0235 -0.0483 0.0117  182 TRP A CE2 
2882 C CE3 . TRP A 179 ? 0.6279 0.5276 0.5578 -0.0068 -0.0349 0.0255  182 TRP A CE3 
2883 C CZ2 . TRP A 179 ? 0.6504 0.5880 0.6312 -0.0147 -0.0493 0.0196  182 TRP A CZ2 
2884 C CZ3 . TRP A 179 ? 0.6410 0.5640 0.5755 0.0040  -0.0360 0.0347  182 TRP A CZ3 
2885 C CH2 . TRP A 179 ? 0.5675 0.5090 0.5278 -0.0023 -0.0439 0.0314  182 TRP A CH2 
2896 N N   . SER A 180 ? 0.6195 0.4570 0.5237 -0.0787 -0.0320 -0.0045 183 SER A N   
2897 C CA  . SER A 180 ? 0.6345 0.4413 0.5061 -0.0859 -0.0239 -0.0032 183 SER A CA  
2898 C C   . SER A 180 ? 0.6860 0.5220 0.5824 -0.0950 -0.0225 -0.0061 183 SER A C   
2899 O O   . SER A 180 ? 0.7149 0.5315 0.5892 -0.0960 -0.0138 -0.0037 183 SER A O   
2900 C CB  . SER A 180 ? 0.6410 0.4100 0.4779 -0.1062 -0.0266 -0.0062 183 SER A CB  
2901 O OG  . SER A 180 ? 0.9247 0.6568 0.7289 -0.0958 -0.0258 -0.0031 183 SER A OG  
2907 N N   . ALA A 181 ? 0.5815 0.4612 0.5196 -0.0993 -0.0296 -0.0104 184 ALA A N   
2908 C CA  . ALA A 181 ? 0.6880 0.5959 0.6480 -0.1058 -0.0284 -0.0126 184 ALA A CA  
2909 C C   . ALA A 181 ? 0.4834 0.4053 0.4548 -0.0903 -0.0217 -0.0105 184 ALA A C   
2910 O O   . ALA A 181 ? 0.5056 0.4359 0.4802 -0.0929 -0.0168 -0.0104 184 ALA A O   
2911 C CB  . ALA A 181 ? 0.4975 0.4448 0.4911 -0.1122 -0.0366 -0.0162 184 ALA A CB  
2917 N N   . TYR A 182 ? 0.4849 0.4124 0.4616 -0.0759 -0.0217 -0.0082 185 TYR A N   
2918 C CA  . TYR A 182 ? 0.5153 0.4632 0.5020 -0.0653 -0.0165 -0.0057 185 TYR A CA  
2919 C C   . TYR A 182 ? 0.5142 0.4513 0.4793 -0.0592 -0.0058 -0.0001 185 TYR A C   
2920 O O   . TYR A 182 ? 0.5044 0.4639 0.4835 -0.0590 -0.0021 -0.0010 185 TYR A O   
2921 C CB  . TYR A 182 ? 0.4806 0.4349 0.4681 -0.0544 -0.0182 -0.0017 185 TYR A CB  
2922 C CG  . TYR A 182 ? 0.5774 0.5480 0.5893 -0.0584 -0.0261 -0.0072 185 TYR A CG  
2923 C CD1 . TYR A 182 ? 0.5513 0.5126 0.5663 -0.0618 -0.0327 -0.0101 185 TYR A CD1 
2924 C CD2 . TYR A 182 ? 0.3957 0.3883 0.4230 -0.0589 -0.0259 -0.0095 185 TYR A CD2 
2925 C CE1 . TYR A 182 ? 0.5694 0.5429 0.6026 -0.0619 -0.0376 -0.0140 185 TYR A CE1 
2926 C CE2 . TYR A 182 ? 0.5732 0.5705 0.6137 -0.0615 -0.0308 -0.0143 185 TYR A CE2 
2927 C CZ  . TYR A 182 ? 0.5590 0.5465 0.6026 -0.0611 -0.0361 -0.0161 185 TYR A CZ  
2928 O OH  . TYR A 182 ? 0.5641 0.5536 0.6169 -0.0602 -0.0388 -0.0198 185 TYR A OH  
2938 N N   . PRO A 183 ? 0.5255 0.4275 0.4537 -0.0522 0.0008  0.0063  186 PRO A N   
2939 C CA  . PRO A 183 ? 0.4996 0.3888 0.4026 -0.0426 0.0136  0.0129  186 PRO A CA  
2940 C C   . PRO A 183 ? 0.5603 0.4451 0.4656 -0.0571 0.0157  0.0082  186 PRO A C   
2941 O O   . PRO A 183 ? 0.6117 0.5017 0.5109 -0.0497 0.0255  0.0122  186 PRO A O   
2942 C CB  . PRO A 183 ? 0.6119 0.4524 0.4659 -0.0314 0.0206  0.0204  186 PRO A CB  
2943 C CG  . PRO A 183 ? 0.6983 0.5241 0.5542 -0.0422 0.0095  0.0149  186 PRO A CG  
2944 C CD  . PRO A 183 ? 0.6046 0.4768 0.5086 -0.0474 -0.0014 0.0093  186 PRO A CD  
2952 N N   . VAL A 184 ? 0.5717 0.4522 0.4859 -0.0774 0.0069  0.0011  187 VAL A N   
2953 C CA  . VAL A 184 ? 0.5241 0.4071 0.4412 -0.0933 0.0079  -0.0016 187 VAL A CA  
2954 C C   . VAL A 184 ? 0.4627 0.3939 0.4209 -0.0911 0.0058  -0.0046 187 VAL A C   
2955 O O   . VAL A 184 ? 0.6151 0.5535 0.5745 -0.0917 0.0120  -0.0033 187 VAL A O   
2956 C CB  . VAL A 184 ? 0.6004 0.4737 0.5131 -0.1171 -0.0013 -0.0059 187 VAL A CB  
2957 C CG1 . VAL A 184 ? 0.6237 0.5077 0.5401 -0.1360 -0.0011 -0.0068 187 VAL A CG1 
2958 C CG2 . VAL A 184 ? 0.6961 0.5145 0.5609 -0.1210 0.0013  -0.0039 187 VAL A CG2 
2968 N N   . VAL A 185 ? 0.4592 0.4197 0.4475 -0.0879 -0.0021 -0.0085 188 VAL A N   
2969 C CA  . VAL A 185 ? 0.5614 0.5589 0.5805 -0.0849 -0.0032 -0.0118 188 VAL A CA  
2970 C C   . VAL A 185 ? 0.5235 0.5307 0.5402 -0.0721 0.0055  -0.0083 188 VAL A C   
2971 O O   . VAL A 185 ? 0.4654 0.4923 0.4939 -0.0713 0.0092  -0.0091 188 VAL A O   
2972 C CB  . VAL A 185 ? 0.5031 0.5180 0.5438 -0.0836 -0.0115 -0.0163 188 VAL A CB  
2973 C CG1 . VAL A 185 ? 0.5754 0.6190 0.6395 -0.0822 -0.0123 -0.0202 188 VAL A CG1 
2974 C CG2 . VAL A 185 ? 0.5081 0.5162 0.5478 -0.0929 -0.0190 -0.0174 188 VAL A CG2 
2984 N N   . TRP A 186 ? 0.4741 0.4728 0.4753 -0.0613 0.0088  -0.0031 189 TRP A N   
2985 C CA  . TRP A 186 ? 0.4065 0.4237 0.4035 -0.0488 0.0174  0.0029  189 TRP A CA  
2986 C C   . TRP A 186 ? 0.4066 0.4142 0.3865 -0.0437 0.0288  0.0078  189 TRP A C   
2987 O O   . TRP A 186 ? 0.6051 0.6396 0.5939 -0.0379 0.0349  0.0097  189 TRP A O   
2988 C CB  . TRP A 186 ? 0.4500 0.4629 0.4292 -0.0370 0.0194  0.0109  189 TRP A CB  
2989 C CG  . TRP A 186 ? 0.5109 0.5588 0.4901 -0.0260 0.0259  0.0188  189 TRP A CG  
2990 C CD1 . TRP A 186 ? 0.5740 0.6535 0.5681 -0.0299 0.0206  0.0185  189 TRP A CD1 
2991 C CD2 . TRP A 186 ? 0.4640 0.5212 0.4240 -0.0103 0.0394  0.0295  189 TRP A CD2 
2992 N NE1 . TRP A 186 ? 0.5681 0.6827 0.5558 -0.0205 0.0286  0.0285  189 TRP A NE1 
2993 C CE2 . TRP A 186 ? 0.7759 0.8798 0.7439 -0.0059 0.0408  0.0360  189 TRP A CE2 
2994 C CE3 . TRP A 186 ? 0.5912 0.6214 0.5247 0.0000  0.0513  0.0349  189 TRP A CE3 
2995 C CZ2 . TRP A 186 ? 0.6184 0.7510 0.5725 0.0107  0.0536  0.0487  189 TRP A CZ2 
2996 C CZ3 . TRP A 186 ? 0.6596 0.7102 0.5766 0.0191  0.0654  0.0471  189 TRP A CZ3 
2997 C CH2 . TRP A 186 ? 0.6242 0.7297 0.5534 0.0255  0.0664  0.0544  189 TRP A CH2 
3008 N N   . LEU A 187 ? 0.5008 0.4680 0.4530 -0.0471 0.0321  0.0097  190 LEU A N   
3009 C CA  . LEU A 187 ? 0.5376 0.4844 0.4635 -0.0417 0.0450  0.0153  190 LEU A CA  
3010 C C   . LEU A 187 ? 0.6851 0.6511 0.6336 -0.0535 0.0437  0.0103  190 LEU A C   
3011 O O   . LEU A 187 ? 0.5685 0.5453 0.5144 -0.0445 0.0538  0.0144  190 LEU A O   
3012 C CB  . LEU A 187 ? 0.5649 0.4530 0.4456 -0.0455 0.0492  0.0181  190 LEU A CB  
3013 C CG  . LEU A 187 ? 0.7729 0.6226 0.6111 -0.0386 0.0653  0.0251  190 LEU A CG  
3014 C CD1 . LEU A 187 ? 0.7854 0.6427 0.6039 -0.0079 0.0802  0.0371  190 LEU A CD1 
3015 C CD2 . LEU A 187 ? 0.8232 0.6064 0.6122 -0.0507 0.0673  0.0249  190 LEU A CD2 
3027 N N   . ILE A 188 ? 0.5626 0.5371 0.5329 -0.0715 0.0320  0.0028  191 ILE A N   
3028 C CA  . ILE A 188 ? 0.5895 0.5864 0.5807 -0.0815 0.0304  -0.0001 191 ILE A CA  
3029 C C   . ILE A 188 ? 0.6793 0.7212 0.7076 -0.0758 0.0258  -0.0046 191 ILE A C   
3030 O O   . ILE A 188 ? 0.6029 0.6675 0.6495 -0.0797 0.0250  -0.0062 191 ILE A O   
3031 C CB  . ILE A 188 ? 0.7237 0.7153 0.7171 -0.1033 0.0210  -0.0030 191 ILE A CB  
3032 C CG1 . ILE A 188 ? 0.6372 0.6429 0.6493 -0.1061 0.0092  -0.0075 191 ILE A CG1 
3033 C CG2 . ILE A 188 ? 0.8323 0.7734 0.7815 -0.1154 0.0261  0.0005  191 ILE A CG2 
3034 C CD1 . ILE A 188 ? 0.8521 0.8520 0.8585 -0.1264 0.0009  -0.0082 191 ILE A CD1 
3046 N N   . GLY A 189 ? 0.5432 0.5964 0.5794 -0.0676 0.0232  -0.0062 192 GLY A N   
3047 C CA  . GLY A 189 ? 0.6876 0.7725 0.7491 -0.0654 0.0191  -0.0115 192 GLY A CA  
3048 C C   . GLY A 189 ? 0.5109 0.6181 0.5739 -0.0560 0.0273  -0.0090 192 GLY A C   
3049 O O   . GLY A 189 ? 0.6100 0.7141 0.6588 -0.0486 0.0373  -0.0024 192 GLY A O   
3053 N N   A SER A 190 ? 0.4644 0.5934 0.5412 -0.0566 0.0237  -0.0141 193 SER A N   
3054 N N   B SER A 190 ? 0.4687 0.5977 0.5455 -0.0566 0.0237  -0.0141 193 SER A N   
3055 C CA  A SER A 190 ? 0.5671 0.7244 0.6466 -0.0519 0.0301  -0.0127 193 SER A CA  
3056 C CA  B SER A 190 ? 0.5654 0.7226 0.6449 -0.0519 0.0301  -0.0126 193 SER A CA  
3057 C C   A SER A 190 ? 0.5697 0.7354 0.6323 -0.0436 0.0374  -0.0032 193 SER A C   
3058 C C   B SER A 190 ? 0.5681 0.7336 0.6306 -0.0436 0.0374  -0.0032 193 SER A C   
3059 O O   A SER A 190 ? 0.5771 0.7678 0.6372 -0.0358 0.0463  0.0024  193 SER A O   
3060 O O   B SER A 190 ? 0.5751 0.7656 0.6352 -0.0357 0.0464  0.0025  193 SER A O   
3061 C CB  A SER A 190 ? 0.5139 0.6842 0.6029 -0.0587 0.0242  -0.0209 193 SER A CB  
3062 C CB  B SER A 190 ? 0.5151 0.6856 0.6042 -0.0586 0.0243  -0.0208 193 SER A CB  
3063 O OG  A SER A 190 ? 0.6595 0.8187 0.7411 -0.0641 0.0184  -0.0223 193 SER A OG  
3064 O OG  B SER A 190 ? 0.6065 0.7761 0.7078 -0.0596 0.0213  -0.0269 193 SER A OG  
3075 N N   . GLU A 191 ? 0.4778 0.6271 0.5281 -0.0429 0.0344  0.0001  194 GLU A N   
3076 C CA  . GLU A 191 ? 0.4306 0.5924 0.4626 -0.0315 0.0418  0.0117  194 GLU A CA  
3077 C C   . GLU A 191 ? 0.5166 0.6610 0.5259 -0.0159 0.0544  0.0216  194 GLU A C   
3078 O O   . GLU A 191 ? 0.5943 0.7574 0.5866 -0.0003 0.0649  0.0337  194 GLU A O   
3079 C CB  . GLU A 191 ? 0.4540 0.6019 0.4773 -0.0331 0.0353  0.0136  194 GLU A CB  
3080 C CG  . GLU A 191 ? 0.5848 0.7481 0.6211 -0.0472 0.0254  0.0068  194 GLU A CG  
3081 C CD  . GLU A 191 ? 0.5423 0.6794 0.5914 -0.0577 0.0161  -0.0053 194 GLU A CD  
3082 O OE1 . GLU A 191 ? 0.5900 0.7065 0.6415 -0.0558 0.0162  -0.0077 194 GLU A OE1 
3083 O OE2 . GLU A 191 ? 0.6353 0.7730 0.6887 -0.0677 0.0094  -0.0114 194 GLU A OE2 
3090 N N   . GLY A 192 ? 0.4998 0.6090 0.5041 -0.0198 0.0545  0.0178  195 GLY A N   
3091 C CA  . GLY A 192 ? 0.5421 0.6202 0.5150 -0.0080 0.0671  0.0263  195 GLY A CA  
3092 C C   . GLY A 192 ? 0.5811 0.6578 0.5588 -0.0108 0.0728  0.0244  195 GLY A C   
3093 O O   . GLY A 192 ? 0.5449 0.6568 0.5347 -0.0035 0.0790  0.0267  195 GLY A O   
3097 N N   . ALA A 193 ? 0.5856 0.6249 0.5535 -0.0230 0.0703  0.0208  196 ALA A N   
3098 C CA  . ALA A 193 ? 0.5429 0.5779 0.5107 -0.0274 0.0761  0.0208  196 ALA A CA  
3099 C C   . ALA A 193 ? 0.8041 0.8812 0.8137 -0.0362 0.0675  0.0131  196 ALA A C   
3100 O O   . ALA A 193 ? 0.5696 0.6590 0.5854 -0.0346 0.0735  0.0145  196 ALA A O   
3101 C CB  . ALA A 193 ? 0.6415 0.6266 0.5828 -0.0433 0.0749  0.0199  196 ALA A CB  
3107 N N   . GLY A 194 ? 0.5803 0.6764 0.6147 -0.0438 0.0546  0.0055  197 GLY A N   
3108 C CA  . GLY A 194 ? 0.6649 0.7949 0.7311 -0.0481 0.0482  -0.0012 197 GLY A CA  
3109 C C   . GLY A 194 ? 0.6882 0.8174 0.7651 -0.0597 0.0430  -0.0032 197 GLY A C   
3110 O O   . GLY A 194 ? 0.6141 0.7702 0.7104 -0.0581 0.0429  -0.0048 197 GLY A O   
3114 N N   . ILE A 195 ? 0.6899 0.7924 0.7534 -0.0721 0.0385  -0.0023 198 ILE A N   
3115 C CA  . ILE A 195 ? 0.7228 0.8333 0.7952 -0.0865 0.0330  -0.0019 198 ILE A CA  
3116 C C   . ILE A 195 ? 0.8158 0.9527 0.9132 -0.0888 0.0214  -0.0064 198 ILE A C   
3117 O O   . ILE A 195 ? 0.6476 0.8129 0.7628 -0.0913 0.0178  -0.0053 198 ILE A O   
3118 C CB  . ILE A 195 ? 0.6652 0.7369 0.7068 -0.1029 0.0338  0.0018  198 ILE A CB  
3119 C CG1 . ILE A 195 ? 0.7115 0.7551 0.7240 -0.0999 0.0478  0.0076  198 ILE A CG1 
3120 C CG2 . ILE A 195 ? 0.7393 0.8284 0.7915 -0.1232 0.0238  0.0025  198 ILE A CG2 
3121 C CD1 . ILE A 195 ? 0.7768 0.8413 0.8006 -0.1064 0.0504  0.0105  198 ILE A CD1 
3133 N N   . VAL A 196 ? 0.5978 0.7261 0.6945 -0.0858 0.0163  -0.0103 199 VAL A N   
3134 C CA  . VAL A 196 ? 0.6298 0.7767 0.7438 -0.0837 0.0079  -0.0140 199 VAL A CA  
3135 C C   . VAL A 196 ? 0.5570 0.7155 0.6802 -0.0706 0.0101  -0.0190 199 VAL A C   
3136 O O   . VAL A 196 ? 0.6103 0.7592 0.7248 -0.0667 0.0142  -0.0203 199 VAL A O   
3137 C CB  . VAL A 196 ? 0.6444 0.7726 0.7496 -0.0889 0.0017  -0.0152 199 VAL A CB  
3138 C CG1 . VAL A 196 ? 0.6763 0.8200 0.7950 -0.0820 -0.0043 -0.0184 199 VAL A CG1 
3139 C CG2 . VAL A 196 ? 0.9063 1.0239 0.9989 -0.1060 -0.0012 -0.0108 199 VAL A CG2 
3149 N N   . PRO A 197 ? 0.4984 0.6778 0.6349 -0.0641 0.0079  -0.0210 200 PRO A N   
3150 C CA  . PRO A 197 ? 0.5065 0.6882 0.6432 -0.0550 0.0102  -0.0270 200 PRO A CA  
3151 C C   . PRO A 197 ? 0.4794 0.6405 0.6054 -0.0555 0.0070  -0.0318 200 PRO A C   
3152 O O   . PRO A 197 ? 0.4982 0.6478 0.6213 -0.0584 0.0024  -0.0306 200 PRO A O   
3153 C CB  . PRO A 197 ? 0.6162 0.8178 0.7624 -0.0460 0.0094  -0.0268 200 PRO A CB  
3154 C CG  . PRO A 197 ? 0.6474 0.8628 0.8007 -0.0497 0.0048  -0.0199 200 PRO A CG  
3155 C CD  . PRO A 197 ? 0.5156 0.7185 0.6634 -0.0645 0.0041  -0.0166 200 PRO A CD  
3163 N N   . LEU A 198 ? 0.4956 0.6536 0.6144 -0.0543 0.0096  -0.0369 201 LEU A N   
3164 C CA  . LEU A 198 ? 0.5840 0.7225 0.6895 -0.0584 0.0071  -0.0409 201 LEU A CA  
3165 C C   . LEU A 198 ? 0.5075 0.6294 0.6073 -0.0535 0.0033  -0.0436 201 LEU A C   
3166 O O   . LEU A 198 ? 0.5115 0.6157 0.6032 -0.0566 0.0003  -0.0445 201 LEU A O   
3167 C CB  . LEU A 198 ? 0.4881 0.6303 0.5835 -0.0630 0.0103  -0.0455 201 LEU A CB  
3168 C CG  . LEU A 198 ? 0.5893 0.7099 0.6655 -0.0708 0.0078  -0.0510 201 LEU A CG  
3169 C CD1 . LEU A 198 ? 0.6924 0.8095 0.7659 -0.0769 0.0051  -0.0467 201 LEU A CD1 
3170 C CD2 . LEU A 198 ? 0.5617 0.6884 0.6246 -0.0795 0.0108  -0.0561 201 LEU A CD2 
3182 N N   . ASN A 199 ? 0.4762 0.6051 0.5786 -0.0433 0.0045  -0.0436 202 ASN A N   
3183 C CA  . ASN A 199 ? 0.5587 0.6729 0.6506 -0.0332 0.0036  -0.0442 202 ASN A CA  
3184 C C   . ASN A 199 ? 0.5874 0.7104 0.6896 -0.0330 -0.0010 -0.0379 202 ASN A C   
3185 O O   . ASN A 199 ? 0.5247 0.6323 0.6173 -0.0279 -0.0022 -0.0381 202 ASN A O   
3186 C CB  . ASN A 199 ? 0.4630 0.5849 0.5506 -0.0178 0.0077  -0.0435 202 ASN A CB  
3187 C CG  . ASN A 199 ? 0.6095 0.7698 0.7195 -0.0135 0.0066  -0.0350 202 ASN A CG  
3188 O OD1 . ASN A 199 ? 0.8296 1.0067 0.9537 -0.0227 0.0065  -0.0336 202 ASN A OD1 
3189 N ND2 . ASN A 199 ? 0.9482 1.1244 1.0591 0.0007  0.0066  -0.0280 202 ASN A ND2 
3196 N N   . ILE A 200 ? 0.4864 0.6324 0.6047 -0.0397 -0.0033 -0.0321 203 ILE A N   
3197 C CA  . ILE A 200 ? 0.4901 0.6441 0.6142 -0.0450 -0.0082 -0.0266 203 ILE A CA  
3198 C C   . ILE A 200 ? 0.4084 0.5388 0.5255 -0.0550 -0.0108 -0.0290 203 ILE A C   
3199 O O   . ILE A 200 ? 0.4577 0.5826 0.5727 -0.0559 -0.0146 -0.0275 203 ILE A O   
3200 C CB  . ILE A 200 ? 0.5814 0.7638 0.7179 -0.0531 -0.0096 -0.0197 203 ILE A CB  
3201 C CG1 . ILE A 200 ? 0.5312 0.7444 0.6758 -0.0407 -0.0077 -0.0149 203 ILE A CG1 
3202 C CG2 . ILE A 200 ? 0.5410 0.7296 0.6782 -0.0651 -0.0154 -0.0147 203 ILE A CG2 
3203 C CD1 . ILE A 200 ? 0.5380 0.7657 0.6801 -0.0260 -0.0086 -0.0099 203 ILE A CD1 
3215 N N   . GLU A 201 ? 0.5167 0.6365 0.6294 -0.0605 -0.0080 -0.0313 204 GLU A N   
3216 C CA  . GLU A 201 ? 0.4976 0.5979 0.6010 -0.0660 -0.0094 -0.0315 204 GLU A CA  
3217 C C   . GLU A 201 ? 0.4912 0.5756 0.5868 -0.0626 -0.0115 -0.0354 204 GLU A C   
3218 O O   . GLU A 201 ? 0.5160 0.5886 0.6078 -0.0644 -0.0151 -0.0342 204 GLU A O   
3219 C CB  . GLU A 201 ? 0.4650 0.5652 0.5629 -0.0680 -0.0043 -0.0307 204 GLU A CB  
3220 C CG  . GLU A 201 ? 0.6470 0.7335 0.7332 -0.0696 -0.0046 -0.0290 204 GLU A CG  
3221 C CD  . GLU A 201 ? 0.7206 0.8160 0.7999 -0.0679 0.0020  -0.0249 204 GLU A CD  
3222 O OE1 . GLU A 201 ? 0.6478 0.7603 0.7324 -0.0666 0.0064  -0.0260 204 GLU A OE1 
3223 O OE2 . GLU A 201 ? 0.5187 0.6062 0.5858 -0.0658 0.0035  -0.0195 204 GLU A OE2 
3230 N N   . THR A 202 ? 0.3951 0.4753 0.4847 -0.0582 -0.0088 -0.0401 205 THR A N   
3231 C CA  . THR A 202 ? 0.5188 0.5761 0.5938 -0.0567 -0.0094 -0.0440 205 THR A CA  
3232 C C   . THR A 202 ? 0.4763 0.5299 0.5526 -0.0476 -0.0116 -0.0417 205 THR A C   
3233 O O   . THR A 202 ? 0.4299 0.4661 0.4982 -0.0475 -0.0134 -0.0423 205 THR A O   
3234 C CB  . THR A 202 ? 0.5775 0.6230 0.6370 -0.0551 -0.0048 -0.0500 205 THR A CB  
3235 O OG1 . THR A 202 ? 0.5069 0.5642 0.5667 -0.0648 -0.0030 -0.0513 205 THR A OG1 
3236 C CG2 . THR A 202 ? 0.4945 0.5073 0.5306 -0.0569 -0.0043 -0.0543 205 THR A CG2 
3244 N N   . LEU A 203 ? 0.4703 0.5452 0.5567 -0.0398 -0.0112 -0.0376 206 LEU A N   
3245 C CA  . LEU A 203 ? 0.5472 0.6312 0.6363 -0.0309 -0.0130 -0.0328 206 LEU A CA  
3246 C C   . LEU A 203 ? 0.3837 0.4713 0.4805 -0.0414 -0.0191 -0.0300 206 LEU A C   
3247 O O   . LEU A 203 ? 0.4906 0.5729 0.5845 -0.0368 -0.0209 -0.0286 206 LEU A O   
3248 C CB  . LEU A 203 ? 0.5281 0.6458 0.6270 -0.0220 -0.0116 -0.0264 206 LEU A CB  
3249 C CG  . LEU A 203 ? 0.4332 0.5793 0.5390 -0.0154 -0.0140 -0.0178 206 LEU A CG  
3250 C CD1 . LEU A 203 ? 0.4608 0.5885 0.5511 0.0016  -0.0103 -0.0177 206 LEU A CD1 
3251 C CD2 . LEU A 203 ? 0.5237 0.7113 0.6386 -0.0074 -0.0125 -0.0095 206 LEU A CD2 
3263 N N   . LEU A 204 ? 0.5329 0.6258 0.6356 -0.0544 -0.0212 -0.0289 207 LEU A N   
3264 C CA  . LEU A 204 ? 0.4304 0.5185 0.5322 -0.0644 -0.0260 -0.0264 207 LEU A CA  
3265 C C   . LEU A 204 ? 0.5741 0.6365 0.6666 -0.0636 -0.0271 -0.0290 207 LEU A C   
3266 O O   . LEU A 204 ? 0.5066 0.5643 0.5977 -0.0639 -0.0309 -0.0276 207 LEU A O   
3267 C CB  . LEU A 204 ? 0.5424 0.6309 0.6423 -0.0766 -0.0255 -0.0244 207 LEU A CB  
3268 C CG  . LEU A 204 ? 0.4523 0.5678 0.5605 -0.0824 -0.0256 -0.0204 207 LEU A CG  
3269 C CD1 . LEU A 204 ? 0.6165 0.7214 0.7160 -0.0942 -0.0229 -0.0189 207 LEU A CD1 
3270 C CD2 . LEU A 204 ? 0.4587 0.5966 0.5712 -0.0881 -0.0311 -0.0154 207 LEU A CD2 
3282 N N   . PHE A 205 ? 0.5188 0.5692 0.6049 -0.0635 -0.0240 -0.0319 208 PHE A N   
3283 C CA  . PHE A 205 ? 0.4824 0.5156 0.5596 -0.0643 -0.0253 -0.0324 208 PHE A CA  
3284 C C   . PHE A 205 ? 0.4970 0.5191 0.5703 -0.0579 -0.0263 -0.0346 208 PHE A C   
3285 O O   . PHE A 205 ? 0.5877 0.5991 0.6573 -0.0577 -0.0293 -0.0333 208 PHE A O   
3286 C CB  . PHE A 205 ? 0.5018 0.5347 0.5722 -0.0680 -0.0218 -0.0334 208 PHE A CB  
3287 C CG  . PHE A 205 ? 0.6298 0.6691 0.6975 -0.0702 -0.0195 -0.0284 208 PHE A CG  
3288 C CD1 . PHE A 205 ? 0.5895 0.6187 0.6501 -0.0693 -0.0212 -0.0235 208 PHE A CD1 
3289 C CD2 . PHE A 205 ? 0.5988 0.6517 0.6668 -0.0712 -0.0144 -0.0281 208 PHE A CD2 
3290 C CE1 . PHE A 205 ? 0.5584 0.5860 0.6078 -0.0672 -0.0165 -0.0177 208 PHE A CE1 
3291 C CE2 . PHE A 205 ? 0.4935 0.5510 0.5547 -0.0692 -0.0099 -0.0219 208 PHE A CE2 
3292 C CZ  . PHE A 205 ? 0.4879 0.5303 0.5375 -0.0661 -0.0103 -0.0164 208 PHE A CZ  
3302 N N   . MET A 206 ? 0.4687 0.4907 0.5393 -0.0504 -0.0226 -0.0372 209 MET A N   
3303 C CA  . MET A 206 ? 0.5399 0.5440 0.5990 -0.0409 -0.0206 -0.0386 209 MET A CA  
3304 C C   . MET A 206 ? 0.4477 0.4636 0.5154 -0.0337 -0.0236 -0.0339 209 MET A C   
3305 O O   . MET A 206 ? 0.5347 0.5359 0.5959 -0.0294 -0.0242 -0.0336 209 MET A O   
3306 C CB  . MET A 206 ? 0.5316 0.5278 0.5780 -0.0306 -0.0138 -0.0412 209 MET A CB  
3307 C CG  . MET A 206 ? 0.4925 0.4596 0.5163 -0.0179 -0.0085 -0.0422 209 MET A CG  
3308 S SD  . MET A 206 ? 0.8267 0.8165 0.8563 0.0054  -0.0055 -0.0341 209 MET A SD  
3309 C CE  . MET A 206 ? 0.5899 0.5837 0.6071 0.0210  0.0028  -0.0332 209 MET A CE  
3319 N N   . VAL A 207 ? 0.4279 0.4725 0.5093 -0.0342 -0.0258 -0.0297 210 VAL A N   
3320 C CA  . VAL A 207 ? 0.3922 0.4555 0.4813 -0.0320 -0.0296 -0.0246 210 VAL A CA  
3321 C C   . VAL A 207 ? 0.5232 0.5732 0.6118 -0.0421 -0.0353 -0.0251 210 VAL A C   
3322 O O   . VAL A 207 ? 0.4588 0.5069 0.5469 -0.0371 -0.0373 -0.0235 210 VAL A O   
3323 C CB  . VAL A 207 ? 0.4146 0.5151 0.5154 -0.0369 -0.0315 -0.0193 210 VAL A CB  
3324 C CG1 . VAL A 207 ? 0.6225 0.7437 0.7291 -0.0450 -0.0376 -0.0146 210 VAL A CG1 
3325 C CG2 . VAL A 207 ? 0.4012 0.5222 0.5017 -0.0199 -0.0255 -0.0154 210 VAL A CG2 
3335 N N   . LEU A 208 ? 0.4548 0.4954 0.5412 -0.0537 -0.0369 -0.0265 211 LEU A N   
3336 C CA  . LEU A 208 ? 0.4519 0.4770 0.5321 -0.0594 -0.0408 -0.0254 211 LEU A CA  
3337 C C   . LEU A 208 ? 0.5756 0.5827 0.6500 -0.0531 -0.0405 -0.0265 211 LEU A C   
3338 O O   . LEU A 208 ? 0.4786 0.4791 0.5512 -0.0513 -0.0441 -0.0246 211 LEU A O   
3339 C CB  . LEU A 208 ? 0.5546 0.5713 0.6271 -0.0676 -0.0395 -0.0247 211 LEU A CB  
3340 C CG  . LEU A 208 ? 0.5658 0.5914 0.6373 -0.0778 -0.0397 -0.0231 211 LEU A CG  
3341 C CD1 . LEU A 208 ? 0.5692 0.5832 0.6302 -0.0806 -0.0348 -0.0222 211 LEU A CD1 
3342 C CD2 . LEU A 208 ? 0.5710 0.5921 0.6345 -0.0868 -0.0447 -0.0211 211 LEU A CD2 
3354 N N   . ASP A 209 ? 0.4420 0.4410 0.5113 -0.0516 -0.0365 -0.0293 212 ASP A N   
3355 C CA  . ASP A 209 ? 0.5561 0.5381 0.6160 -0.0511 -0.0365 -0.0297 212 ASP A CA  
3356 C C   . ASP A 209 ? 0.5504 0.5237 0.6085 -0.0415 -0.0363 -0.0297 212 ASP A C   
3357 O O   . ASP A 209 ? 0.4950 0.4593 0.5503 -0.0406 -0.0390 -0.0277 212 ASP A O   
3358 C CB  . ASP A 209 ? 0.4076 0.3818 0.4571 -0.0566 -0.0323 -0.0333 212 ASP A CB  
3359 C CG  . ASP A 209 ? 0.6578 0.6441 0.7074 -0.0652 -0.0322 -0.0312 212 ASP A CG  
3360 O OD1 . ASP A 209 ? 0.5136 0.5067 0.5659 -0.0647 -0.0345 -0.0261 212 ASP A OD1 
3361 O OD2 . ASP A 209 ? 0.4937 0.4817 0.5369 -0.0713 -0.0288 -0.0340 212 ASP A OD2 
3366 N N   . VAL A 210 ? 0.4927 0.4708 0.5511 -0.0317 -0.0321 -0.0306 213 VAL A N   
3367 C CA  . VAL A 210 ? 0.6011 0.5714 0.6536 -0.0179 -0.0291 -0.0291 213 VAL A CA  
3368 C C   . VAL A 210 ? 0.5432 0.5324 0.6090 -0.0155 -0.0346 -0.0247 213 VAL A C   
3369 O O   . VAL A 210 ? 0.5261 0.5062 0.5887 -0.0083 -0.0347 -0.0231 213 VAL A O   
3370 C CB  . VAL A 210 ? 0.4932 0.4670 0.5381 -0.0032 -0.0212 -0.0286 213 VAL A CB  
3371 C CG1 . VAL A 210 ? 0.7034 0.6694 0.7377 0.0161  -0.0154 -0.0250 213 VAL A CG1 
3372 C CG2 . VAL A 210 ? 0.5169 0.4648 0.5428 -0.0068 -0.0156 -0.0340 213 VAL A CG2 
3382 N N   . SER A 211 ? 0.4591 0.4731 0.5371 -0.0231 -0.0391 -0.0229 214 SER A N   
3383 C CA  . SER A 211 ? 0.3790 0.4094 0.4645 -0.0251 -0.0448 -0.0194 214 SER A CA  
3384 C C   . SER A 211 ? 0.4966 0.5072 0.5777 -0.0308 -0.0497 -0.0197 214 SER A C   
3385 O O   . SER A 211 ? 0.4532 0.4662 0.5361 -0.0267 -0.0528 -0.0175 214 SER A O   
3386 C CB  . SER A 211 ? 0.4916 0.5482 0.5838 -0.0372 -0.0482 -0.0176 214 SER A CB  
3387 O OG  . SER A 211 ? 0.6115 0.6951 0.7090 -0.0300 -0.0439 -0.0147 214 SER A OG  
3393 N N   . ALA A 212 ? 0.4835 0.4782 0.5581 -0.0382 -0.0500 -0.0211 215 ALA A N   
3394 C CA  . ALA A 212 ? 0.5111 0.4917 0.5785 -0.0406 -0.0537 -0.0187 215 ALA A CA  
3395 C C   . ALA A 212 ? 0.5600 0.5285 0.6242 -0.0345 -0.0533 -0.0175 215 ALA A C   
3396 O O   . ALA A 212 ? 0.5657 0.5279 0.6257 -0.0328 -0.0567 -0.0136 215 ALA A O   
3397 C CB  . ALA A 212 ? 0.4803 0.4551 0.5394 -0.0477 -0.0524 -0.0178 215 ALA A CB  
3403 N N   . LYS A 213 ? 0.5365 0.4991 0.5984 -0.0313 -0.0485 -0.0201 216 LYS A N   
3404 C CA  . LYS A 213 ? 0.5416 0.4873 0.5943 -0.0301 -0.0473 -0.0193 216 LYS A CA  
3405 C C   . LYS A 213 ? 0.6064 0.5447 0.6575 -0.0173 -0.0438 -0.0196 216 LYS A C   
3406 O O   . LYS A 213 ? 0.6538 0.5886 0.7061 -0.0125 -0.0465 -0.0163 216 LYS A O   
3407 C CB  . LYS A 213 ? 0.5840 0.5191 0.6243 -0.0398 -0.0433 -0.0221 216 LYS A CB  
3408 C CG  . LYS A 213 ? 0.4693 0.4176 0.5102 -0.0499 -0.0455 -0.0196 216 LYS A CG  
3409 C CD  . LYS A 213 ? 0.5279 0.4728 0.5566 -0.0622 -0.0422 -0.0219 216 LYS A CD  
3410 C CE  . LYS A 213 ? 0.5776 0.5440 0.6078 -0.0688 -0.0431 -0.0173 216 LYS A CE  
3411 N NZ  . LYS A 213 ? 0.6607 0.6360 0.7007 -0.0626 -0.0426 -0.0176 216 LYS A NZ  
3422 N N   . VAL A 214 ? 0.7472 0.6864 0.7954 -0.0095 -0.0375 -0.0219 217 VAL A N   
3423 C CA  . VAL A 214 ? 0.5205 0.4537 0.5623 0.0078  -0.0312 -0.0202 217 VAL A CA  
3424 C C   . VAL A 214 ? 0.5766 0.5418 0.6359 0.0162  -0.0349 -0.0158 217 VAL A C   
3425 O O   . VAL A 214 ? 0.5605 0.5257 0.6202 0.0270  -0.0341 -0.0127 217 VAL A O   
3426 C CB  . VAL A 214 ? 0.5401 0.4619 0.5659 0.0177  -0.0212 -0.0221 217 VAL A CB  
3427 C CG1 . VAL A 214 ? 0.5708 0.4706 0.5768 0.0378  -0.0113 -0.0196 217 VAL A CG1 
3428 C CG2 . VAL A 214 ? 0.6984 0.5950 0.7080 0.0032  -0.0194 -0.0276 217 VAL A CG2 
3438 N N   . GLY A 215 ? 0.5684 0.5619 0.6404 0.0095  -0.0388 -0.0154 218 GLY A N   
3439 C CA  . GLY A 215 ? 0.6616 0.6875 0.7464 0.0105  -0.0435 -0.0114 218 GLY A CA  
3440 C C   . GLY A 215 ? 0.5978 0.6166 0.6854 0.0045  -0.0510 -0.0110 218 GLY A C   
3441 O O   . GLY A 215 ? 0.5871 0.6217 0.6801 0.0113  -0.0529 -0.0077 218 GLY A O   
3445 N N   . PHE A 216 ? 0.4945 0.4920 0.5767 -0.0063 -0.0548 -0.0132 219 PHE A N   
3446 C CA  . PHE A 216 ? 0.5397 0.5275 0.6199 -0.0082 -0.0608 -0.0112 219 PHE A CA  
3447 C C   . PHE A 216 ? 0.6351 0.6139 0.7152 0.0044  -0.0591 -0.0088 219 PHE A C   
3448 O O   . PHE A 216 ? 0.5067 0.4906 0.5903 0.0091  -0.0632 -0.0061 219 PHE A O   
3449 C CB  . PHE A 216 ? 0.7163 0.6873 0.7875 -0.0170 -0.0625 -0.0111 219 PHE A CB  
3450 C CG  . PHE A 216 ? 0.5336 0.4946 0.5981 -0.0152 -0.0674 -0.0068 219 PHE A CG  
3451 C CD1 . PHE A 216 ? 0.6114 0.5652 0.6748 -0.0086 -0.0677 -0.0031 219 PHE A CD1 
3452 C CD2 . PHE A 216 ? 0.5241 0.4798 0.5784 -0.0202 -0.0709 -0.0058 219 PHE A CD2 
3453 C CE1 . PHE A 216 ? 0.6671 0.6159 0.7240 -0.0042 -0.0720 0.0027  219 PHE A CE1 
3454 C CE2 . PHE A 216 ? 0.5849 0.5277 0.6273 -0.0146 -0.0740 -0.0008 219 PHE A CE2 
3455 C CZ  . PHE A 216 ? 0.4758 0.4186 0.5216 -0.0053 -0.0749 0.0041  219 PHE A CZ  
3465 N N   . GLY A 217 ? 0.4943 0.4564 0.5668 0.0089  -0.0526 -0.0098 220 GLY A N   
3466 C CA  . GLY A 217 ? 0.5163 0.4631 0.5832 0.0186  -0.0499 -0.0074 220 GLY A CA  
3467 C C   . GLY A 217 ? 0.5768 0.5363 0.6476 0.0362  -0.0450 -0.0050 220 GLY A C   
3468 O O   . GLY A 217 ? 0.5655 0.5230 0.6379 0.0454  -0.0454 -0.0016 220 GLY A O   
3472 N N   . LEU A 218 ? 0.4346 0.4116 0.5067 0.0427  -0.0397 -0.0052 221 LEU A N   
3473 C CA  . LEU A 218 ? 0.4915 0.4911 0.5667 0.0624  -0.0338 -0.0001 221 LEU A CA  
3474 C C   . LEU A 218 ? 0.5879 0.6198 0.6799 0.0603  -0.0422 0.0028  221 LEU A C   
3475 O O   . LEU A 218 ? 0.5317 0.5772 0.6267 0.0761  -0.0389 0.0076  221 LEU A O   
3476 C CB  . LEU A 218 ? 0.4390 0.4608 0.5124 0.0700  -0.0270 0.0016  221 LEU A CB  
3477 C CG  . LEU A 218 ? 0.7309 0.7174 0.7797 0.0811  -0.0149 0.0002  221 LEU A CG  
3478 C CD1 . LEU A 218 ? 0.7302 0.7415 0.7782 0.0876  -0.0098 0.0025  221 LEU A CD1 
3479 C CD2 . LEU A 218 ? 0.6980 0.6606 0.7270 0.1047  -0.0032 0.0043  221 LEU A CD2 
3491 N N   . ILE A 219 ? 0.4969 0.5382 0.5958 0.0412  -0.0520 0.0002  222 ILE A N   
3492 C CA  . ILE A 219 ? 0.4281 0.4912 0.5349 0.0355  -0.0601 0.0019  222 ILE A CA  
3493 C C   . ILE A 219 ? 0.6299 0.6708 0.7349 0.0404  -0.0637 0.0027  222 ILE A C   
3494 O O   . ILE A 219 ? 0.5179 0.5752 0.6288 0.0478  -0.0660 0.0057  222 ILE A O   
3495 C CB  . ILE A 219 ? 0.5680 0.6355 0.6722 0.0129  -0.0678 -0.0013 222 ILE A CB  
3496 C CG1 . ILE A 219 ? 0.4927 0.5914 0.6009 0.0073  -0.0650 -0.0004 222 ILE A CG1 
3497 C CG2 . ILE A 219 ? 0.5347 0.6108 0.6368 0.0039  -0.0761 -0.0008 222 ILE A CG2 
3498 C CD1 . ILE A 219 ? 0.5307 0.6232 0.6320 -0.0156 -0.0702 -0.0040 222 ILE A CD1 
3510 N N   . LEU A 220 ? 0.5023 0.5108 0.5994 0.0363  -0.0644 0.0012  223 LEU A N   
3511 C CA  . LEU A 220 ? 0.4998 0.4925 0.5948 0.0397  -0.0687 0.0040  223 LEU A CA  
3512 C C   . LEU A 220 ? 0.5247 0.5138 0.6216 0.0566  -0.0630 0.0075  223 LEU A C   
3513 O O   . LEU A 220 ? 0.5332 0.5291 0.6354 0.0648  -0.0663 0.0109  223 LEU A O   
3514 C CB  . LEU A 220 ? 0.4699 0.4396 0.5554 0.0304  -0.0703 0.0041  223 LEU A CB  
3515 C CG  . LEU A 220 ? 0.5357 0.4954 0.6176 0.0340  -0.0750 0.0097  223 LEU A CG  
3516 C CD1 . LEU A 220 ? 0.5020 0.4676 0.5831 0.0369  -0.0819 0.0117  223 LEU A CD1 
3517 C CD2 . LEU A 220 ? 0.5451 0.4942 0.6172 0.0246  -0.0756 0.0121  223 LEU A CD2 
3529 N N   . LEU A 221 ? 0.5078 0.4818 0.5961 0.0624  -0.0536 0.0067  224 LEU A N   
3530 C CA  . LEU A 221 ? 0.4719 0.4279 0.5521 0.0765  -0.0463 0.0100  224 LEU A CA  
3531 C C   . LEU A 221 ? 0.5398 0.5173 0.6247 0.0980  -0.0391 0.0138  224 LEU A C   
3532 O O   . LEU A 221 ? 0.6741 0.6357 0.7502 0.1132  -0.0316 0.0174  224 LEU A O   
3533 C CB  . LEU A 221 ? 0.5412 0.4616 0.5997 0.0721  -0.0379 0.0075  224 LEU A CB  
3534 C CG  . LEU A 221 ? 0.5532 0.4593 0.6063 0.0504  -0.0443 0.0055  224 LEU A CG  
3535 C CD1 . LEU A 221 ? 0.6563 0.5290 0.6848 0.0422  -0.0361 0.0020  224 LEU A CD1 
3536 C CD2 . LEU A 221 ? 0.6040 0.5093 0.6606 0.0468  -0.0515 0.0109  224 LEU A CD2 
3548 N N   . ARG A 222 ? 0.6264 0.8179 0.9187 -0.0211 0.0116  0.2984  225 ARG A N   
3549 C CA  . ARG A 222 ? 0.6743 0.8661 0.9738 -0.0305 -0.0133 0.3404  225 ARG A CA  
3550 C C   . ARG A 222 ? 0.7713 0.9126 1.0126 -0.0479 -0.0655 0.3414  225 ARG A C   
3551 O O   . ARG A 222 ? 0.7304 0.8665 0.9643 -0.0517 -0.0895 0.3610  225 ARG A O   
3552 C CB  . ARG A 222 ? 0.5719 0.8204 0.9446 -0.0327 -0.0309 0.3630  225 ARG A CB  
3553 C CG  . ARG A 222 ? 0.8999 1.1911 1.3172 -0.0035 0.0062  0.3617  225 ARG A CG  
3554 C CD  . ARG A 222 ? 0.9495 1.2615 1.3999 -0.0029 -0.0063 0.3727  225 ARG A CD  
3555 N NE  . ARG A 222 ? 1.0266 1.3547 1.5105 -0.0351 -0.0440 0.3975  225 ARG A NE  
3556 C CZ  . ARG A 222 ? 1.1034 1.4482 1.6167 -0.0444 -0.0546 0.4186  225 ARG A CZ  
3557 N NH1 . ARG A 222 ? 1.1914 1.5449 1.7071 -0.0242 -0.0318 0.4188  225 ARG A NH1 
3558 N NH2 . ARG A 222 ? 1.1089 1.4547 1.6498 -0.0748 -0.0906 0.4417  225 ARG A NH2 
3572 N N   . SER A 223 ? 0.6029 0.7106 0.7999 -0.0542 -0.0829 0.2987  226 SER A N   
3573 C CA  . SER A 223 ? 0.7203 0.7829 0.8625 -0.0697 -0.1342 0.2881  226 SER A CA  
3574 C C   . SER A 223 ? 0.6706 0.6860 0.7346 -0.0653 -0.1111 0.2530  226 SER A C   
3575 O O   . SER A 223 ? 0.7198 0.7302 0.7697 -0.0540 -0.0555 0.2167  226 SER A O   
3576 C CB  . SER A 223 ? 0.6686 0.7148 0.8013 -0.0782 -0.1652 0.2579  226 SER A CB  
3577 O OG  . SER A 223 ? 1.0441 1.0415 1.1107 -0.0884 -0.1987 0.2251  226 SER A OG  
3583 N N   . ARG A 224 ? 0.9373 0.9170 0.9508 -0.0741 -0.1528 0.2619  227 ARG A N   
3584 C CA  . ARG A 224 ? 0.8669 0.7907 0.7915 -0.0720 -0.1343 0.2293  227 ARG A CA  
3585 C C   . ARG A 224 ? 0.6947 0.5871 0.5752 -0.0806 -0.1397 0.1668  227 ARG A C   
3586 O O   . ARG A 224 ? 0.7765 0.6239 0.5863 -0.0806 -0.1135 0.1297  227 ARG A O   
3587 C CB  . ARG A 224 ? 0.9900 0.8855 0.8679 -0.0730 -0.1803 0.2613  227 ARG A CB  
3588 C CG  . ARG A 224 ? 1.0576 0.8954 0.8435 -0.0624 -0.1436 0.2519  227 ARG A CG  
3589 C CD  . ARG A 224 ? 1.1699 1.0156 0.9694 -0.0442 -0.1144 0.2989  227 ARG A CD  
3590 N NE  . ARG A 224 ? 1.4845 1.2604 1.1819 -0.0326 -0.0841 0.2973  227 ARG A NE  
3591 C CZ  . ARG A 224 ? 1.2330 0.9879 0.9146 -0.0183 -0.0203 0.3093  227 ARG A CZ  
3592 N NH1 . ARG A 224 ? 1.3214 1.1262 1.0875 -0.0131 0.0191  0.3212  227 ARG A NH1 
3593 N NH2 . ARG A 224 ? 1.5218 1.1998 1.0971 -0.0086 0.0066  0.3093  227 ARG A NH2 
3607 N N   . ALA A 225 ? 0.7412 0.6527 0.6595 -0.0870 -0.1710 0.1535  228 ALA A N   
3608 C CA  . ALA A 225 ? 0.8151 0.6975 0.6950 -0.0920 -0.1826 0.0922  228 ALA A CA  
3609 C C   . ALA A 225 ? 0.7568 0.6369 0.6258 -0.0799 -0.1191 0.0333  228 ALA A C   
3610 O O   . ALA A 225 ? 0.7609 0.6112 0.5868 -0.0831 -0.1184 -0.0268 228 ALA A O   
3611 C CB  . ALA A 225 ? 0.7918 0.6896 0.7144 -0.0972 -0.2278 0.0957  228 ALA A CB  
3617 N N   . ILE A 226 ? 0.5954 0.5093 0.5084 -0.0660 -0.0659 0.0442  229 ILE A N   
3618 C CA  . ILE A 226 ? 0.6541 0.5733 0.5712 -0.0538 -0.0045 -0.0180 229 ILE A CA  
3619 C C   . ILE A 226 ? 0.8870 0.7662 0.7500 -0.0588 0.0462  -0.0438 229 ILE A C   
3620 O O   . ILE A 226 ? 0.6266 0.5041 0.4918 -0.0536 0.0992  -0.1069 229 ILE A O   
3621 C CB  . ILE A 226 ? 0.6325 0.6054 0.6214 -0.0356 0.0352  -0.0025 229 ILE A CB  
3622 C CG1 . ILE A 226 ? 0.6802 0.6645 0.6871 -0.0353 0.0585  0.0599  229 ILE A CG1 
3623 C CG2 . ILE A 226 ? 0.5096 0.5143 0.5420 -0.0287 -0.0056 0.0179  229 ILE A CG2 
3624 C CD1 . ILE A 226 ? 0.7855 0.8196 0.8590 -0.0173 0.1098  0.0644  229 ILE A CD1 
3636 N N   . PHE A 227 ? 0.7819 0.8311 0.6772 -0.0211 -0.0270 -0.0174 230 PHE A N   
3637 C CA  . PHE A 227 ? 0.8409 0.8158 0.7158 -0.0083 -0.0565 -0.0061 230 PHE A CA  
3638 C C   . PHE A 227 ? 0.8266 0.6925 0.6220 -0.0543 -0.0173 0.0158  230 PHE A C   
3639 O O   . PHE A 227 ? 0.8804 0.7446 0.6326 -0.1009 0.0099  0.0103  230 PHE A O   
3640 C CB  . PHE A 227 ? 0.7216 0.7618 0.6171 0.0044  -0.1199 -0.0293 230 PHE A CB  
3641 C CG  . PHE A 227 ? 0.7449 0.8823 0.7186 0.0588  -0.1655 -0.0529 230 PHE A CG  
3642 C CD1 . PHE A 227 ? 0.7624 0.8739 0.7738 0.1072  -0.2043 -0.0485 230 PHE A CD1 
3643 C CD2 . PHE A 227 ? 0.5235 0.7792 0.5331 0.0618  -0.1712 -0.0795 230 PHE A CD2 
3644 C CE1 . PHE A 227 ? 0.7168 0.8862 0.7871 0.1383  -0.2150 -0.0648 230 PHE A CE1 
3645 C CE2 . PHE A 227 ? 0.7357 1.0595 0.8093 0.1074  -0.1978 -0.0976 230 PHE A CE2 
3646 C CZ  . PHE A 227 ? 0.8442 1.1014 0.9370 0.1355  -0.2053 -0.0862 230 PHE A CZ  
3656 N N   . GLY A 228 ? 0.9050 0.6811 0.6813 -0.0407 -0.0157 0.0407  231 GLY A N   
3657 C CA  . GLY A 228 ? 1.0718 0.7474 0.7709 -0.0787 0.0180  0.0601  231 GLY A CA  
3658 C C   . GLY A 228 ? 1.0974 0.7818 0.7570 -0.1062 -0.0150 0.0471  231 GLY A C   
3659 O O   . GLY A 228 ? 1.0379 0.7757 0.7320 -0.0840 -0.0725 0.0357  231 GLY A O   
3663 N N   . GLU A 229 ? 1.2045 0.8347 0.7911 -0.1552 0.0207  0.0484  232 GLU A N   
3664 C CA  . GLU A 229 ? 0.9394 0.5710 0.4793 -0.1868 -0.0071 0.0377  232 GLU A CA  
3665 C C   . GLU A 229 ? 1.2726 0.8608 0.8026 -0.1672 -0.0409 0.0565  232 GLU A C   
3666 O O   . GLU A 229 ? 1.3623 0.8630 0.8545 -0.1668 -0.0116 0.0823  232 GLU A O   
3667 C CB  . GLU A 229 ? 1.2228 0.7899 0.6806 -0.2420 0.0407  0.0360  232 GLU A CB  
3668 C CG  . GLU A 229 ? 1.5069 1.1178 0.9332 -0.2832 0.0151  0.0135  232 GLU A CG  
3669 C CD  . GLU A 229 ? 1.3554 0.9035 0.7045 -0.3381 0.0611  0.0082  232 GLU A CD  
3670 O OE1 . GLU A 229 ? 1.3216 0.8291 0.6929 -0.3121 0.0964  0.0036  232 GLU A OE1 
3671 O OE2 . GLU A 229 ? 1.3673 0.9474 0.6879 -0.3771 0.0434  -0.0095 232 GLU A OE2 
3678 N N   . ALA A 230 ? 1.1377 0.7899 0.7038 -0.1507 -0.1032 0.0457  233 ALA A N   
3679 C CA  . ALA A 230 ? 1.1006 0.7237 0.6699 -0.1303 -0.1445 0.0654  233 ALA A CA  
3680 C C   . ALA A 230 ? 0.9376 0.6095 0.4975 -0.1485 -0.1957 0.0514  233 ALA A C   
3681 O O   . ALA A 230 ? 1.3183 1.0643 0.8913 -0.1638 -0.2090 0.0247  233 ALA A O   
3682 C CB  . ALA A 230 ? 1.1888 0.8374 0.8399 -0.0723 -0.1789 0.0736  233 ALA A CB  
3688 N N   . GLU A 231 ? 1.1316 0.7647 0.6704 -0.1475 -0.2250 0.0728  234 GLU A N   
3689 C CA  . GLU A 231 ? 1.1782 0.8532 0.7101 -0.1632 -0.2776 0.0656  234 GLU A CA  
3690 C C   . GLU A 231 ? 1.3083 1.0594 0.9366 -0.1144 -0.3401 0.0582  234 GLU A C   
3691 O O   . GLU A 231 ? 1.2491 0.9881 0.9344 -0.0708 -0.3479 0.0709  234 GLU A O   
3692 C CB  . GLU A 231 ? 1.1294 0.7319 0.5948 -0.1863 -0.2780 0.0940  234 GLU A CB  
3693 C CG  . GLU A 231 ? 1.0432 0.6820 0.4873 -0.2159 -0.3127 0.0863  234 GLU A CG  
3694 C CD  . GLU A 231 ? 1.0780 0.7407 0.4780 -0.2615 -0.2851 0.0587  234 GLU A CD  
3695 O OE1 . GLU A 231 ? 1.2477 0.8499 0.5759 -0.2925 -0.2330 0.0551  234 GLU A OE1 
3696 O OE2 . GLU A 231 ? 1.2826 1.0248 0.7280 -0.2619 -0.3093 0.0420  234 GLU A OE2 
4193 C C1  . RET R .   ? 0.5652 0.5891 0.5121 -0.0080 0.0111  0.0357  317 RET A C1  
4194 C C2  . RET R .   ? 0.5054 0.5398 0.4376 0.0035  0.0242  0.0433  317 RET A C2  
4195 C C3  . RET R .   ? 0.7786 0.7660 0.6843 0.0082  0.0318  0.0424  317 RET A C3  
4196 C C4  . RET R .   ? 0.7997 0.7443 0.6691 0.0206  0.0344  0.0489  317 RET A C4  
4197 C C5  . RET R .   ? 0.6626 0.6088 0.5459 0.0143  0.0220  0.0454  317 RET A C5  
4198 C C6  . RET R .   ? 0.5692 0.5473 0.4902 -0.0007 0.0111  0.0374  317 RET A C6  
4199 C C7  . RET R .   ? 0.4477 0.4123 0.3829 -0.0120 -0.0007 0.0289  317 RET A C7  
4200 C C8  . RET R .   ? 0.5889 0.5742 0.5491 -0.0205 -0.0098 0.0244  317 RET A C8  
4201 C C9  . RET R .   ? 0.5227 0.4929 0.4922 -0.0270 -0.0192 0.0180  317 RET A C9  
4202 C C10 . RET R .   ? 0.5235 0.5107 0.5168 -0.0363 -0.0260 0.0119  317 RET A C10 
4203 C C11 . RET R .   ? 0.5866 0.5635 0.5915 -0.0413 -0.0337 0.0055  317 RET A C11 
4204 C C12 . RET R .   ? 0.6124 0.5987 0.6344 -0.0482 -0.0378 -0.0004 317 RET A C12 
4205 C C13 . RET R .   ? 0.6591 0.6361 0.6916 -0.0501 -0.0430 -0.0065 317 RET A C13 
4206 C C14 . RET R .   ? 0.7617 0.7424 0.8040 -0.0542 -0.0437 -0.0118 317 RET A C14 
4207 C C15 . RET R .   ? 0.5130 0.4980 0.5524 -0.0592 -0.0434 -0.0113 317 RET A C15 
4208 C C16 . RET R .   ? 0.5620 0.5855 0.5378 -0.0277 0.0029  0.0205  317 RET A C16 
4209 C C17 . RET R .   ? 0.5085 0.5713 0.4634 -0.0069 0.0075  0.0431  317 RET A C17 
4210 C C18 . RET R .   ? 0.6601 0.5614 0.5063 0.0260  0.0241  0.0508  317 RET A C18 
4211 C C19 . RET R .   ? 0.5659 0.4981 0.5147 -0.0249 -0.0199 0.0173  317 RET A C19 
4212 C C20 . RET R .   ? 0.6217 0.5839 0.6499 -0.0486 -0.0457 -0.0073 317 RET A C20 
# 
