data_7OAO
# 
_entry.id   7OAO 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.347 
_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   7OAO         pdb_00007oao 10.2210/pdb7oao/pdb 
WWPDB D_1292115383 ?            ?                   
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        7OAO 
_pdbx_database_status.recvd_initial_deposition_date   2021-04-19 
_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           N 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Naismith, J.H.' 1 0000-0001-6744-5061 
'Mikolajek, H.'  2 0000-0003-0776-9974 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   US 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'Res Sq' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           2693-5015 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            ? 
_citation.language                  ? 
_citation.page_first                ? 
_citation.page_last                 ? 
_citation.title                     
'A potent SARS-CoV-2 neutralising nanobody shows therapeutic efficacy in the Syrian golden hamster model of COVID-19' 
_citation.year                      2021 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.21203/rs.3.rs-548968/v1 
_citation.pdbx_database_id_PubMed   ? 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Huo, J.'          1  ? 
primary 'Mikolajek, H.'    2  ? 
primary 'Le Bas, A.'       3  ? 
primary 'Clark, J.'        4  ? 
primary 'Sharma, P.'       5  ? 
primary 'Kipar, A.'        6  ? 
primary 'Dormon, J.'       7  ? 
primary 'Norman, C.'       8  ? 
primary 'Weckener, M.'     9  ? 
primary 'Clare, D.'        10 ? 
primary 'Harrison, P.'     11 ? 
primary 'Tree, J.'         12 ? 
primary 'Buttigieg, K.'    13 ? 
primary 'Salguero, F.'     14 ? 
primary 'Watson, R.'       15 ? 
primary 'Knott, D.'        16 ? 
primary 'Carnell, O.'      17 ? 
primary 'Ngabo, D.'        18 ? 
primary 'Elmore, M.'       19 ? 
primary 'Fotheringham, S.' 20 ? 
primary 'Harding, A.'      21 ? 
primary 'Ward, P.'         22 ? 
primary 'Moynie, L.'       23 ? 
primary 'Dumoux, M.'       24 ? 
primary 'Hall, Y.'         25 ? 
primary 'Hiscox, J.'       26 ? 
primary 'Owen, A.'         27 ? 
primary 'James, W.'        28 ? 
primary 'Carroll, M.'      29 ? 
primary 'Stewart, J.'      30 ? 
primary 'Naismith, J.'     31 ? 
primary 'Owens, R.'        32 ? 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.000 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     7OAO 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     71.220 
_cell.length_a_esd                 ? 
_cell.length_b                     154.330 
_cell.length_b_esd                 ? 
_cell.length_c                     28.820 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        4 
_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             ? 
# 
_symmetry.entry_id                         7OAO 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                18 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 21 21 2' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
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 'Spike protein S1'                       23716.580 1   ? ? ? ? 
2 polymer     man 'C5 nanobody'                            13834.428 1   ? ? ? ? 
3 non-polymer syn 2-acetamido-2-deoxy-beta-D-glucopyranose 221.208   1   ? ? ? ? 
4 non-polymer syn 'ACETATE ION'                            59.044    1   ? ? ? ? 
5 water       nat water                                    18.015    290 ? ? ? ? 
# 
loop_
_entity_poly.entity_id 
_entity_poly.type 
_entity_poly.nstd_linkage 
_entity_poly.nstd_monomer 
_entity_poly.pdbx_seq_one_letter_code 
_entity_poly.pdbx_seq_one_letter_code_can 
_entity_poly.pdbx_strand_id 
_entity_poly.pdbx_target_identifier 
1 'polypeptide(L)' no no 
;PNITNLCPFGEVFNATRFASVYAWNRKRISNCVADYSVLYNSASFSTFKCYGVSPTKLNDLCFTNVYADSFVIRGDEVRQ
IAPGQTGKIADYNYKLPDDFTGCVIAWNSNNLDSKVGGNYNYLYRLFRKSNLKPFERDISTEIYQAGSTPCNGVEGFNCY
FPLQSYGFQPTNGVGYQPYRVVVLSFELLHAPATVCGPKKSTNKHHHHHH
;
;PNITNLCPFGEVFNATRFASVYAWNRKRISNCVADYSVLYNSASFSTFKCYGVSPTKLNDLCFTNVYADSFVIRGDEVRQ
IAPGQTGKIADYNYKLPDDFTGCVIAWNSNNLDSKVGGNYNYLYRLFRKSNLKPFERDISTEIYQAGSTPCNGVEGFNCY
FPLQSYGFQPTNGVGYQPYRVVVLSFELLHAPATVCGPKKSTNKHHHHHH
;
EEE ? 
2 'polypeptide(L)' no no 
;QVQLVESGGGSVQAGGSLTLSCVASGVTLGRHAIGWFRQAPGKERERVSCIRTFDGITSYVESTKGRFTISSNNAMNTVY
LQMNSLKPEDTAVYFCALGVTAACSDNPYFWGQGTQVTVSSKHHHHHH
;
;QVQLVESGGGSVQAGGSLTLSCVASGVTLGRHAIGWFRQAPGKERERVSCIRTFDGITSYVESTKGRFTISSNNAMNTVY
LQMNSLKPEDTAVYFCALGVTAACSDNPYFWGQGTQVTVSSKHHHHHH
;
FFF ? 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   PRO n 
1 2   ASN n 
1 3   ILE n 
1 4   THR n 
1 5   ASN n 
1 6   LEU n 
1 7   CYS n 
1 8   PRO n 
1 9   PHE n 
1 10  GLY n 
1 11  GLU n 
1 12  VAL n 
1 13  PHE n 
1 14  ASN n 
1 15  ALA n 
1 16  THR n 
1 17  ARG n 
1 18  PHE n 
1 19  ALA n 
1 20  SER n 
1 21  VAL n 
1 22  TYR n 
1 23  ALA n 
1 24  TRP n 
1 25  ASN n 
1 26  ARG n 
1 27  LYS n 
1 28  ARG n 
1 29  ILE n 
1 30  SER n 
1 31  ASN n 
1 32  CYS n 
1 33  VAL n 
1 34  ALA n 
1 35  ASP n 
1 36  TYR n 
1 37  SER n 
1 38  VAL n 
1 39  LEU n 
1 40  TYR n 
1 41  ASN n 
1 42  SER n 
1 43  ALA n 
1 44  SER n 
1 45  PHE n 
1 46  SER n 
1 47  THR n 
1 48  PHE n 
1 49  LYS n 
1 50  CYS n 
1 51  TYR n 
1 52  GLY n 
1 53  VAL n 
1 54  SER n 
1 55  PRO n 
1 56  THR n 
1 57  LYS n 
1 58  LEU n 
1 59  ASN n 
1 60  ASP n 
1 61  LEU n 
1 62  CYS n 
1 63  PHE n 
1 64  THR n 
1 65  ASN n 
1 66  VAL n 
1 67  TYR n 
1 68  ALA n 
1 69  ASP n 
1 70  SER n 
1 71  PHE n 
1 72  VAL n 
1 73  ILE n 
1 74  ARG n 
1 75  GLY n 
1 76  ASP n 
1 77  GLU n 
1 78  VAL n 
1 79  ARG n 
1 80  GLN n 
1 81  ILE n 
1 82  ALA n 
1 83  PRO n 
1 84  GLY n 
1 85  GLN n 
1 86  THR n 
1 87  GLY n 
1 88  LYS n 
1 89  ILE n 
1 90  ALA n 
1 91  ASP n 
1 92  TYR n 
1 93  ASN n 
1 94  TYR n 
1 95  LYS n 
1 96  LEU n 
1 97  PRO n 
1 98  ASP n 
1 99  ASP n 
1 100 PHE n 
1 101 THR n 
1 102 GLY n 
1 103 CYS n 
1 104 VAL n 
1 105 ILE n 
1 106 ALA n 
1 107 TRP n 
1 108 ASN n 
1 109 SER n 
1 110 ASN n 
1 111 ASN n 
1 112 LEU n 
1 113 ASP n 
1 114 SER n 
1 115 LYS n 
1 116 VAL n 
1 117 GLY n 
1 118 GLY n 
1 119 ASN n 
1 120 TYR n 
1 121 ASN n 
1 122 TYR n 
1 123 LEU n 
1 124 TYR n 
1 125 ARG n 
1 126 LEU n 
1 127 PHE n 
1 128 ARG n 
1 129 LYS n 
1 130 SER n 
1 131 ASN n 
1 132 LEU n 
1 133 LYS n 
1 134 PRO n 
1 135 PHE n 
1 136 GLU n 
1 137 ARG n 
1 138 ASP n 
1 139 ILE n 
1 140 SER n 
1 141 THR n 
1 142 GLU n 
1 143 ILE n 
1 144 TYR n 
1 145 GLN n 
1 146 ALA n 
1 147 GLY n 
1 148 SER n 
1 149 THR n 
1 150 PRO n 
1 151 CYS n 
1 152 ASN n 
1 153 GLY n 
1 154 VAL n 
1 155 GLU n 
1 156 GLY n 
1 157 PHE n 
1 158 ASN n 
1 159 CYS n 
1 160 TYR n 
1 161 PHE n 
1 162 PRO n 
1 163 LEU n 
1 164 GLN n 
1 165 SER n 
1 166 TYR n 
1 167 GLY n 
1 168 PHE n 
1 169 GLN n 
1 170 PRO n 
1 171 THR n 
1 172 ASN n 
1 173 GLY n 
1 174 VAL n 
1 175 GLY n 
1 176 TYR n 
1 177 GLN n 
1 178 PRO n 
1 179 TYR n 
1 180 ARG n 
1 181 VAL n 
1 182 VAL n 
1 183 VAL n 
1 184 LEU n 
1 185 SER n 
1 186 PHE n 
1 187 GLU n 
1 188 LEU n 
1 189 LEU n 
1 190 HIS n 
1 191 ALA n 
1 192 PRO n 
1 193 ALA n 
1 194 THR n 
1 195 VAL n 
1 196 CYS n 
1 197 GLY n 
1 198 PRO n 
1 199 LYS n 
1 200 LYS n 
1 201 SER n 
1 202 THR n 
1 203 ASN n 
1 204 LYS n 
1 205 HIS n 
1 206 HIS n 
1 207 HIS n 
1 208 HIS n 
1 209 HIS n 
1 210 HIS n 
2 1   GLN n 
2 2   VAL n 
2 3   GLN n 
2 4   LEU n 
2 5   VAL n 
2 6   GLU n 
2 7   SER n 
2 8   GLY n 
2 9   GLY n 
2 10  GLY n 
2 11  SER n 
2 12  VAL n 
2 13  GLN n 
2 14  ALA n 
2 15  GLY n 
2 16  GLY n 
2 17  SER n 
2 18  LEU n 
2 19  THR n 
2 20  LEU n 
2 21  SER n 
2 22  CYS n 
2 23  VAL n 
2 24  ALA n 
2 25  SER n 
2 26  GLY n 
2 27  VAL n 
2 28  THR n 
2 29  LEU n 
2 30  GLY n 
2 31  ARG n 
2 32  HIS n 
2 33  ALA n 
2 34  ILE n 
2 35  GLY n 
2 36  TRP n 
2 37  PHE n 
2 38  ARG n 
2 39  GLN n 
2 40  ALA n 
2 41  PRO n 
2 42  GLY n 
2 43  LYS n 
2 44  GLU n 
2 45  ARG n 
2 46  GLU n 
2 47  ARG n 
2 48  VAL n 
2 49  SER n 
2 50  CYS n 
2 51  ILE n 
2 52  ARG n 
2 53  THR n 
2 54  PHE n 
2 55  ASP n 
2 56  GLY n 
2 57  ILE n 
2 58  THR n 
2 59  SER n 
2 60  TYR n 
2 61  VAL n 
2 62  GLU n 
2 63  SER n 
2 64  THR n 
2 65  LYS n 
2 66  GLY n 
2 67  ARG n 
2 68  PHE n 
2 69  THR n 
2 70  ILE n 
2 71  SER n 
2 72  SER n 
2 73  ASN n 
2 74  ASN n 
2 75  ALA n 
2 76  MET n 
2 77  ASN n 
2 78  THR n 
2 79  VAL n 
2 80  TYR n 
2 81  LEU n 
2 82  GLN n 
2 83  MET n 
2 84  ASN n 
2 85  SER n 
2 86  LEU n 
2 87  LYS n 
2 88  PRO n 
2 89  GLU n 
2 90  ASP n 
2 91  THR n 
2 92  ALA n 
2 93  VAL n 
2 94  TYR n 
2 95  PHE n 
2 96  CYS n 
2 97  ALA n 
2 98  LEU n 
2 99  GLY n 
2 100 VAL n 
2 101 THR n 
2 102 ALA n 
2 103 ALA n 
2 104 CYS n 
2 105 SER n 
2 106 ASP n 
2 107 ASN n 
2 108 PRO n 
2 109 TYR n 
2 110 PHE n 
2 111 TRP n 
2 112 GLY n 
2 113 GLN n 
2 114 GLY n 
2 115 THR n 
2 116 GLN n 
2 117 VAL n 
2 118 THR n 
2 119 VAL n 
2 120 SER n 
2 121 SER n 
2 122 LYS n 
2 123 HIS n 
2 124 HIS n 
2 125 HIS n 
2 126 HIS n 
2 127 HIS n 
2 128 HIS 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' 1 210 '2019-nCoV, SARS-CoV-2' ? 'S, 2' ? ? ? ? ? ? 
'Severe acute respiratory syndrome coronavirus 2' 2697049 ? ? ? ? ? ? ? ? 'Homo sapiens'     9606 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 
? ? ? ? ? 
2 1 sample 'Biological sequence' 1 128 ?                       ? ?      ? ? ? ? ? ? 'Lama glama' 9844    ? ? ? ? ? ? ? ? 
'Escherichia coli' 562  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 
# 
loop_
_struct_ref.id 
_struct_ref.db_name 
_struct_ref.db_code 
_struct_ref.pdbx_db_accession 
_struct_ref.pdbx_db_isoform 
_struct_ref.entity_id 
_struct_ref.pdbx_seq_one_letter_code 
_struct_ref.pdbx_align_begin 
1 UNP SPIKE_SARS2 P0DTC2 ? 1 
;PNITNLCPFGEVFNATRFASVYAWNRKRISNCVADYSVLYNSASFSTFKCYGVSPTKLNDLCFTNVYADSFVIRGDEVRQ
IAPGQTGKIADYNYKLPDDFTGCVIAWNSNNLDSKVGGNYNYLYRLFRKSNLKPFERDISTEIYQAGSTPCNGVEGFNCY
FPLQSYGFQPTNGVGYQPYRVVVLSFELLHAPATVCGPKKSTN
;
330 
2 PDB 7OAO        7OAO   ? 2 ? 1   
# 
loop_
_struct_ref_seq.align_id 
_struct_ref_seq.ref_id 
_struct_ref_seq.pdbx_PDB_id_code 
_struct_ref_seq.pdbx_strand_id 
_struct_ref_seq.seq_align_beg 
_struct_ref_seq.pdbx_seq_align_beg_ins_code 
_struct_ref_seq.seq_align_end 
_struct_ref_seq.pdbx_seq_align_end_ins_code 
_struct_ref_seq.pdbx_db_accession 
_struct_ref_seq.db_align_beg 
_struct_ref_seq.pdbx_db_align_beg_ins_code 
_struct_ref_seq.db_align_end 
_struct_ref_seq.pdbx_db_align_end_ins_code 
_struct_ref_seq.pdbx_auth_seq_align_beg 
_struct_ref_seq.pdbx_auth_seq_align_end 
1 1 7OAO EEE 1 ? 203 ? P0DTC2 330 ? 532 ? 330 532 
2 2 7OAO FFF 1 ? 128 ? 7OAO   1   ? 128 ? 1   128 
# 
loop_
_struct_ref_seq_dif.align_id 
_struct_ref_seq_dif.pdbx_pdb_id_code 
_struct_ref_seq_dif.mon_id 
_struct_ref_seq_dif.pdbx_pdb_strand_id 
_struct_ref_seq_dif.seq_num 
_struct_ref_seq_dif.pdbx_pdb_ins_code 
_struct_ref_seq_dif.pdbx_seq_db_name 
_struct_ref_seq_dif.pdbx_seq_db_accession_code 
_struct_ref_seq_dif.db_mon_id 
_struct_ref_seq_dif.pdbx_seq_db_seq_num 
_struct_ref_seq_dif.details 
_struct_ref_seq_dif.pdbx_auth_seq_num 
_struct_ref_seq_dif.pdbx_ordinal 
1 7OAO LYS EEE 204 ? UNP P0DTC2 ? ? 'expression tag' 533 1 
1 7OAO HIS EEE 205 ? UNP P0DTC2 ? ? 'expression tag' 534 2 
1 7OAO HIS EEE 206 ? UNP P0DTC2 ? ? 'expression tag' 535 3 
1 7OAO HIS EEE 207 ? UNP P0DTC2 ? ? 'expression tag' 536 4 
1 7OAO HIS EEE 208 ? UNP P0DTC2 ? ? 'expression tag' 537 5 
1 7OAO HIS EEE 209 ? UNP P0DTC2 ? ? 'expression tag' 538 6 
1 7OAO HIS EEE 210 ? UNP P0DTC2 ? ? 'expression tag' 539 7 
# 
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 
ACT non-polymer                  . 'ACETATE ION'                            ? 'C2 H3 O2 -1'    59.044  
ALA 'L-peptide linking'          y ALANINE                                  ? 'C3 H7 N O2'     89.093  
ARG 'L-peptide linking'          y ARGININE                                 ? 'C6 H15 N4 O2 1' 175.209 
ASN 'L-peptide linking'          y ASPARAGINE                               ? 'C4 H8 N2 O3'    132.118 
ASP 'L-peptide linking'          y 'ASPARTIC ACID'                          ? 'C4 H7 N O4'     133.103 
CYS 'L-peptide linking'          y CYSTEINE                                 ? 'C3 H7 N O2 S'   121.158 
GLN 'L-peptide linking'          y GLUTAMINE                                ? 'C5 H10 N2 O3'   146.144 
GLU 'L-peptide linking'          y 'GLUTAMIC ACID'                          ? 'C5 H9 N O4'     147.129 
GLY 'peptide linking'            y GLYCINE                                  ? 'C2 H5 N O2'     75.067  
HIS 'L-peptide linking'          y HISTIDINE                                ? 'C6 H10 N3 O2 1' 156.162 
HOH non-polymer                  . WATER                                    ? 'H2 O'           18.015  
ILE 'L-peptide linking'          y ISOLEUCINE                               ? 'C6 H13 N O2'    131.173 
LEU 'L-peptide linking'          y LEUCINE                                  ? 'C6 H13 N O2'    131.173 
LYS 'L-peptide linking'          y LYSINE                                   ? 'C6 H15 N2 O2 1' 147.195 
MET 'L-peptide linking'          y METHIONINE                               ? 'C5 H11 N O2 S'  149.211 
NAG 'D-saccharide, beta linking' . 2-acetamido-2-deoxy-beta-D-glucopyranose 
;N-acetyl-beta-D-glucosamine; 2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose; 2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE
;
'C8 H15 N O6'    221.208 
PHE 'L-peptide linking'          y PHENYLALANINE                            ? 'C9 H11 N O2'    165.189 
PRO 'L-peptide linking'          y PROLINE                                  ? 'C5 H9 N O2'     115.130 
SER 'L-peptide linking'          y SERINE                                   ? 'C3 H7 N O3'     105.093 
THR 'L-peptide linking'          y THREONINE                                ? 'C4 H9 N O3'     119.119 
TRP 'L-peptide linking'          y TRYPTOPHAN                               ? 'C11 H12 N2 O2'  204.225 
TYR 'L-peptide linking'          y TYROSINE                                 ? 'C9 H11 N O3'    181.189 
VAL 'L-peptide linking'          y VALINE                                   ? 'C5 H11 N O2'    117.146 
# 
_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                   7OAO 
_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            2.11 
_exptl_crystal.density_method              ? 
_exptl_crystal.density_percent_sol         41.68 
_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_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'VAPOR DIFFUSION' 
_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            293 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    '0.2 M Sodium Acetate, 0.1 M Sodium Cacodylate pH 6.5, 30 % w/v PEG 8000' 
_exptl_crystal_grow.pdbx_pH_range   ? 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS PILATUS 6M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2020-07-14 
_diffrn_detector.pdbx_frequency               ? 
# 
_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   0.9762 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.current                     ? 
_diffrn_source.details                     ? 
_diffrn_source.diffrn_id                   1 
_diffrn_source.power                       ? 
_diffrn_source.size                        ? 
_diffrn_source.source                      SYNCHROTRON 
_diffrn_source.target                      ? 
_diffrn_source.type                        'DIAMOND BEAMLINE I03' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.9762 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   I03 
_diffrn_source.pdbx_synchrotron_site       Diamond 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       7OAO 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.5 
_reflns.d_resolution_low                               51.443 
_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                                     51783 
_reflns.observed_criterion                             ? 
_reflns.observed_criterion_F_max                       ? 
_reflns.observed_criterion_F_min                       ? 
_reflns.observed_criterion_I_max                       ? 
_reflns.observed_criterion_I_min                       ? 
_reflns.observed_criterion_sigma_F                     ? 
_reflns.observed_criterion_sigma_I                     ? 
_reflns.percent_possible_obs                           99.4 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                11.8 
_reflns.pdbx_Rmerge_I_obs                              ? 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          28.1 
_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                                0.013 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   1 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_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                                    1.5 
_reflns_shell.d_res_low                                     1.54 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           6 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             3353 
_reflns_shell.percent_possible_all                          93.7 
_reflns_shell.percent_possible_obs                          ? 
_reflns_shell.Rmerge_F_all                                  ? 
_reflns_shell.Rmerge_F_obs                                  ? 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_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_Rsym_value                               ? 
_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                               0.15 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.96 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_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]                            2.782 
_refine.aniso_B[1][2]                            -0.000 
_refine.aniso_B[1][3]                            0.000 
_refine.aniso_B[2][2]                            -2.664 
_refine.aniso_B[2][3]                            -0.000 
_refine.aniso_B[3][3]                            -0.118 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               25.667 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.973 
_refine.correlation_coeff_Fo_to_Fc_free          0.965 
_refine.details                                  'Hydrogens have been added in their riding positions' 
_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                                 7OAO 
_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                            1.500 
_refine.ls_d_res_low                             51.443 
_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                     51782 
_refine.ls_number_reflns_R_free                  2555 
_refine.ls_number_reflns_R_work                  49227 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.351 
_refine.ls_percent_reflns_R_free                 4.934 
_refine.ls_R_factor_all                          0.154 
_refine.ls_R_factor_obs                          ? 
_refine.ls_R_factor_R_free                       0.1860 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1521 
_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                    'MASK BULK SOLVENT' 
_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                          ? 
_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                      6ZBP 
_refine.pdbx_stereochemistry_target_values       ? 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       0.079 
_refine.pdbx_overall_ESU_R_Free                  0.068 
_refine.pdbx_solvent_vdw_probe_radii             1.100 
_refine.pdbx_solvent_ion_probe_radii             0.700 
_refine.pdbx_solvent_shrinkage_radii             0.700 
_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                 ? 
_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                             2.653 
_refine.overall_SU_ML                            0.044 
_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        2452 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         18 
_refine_hist.number_atoms_solvent             290 
_refine_hist.number_atoms_total               2760 
_refine_hist.d_res_high                       1.500 
_refine_hist.d_res_low                        51.443 
# 
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' ? 0.008  0.013  2585 ? r_bond_refined_d               ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.017  2279 ? r_bond_other_d                 ? ? 
'X-RAY DIFFRACTION' ? 1.443  1.653  3533 ? r_angle_refined_deg            ? ? 
'X-RAY DIFFRACTION' ? 1.388  1.574  5298 ? r_angle_other_deg              ? ? 
'X-RAY DIFFRACTION' ? 6.983  5.000  331  ? r_dihedral_angle_1_deg         ? ? 
'X-RAY DIFFRACTION' ? 30.572 22.180 133  ? r_dihedral_angle_2_deg         ? ? 
'X-RAY DIFFRACTION' ? 11.178 15.000 392  ? r_dihedral_angle_3_deg         ? ? 
'X-RAY DIFFRACTION' ? 16.935 15.000 15   ? r_dihedral_angle_4_deg         ? ? 
'X-RAY DIFFRACTION' ? 0.065  0.200  337  ? r_chiral_restr                 ? ? 
'X-RAY DIFFRACTION' ? 0.008  0.020  2961 ? r_gen_planes_refined           ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.020  586  ? r_gen_planes_other             ? ? 
'X-RAY DIFFRACTION' ? 0.197  0.200  380  ? r_nbd_refined                  ? ? 
'X-RAY DIFFRACTION' ? 0.176  0.200  2145 ? r_symmetry_nbd_other           ? ? 
'X-RAY DIFFRACTION' ? 0.171  0.200  1249 ? r_nbtor_refined                ? ? 
'X-RAY DIFFRACTION' ? 0.077  0.200  1252 ? r_symmetry_nbtor_other         ? ? 
'X-RAY DIFFRACTION' ? 0.230  0.200  184  ? r_xyhbond_nbd_refined          ? ? 
'X-RAY DIFFRACTION' ? 0.260  0.200  12   ? r_symmetry_nbd_refined         ? ? 
'X-RAY DIFFRACTION' ? 0.230  0.200  49   ? r_nbd_other                    ? ? 
'X-RAY DIFFRACTION' ? 0.235  0.200  15   ? r_symmetry_xyhbond_nbd_refined ? ? 
'X-RAY DIFFRACTION' ? 1.579  2.508  1285 ? r_mcbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 1.570  2.504  1283 ? r_mcbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 2.044  3.770  1606 ? r_mcangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 2.046  3.774  1607 ? r_mcangle_other                ? ? 
'X-RAY DIFFRACTION' ? 1.711  2.797  1300 ? r_scbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 1.711  2.797  1301 ? r_scbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 2.180  4.096  1918 ? r_scangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 2.180  4.097  1919 ? r_scangle_other                ? ? 
'X-RAY DIFFRACTION' ? 3.205  29.850 2808 ? r_lrange_it                    ? ? 
'X-RAY DIFFRACTION' ? 3.210  29.861 2809 ? r_lrange_other                 ? ? 
'X-RAY DIFFRACTION' ? 1.856  3.000  4864 ? r_rigid_bond_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 
_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 
'X-RAY DIFFRACTION' 1.500 1.539  3782 . 186 3353 93.5748  . 0.195 . 0.253 . 0.192 . . . . . 0.160 . 20 . 0.908 0.891 
'X-RAY DIFFRACTION' 1.539 1.582  3697 . 175 3450 98.0525  . 0.157 . 0.199 . 0.155 . . . . . 0.130 . 20 . 0.945 0.929 
'X-RAY DIFFRACTION' 1.582 1.627  3587 . 167 3416 99.8885  . 0.132 . 0.191 . 0.129 . . . . . 0.108 . 20 . 0.960 0.940 
'X-RAY DIFFRACTION' 1.627 1.677  3499 . 182 3317 100.0000 . 0.132 . 0.191 . 0.128 . . . . . 0.111 . 20 . 0.962 0.949 
'X-RAY DIFFRACTION' 1.677 1.732  3387 . 169 3217 99.9705  . 0.123 . 0.205 . 0.119 . . . . . 0.103 . 20 . 0.969 0.952 
'X-RAY DIFFRACTION' 1.732 1.793  3309 . 165 3144 100.0000 . 0.123 . 0.168 . 0.121 . . . . . 0.106 . 20 . 0.972 0.973 
'X-RAY DIFFRACTION' 1.793 1.861  3128 . 154 2974 100.0000 . 0.119 . 0.174 . 0.116 . . . . . 0.106 . 20 . 0.975 0.968 
'X-RAY DIFFRACTION' 1.861 1.937  3104 . 140 2964 100.0000 . 0.128 . 0.198 . 0.125 . . . . . 0.118 . 20 . 0.973 0.956 
'X-RAY DIFFRACTION' 1.937 2.023  2917 . 144 2773 100.0000 . 0.129 . 0.165 . 0.127 . . . . . 0.122 . 20 . 0.974 0.970 
'X-RAY DIFFRACTION' 2.023 2.121  2815 . 137 2678 100.0000 . 0.140 . 0.185 . 0.138 . . . . . 0.135 . 20 . 0.970 0.955 
'X-RAY DIFFRACTION' 2.121 2.236  2722 . 125 2597 100.0000 . 0.143 . 0.182 . 0.141 . . . . . 0.143 . 20 . 0.969 0.964 
'X-RAY DIFFRACTION' 2.236 2.371  2527 . 123 2404 100.0000 . 0.142 . 0.181 . 0.140 . . . . . 0.146 . 20 . 0.968 0.959 
'X-RAY DIFFRACTION' 2.371 2.534  2407 . 112 2295 100.0000 . 0.140 . 0.175 . 0.139 . . . . . 0.151 . 20 . 0.972 0.963 
'X-RAY DIFFRACTION' 2.534 2.737  2241 . 123 2118 100.0000 . 0.154 . 0.188 . 0.151 . . . . . 0.171 . 20 . 0.968 0.958 
'X-RAY DIFFRACTION' 2.737 2.997  2079 . 113 1965 99.9519  . 0.158 . 0.177 . 0.157 . . . . . 0.179 . 20 . 0.966 0.960 
'X-RAY DIFFRACTION' 2.997 3.349  1904 . 83  1821 100.0000 . 0.167 . 0.196 . 0.166 . . . . . 0.193 . 20 . 0.965 0.959 
'X-RAY DIFFRACTION' 3.349 3.865  1689 . 86  1603 100.0000 . 0.165 . 0.197 . 0.164 . . . . . 0.197 . 20 . 0.968 0.962 
'X-RAY DIFFRACTION' 3.865 4.727  1464 . 82  1382 100.0000 . 0.155 . 0.168 . 0.154 . . . . . 0.198 . 20 . 0.972 0.970 
'X-RAY DIFFRACTION' 4.727 6.657  1147 . 55  1092 100.0000 . 0.189 . 0.211 . 0.188 . . . . . 0.251 . 20 . 0.968 0.965 
'X-RAY DIFFRACTION' 6.657 51.443 712  . 34  664  98.0337  . 0.212 . 0.185 . 0.213 . . . . . 0.296 . 20 . 0.963 0.958 
# 
_struct.entry_id                     7OAO 
_struct.title                        'Nanobody C5 bound to RBD' 
_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        7OAO 
_struct_keywords.text            'RBD, nanobody, high affinity, ANTIVIRAL PROTEIN' 
_struct_keywords.pdbx_keywords   'ANTIVIRAL PROTEIN' 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 2 ? 
C N N 3 ? 
D N N 4 ? 
E N N 5 ? 
F N N 5 ? 
# 
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 PHE A 9   ? ASN A 14  ? PHE EEE 338 ASN EEE 343 1 ? 6 
HELX_P HELX_P2  AA2 SER A 20  ? TRP A 24  ? SER EEE 349 TRP EEE 353 5 ? 5 
HELX_P HELX_P3  AA3 ASP A 35  ? ASN A 41  ? ASP EEE 364 ASN EEE 370 1 ? 7 
HELX_P HELX_P4  AA4 SER A 54  ? ASP A 60  ? SER EEE 383 ASP EEE 389 5 ? 7 
HELX_P HELX_P5  AA5 ASP A 76  ? ILE A 81  ? ASP EEE 405 ILE EEE 410 5 ? 6 
HELX_P HELX_P6  AA6 GLY A 87  ? ASN A 93  ? GLY EEE 416 ASN EEE 422 1 ? 7 
HELX_P HELX_P7  AA7 SER A 109 ? SER A 114 ? SER EEE 438 SER EEE 443 1 ? 6 
HELX_P HELX_P8  AA8 GLY A 173 ? TYR A 176 ? GLY EEE 502 TYR EEE 505 5 ? 4 
HELX_P HELX_P9  AA9 ASN B 74  ? MET B 76  ? ASN FFF 74  MET FFF 76  5 ? 3 
HELX_P HELX_P10 AB1 LYS B 87  ? THR B 91  ? LYS FFF 87  THR FFF 91  5 ? 5 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
disulf1 disulf ?   ? A CYS 7   SG  ? ? ? 1_555 A CYS 32  SG ? ? EEE CYS 336 EEE CYS 361 1_555 ? ? ? ? ? ? ? 2.040 ? ? 
disulf2 disulf ?   ? A CYS 50  SG  ? ? ? 1_555 A CYS 103 SG ? ? EEE CYS 379 EEE CYS 432 1_555 ? ? ? ? ? ? ? 2.087 ? ? 
disulf3 disulf ?   ? A CYS 62  SG  ? ? ? 1_555 A CYS 196 SG ? ? EEE CYS 391 EEE CYS 525 1_555 ? ? ? ? ? ? ? 2.096 ? ? 
disulf4 disulf ?   ? A CYS 151 SG  ? ? ? 1_555 A CYS 159 SG ? ? EEE CYS 480 EEE CYS 488 1_555 ? ? ? ? ? ? ? 2.118 ? ? 
disulf5 disulf ?   ? B CYS 22  SG  ? ? ? 1_555 B CYS 96  SG ? ? FFF CYS 22  FFF CYS 96  1_555 ? ? ? ? ? ? ? 2.046 ? ? 
disulf6 disulf ?   ? B CYS 50  SG  ? ? ? 1_555 B CYS 104 SG ? ? FFF CYS 50  FFF CYS 104 1_555 ? ? ? ? ? ? ? 2.044 ? ? 
covale1 covale one ? A ASN 14  ND2 ? ? ? 1_555 C NAG .   C1 ? ? EEE ASN 343 EEE NAG 601 1_555 ? ? ? ? ? ? ? 1.433 ? 
N-Glycosylation 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
disulf ? ? 
covale ? ? 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 5 ? 
AA2 ? 3 ? 
AA3 ? 2 ? 
AA4 ? 2 ? 
AA5 ? 4 ? 
AA6 ? 6 ? 
AA7 ? 4 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? anti-parallel 
AA1 2 3 ? anti-parallel 
AA1 3 4 ? anti-parallel 
AA1 4 5 ? anti-parallel 
AA2 1 2 ? parallel      
AA2 2 3 ? anti-parallel 
AA3 1 2 ? anti-parallel 
AA4 1 2 ? anti-parallel 
AA5 1 2 ? anti-parallel 
AA5 2 3 ? anti-parallel 
AA5 3 4 ? anti-parallel 
AA6 1 2 ? parallel      
AA6 2 3 ? anti-parallel 
AA6 3 4 ? anti-parallel 
AA6 4 5 ? anti-parallel 
AA6 5 6 ? anti-parallel 
AA7 1 2 ? parallel      
AA7 2 3 ? anti-parallel 
AA7 3 4 ? 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 ASN A 25  ? ILE A 29  ? ASN EEE 354 ILE EEE 358 
AA1 2 ASN A 65  ? ARG A 74  ? ASN EEE 394 ARG EEE 403 
AA1 3 PRO A 178 ? GLU A 187 ? PRO EEE 507 GLU EEE 516 
AA1 4 GLY A 102 ? ASN A 108 ? GLY EEE 431 ASN EEE 437 
AA1 5 THR A 47  ? TYR A 51  ? THR EEE 376 TYR EEE 380 
AA2 1 CYS A 32  ? VAL A 33  ? CYS EEE 361 VAL EEE 362 
AA2 2 VAL A 195 ? CYS A 196 ? VAL EEE 524 CYS EEE 525 
AA2 3 CYS A 62  ? PHE A 63  ? CYS EEE 391 PHE EEE 392 
AA3 1 LEU A 123 ? ARG A 125 ? LEU EEE 452 ARG EEE 454 
AA3 2 LEU A 163 ? SER A 165 ? LEU EEE 492 SER EEE 494 
AA4 1 TYR A 144 ? GLN A 145 ? TYR EEE 473 GLN EEE 474 
AA4 2 CYS A 159 ? TYR A 160 ? CYS EEE 488 TYR EEE 489 
AA5 1 GLN B 3   ? SER B 7   ? GLN FFF 3   SER FFF 7   
AA5 2 LEU B 18  ? SER B 25  ? LEU FFF 18  SER FFF 25  
AA5 3 THR B 78  ? MET B 83  ? THR FFF 78  MET FFF 83  
AA5 4 PHE B 68  ? ASN B 73  ? PHE FFF 68  ASN FFF 73  
AA6 1 GLY B 10  ? GLN B 13  ? GLY FFF 10  GLN FFF 13  
AA6 2 THR B 115 ? SER B 120 ? THR FFF 115 SER FFF 120 
AA6 3 ALA B 92  ? LEU B 98  ? ALA FFF 92  LEU FFF 98  
AA6 4 ALA B 33  ? GLN B 39  ? ALA FFF 33  GLN FFF 39  
AA6 5 GLU B 46  ? ARG B 52  ? GLU FFF 46  ARG FFF 52  
AA6 6 THR B 58  ? TYR B 60  ? THR FFF 58  TYR FFF 60  
AA7 1 GLY B 10  ? GLN B 13  ? GLY FFF 10  GLN FFF 13  
AA7 2 THR B 115 ? SER B 120 ? THR FFF 115 SER FFF 120 
AA7 3 ALA B 92  ? LEU B 98  ? ALA FFF 92  LEU FFF 98  
AA7 4 PHE B 110 ? TRP B 111 ? PHE FFF 110 TRP FFF 111 
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
AA1 1 2 N ILE A 29  ? N ILE EEE 358 O VAL A 66  ? O VAL EEE 395 
AA1 2 3 N ASP A 69  ? N ASP EEE 398 O VAL A 183 ? O VAL EEE 512 
AA1 3 4 O LEU A 184 ? O LEU EEE 513 N CYS A 103 ? N CYS EEE 432 
AA1 4 5 O VAL A 104 ? O VAL EEE 433 N LYS A 49  ? N LYS EEE 378 
AA2 1 2 N CYS A 32  ? N CYS EEE 361 O CYS A 196 ? O CYS EEE 525 
AA2 2 3 O VAL A 195 ? O VAL EEE 524 N PHE A 63  ? N PHE EEE 392 
AA3 1 2 N TYR A 124 ? N TYR EEE 453 O GLN A 164 ? O GLN EEE 493 
AA4 1 2 N TYR A 144 ? N TYR EEE 473 O TYR A 160 ? O TYR EEE 489 
AA5 1 2 N VAL B 5   ? N VAL FFF 5   O VAL B 23  ? O VAL FFF 23  
AA5 2 3 N LEU B 18  ? N LEU FFF 18  O MET B 83  ? O MET FFF 83  
AA5 3 4 O THR B 78  ? O THR FFF 78  N ASN B 73  ? N ASN FFF 73  
AA6 1 2 N GLY B 10  ? N GLY FFF 10  O GLN B 116 ? O GLN FFF 116 
AA6 2 3 O THR B 115 ? O THR FFF 115 N TYR B 94  ? N TYR FFF 94  
AA6 3 4 O PHE B 95  ? O PHE FFF 95  N PHE B 37  ? N PHE FFF 37  
AA6 4 5 N TRP B 36  ? N TRP FFF 36  O SER B 49  ? O SER FFF 49  
AA6 5 6 N CYS B 50  ? N CYS FFF 50  O SER B 59  ? O SER FFF 59  
AA7 1 2 N GLY B 10  ? N GLY FFF 10  O GLN B 116 ? O GLN FFF 116 
AA7 2 3 O THR B 115 ? O THR FFF 115 N TYR B 94  ? N TYR FFF 94  
AA7 3 4 N LEU B 98  ? N LEU FFF 98  O PHE B 110 ? O PHE FFF 110 
# 
_atom_sites.entry_id                    7OAO 
_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.fract_transf_matrix[1][1]   0.014041 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_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]   0.006480 
_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]   0.034698 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
_atom_type.scat_Cromer_Mann_a1 
_atom_type.scat_Cromer_Mann_b1 
_atom_type.scat_Cromer_Mann_a2 
_atom_type.scat_Cromer_Mann_b2 
_atom_type.scat_Cromer_Mann_a3 
_atom_type.scat_Cromer_Mann_b3 
_atom_type.scat_Cromer_Mann_a4 
_atom_type.scat_Cromer_Mann_b4 
_atom_type.scat_Cromer_Mann_c 
C 2.310  20.844 1.020 10.208 1.589 0.569  0.865 51.651 0.216   
H 0.493  10.511 0.323 26.126 0.140 3.142  0.041 57.800 0.003   
N 12.222 0.006  3.135 9.893  2.014 28.997 1.167 0.583  -11.538 
O 3.049  13.277 2.287 5.701  1.546 0.324  0.867 32.909 0.251   
S 6.905  1.468  5.203 22.215 1.438 0.254  1.586 56.172 1.049   
# 
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_site.calc_flag 
ATOM   1    N N   . ILE A 1 3   ? -35.812 -6.574 -3.668  1.000 65.533 ? 332 ILE EEE N   1 ? 
ATOM   2    C CA  . ILE A 1 3   ? -35.628 -5.107 -3.441  1.000 62.720 ? 332 ILE EEE CA  1 ? 
ATOM   3    C C   . ILE A 1 3   ? -34.435 -4.625 -4.279  1.000 55.287 ? 332 ILE EEE C   1 ? 
ATOM   4    O O   . ILE A 1 3   ? -33.311 -4.569 -3.739  1.000 56.507 ? 332 ILE EEE O   1 ? 
ATOM   5    C CB  . ILE A 1 3   ? -35.455 -4.803 -1.935  1.000 68.160 ? 332 ILE EEE CB  1 ? 
ATOM   6    C CG1 . ILE A 1 3   ? -36.669 -5.269 -1.125  1.000 70.829 ? 332 ILE EEE CG1 1 ? 
ATOM   7    C CG2 . ILE A 1 3   ? -35.162 -3.325 -1.704  1.000 70.924 ? 332 ILE EEE CG2 1 ? 
ATOM   8    C CD1 . ILE A 1 3   ? -36.412 -5.396 0.362   1.000 72.698 ? 332 ILE EEE CD1 1 ? 
ATOM   9    N N   . THR A 1 4   ? -34.676 -4.322 -5.560  1.000 48.721 ? 333 THR EEE N   1 ? 
ATOM   10   C CA  . THR A 1 4   ? -33.688 -3.752 -6.516  1.000 43.538 ? 333 THR EEE CA  1 ? 
ATOM   11   C C   . THR A 1 4   ? -34.052 -2.291 -6.807  1.000 37.659 ? 333 THR EEE C   1 ? 
ATOM   12   O O   . THR A 1 4   ? -35.130 -2.045 -7.393  1.000 37.622 ? 333 THR EEE O   1 ? 
ATOM   13   C CB  . THR A 1 4   ? -33.608 -4.574 -7.808  1.000 47.974 ? 333 THR EEE CB  1 ? 
ATOM   14   O OG1 . THR A 1 4   ? -33.077 -5.857 -7.472  1.000 56.525 ? 333 THR EEE OG1 1 ? 
ATOM   15   C CG2 . THR A 1 4   ? -32.741 -3.928 -8.866  1.000 51.525 ? 333 THR EEE CG2 1 ? 
ATOM   16   N N   . ASN A 1 5   ? -33.180 -1.363 -6.412  1.000 33.975 ? 334 ASN EEE N   1 ? 
ATOM   17   C CA  . ASN A 1 5   ? -33.402 0.095  -6.566  1.000 35.160 ? 334 ASN EEE CA  1 ? 
ATOM   18   C C   . ASN A 1 5   ? -32.903 0.526  -7.945  1.000 34.198 ? 334 ASN EEE C   1 ? 
ATOM   19   O O   . ASN A 1 5   ? -31.849 0.043  -8.370  1.000 32.176 ? 334 ASN EEE O   1 ? 
ATOM   20   C CB  . ASN A 1 5   ? -32.685 0.906  -5.488  1.000 38.819 ? 334 ASN EEE CB  1 ? 
ATOM   21   C CG  . ASN A 1 5   ? -33.230 0.662  -4.098  1.000 44.880 ? 334 ASN EEE CG  1 ? 
ATOM   22   O OD1 . ASN A 1 5   ? -34.417 0.383  -3.926  1.000 50.058 ? 334 ASN EEE OD1 1 ? 
ATOM   23   N ND2 . ASN A 1 5   ? -32.368 0.780  -3.102  1.000 49.091 ? 334 ASN EEE ND2 1 ? 
ATOM   24   N N   . LEU A 1 6   ? -33.642 1.412  -8.604  1.000 33.747 ? 335 LEU EEE N   1 ? 
ATOM   25   C CA  . LEU A 1 6   ? -33.201 2.112  -9.834  1.000 33.306 ? 335 LEU EEE CA  1 ? 
ATOM   26   C C   . LEU A 1 6   ? -32.290 3.266  -9.409  1.000 32.120 ? 335 LEU EEE C   1 ? 
ATOM   27   O O   . LEU A 1 6   ? -32.677 4.022  -8.503  1.000 31.462 ? 335 LEU EEE O   1 ? 
ATOM   28   C CB  . LEU A 1 6   ? -34.439 2.637  -10.564 1.000 36.874 ? 335 LEU EEE CB  1 ? 
ATOM   29   C CG  . LEU A 1 6   ? -34.184 3.374  -11.878 1.000 41.702 ? 335 LEU EEE CG  1 ? 
ATOM   30   C CD1 . LEU A 1 6   ? -33.507 2.459  -12.891 1.000 45.306 ? 335 LEU EEE CD1 1 ? 
ATOM   31   C CD2 . LEU A 1 6   ? -35.487 3.934  -12.442 1.000 46.877 ? 335 LEU EEE CD2 1 ? 
ATOM   32   N N   . CYS A 1 7   ? -31.117 3.403  -10.010 1.000 30.056 ? 336 CYS EEE N   1 ? 
ATOM   33   C CA  . CYS A 1 7   ? -30.194 4.506  -9.648  1.000 29.995 ? 336 CYS EEE CA  1 ? 
ATOM   34   C C   . CYS A 1 7   ? -30.890 5.831  -9.945  1.000 27.804 ? 336 CYS EEE C   1 ? 
ATOM   35   O O   . CYS A 1 7   ? -31.493 5.984  -11.005 1.000 29.894 ? 336 CYS EEE O   1 ? 
ATOM   36   C CB  . CYS A 1 7   ? -28.886 4.439  -10.416 1.000 30.331 ? 336 CYS EEE CB  1 ? 
ATOM   37   S SG  . CYS A 1 7   ? -27.838 3.030  -9.979  1.000 31.014 ? 336 CYS EEE SG  1 ? 
ATOM   38   N N   . PRO A 1 8   ? -30.822 6.816  -9.026  1.000 30.571 ? 337 PRO EEE N   1 ? 
ATOM   39   C CA  . PRO A 1 8   ? -31.514 8.096  -9.203  1.000 30.988 ? 337 PRO EEE CA  1 ? 
ATOM   40   C C   . PRO A 1 8   ? -30.762 9.103  -10.092 1.000 30.190 ? 337 PRO EEE C   1 ? 
ATOM   41   O O   . PRO A 1 8   ? -30.476 10.217 -9.638  1.000 32.363 ? 337 PRO EEE O   1 ? 
ATOM   42   C CB  . PRO A 1 8   ? -31.602 8.581  -7.748  1.000 32.988 ? 337 PRO EEE CB  1 ? 
ATOM   43   C CG  . PRO A 1 8   ? -30.282 8.128  -7.161  1.000 32.004 ? 337 PRO EEE CG  1 ? 
ATOM   44   C CD  . PRO A 1 8   ? -30.105 6.740  -7.741  1.000 30.786 ? 337 PRO EEE CD  1 ? 
ATOM   45   N N   . PHE A 1 9   ? -30.490 8.726  -11.342 1.000 29.781 ? 338 PHE EEE N   1 ? 
ATOM   46   C CA  . PHE A 1 9   ? -29.773 9.585  -12.317 1.000 31.722 ? 338 PHE EEE CA  1 ? 
ATOM   47   C C   . PHE A 1 9   ? -30.685 10.742 -12.757 1.000 32.002 ? 338 PHE EEE C   1 ? 
ATOM   48   O O   . PHE A 1 9   ? -30.156 11.839 -13.025 1.000 31.945 ? 338 PHE EEE O   1 ? 
ATOM   49   C CB  . PHE A 1 9   ? -29.203 8.743  -13.458 1.000 33.166 ? 338 PHE EEE CB  1 ? 
ATOM   50   C CG  . PHE A 1 9   ? -27.916 8.043  -13.097 1.000 34.122 ? 338 PHE EEE CG  1 ? 
ATOM   51   C CD1 . PHE A 1 9   ? -26.795 8.772  -12.734 1.000 36.402 ? 338 PHE EEE CD1 1 ? 
ATOM   52   C CD2 . PHE A 1 9   ? -27.815 6.662  -13.126 1.000 36.389 ? 338 PHE EEE CD2 1 ? 
ATOM   53   C CE1 . PHE A 1 9   ? -25.606 8.139  -12.414 1.000 36.804 ? 338 PHE EEE CE1 1 ? 
ATOM   54   C CE2 . PHE A 1 9   ? -26.624 6.029  -12.800 1.000 37.093 ? 338 PHE EEE CE2 1 ? 
ATOM   55   C CZ  . PHE A 1 9   ? -25.522 6.769  -12.448 1.000 37.142 ? 338 PHE EEE CZ  1 ? 
ATOM   56   N N   . GLY A 1 10  ? -32.006 10.544 -12.744 1.000 32.234 ? 339 GLY EEE N   1 ? 
ATOM   57   C CA  . GLY A 1 10  ? -32.986 11.610 -13.039 1.000 33.993 ? 339 GLY EEE CA  1 ? 
ATOM   58   C C   . GLY A 1 10  ? -32.767 12.829 -12.154 1.000 32.356 ? 339 GLY EEE C   1 ? 
ATOM   59   O O   . GLY A 1 10  ? -32.797 13.963 -12.673 1.000 33.537 ? 339 GLY EEE O   1 ? 
ATOM   60   N N   . GLU A 1 11  ? -32.517 12.612 -10.862 1.000 31.415 ? 340 GLU EEE N   1 ? 
ATOM   61   C CA  . GLU A 1 11  ? -32.302 13.693 -9.863  1.000 32.489 ? 340 GLU EEE CA  1 ? 
ATOM   62   C C   . GLU A 1 11  ? -31.060 14.506 -10.231 1.000 29.247 ? 340 GLU EEE C   1 ? 
ATOM   63   O O   . GLU A 1 11  ? -31.002 15.679 -9.858  1.000 30.793 ? 340 GLU EEE O   1 ? 
ATOM   64   C CB  . GLU A 1 11  ? -32.147 13.124 -8.453  1.000 35.261 ? 340 GLU EEE CB  1 ? 
ATOM   65   C CG  . GLU A 1 11  ? -33.447 12.603 -7.882  1.000 40.354 ? 340 GLU EEE CG  1 ? 
ATOM   66   C CD  . GLU A 1 11  ? -33.300 11.851 -6.575  1.000 45.438 ? 340 GLU EEE CD  1 ? 
ATOM   67   O OE1 . GLU A 1 11  ? -32.269 12.046 -5.895  1.000 50.105 ? 340 GLU EEE OE1 1 ? 
ATOM   68   O OE2 . GLU A 1 11  ? -34.214 11.073 -6.245  1.000 50.854 ? 340 GLU EEE OE2 1 ? 
ATOM   69   N N   . VAL A 1 12  ? -30.089 13.891 -10.906 1.000 26.207 ? 341 VAL EEE N   1 ? 
ATOM   70   C CA  . VAL A 1 12  ? -28.839 14.587 -11.322 1.000 25.955 ? 341 VAL EEE CA  1 ? 
ATOM   71   C C   . VAL A 1 12  ? -29.085 15.342 -12.630 1.000 23.547 ? 341 VAL EEE C   1 ? 
ATOM   72   O O   . VAL A 1 12  ? -28.906 16.578 -12.656 1.000 25.317 ? 341 VAL EEE O   1 ? 
ATOM   73   C CB  . VAL A 1 12  ? -27.680 13.589 -11.458 1.000 28.853 ? 341 VAL EEE CB  1 ? 
ATOM   74   C CG1 . VAL A 1 12  ? -26.390 14.292 -11.831 1.000 27.399 ? 341 VAL EEE CG1 1 ? 
ATOM   75   C CG2 . VAL A 1 12  ? -27.514 12.771 -10.182 1.000 29.156 ? 341 VAL EEE CG2 1 ? 
ATOM   76   N N   . PHE A 1 13  ? -29.431 14.632 -13.700 1.000 23.827 ? 342 PHE EEE N   1 ? 
ATOM   77   C CA  . PHE A 1 13  ? -29.478 15.220 -15.065 1.000 24.710 ? 342 PHE EEE CA  1 ? 
ATOM   78   C C   . PHE A 1 13  ? -30.636 16.217 -15.167 1.000 26.533 ? 342 PHE EEE C   1 ? 
ATOM   79   O O   . PHE A 1 13  ? -30.494 17.222 -15.887 1.000 27.579 ? 342 PHE EEE O   1 ? 
ATOM   80   C CB  . PHE A 1 13  ? -29.591 14.121 -16.121 1.000 26.364 ? 342 PHE EEE CB  1 ? 
ATOM   81   C CG  . PHE A 1 13  ? -28.316 13.344 -16.299 1.000 24.617 ? 342 PHE EEE CG  1 ? 
ATOM   82   C CD1 . PHE A 1 13  ? -28.051 12.221 -15.534 1.000 26.080 ? 342 PHE EEE CD1 1 ? 
ATOM   83   C CD2 . PHE A 1 13  ? -27.356 13.768 -17.203 1.000 22.872 ? 342 PHE EEE CD2 1 ? 
ATOM   84   C CE1 . PHE A 1 13  ? -26.869 11.513 -15.695 1.000 26.508 ? 342 PHE EEE CE1 1 ? 
ATOM   85   C CE2 . PHE A 1 13  ? -26.166 13.066 -17.352 1.000 23.588 ? 342 PHE EEE CE2 1 ? 
ATOM   86   C CZ  . PHE A 1 13  ? -25.928 11.944 -16.595 1.000 25.155 ? 342 PHE EEE CZ  1 ? 
ATOM   87   N N   . ASN A 1 14  ? -31.739 15.944 -14.463 1.000 28.277 ? 343 ASN EEE N   1 ? 
ATOM   88   C CA  . ASN A 1 14  ? -32.986 16.738 -14.574 1.000 29.155 ? 343 ASN EEE CA  1 ? 
ATOM   89   C C   . ASN A 1 14  ? -33.208 17.594 -13.327 1.000 26.805 ? 343 ASN EEE C   1 ? 
ATOM   90   O O   . ASN A 1 14  ? -34.344 18.071 -13.129 1.000 32.577 ? 343 ASN EEE O   1 ? 
ATOM   91   C CB  . ASN A 1 14  ? -34.172 15.825 -14.870 1.000 31.198 ? 343 ASN EEE CB  1 ? 
ATOM   92   C CG  . ASN A 1 14  ? -34.143 15.340 -16.299 1.000 35.635 ? 343 ASN EEE CG  1 ? 
ATOM   93   O OD1 . ASN A 1 14  ? -33.609 16.015 -17.175 1.000 40.688 ? 343 ASN EEE OD1 1 ? 
ATOM   94   N ND2 . ASN A 1 14  ? -34.707 14.177 -16.546 1.000 39.355 ? 343 ASN EEE ND2 1 ? 
ATOM   95   N N   . ALA A 1 15  ? -32.155 17.858 -12.558 1.000 25.519 ? 344 ALA EEE N   1 ? 
ATOM   96   C CA  . ALA A 1 15  ? -32.212 18.801 -11.422 1.000 27.201 ? 344 ALA EEE CA  1 ? 
ATOM   97   C C   . ALA A 1 15  ? -32.703 20.161 -11.933 1.000 28.350 ? 344 ALA EEE C   1 ? 
ATOM   98   O O   . ALA A 1 15  ? -32.306 20.607 -13.044 1.000 29.501 ? 344 ALA EEE O   1 ? 
ATOM   99   C CB  . ALA A 1 15  ? -30.875 18.929 -10.748 1.000 27.712 ? 344 ALA EEE CB  1 ? 
ATOM   100  N N   . THR A 1 16  ? -33.565 20.791 -11.153 1.000 31.320 ? 345 THR EEE N   1 ? 
ATOM   101  C CA  A THR A 1 16  ? -34.135 22.119 -11.491 0.500 34.342 ? 345 THR EEE CA  1 ? 
ATOM   102  C CA  B THR A 1 16  ? -34.134 22.121 -11.481 0.500 34.623 ? 345 THR EEE CA  1 ? 
ATOM   103  C C   . THR A 1 16  ? -33.021 23.163 -11.342 1.000 35.426 ? 345 THR EEE C   1 ? 
ATOM   104  O O   . THR A 1 16  ? -32.932 24.041 -12.222 1.000 39.323 ? 345 THR EEE O   1 ? 
ATOM   105  C CB  A THR A 1 16  ? -35.414 22.392 -10.684 0.500 38.125 ? 345 THR EEE CB  1 ? 
ATOM   106  C CB  B THR A 1 16  ? -35.378 22.397 -10.628 0.500 37.475 ? 345 THR EEE CB  1 ? 
ATOM   107  O OG1 A THR A 1 16  ? -35.782 23.751 -10.913 0.500 39.146 ? 345 THR EEE OG1 1 ? 
ATOM   108  O OG1 B THR A 1 16  ? -35.078 22.064 -9.271  0.500 38.895 ? 345 THR EEE OG1 1 ? 
ATOM   109  C CG2 A THR A 1 16  ? -35.268 22.154 -9.196  0.500 39.273 ? 345 THR EEE CG2 1 ? 
ATOM   110  C CG2 B THR A 1 16  ? -36.579 21.604 -11.091 0.500 39.242 ? 345 THR EEE CG2 1 ? 
ATOM   111  N N   . ARG A 1 17  ? -32.173 23.015 -10.317 1.000 29.002 ? 346 ARG EEE N   1 ? 
ATOM   112  C CA  . ARG A 1 17  ? -31.080 23.976 -10.020 1.000 26.476 ? 346 ARG EEE CA  1 ? 
ATOM   113  C C   . ARG A 1 17  ? -29.742 23.252 -10.202 1.000 21.701 ? 346 ARG EEE C   1 ? 
ATOM   114  O O   . ARG A 1 17  ? -29.631 22.085 -9.789  1.000 23.816 ? 346 ARG EEE O   1 ? 
ATOM   115  C CB  . ARG A 1 17  ? -31.188 24.535 -8.596  1.000 31.874 ? 346 ARG EEE CB  1 ? 
ATOM   116  C CG  . ARG A 1 17  ? -32.484 25.274 -8.290  1.000 39.245 ? 346 ARG EEE CG  1 ? 
ATOM   117  C CD  . ARG A 1 17  ? -32.457 26.721 -8.739  1.000 45.928 ? 346 ARG EEE CD  1 ? 
ATOM   118  N NE  . ARG A 1 17  ? -33.713 27.409 -8.460  1.000 55.216 ? 346 ARG EEE NE  1 ? 
ATOM   119  C CZ  . ARG A 1 17  ? -34.131 28.521 -9.067  1.000 58.575 ? 346 ARG EEE CZ  1 ? 
ATOM   120  N NH1 . ARG A 1 17  ? -33.394 29.095 -10.005 1.000 62.584 ? 346 ARG EEE NH1 1 ? 
ATOM   121  N NH2 . ARG A 1 17  ? -35.290 29.061 -8.730  1.000 62.355 ? 346 ARG EEE NH2 1 ? 
ATOM   122  N N   . PHE A 1 18  ? -28.769 23.926 -10.810 1.000 19.655 ? 347 PHE EEE N   1 ? 
ATOM   123  C CA  . PHE A 1 18  ? -27.368 23.435 -10.936 1.000 18.445 ? 347 PHE EEE CA  1 ? 
ATOM   124  C C   . PHE A 1 18  ? -26.453 24.341 -10.121 1.000 17.330 ? 347 PHE EEE C   1 ? 
ATOM   125  O O   . PHE A 1 18  ? -26.731 25.542 -9.996  1.000 16.873 ? 347 PHE EEE O   1 ? 
ATOM   126  C CB  . PHE A 1 18  ? -26.937 23.350 -12.399 1.000 19.377 ? 347 PHE EEE CB  1 ? 
ATOM   127  C CG  . PHE A 1 18  ? -27.144 21.995 -13.024 1.000 20.670 ? 347 PHE EEE CG  1 ? 
ATOM   128  C CD1 . PHE A 1 18  ? -28.404 21.415 -13.079 1.000 23.186 ? 347 PHE EEE CD1 1 ? 
ATOM   129  C CD2 . PHE A 1 18  ? -26.078 21.301 -13.564 1.000 21.445 ? 347 PHE EEE CD2 1 ? 
ATOM   130  C CE1 . PHE A 1 18  ? -28.573 20.163 -13.650 1.000 23.766 ? 347 PHE EEE CE1 1 ? 
ATOM   131  C CE2 . PHE A 1 18  ? -26.253 20.048 -14.126 1.000 23.629 ? 347 PHE EEE CE2 1 ? 
ATOM   132  C CZ  . PHE A 1 18  ? -27.496 19.477 -14.147 1.000 24.563 ? 347 PHE EEE CZ  1 ? 
ATOM   133  N N   . ALA A 1 19  ? -25.385 23.754 -9.572  1.000 17.474 ? 348 ALA EEE N   1 ? 
ATOM   134  C CA  . ALA A 1 19  ? -24.352 24.474 -8.796  1.000 17.529 ? 348 ALA EEE CA  1 ? 
ATOM   135  C C   . ALA A 1 19  ? -23.494 25.387 -9.683  1.000 14.322 ? 348 ALA EEE C   1 ? 
ATOM   136  O O   . ALA A 1 19  ? -23.252 25.063 -10.861 1.000 15.141 ? 348 ALA EEE O   1 ? 
ATOM   137  C CB  . ALA A 1 19  ? -23.451 23.489 -8.103  1.000 17.694 ? 348 ALA EEE CB  1 ? 
ATOM   138  N N   . SER A 1 20  ? -22.991 26.475 -9.096  1.000 14.804 ? 349 SER EEE N   1 ? 
ATOM   139  C CA  . SER A 1 20  ? -21.785 27.158 -9.621  1.000 14.606 ? 349 SER EEE CA  1 ? 
ATOM   140  C C   . SER A 1 20  ? -20.623 26.161 -9.592  1.000 14.544 ? 349 SER EEE C   1 ? 
ATOM   141  O O   . SER A 1 20  ? -20.481 25.398 -8.626  1.000 14.433 ? 349 SER EEE O   1 ? 
ATOM   142  C CB  . SER A 1 20  ? -21.427 28.392 -8.835  1.000 14.982 ? 349 SER EEE CB  1 ? 
ATOM   143  O OG  . SER A 1 20  ? -22.359 29.453 -9.025  1.000 16.404 ? 349 SER EEE OG  1 ? 
ATOM   144  N N   . VAL A 1 21  ? -19.767 26.248 -10.608 1.000 14.256 ? 350 VAL EEE N   1 ? 
ATOM   145  C CA  . VAL A 1 21  ? -18.603 25.331 -10.726 1.000 13.974 ? 350 VAL EEE CA  1 ? 
ATOM   146  C C   . VAL A 1 21  ? -17.677 25.427 -9.506  1.000 13.773 ? 350 VAL EEE C   1 ? 
ATOM   147  O O   . VAL A 1 21  ? -17.178 24.370 -9.096  1.000 14.267 ? 350 VAL EEE O   1 ? 
ATOM   148  C CB  . VAL A 1 21  ? -17.853 25.576 -12.043 1.000 14.250 ? 350 VAL EEE CB  1 ? 
ATOM   149  C CG1 . VAL A 1 21  ? -17.233 26.970 -12.128 1.000 12.695 ? 350 VAL EEE CG1 1 ? 
ATOM   150  C CG2 . VAL A 1 21  ? -16.848 24.469 -12.303 1.000 14.766 ? 350 VAL EEE CG2 1 ? 
ATOM   151  N N   . TYR A 1 22  ? -17.464 26.589 -8.908  1.000 14.302 ? 351 TYR EEE N   1 ? 
ATOM   152  C CA  . TYR A 1 22  ? -16.536 26.653 -7.755  1.000 14.765 ? 351 TYR EEE CA  1 ? 
ATOM   153  C C   . TYR A 1 22  ? -17.103 25.816 -6.596  1.000 14.454 ? 351 TYR EEE C   1 ? 
ATOM   154  O O   . TYR A 1 22  ? -16.359 25.269 -5.762  1.000 15.734 ? 351 TYR EEE O   1 ? 
ATOM   155  C CB  . TYR A 1 22  ? -16.233 28.098 -7.373  1.000 14.073 ? 351 TYR EEE CB  1 ? 
ATOM   156  C CG  . TYR A 1 22  ? -17.227 28.705 -6.429  1.000 14.977 ? 351 TYR EEE CG  1 ? 
ATOM   157  C CD1 . TYR A 1 22  ? -18.375 29.311 -6.907  1.000 15.592 ? 351 TYR EEE CD1 1 ? 
ATOM   158  C CD2 . TYR A 1 22  ? -17.008 28.706 -5.063  1.000 15.894 ? 351 TYR EEE CD2 1 ? 
ATOM   159  C CE1 . TYR A 1 22  ? -19.300 29.873 -6.042  1.000 16.977 ? 351 TYR EEE CE1 1 ? 
ATOM   160  C CE2 . TYR A 1 22  ? -17.929 29.244 -4.184  1.000 18.331 ? 351 TYR EEE CE2 1 ? 
ATOM   161  C CZ  . TYR A 1 22  ? -19.079 29.834 -4.675  1.000 18.305 ? 351 TYR EEE CZ  1 ? 
ATOM   162  O OH  . TYR A 1 22  ? -19.953 30.383 -3.781  1.000 23.436 ? 351 TYR EEE OH  1 ? 
ATOM   163  N N   . ALA A 1 23  ? -18.436 25.765 -6.505  1.000 14.555 ? 352 ALA EEE N   1 ? 
ATOM   164  C CA  . ALA A 1 23  ? -19.169 25.081 -5.416  1.000 15.814 ? 352 ALA EEE CA  1 ? 
ATOM   165  C C   . ALA A 1 23  ? -19.858 23.834 -5.976  1.000 15.840 ? 352 ALA EEE C   1 ? 
ATOM   166  O O   . ALA A 1 23  ? -21.029 23.524 -5.621  1.000 17.247 ? 352 ALA EEE O   1 ? 
ATOM   167  C CB  . ALA A 1 23  ? -20.168 26.030 -4.798  1.000 16.419 ? 352 ALA EEE CB  1 ? 
ATOM   168  N N   . TRP A 1 24  ? -19.174 23.134 -6.860  1.000 15.429 ? 353 TRP EEE N   1 ? 
ATOM   169  C CA  . TRP A 1 24  ? -19.748 22.015 -7.630  1.000 15.764 ? 353 TRP EEE CA  1 ? 
ATOM   170  C C   . TRP A 1 24  ? -20.430 21.017 -6.695  1.000 16.046 ? 353 TRP EEE C   1 ? 
ATOM   171  O O   . TRP A 1 24  ? -19.939 20.720 -5.594  1.000 17.311 ? 353 TRP EEE O   1 ? 
ATOM   172  C CB  . TRP A 1 24  ? -18.674 21.355 -8.492  1.000 15.385 ? 353 TRP EEE CB  1 ? 
ATOM   173  C CG  . TRP A 1 24  ? -17.401 20.957 -7.811  1.000 15.671 ? 353 TRP EEE CG  1 ? 
ATOM   174  C CD1 . TRP A 1 24  ? -16.260 21.703 -7.735  1.000 15.947 ? 353 TRP EEE CD1 1 ? 
ATOM   175  C CD2 . TRP A 1 24  ? -17.082 19.662 -7.277  1.000 16.139 ? 353 TRP EEE CD2 1 ? 
ATOM   176  N NE1 . TRP A 1 24  ? -15.269 20.967 -7.144  1.000 15.739 ? 353 TRP EEE NE1 1 ? 
ATOM   177  C CE2 . TRP A 1 24  ? -15.732 19.709 -6.855  1.000 15.759 ? 353 TRP EEE CE2 1 ? 
ATOM   178  C CE3 . TRP A 1 24  ? -17.773 18.454 -7.143  1.000 17.931 ? 353 TRP EEE CE3 1 ? 
ATOM   179  C CZ2 . TRP A 1 24  ? -15.099 18.617 -6.262  1.000 18.117 ? 353 TRP EEE CZ2 1 ? 
ATOM   180  C CZ3 . TRP A 1 24  ? -17.149 17.379 -6.549  1.000 17.878 ? 353 TRP EEE CZ3 1 ? 
ATOM   181  C CH2 . TRP A 1 24  ? -15.812 17.453 -6.146  1.000 19.013 ? 353 TRP EEE CH2 1 ? 
ATOM   182  N N   . ASN A 1 25  ? -21.547 20.480 -7.154  1.000 16.712 ? 354 ASN EEE N   1 ? 
ATOM   183  C CA  . ASN A 1 25  ? -22.314 19.493 -6.375  1.000 16.877 ? 354 ASN EEE CA  1 ? 
ATOM   184  C C   . ASN A 1 25  ? -21.789 18.082 -6.630  1.000 16.609 ? 354 ASN EEE C   1 ? 
ATOM   185  O O   . ASN A 1 25  ? -21.416 17.773 -7.781  1.000 18.621 ? 354 ASN EEE O   1 ? 
ATOM   186  C CB  . ASN A 1 25  ? -23.785 19.593 -6.764  1.000 17.658 ? 354 ASN EEE CB  1 ? 
ATOM   187  C CG  . ASN A 1 25  ? -24.689 18.796 -5.850  1.000 22.808 ? 354 ASN EEE CG  1 ? 
ATOM   188  O OD1 . ASN A 1 25  ? -25.022 19.253 -4.755  1.000 29.949 ? 354 ASN EEE OD1 1 ? 
ATOM   189  N ND2 . ASN A 1 25  ? -25.077 17.611 -6.293  1.000 24.115 ? 354 ASN EEE ND2 1 ? 
ATOM   190  N N   . ARG A 1 26  ? -21.838 17.242 -5.593  1.000 19.039 ? 355 ARG EEE N   1 ? 
ATOM   191  C CA  . ARG A 1 26  ? -21.583 15.788 -5.724  1.000 18.791 ? 355 ARG EEE CA  1 ? 
ATOM   192  C C   . ARG A 1 26  ? -22.772 15.010 -5.166  1.000 18.834 ? 355 ARG EEE C   1 ? 
ATOM   193  O O   . ARG A 1 26  ? -23.173 15.276 -4.028  1.000 22.015 ? 355 ARG EEE O   1 ? 
ATOM   194  C CB  . ARG A 1 26  ? -20.292 15.391 -5.004  1.000 18.457 ? 355 ARG EEE CB  1 ? 
ATOM   195  C CG  . ARG A 1 26  ? -20.092 13.887 -4.880  1.000 20.280 ? 355 ARG EEE CG  1 ? 
ATOM   196  C CD  . ARG A 1 26  ? -18.661 13.516 -4.562  1.000 22.061 ? 355 ARG EEE CD  1 ? 
ATOM   197  N NE  . ARG A 1 26  ? -17.849 13.696 -5.744  1.000 21.191 ? 355 ARG EEE NE  1 ? 
ATOM   198  C CZ  . ARG A 1 26  ? -16.600 13.273 -5.868  1.000 22.426 ? 355 ARG EEE CZ  1 ? 
ATOM   199  N NH1 . ARG A 1 26  ? -16.010 12.606 -4.890  1.000 25.014 ? 355 ARG EEE NH1 1 ? 
ATOM   200  N NH2 . ARG A 1 26  ? -15.965 13.468 -7.002  1.000 23.333 ? 355 ARG EEE NH2 1 ? 
ATOM   201  N N   . LYS A 1 27  ? -23.249 14.047 -5.937  1.000 19.944 ? 356 LYS EEE N   1 ? 
ATOM   202  C CA  . LYS A 1 27  ? -24.200 13.027 -5.452  1.000 21.908 ? 356 LYS EEE CA  1 ? 
ATOM   203  C C   . LYS A 1 27  ? -23.517 11.664 -5.530  1.000 23.052 ? 356 LYS EEE C   1 ? 
ATOM   204  O O   . LYS A 1 27  ? -22.969 11.307 -6.600  1.000 23.728 ? 356 LYS EEE O   1 ? 
ATOM   205  C CB  . LYS A 1 27  ? -25.495 13.035 -6.259  1.000 23.716 ? 356 LYS EEE CB  1 ? 
ATOM   206  C CG  . LYS A 1 27  ? -26.532 12.041 -5.750  1.000 28.476 ? 356 LYS EEE CG  1 ? 
ATOM   207  C CD  . LYS A 1 27  ? -27.896 12.197 -6.374  1.000 33.635 ? 356 LYS EEE CD  1 ? 
ATOM   208  C CE  . LYS A 1 27  ? -28.936 11.278 -5.765  1.000 36.943 ? 356 LYS EEE CE  1 ? 
ATOM   209  N NZ  . LYS A 1 27  ? -29.168 11.554 -4.326  1.000 40.719 ? 356 LYS EEE NZ  1 ? 
ATOM   210  N N   . ARG A 1 28  ? -23.570 10.918 -4.437  1.000 23.770 ? 357 ARG EEE N   1 ? 
ATOM   211  C CA  . ARG A 1 28  ? -23.061 9.527  -4.431  1.000 24.566 ? 357 ARG EEE CA  1 ? 
ATOM   212  C C   . ARG A 1 28  ? -24.202 8.599  -4.847  1.000 24.637 ? 357 ARG EEE C   1 ? 
ATOM   213  O O   . ARG A 1 28  ? -25.314 8.747  -4.296  1.000 28.281 ? 357 ARG EEE O   1 ? 
ATOM   214  C CB  . ARG A 1 28  ? -22.496 9.158  -3.062  1.000 24.910 ? 357 ARG EEE CB  1 ? 
ATOM   215  C CG  . ARG A 1 28  ? -22.021 7.712  -2.982  1.000 28.066 ? 357 ARG EEE CG  1 ? 
ATOM   216  C CD  . ARG A 1 28  ? -21.465 7.349  -1.616  1.000 31.831 ? 357 ARG EEE CD  1 ? 
ATOM   217  N NE  . ARG A 1 28  ? -22.503 7.519  -0.607  1.000 35.076 ? 357 ARG EEE NE  1 ? 
ATOM   218  C CZ  . ARG A 1 28  ? -23.456 6.636  -0.324  1.000 39.056 ? 357 ARG EEE CZ  1 ? 
ATOM   219  N NH1 . ARG A 1 28  ? -23.507 5.464  -0.941  1.000 43.945 ? 357 ARG EEE NH1 1 ? 
ATOM   220  N NH2 . ARG A 1 28  ? -24.354 6.925  0.600   1.000 44.515 ? 357 ARG EEE NH2 1 ? 
ATOM   221  N N   . ILE A 1 29  ? -23.936 7.725  -5.816  1.000 24.575 ? 358 ILE EEE N   1 ? 
ATOM   222  C CA  . ILE A 1 29  ? -24.887 6.725  -6.371  1.000 25.500 ? 358 ILE EEE CA  1 ? 
ATOM   223  C C   . ILE A 1 29  ? -24.369 5.350  -5.937  1.000 25.958 ? 358 ILE EEE C   1 ? 
ATOM   224  O O   . ILE A 1 29  ? -23.200 5.030  -6.232  1.000 25.476 ? 358 ILE EEE O   1 ? 
ATOM   225  C CB  . ILE A 1 29  ? -25.000 6.854  -7.906  1.000 28.694 ? 358 ILE EEE CB  1 ? 
ATOM   226  C CG1 . ILE A 1 29  ? -25.419 8.258  -8.357  1.000 32.015 ? 358 ILE EEE CG1 1 ? 
ATOM   227  C CG2 . ILE A 1 29  ? -25.927 5.782  -8.466  1.000 30.012 ? 358 ILE EEE CG2 1 ? 
ATOM   228  C CD1 . ILE A 1 29  ? -26.820 8.627  -7.994  1.000 34.238 ? 358 ILE EEE CD1 1 ? 
ATOM   229  N N   . SER A 1 30  ? -25.188 4.566  -5.236  1.000 27.195 ? 359 SER EEE N   1 ? 
ATOM   230  C CA  . SER A 1 30  ? -24.790 3.217  -4.764  1.000 28.336 ? 359 SER EEE CA  1 ? 
ATOM   231  C C   . SER A 1 30  ? -25.989 2.263  -4.699  1.000 26.635 ? 359 SER EEE C   1 ? 
ATOM   232  O O   . SER A 1 30  ? -27.152 2.734  -4.668  1.000 27.672 ? 359 SER EEE O   1 ? 
ATOM   233  C CB  . SER A 1 30  ? -24.089 3.293  -3.442  1.000 34.628 ? 359 SER EEE CB  1 ? 
ATOM   234  O OG  . SER A 1 30  ? -24.999 3.619  -2.409  1.000 42.928 ? 359 SER EEE OG  1 ? 
ATOM   235  N N   . ASN A 1 31  ? -25.706 0.960  -4.637  1.000 29.098 ? 360 ASN EEE N   1 ? 
ATOM   236  C CA  . ASN A 1 31  ? -26.716 -0.071 -4.288  1.000 30.813 ? 360 ASN EEE CA  1 ? 
ATOM   237  C C   . ASN A 1 31  ? -27.914 0.065  -5.222  1.000 29.298 ? 360 ASN EEE C   1 ? 
ATOM   238  O O   . ASN A 1 31  ? -29.050 0.153  -4.721  1.000 33.428 ? 360 ASN EEE O   1 ? 
ATOM   239  C CB  . ASN A 1 31  ? -27.161 0.074  -2.833  1.000 33.699 ? 360 ASN EEE CB  1 ? 
ATOM   240  C CG  . ASN A 1 31  ? -26.026 -0.128 -1.858  1.000 37.203 ? 360 ASN EEE CG  1 ? 
ATOM   241  O OD1 . ASN A 1 31  ? -25.549 -1.247 -1.698  1.000 49.455 ? 360 ASN EEE OD1 1 ? 
ATOM   242  N ND2 . ASN A 1 31  ? -25.601 0.937  -1.200  1.000 43.896 ? 360 ASN EEE ND2 1 ? 
ATOM   243  N N   . CYS A 1 32  ? -27.675 0.125  -6.530  1.000 27.856 ? 361 CYS EEE N   1 ? 
ATOM   244  C CA  . CYS A 1 32  ? -28.749 0.376  -7.516  1.000 29.930 ? 361 CYS EEE CA  1 ? 
ATOM   245  C C   . CYS A 1 32  ? -28.329 -0.119 -8.903  1.000 29.026 ? 361 CYS EEE C   1 ? 
ATOM   246  O O   . CYS A 1 32  ? -27.147 -0.425 -9.103  1.000 28.900 ? 361 CYS EEE O   1 ? 
ATOM   247  C CB  . CYS A 1 32  ? -29.125 1.854  -7.536  1.000 29.890 ? 361 CYS EEE CB  1 ? 
ATOM   248  S SG  . CYS A 1 32  ? -27.738 2.940  -7.943  1.000 28.832 ? 361 CYS EEE SG  1 ? 
ATOM   249  N N   . VAL A 1 33  ? -29.296 -0.212 -9.811  1.000 31.157 ? 362 VAL EEE N   1 ? 
ATOM   250  C CA  A VAL A 1 33  ? -29.081 -0.596 -11.235 0.500 31.783 ? 362 VAL EEE CA  1 ? 
ATOM   251  C CA  B VAL A 1 33  ? -29.058 -0.589 -11.233 0.500 31.156 ? 362 VAL EEE CA  1 ? 
ATOM   252  C C   . VAL A 1 33  ? -29.335 0.639  -12.106 1.000 31.267 ? 362 VAL EEE C   1 ? 
ATOM   253  O O   . VAL A 1 33  ? -30.291 1.391  -11.810 1.000 31.698 ? 362 VAL EEE O   1 ? 
ATOM   254  C CB  A VAL A 1 33  ? -29.980 -1.780 -11.646 0.500 35.263 ? 362 VAL EEE CB  1 ? 
ATOM   255  C CB  B VAL A 1 33  ? -29.899 -1.806 -11.672 0.500 33.390 ? 362 VAL EEE CB  1 ? 
ATOM   256  C CG1 A VAL A 1 33  ? -31.417 -1.600 -11.192 0.500 36.997 ? 362 VAL EEE CG1 1 ? 
ATOM   257  C CG1 B VAL A 1 33  ? -29.375 -3.102 -11.068 0.500 31.768 ? 362 VAL EEE CG1 1 ? 
ATOM   258  C CG2 A VAL A 1 33  ? -29.921 -2.044 -13.142 0.500 35.477 ? 362 VAL EEE CG2 1 ? 
ATOM   259  C CG2 B VAL A 1 33  ? -31.374 -1.634 -11.361 0.500 34.998 ? 362 VAL EEE CG2 1 ? 
ATOM   260  N N   . ALA A 1 34  ? -28.516 0.829  -13.131 1.000 31.786 ? 363 ALA EEE N   1 ? 
ATOM   261  C CA  . ALA A 1 34  ? -28.658 1.950  -14.080 1.000 35.479 ? 363 ALA EEE CA  1 ? 
ATOM   262  C C   . ALA A 1 34  ? -28.540 1.406  -15.499 1.000 34.248 ? 363 ALA EEE C   1 ? 
ATOM   263  O O   . ALA A 1 34  ? -27.807 0.424  -15.693 1.000 37.806 ? 363 ALA EEE O   1 ? 
ATOM   264  C CB  . ALA A 1 34  ? -27.613 2.997  -13.797 1.000 38.530 ? 363 ALA EEE CB  1 ? 
ATOM   265  N N   . ASP A 1 35  ? -29.293 1.988  -16.427 1.000 36.921 ? 364 ASP EEE N   1 ? 
ATOM   266  C CA  . ASP A 1 35  ? -29.152 1.725  -17.877 1.000 35.522 ? 364 ASP EEE CA  1 ? 
ATOM   267  C C   . ASP A 1 35  ? -28.339 2.888  -18.450 1.000 34.736 ? 364 ASP EEE C   1 ? 
ATOM   268  O O   . ASP A 1 35  ? -28.922 3.939  -18.758 1.000 34.148 ? 364 ASP EEE O   1 ? 
ATOM   269  C CB  . ASP A 1 35  ? -30.512 1.528  -18.554 1.000 36.820 ? 364 ASP EEE CB  1 ? 
ATOM   270  C CG  . ASP A 1 35  ? -30.387 1.032  -19.983 1.000 39.633 ? 364 ASP EEE CG  1 ? 
ATOM   271  O OD1 . ASP A 1 35  ? -29.282 1.174  -20.563 1.000 37.928 ? 364 ASP EEE OD1 1 ? 
ATOM   272  O OD2 . ASP A 1 35  ? -31.392 0.506  -20.508 1.000 45.859 ? 364 ASP EEE OD2 1 ? 
ATOM   273  N N   . TYR A 1 36  ? -27.021 2.721  -18.518 1.000 31.493 ? 365 TYR EEE N   1 ? 
ATOM   274  C CA  . TYR A 1 36  ? -26.084 3.747  -19.029 1.000 32.608 ? 365 TYR EEE CA  1 ? 
ATOM   275  C C   . TYR A 1 36  ? -26.287 3.923  -20.532 1.000 32.528 ? 365 TYR EEE C   1 ? 
ATOM   276  O O   . TYR A 1 36  ? -26.058 5.026  -21.039 1.000 33.767 ? 365 TYR EEE O   1 ? 
ATOM   277  C CB  . TYR A 1 36  ? -24.642 3.332  -18.745 1.000 32.122 ? 365 TYR EEE CB  1 ? 
ATOM   278  C CG  . TYR A 1 36  ? -24.313 3.262  -17.279 1.000 31.021 ? 365 TYR EEE CG  1 ? 
ATOM   279  C CD1 . TYR A 1 36  ? -23.983 4.402  -16.569 1.000 33.042 ? 365 TYR EEE CD1 1 ? 
ATOM   280  C CD2 . TYR A 1 36  ? -24.348 2.057  -16.598 1.000 32.056 ? 365 TYR EEE CD2 1 ? 
ATOM   281  C CE1 . TYR A 1 36  ? -23.674 4.347  -15.222 1.000 33.215 ? 365 TYR EEE CE1 1 ? 
ATOM   282  C CE2 . TYR A 1 36  ? -24.045 1.986  -15.249 1.000 33.403 ? 365 TYR EEE CE2 1 ? 
ATOM   283  C CZ  . TYR A 1 36  ? -23.714 3.137  -14.557 1.000 34.048 ? 365 TYR EEE CZ  1 ? 
ATOM   284  O OH  . TYR A 1 36  ? -23.422 3.090  -13.229 1.000 40.648 ? 365 TYR EEE OH  1 ? 
ATOM   285  N N   . SER A 1 37  ? -26.676 2.844  -21.216 1.000 36.046 ? 366 SER EEE N   1 ? 
ATOM   286  C CA  . SER A 1 37  ? -26.931 2.833  -22.673 1.000 37.662 ? 366 SER EEE CA  1 ? 
ATOM   287  C C   . SER A 1 37  ? -27.963 3.919  -23.015 1.000 35.076 ? 366 SER EEE C   1 ? 
ATOM   288  O O   . SER A 1 37  ? -27.771 4.611  -24.030 1.000 35.965 ? 366 SER EEE O   1 ? 
ATOM   289  C CB  . SER A 1 37  ? -27.374 1.465  -23.129 1.000 40.842 ? 366 SER EEE CB  1 ? 
ATOM   290  O OG  . SER A 1 37  ? -27.428 1.402  -24.541 1.000 48.975 ? 366 SER EEE OG  1 ? 
ATOM   291  N N   . VAL A 1 38  ? -29.004 4.081  -22.191 1.000 35.368 ? 367 VAL EEE N   1 ? 
ATOM   292  C CA  . VAL A 1 38  ? -30.094 5.075  -22.432 1.000 37.138 ? 367 VAL EEE CA  1 ? 
ATOM   293  C C   . VAL A 1 38  ? -29.489 6.483  -22.400 1.000 35.146 ? 367 VAL EEE C   1 ? 
ATOM   294  O O   . VAL A 1 38  ? -29.839 7.277  -23.273 1.000 38.381 ? 367 VAL EEE O   1 ? 
ATOM   295  C CB  . VAL A 1 38  ? -31.267 4.931  -21.438 1.000 41.804 ? 367 VAL EEE CB  1 ? 
ATOM   296  C CG1 . VAL A 1 38  ? -30.914 5.398  -20.038 1.000 46.640 ? 367 VAL EEE CG1 1 ? 
ATOM   297  C CG2 . VAL A 1 38  ? -32.499 5.671  -21.924 1.000 42.570 ? 367 VAL EEE CG2 1 ? 
ATOM   298  N N   . LEU A 1 39  ? -28.585 6.769  -21.454 1.000 32.338 ? 368 LEU EEE N   1 ? 
ATOM   299  C CA  . LEU A 1 39  ? -27.889 8.085  -21.368 1.000 32.626 ? 368 LEU EEE CA  1 ? 
ATOM   300  C C   . LEU A 1 39  ? -26.984 8.241  -22.594 1.000 30.711 ? 368 LEU EEE C   1 ? 
ATOM   301  O O   . LEU A 1 39  ? -27.020 9.291  -23.245 1.000 32.372 ? 368 LEU EEE O   1 ? 
ATOM   302  C CB  . LEU A 1 39  ? -27.030 8.173  -20.099 1.000 34.381 ? 368 LEU EEE CB  1 ? 
ATOM   303  C CG  . LEU A 1 39  ? -27.745 8.083  -18.751 1.000 38.171 ? 368 LEU EEE CG  1 ? 
ATOM   304  C CD1 . LEU A 1 39  ? -26.734 7.963  -17.620 1.000 39.510 ? 368 LEU EEE CD1 1 ? 
ATOM   305  C CD2 . LEU A 1 39  ? -28.640 9.283  -18.522 1.000 38.809 ? 368 LEU EEE CD2 1 ? 
ATOM   306  N N   . TYR A 1 40  ? -26.150 7.237  -22.864 1.000 29.391 ? 369 TYR EEE N   1 ? 
ATOM   307  C CA  . TYR A 1 40  ? -25.117 7.304  -23.925 1.000 30.844 ? 369 TYR EEE CA  1 ? 
ATOM   308  C C   . TYR A 1 40  ? -25.789 7.535  -25.284 1.000 32.725 ? 369 TYR EEE C   1 ? 
ATOM   309  O O   . TYR A 1 40  ? -25.258 8.308  -26.097 1.000 32.850 ? 369 TYR EEE O   1 ? 
ATOM   310  C CB  . TYR A 1 40  ? -24.256 6.041  -23.904 1.000 31.836 ? 369 TYR EEE CB  1 ? 
ATOM   311  C CG  . TYR A 1 40  ? -23.127 6.050  -24.900 1.000 33.827 ? 369 TYR EEE CG  1 ? 
ATOM   312  C CD1 . TYR A 1 40  ? -22.313 7.162  -25.045 1.000 35.978 ? 369 TYR EEE CD1 1 ? 
ATOM   313  C CD2 . TYR A 1 40  ? -22.884 4.956  -25.713 1.000 34.882 ? 369 TYR EEE CD2 1 ? 
ATOM   314  C CE1 . TYR A 1 40  ? -21.285 7.187  -25.970 1.000 37.547 ? 369 TYR EEE CE1 1 ? 
ATOM   315  C CE2 . TYR A 1 40  ? -21.848 4.958  -26.633 1.000 37.581 ? 369 TYR EEE CE2 1 ? 
ATOM   316  C CZ  . TYR A 1 40  ? -21.045 6.075  -26.757 1.000 36.027 ? 369 TYR EEE CZ  1 ? 
ATOM   317  O OH  . TYR A 1 40  ? -20.025 6.088  -27.658 1.000 43.918 ? 369 TYR EEE OH  1 ? 
ATOM   318  N N   . ASN A 1 41  ? -26.949 6.920  -25.514 1.000 34.655 ? 370 ASN EEE N   1 ? 
ATOM   319  C CA  . ASN A 1 41  ? -27.627 6.975  -26.835 1.000 36.697 ? 370 ASN EEE CA  1 ? 
ATOM   320  C C   . ASN A 1 41  ? -28.609 8.154  -26.881 1.000 36.674 ? 370 ASN EEE C   1 ? 
ATOM   321  O O   . ASN A 1 41  ? -29.334 8.248  -27.874 1.000 42.334 ? 370 ASN EEE O   1 ? 
ATOM   322  C CB  . ASN A 1 41  ? -28.274 5.631  -27.184 1.000 37.410 ? 370 ASN EEE CB  1 ? 
ATOM   323  C CG  . ASN A 1 41  ? -27.256 4.510  -27.283 1.000 40.193 ? 370 ASN EEE CG  1 ? 
ATOM   324  O OD1 . ASN A 1 41  ? -26.177 4.680  -27.850 1.000 41.331 ? 370 ASN EEE OD1 1 ? 
ATOM   325  N ND2 . ASN A 1 41  ? -27.576 3.362  -26.716 1.000 45.008 ? 370 ASN EEE ND2 1 ? 
ATOM   326  N N   . SER A 1 42  ? -28.612 9.045  -25.881 1.000 38.472 ? 371 SER EEE N   1 ? 
ATOM   327  C CA  . SER A 1 42  ? -29.510 10.233 -25.840 1.000 38.268 ? 371 SER EEE CA  1 ? 
ATOM   328  C C   . SER A 1 42  ? -28.987 11.341 -26.763 1.000 37.028 ? 371 SER EEE C   1 ? 
ATOM   329  O O   . SER A 1 42  ? -27.845 11.794 -26.556 1.000 39.975 ? 371 SER EEE O   1 ? 
ATOM   330  C CB  . SER A 1 42  ? -29.680 10.778 -24.451 1.000 36.887 ? 371 SER EEE CB  1 ? 
ATOM   331  O OG  . SER A 1 42  ? -30.490 11.951 -24.481 1.000 36.430 ? 371 SER EEE OG  1 ? 
ATOM   332  N N   . ALA A 1 43  ? -29.834 11.839 -27.665 1.000 34.921 ? 372 ALA EEE N   1 ? 
ATOM   333  C CA  . ALA A 1 43  ? -29.545 13.021 -28.513 1.000 35.215 ? 372 ALA EEE CA  1 ? 
ATOM   334  C C   . ALA A 1 43  ? -29.473 14.310 -27.667 1.000 36.513 ? 372 ALA EEE C   1 ? 
ATOM   335  O O   . ALA A 1 43  ? -29.071 15.342 -28.232 1.000 40.120 ? 372 ALA EEE O   1 ? 
ATOM   336  C CB  . ALA A 1 43  ? -30.582 13.128 -29.609 1.000 37.603 ? 372 ALA EEE CB  1 ? 
ATOM   337  N N   . SER A 1 44  ? -29.813 14.270 -26.370 1.000 36.016 ? 373 SER EEE N   1 ? 
ATOM   338  C CA  . SER A 1 44  ? -29.838 15.454 -25.465 1.000 36.932 ? 373 SER EEE CA  1 ? 
ATOM   339  C C   . SER A 1 44  ? -28.430 16.009 -25.195 1.000 33.973 ? 373 SER EEE C   1 ? 
ATOM   340  O O   . SER A 1 44  ? -28.338 17.178 -24.810 1.000 36.680 ? 373 SER EEE O   1 ? 
ATOM   341  C CB  . SER A 1 44  ? -30.527 15.144 -24.159 1.000 39.181 ? 373 SER EEE CB  1 ? 
ATOM   342  O OG  . SER A 1 44  ? -31.929 15.001 -24.349 1.000 44.336 ? 373 SER EEE OG  1 ? 
ATOM   343  N N   . PHE A 1 45  ? -27.371 15.215 -25.359 1.000 27.453 ? 374 PHE EEE N   1 ? 
ATOM   344  C CA  . PHE A 1 45  ? -25.997 15.569 -24.916 1.000 26.454 ? 374 PHE EEE CA  1 ? 
ATOM   345  C C   . PHE A 1 45  ? -25.108 15.903 -26.121 1.000 29.202 ? 374 PHE EEE C   1 ? 
ATOM   346  O O   . PHE A 1 45  ? -25.114 15.140 -27.111 1.000 36.539 ? 374 PHE EEE O   1 ? 
ATOM   347  C CB  . PHE A 1 45  ? -25.423 14.410 -24.098 1.000 23.407 ? 374 PHE EEE CB  1 ? 
ATOM   348  C CG  . PHE A 1 45  ? -26.286 13.974 -22.943 1.000 23.258 ? 374 PHE EEE CG  1 ? 
ATOM   349  C CD1 . PHE A 1 45  ? -26.751 14.895 -22.015 1.000 23.886 ? 374 PHE EEE CD1 1 ? 
ATOM   350  C CD2 . PHE A 1 45  ? -26.645 12.643 -22.782 1.000 22.885 ? 374 PHE EEE CD2 1 ? 
ATOM   351  C CE1 . PHE A 1 45  ? -27.542 14.492 -20.949 1.000 24.966 ? 374 PHE EEE CE1 1 ? 
ATOM   352  C CE2 . PHE A 1 45  ? -27.436 12.241 -21.713 1.000 23.889 ? 374 PHE EEE CE2 1 ? 
ATOM   353  C CZ  . PHE A 1 45  ? -27.889 13.167 -20.802 1.000 25.362 ? 374 PHE EEE CZ  1 ? 
ATOM   354  N N   . SER A 1 46  ? -24.351 17.002 -26.032 1.000 27.257 ? 375 SER EEE N   1 ? 
ATOM   355  C CA  . SER A 1 46  ? -23.378 17.449 -27.066 1.000 28.907 ? 375 SER EEE CA  1 ? 
ATOM   356  C C   . SER A 1 46  ? -21.975 16.940 -26.729 1.000 26.666 ? 375 SER EEE C   1 ? 
ATOM   357  O O   . SER A 1 46  ? -21.147 16.848 -27.639 1.000 29.672 ? 375 SER EEE O   1 ? 
ATOM   358  C CB  . SER A 1 46  ? -23.384 18.940 -27.227 1.000 32.773 ? 375 SER EEE CB  1 ? 
ATOM   359  O OG  . SER A 1 46  ? -23.319 19.587 -25.969 1.000 34.050 ? 375 SER EEE OG  1 ? 
ATOM   360  N N   . THR A 1 47  ? -21.729 16.614 -25.463 1.000 25.324 ? 376 THR EEE N   1 ? 
ATOM   361  C CA  . THR A 1 47  ? -20.483 15.949 -24.998 1.000 25.575 ? 376 THR EEE CA  1 ? 
ATOM   362  C C   . THR A 1 47  ? -20.885 14.678 -24.249 1.000 23.159 ? 376 THR EEE C   1 ? 
ATOM   363  O O   . THR A 1 47  ? -21.743 14.764 -23.363 1.000 22.925 ? 376 THR EEE O   1 ? 
ATOM   364  C CB  . THR A 1 47  ? -19.627 16.861 -24.106 1.000 26.709 ? 376 THR EEE CB  1 ? 
ATOM   365  O OG1 . THR A 1 47  ? -19.116 17.956 -24.866 1.000 29.240 ? 376 THR EEE OG1 1 ? 
ATOM   366  C CG2 . THR A 1 47  ? -18.441 16.145 -23.497 1.000 28.209 ? 376 THR EEE CG2 1 ? 
ATOM   367  N N   . PHE A 1 48  ? -20.280 13.545 -24.596 1.000 24.429 ? 377 PHE EEE N   1 ? 
ATOM   368  C CA  . PHE A 1 48  ? -20.349 12.286 -23.821 1.000 23.996 ? 377 PHE EEE CA  1 ? 
ATOM   369  C C   . PHE A 1 48  ? -19.028 11.560 -24.081 1.000 24.808 ? 377 PHE EEE C   1 ? 
ATOM   370  O O   . PHE A 1 48  ? -18.870 10.834 -25.083 1.000 28.723 ? 377 PHE EEE O   1 ? 
ATOM   371  C CB  . PHE A 1 48  ? -21.583 11.465 -24.198 1.000 25.206 ? 377 PHE EEE CB  1 ? 
ATOM   372  C CG  . PHE A 1 48  ? -22.018 10.499 -23.127 1.000 27.194 ? 377 PHE EEE CG  1 ? 
ATOM   373  C CD1 . PHE A 1 48  ? -21.144 9.534  -22.644 1.000 30.409 ? 377 PHE EEE CD1 1 ? 
ATOM   374  C CD2 . PHE A 1 48  ? -23.300 10.553 -22.601 1.000 26.847 ? 377 PHE EEE CD2 1 ? 
ATOM   375  C CE1 . PHE A 1 48  ? -21.550 8.649  -21.656 1.000 31.720 ? 377 PHE EEE CE1 1 ? 
ATOM   376  C CE2 . PHE A 1 48  ? -23.701 9.666  -21.614 1.000 26.439 ? 377 PHE EEE CE2 1 ? 
ATOM   377  C CZ  . PHE A 1 48  ? -22.830 8.714  -21.152 1.000 30.554 ? 377 PHE EEE CZ  1 ? 
ATOM   378  N N   . LYS A 1 49  ? -18.064 11.838 -23.215 1.000 23.694 ? 378 LYS EEE N   1 ? 
ATOM   379  C CA  . LYS A 1 49  ? -16.665 11.380 -23.388 1.000 24.225 ? 378 LYS EEE CA  1 ? 
ATOM   380  C C   . LYS A 1 49  ? -16.297 10.544 -22.167 1.000 24.924 ? 378 LYS EEE C   1 ? 
ATOM   381  O O   . LYS A 1 49  ? -16.370 11.070 -21.046 1.000 25.917 ? 378 LYS EEE O   1 ? 
ATOM   382  C CB  . LYS A 1 49  ? -15.751 12.589 -23.593 1.000 27.137 ? 378 LYS EEE CB  1 ? 
ATOM   383  C CG  . LYS A 1 49  ? -15.927 13.270 -24.939 1.000 32.809 ? 378 LYS EEE CG  1 ? 
ATOM   384  C CD  . LYS A 1 49  ? -15.044 14.469 -25.199 1.000 37.130 ? 378 LYS EEE CD  1 ? 
ATOM   385  C CE  . LYS A 1 49  ? -15.365 15.089 -26.547 1.000 41.899 ? 378 LYS EEE CE  1 ? 
ATOM   386  N NZ  . LYS A 1 49  ? -14.374 16.109 -26.960 1.000 47.047 ? 378 LYS EEE NZ  1 ? 
ATOM   387  N N   . CYS A 1 50  ? -15.883 9.298  -22.385 1.000 26.850 ? 379 CYS EEE N   1 ? 
ATOM   388  C CA  . CYS A 1 50  ? -15.505 8.376  -21.288 1.000 26.696 ? 379 CYS EEE CA  1 ? 
ATOM   389  C C   . CYS A 1 50  ? -13.997 8.127  -21.309 1.000 26.038 ? 379 CYS EEE C   1 ? 
ATOM   390  O O   . CYS A 1 50  ? -13.368 8.205  -22.385 1.000 28.182 ? 379 CYS EEE O   1 ? 
ATOM   391  C CB  . CYS A 1 50  ? -16.276 7.065  -21.336 1.000 28.875 ? 379 CYS EEE CB  1 ? 
ATOM   392  S SG  . CYS A 1 50  ? -18.064 7.306  -21.203 1.000 31.127 ? 379 CYS EEE SG  1 ? 
ATOM   393  N N   . TYR A 1 51  ? -13.465 7.870  -20.123 1.000 25.997 ? 380 TYR EEE N   1 ? 
ATOM   394  C CA  . TYR A 1 51  ? -12.022 7.695  -19.836 1.000 26.240 ? 380 TYR EEE CA  1 ? 
ATOM   395  C C   . TYR A 1 51  ? -11.886 6.442  -18.973 1.000 25.820 ? 380 TYR EEE C   1 ? 
ATOM   396  O O   . TYR A 1 51  ? -12.636 6.283  -18.010 1.000 27.653 ? 380 TYR EEE O   1 ? 
ATOM   397  C CB  . TYR A 1 51  ? -11.466 8.958  -19.166 1.000 26.438 ? 380 TYR EEE CB  1 ? 
ATOM   398  C CG  . TYR A 1 51  ? -11.679 10.232 -19.949 1.000 25.611 ? 380 TYR EEE CG  1 ? 
ATOM   399  C CD1 . TYR A 1 51  ? -12.834 10.989 -19.809 1.000 25.937 ? 380 TYR EEE CD1 1 ? 
ATOM   400  C CD2 . TYR A 1 51  ? -10.747 10.673 -20.868 1.000 25.502 ? 380 TYR EEE CD2 1 ? 
ATOM   401  C CE1 . TYR A 1 51  ? -13.037 12.152 -20.536 1.000 25.339 ? 380 TYR EEE CE1 1 ? 
ATOM   402  C CE2 . TYR A 1 51  ? -10.939 11.823 -21.616 1.000 26.839 ? 380 TYR EEE CE2 1 ? 
ATOM   403  C CZ  . TYR A 1 51  ? -12.086 12.577 -21.445 1.000 25.511 ? 380 TYR EEE CZ  1 ? 
ATOM   404  O OH  . TYR A 1 51  ? -12.280 13.699 -22.193 1.000 27.640 ? 380 TYR EEE OH  1 ? 
ATOM   405  N N   . GLY A 1 52  ? -10.993 5.532  -19.351 1.000 28.211 ? 381 GLY EEE N   1 ? 
ATOM   406  C CA  . GLY A 1 52  ? -10.693 4.329  -18.551 1.000 30.056 ? 381 GLY EEE CA  1 ? 
ATOM   407  C C   . GLY A 1 52  ? -11.692 3.200  -18.739 1.000 30.311 ? 381 GLY EEE C   1 ? 
ATOM   408  O O   . GLY A 1 52  ? -11.393 2.096  -18.290 1.000 34.092 ? 381 GLY EEE O   1 ? 
ATOM   409  N N   . VAL A 1 53  ? -12.855 3.462  -19.337 1.000 31.176 ? 382 VAL EEE N   1 ? 
ATOM   410  C CA  . VAL A 1 53  ? -13.894 2.441  -19.658 1.000 33.484 ? 382 VAL EEE CA  1 ? 
ATOM   411  C C   . VAL A 1 53  ? -14.481 2.785  -21.025 1.000 31.290 ? 382 VAL EEE C   1 ? 
ATOM   412  O O   . VAL A 1 53  ? -14.444 3.965  -21.416 1.000 30.802 ? 382 VAL EEE O   1 ? 
ATOM   413  C CB  . VAL A 1 53  ? -15.009 2.358  -18.597 1.000 37.296 ? 382 VAL EEE CB  1 ? 
ATOM   414  C CG1 . VAL A 1 53  ? -14.571 1.573  -17.369 1.000 40.331 ? 382 VAL EEE CG1 1 ? 
ATOM   415  C CG2 . VAL A 1 53  ? -15.533 3.732  -18.216 1.000 36.913 ? 382 VAL EEE CG2 1 ? 
ATOM   416  N N   . SER A 1 54  ? -15.020 1.780  -21.706 1.000 32.259 ? 383 SER EEE N   1 ? 
ATOM   417  C CA  . SER A 1 54  ? -15.744 1.934  -22.986 1.000 31.683 ? 383 SER EEE CA  1 ? 
ATOM   418  C C   . SER A 1 54  ? -17.206 2.202  -22.661 1.000 31.347 ? 383 SER EEE C   1 ? 
ATOM   419  O O   . SER A 1 54  ? -17.817 1.444  -21.903 1.000 30.210 ? 383 SER EEE O   1 ? 
ATOM   420  C CB  . SER A 1 54  ? -15.597 0.709  -23.844 1.000 37.606 ? 383 SER EEE CB  1 ? 
ATOM   421  O OG  . SER A 1 54  ? -16.500 0.767  -24.938 1.000 45.483 ? 383 SER EEE OG  1 ? 
ATOM   422  N N   . PRO A 1 55  ? -17.825 3.263  -23.215 1.000 33.013 ? 384 PRO EEE N   1 ? 
ATOM   423  C CA  . PRO A 1 55  ? -19.229 3.535  -22.917 1.000 31.245 ? 384 PRO EEE CA  1 ? 
ATOM   424  C C   . PRO A 1 55  ? -20.154 2.373  -23.321 1.000 31.133 ? 384 PRO EEE C   1 ? 
ATOM   425  O O   . PRO A 1 55  ? -21.199 2.219  -22.716 1.000 32.382 ? 384 PRO EEE O   1 ? 
ATOM   426  C CB  . PRO A 1 55  ? -19.544 4.806  -23.723 1.000 33.016 ? 384 PRO EEE CB  1 ? 
ATOM   427  C CG  . PRO A 1 55  ? -18.461 4.872  -24.783 1.000 34.509 ? 384 PRO EEE CG  1 ? 
ATOM   428  C CD  . PRO A 1 55  ? -17.242 4.233  -24.153 1.000 35.132 ? 384 PRO EEE CD  1 ? 
ATOM   429  N N   . THR A 1 56  ? -19.760 1.575  -24.316 1.000 30.118 ? 385 THR EEE N   1 ? 
ATOM   430  C CA  . THR A 1 56  ? -20.594 0.453  -24.830 1.000 29.925 ? 385 THR EEE CA  1 ? 
ATOM   431  C C   . THR A 1 56  ? -20.604 -0.718 -23.848 1.000 29.682 ? 385 THR EEE C   1 ? 
ATOM   432  O O   . THR A 1 56  ? -21.488 -1.573 -23.993 1.000 34.419 ? 385 THR EEE O   1 ? 
ATOM   433  C CB  . THR A 1 56  ? -20.122 -0.030 -26.203 1.000 34.158 ? 385 THR EEE CB  1 ? 
ATOM   434  O OG1 . THR A 1 56  ? -18.768 -0.486 -26.107 1.000 36.833 ? 385 THR EEE OG1 1 ? 
ATOM   435  C CG2 . THR A 1 56  ? -20.240 1.067  -27.237 1.000 36.966 ? 385 THR EEE CG2 1 ? 
ATOM   436  N N   . LYS A 1 57  ? -19.654 -0.767 -22.906 1.000 28.831 ? 386 LYS EEE N   1 ? 
ATOM   437  C CA  . LYS A 1 57  ? -19.523 -1.900 -21.951 1.000 31.050 ? 386 LYS EEE CA  1 ? 
ATOM   438  C C   . LYS A 1 57  ? -20.164 -1.540 -20.607 1.000 27.820 ? 386 LYS EEE C   1 ? 
ATOM   439  O O   . LYS A 1 57  ? -20.259 -2.431 -19.768 1.000 26.170 ? 386 LYS EEE O   1 ? 
ATOM   440  C CB  . LYS A 1 57  ? -18.051 -2.273 -21.752 1.000 34.768 ? 386 LYS EEE CB  1 ? 
ATOM   441  C CG  . LYS A 1 57  ? -17.251 -2.543 -23.026 1.000 40.980 ? 386 LYS EEE CG  1 ? 
ATOM   442  C CD  . LYS A 1 57  ? -17.753 -3.678 -23.902 1.000 48.595 ? 386 LYS EEE CD  1 ? 
ATOM   443  C CE  . LYS A 1 57  ? -16.902 -3.837 -25.150 1.000 55.152 ? 386 LYS EEE CE  1 ? 
ATOM   444  N NZ  . LYS A 1 57  ? -17.582 -4.612 -26.216 1.000 60.987 ? 386 LYS EEE NZ  1 ? 
ATOM   445  N N   . LEU A 1 58  ? -20.578 -0.283 -20.396 1.000 28.853 ? 387 LEU EEE N   1 ? 
ATOM   446  C CA  . LEU A 1 58  ? -20.997 0.207  -19.055 1.000 27.490 ? 387 LEU EEE CA  1 ? 
ATOM   447  C C   . LEU A 1 58  ? -22.109 -0.684 -18.491 1.000 26.128 ? 387 LEU EEE C   1 ? 
ATOM   448  O O   . LEU A 1 58  ? -22.058 -0.984 -17.277 1.000 27.231 ? 387 LEU EEE O   1 ? 
ATOM   449  C CB  . LEU A 1 58  ? -21.445 1.668  -19.151 1.000 29.139 ? 387 LEU EEE CB  1 ? 
ATOM   450  C CG  . LEU A 1 58  ? -20.386 2.731  -18.849 1.000 33.744 ? 387 LEU EEE CG  1 ? 
ATOM   451  C CD1 . LEU A 1 58  ? -19.029 2.387  -19.412 1.000 37.873 ? 387 LEU EEE CD1 1 ? 
ATOM   452  C CD2 . LEU A 1 58  ? -20.839 4.090  -19.351 1.000 29.933 ? 387 LEU EEE CD2 1 ? 
ATOM   453  N N   . ASN A 1 59  ? -23.068 -1.117 -19.326 1.000 26.038 ? 388 ASN EEE N   1 ? 
ATOM   454  C CA  . ASN A 1 59  ? -24.203 -1.945 -18.838 1.000 29.156 ? 388 ASN EEE CA  1 ? 
ATOM   455  C C   . ASN A 1 59  ? -23.705 -3.313 -18.351 1.000 27.217 ? 388 ASN EEE C   1 ? 
ATOM   456  O O   . ASN A 1 59  ? -24.454 -3.962 -17.635 1.000 29.215 ? 388 ASN EEE O   1 ? 
ATOM   457  C CB  . ASN A 1 59  ? -25.316 -2.075 -19.883 1.000 29.844 ? 388 ASN EEE CB  1 ? 
ATOM   458  C CG  . ASN A 1 59  ? -26.283 -0.913 -19.841 1.000 32.159 ? 388 ASN EEE CG  1 ? 
ATOM   459  O OD1 . ASN A 1 59  ? -26.060 0.059  -19.121 1.000 34.133 ? 388 ASN EEE OD1 1 ? 
ATOM   460  N ND2 . ASN A 1 59  ? -27.354 -1.004 -20.610 1.000 32.475 ? 388 ASN EEE ND2 1 ? 
ATOM   461  N N   . ASP A 1 60  ? -22.486 -3.725 -18.703 1.000 27.619 ? 389 ASP EEE N   1 ? 
ATOM   462  C CA  . ASP A 1 60  ? -21.908 -5.049 -18.331 1.000 29.074 ? 389 ASP EEE CA  1 ? 
ATOM   463  C C   . ASP A 1 60  ? -20.937 -4.936 -17.146 1.000 28.500 ? 389 ASP EEE C   1 ? 
ATOM   464  O O   . ASP A 1 60  ? -20.303 -5.968 -16.813 1.000 28.828 ? 389 ASP EEE O   1 ? 
ATOM   465  C CB  . ASP A 1 60  ? -21.206 -5.674 -19.536 1.000 30.962 ? 389 ASP EEE CB  1 ? 
ATOM   466  C CG  . ASP A 1 60  ? -22.168 -6.010 -20.660 1.000 36.687 ? 389 ASP EEE CG  1 ? 
ATOM   467  O OD1 . ASP A 1 60  ? -23.250 -6.548 -20.354 1.000 41.228 ? 389 ASP EEE OD1 1 ? 
ATOM   468  O OD2 . ASP A 1 60  ? -21.832 -5.731 -21.825 1.000 42.573 ? 389 ASP EEE OD2 1 ? 
ATOM   469  N N   . LEU A 1 61  ? -20.816 -3.756 -16.521 1.000 25.909 ? 390 LEU EEE N   1 ? 
ATOM   470  C CA  . LEU A 1 61  ? -19.815 -3.514 -15.443 1.000 25.696 ? 390 LEU EEE CA  1 ? 
ATOM   471  C C   . LEU A 1 61  ? -20.536 -3.203 -14.136 1.000 25.781 ? 390 LEU EEE C   1 ? 
ATOM   472  O O   . LEU A 1 61  ? -21.673 -2.700 -14.182 1.000 27.236 ? 390 LEU EEE O   1 ? 
ATOM   473  C CB  . LEU A 1 61  ? -18.910 -2.342 -15.823 1.000 25.389 ? 390 LEU EEE CB  1 ? 
ATOM   474  C CG  . LEU A 1 61  ? -18.170 -2.457 -17.155 1.000 27.164 ? 390 LEU EEE CG  1 ? 
ATOM   475  C CD1 . LEU A 1 61  ? -17.333 -1.210 -17.408 1.000 27.629 ? 390 LEU EEE CD1 1 ? 
ATOM   476  C CD2 . LEU A 1 61  ? -17.296 -3.703 -17.208 1.000 28.294 ? 390 LEU EEE CD2 1 ? 
ATOM   477  N N   . CYS A 1 62  ? -19.859 -3.459 -13.026 1.000 23.943 ? 391 CYS EEE N   1 ? 
ATOM   478  C CA  . CYS A 1 62  ? -20.310 -3.105 -11.660 1.000 26.771 ? 391 CYS EEE CA  1 ? 
ATOM   479  C C   . CYS A 1 62  ? -19.212 -2.268 -11.019 1.000 24.868 ? 391 CYS EEE C   1 ? 
ATOM   480  O O   . CYS A 1 62  ? -18.030 -2.582 -11.233 1.000 26.314 ? 391 CYS EEE O   1 ? 
ATOM   481  C CB  . CYS A 1 62  ? -20.625 -4.332 -10.817 1.000 30.065 ? 391 CYS EEE CB  1 ? 
ATOM   482  S SG  . CYS A 1 62  ? -22.070 -5.259 -11.395 1.000 34.259 ? 391 CYS EEE SG  1 ? 
ATOM   483  N N   . PHE A 1 63  ? -19.596 -1.237 -10.280 1.000 24.469 ? 392 PHE EEE N   1 ? 
ATOM   484  C CA  . PHE A 1 63  ? -18.653 -0.327 -9.597  1.000 23.491 ? 392 PHE EEE CA  1 ? 
ATOM   485  C C   . PHE A 1 63  ? -18.966 -0.327 -8.104  1.000 24.181 ? 392 PHE EEE C   1 ? 
ATOM   486  O O   . PHE A 1 63  ? -20.104 -0.654 -7.720  1.000 25.274 ? 392 PHE EEE O   1 ? 
ATOM   487  C CB  . PHE A 1 63  ? -18.723 1.065  -10.232 1.000 22.593 ? 392 PHE EEE CB  1 ? 
ATOM   488  C CG  . PHE A 1 63  ? -18.401 1.084  -11.703 1.000 26.654 ? 392 PHE EEE CG  1 ? 
ATOM   489  C CD1 . PHE A 1 63  ? -17.107 0.870  -12.158 1.000 27.437 ? 392 PHE EEE CD1 1 ? 
ATOM   490  C CD2 . PHE A 1 63  ? -19.400 1.305  -12.639 1.000 29.888 ? 392 PHE EEE CD2 1 ? 
ATOM   491  C CE1 . PHE A 1 63  ? -16.818 0.887  -13.517 1.000 29.836 ? 392 PHE EEE CE1 1 ? 
ATOM   492  C CE2 . PHE A 1 63  ? -19.110 1.314  -13.997 1.000 31.915 ? 392 PHE EEE CE2 1 ? 
ATOM   493  C CZ  . PHE A 1 63  ? -17.824 1.094  -14.433 1.000 29.990 ? 392 PHE EEE CZ  1 ? 
ATOM   494  N N   . THR A 1 64  ? -17.990 0.089  -7.294  1.000 24.146 ? 393 THR EEE N   1 ? 
ATOM   495  C CA  . THR A 1 64  ? -18.138 0.122  -5.817  1.000 25.454 ? 393 THR EEE CA  1 ? 
ATOM   496  C C   . THR A 1 64  ? -18.986 1.333  -5.435  1.000 27.111 ? 393 THR EEE C   1 ? 
ATOM   497  O O   . THR A 1 64  ? -19.632 1.278  -4.382  1.000 32.404 ? 393 THR EEE O   1 ? 
ATOM   498  C CB  . THR A 1 64  ? -16.767 -0.003 -5.157  1.000 27.424 ? 393 THR EEE CB  1 ? 
ATOM   499  O OG1 . THR A 1 64  ? -15.932 1.047  -5.643  1.000 27.225 ? 393 THR EEE OG1 1 ? 
ATOM   500  C CG2 . THR A 1 64  ? -16.150 -1.357 -5.441  1.000 29.506 ? 393 THR EEE CG2 1 ? 
ATOM   501  N N   . ASN A 1 65  ? -18.996 2.355  -6.293  1.000 25.780 ? 394 ASN EEE N   1 ? 
ATOM   502  C CA  . ASN A 1 65  ? -19.824 3.583  -6.175  1.000 26.319 ? 394 ASN EEE CA  1 ? 
ATOM   503  C C   . ASN A 1 65  ? -19.761 4.333  -7.499  1.000 24.982 ? 394 ASN EEE C   1 ? 
ATOM   504  O O   . ASN A 1 65  ? -18.827 4.098  -8.277  1.000 24.440 ? 394 ASN EEE O   1 ? 
ATOM   505  C CB  . ASN A 1 65  ? -19.337 4.532  -5.079  1.000 27.157 ? 394 ASN EEE CB  1 ? 
ATOM   506  C CG  . ASN A 1 65  ? -19.831 4.151  -3.703  1.000 29.105 ? 394 ASN EEE CG  1 ? 
ATOM   507  O OD1 . ASN A 1 65  ? -21.033 4.033  -3.473  1.000 32.989 ? 394 ASN EEE OD1 1 ? 
ATOM   508  N ND2 . ASN A 1 65  ? -18.907 3.930  -2.787  1.000 33.386 ? 394 ASN EEE ND2 1 ? 
ATOM   509  N N   . VAL A 1 66  ? -20.729 5.207  -7.744  1.000 24.900 ? 395 VAL EEE N   1 ? 
ATOM   510  C CA  . VAL A 1 66  ? -20.626 6.203  -8.837  1.000 23.343 ? 395 VAL EEE CA  1 ? 
ATOM   511  C C   . VAL A 1 66  ? -20.836 7.563  -8.185  1.000 22.765 ? 395 VAL EEE C   1 ? 
ATOM   512  O O   . VAL A 1 66  ? -21.757 7.706  -7.393  1.000 25.724 ? 395 VAL EEE O   1 ? 
ATOM   513  C CB  . VAL A 1 66  ? -21.594 5.939  -9.998  1.000 24.545 ? 395 VAL EEE CB  1 ? 
ATOM   514  C CG1 . VAL A 1 66  ? -21.486 7.010  -11.077 1.000 24.499 ? 395 VAL EEE CG1 1 ? 
ATOM   515  C CG2 . VAL A 1 66  ? -21.371 4.553  -10.588 1.000 25.908 ? 395 VAL EEE CG2 1 ? 
ATOM   516  N N   . TYR A 1 67  ? -19.938 8.498  -8.436  1.000 20.269 ? 396 TYR EEE N   1 ? 
ATOM   517  C CA  . TYR A 1 67  ? -20.114 9.897  -7.997  1.000 21.127 ? 396 TYR EEE CA  1 ? 
ATOM   518  C C   . TYR A 1 67  ? -20.543 10.694 -9.213  1.000 20.227 ? 396 TYR EEE C   1 ? 
ATOM   519  O O   . TYR A 1 67  ? -19.948 10.576 -10.292 1.000 22.733 ? 396 TYR EEE O   1 ? 
ATOM   520  C CB  . TYR A 1 67  ? -18.831 10.428 -7.356  1.000 22.977 ? 396 TYR EEE CB  1 ? 
ATOM   521  C CG  . TYR A 1 67  ? -18.363 9.581  -6.205  1.000 26.418 ? 396 TYR EEE CG  1 ? 
ATOM   522  C CD1 . TYR A 1 67  ? -18.987 9.630  -4.973  1.000 26.722 ? 396 TYR EEE CD1 1 ? 
ATOM   523  C CD2 . TYR A 1 67  ? -17.328 8.676  -6.378  1.000 28.987 ? 396 TYR EEE CD2 1 ? 
ATOM   524  C CE1 . TYR A 1 67  ? -18.576 8.811  -3.929  1.000 31.062 ? 396 TYR EEE CE1 1 ? 
ATOM   525  C CE2 . TYR A 1 67  ? -16.909 7.849  -5.354  1.000 29.854 ? 396 TYR EEE CE2 1 ? 
ATOM   526  C CZ  . TYR A 1 67  ? -17.537 7.913  -4.124  1.000 31.582 ? 396 TYR EEE CZ  1 ? 
ATOM   527  O OH  . TYR A 1 67  ? -17.102 7.092  -3.124  1.000 38.740 ? 396 TYR EEE OH  1 ? 
ATOM   528  N N   . ALA A 1 68  ? -21.594 11.479 -9.027  1.000 19.558 ? 397 ALA EEE N   1 ? 
ATOM   529  C CA  . ALA A 1 68  ? -22.136 12.366 -10.063 1.000 18.780 ? 397 ALA EEE CA  1 ? 
ATOM   530  C C   . ALA A 1 68  ? -21.907 13.805 -9.624  1.000 18.471 ? 397 ALA EEE C   1 ? 
ATOM   531  O O   . ALA A 1 68  ? -22.518 14.258 -8.632  1.000 18.199 ? 397 ALA EEE O   1 ? 
ATOM   532  C CB  . ALA A 1 68  ? -23.602 12.075 -10.248 1.000 18.689 ? 397 ALA EEE CB  1 ? 
ATOM   533  N N   . ASP A 1 69  ? -20.960 14.461 -10.273 1.000 18.159 ? 398 ASP EEE N   1 ? 
ATOM   534  C CA  . ASP A 1 69  ? -20.622 15.868 -9.992  1.000 16.668 ? 398 ASP EEE CA  1 ? 
ATOM   535  C C   . ASP A 1 69  ? -21.291 16.723 -11.054 1.000 15.657 ? 398 ASP EEE C   1 ? 
ATOM   536  O O   . ASP A 1 69  ? -21.266 16.342 -12.225 1.000 19.894 ? 398 ASP EEE O   1 ? 
ATOM   537  C CB  . ASP A 1 69  ? -19.110 16.057 -9.960  1.000 17.222 ? 398 ASP EEE CB  1 ? 
ATOM   538  C CG  . ASP A 1 69  ? -18.424 15.191 -8.928  1.000 18.519 ? 398 ASP EEE CG  1 ? 
ATOM   539  O OD1 . ASP A 1 69  ? -19.074 14.847 -7.909  1.000 18.465 ? 398 ASP EEE OD1 1 ? 
ATOM   540  O OD2 . ASP A 1 69  ? -17.211 14.901 -9.129  1.000 19.007 ? 398 ASP EEE OD2 1 ? 
ATOM   541  N N   . SER A 1 70  ? -21.836 17.865 -10.664 1.000 16.574 ? 399 SER EEE N   1 ? 
ATOM   542  C CA  . SER A 1 70  ? -22.579 18.699 -11.634 1.000 15.787 ? 399 SER EEE CA  1 ? 
ATOM   543  C C   . SER A 1 70  ? -22.423 20.184 -11.326 1.000 14.267 ? 399 SER EEE C   1 ? 
ATOM   544  O O   . SER A 1 70  ? -22.253 20.578 -10.163 1.000 15.036 ? 399 SER EEE O   1 ? 
ATOM   545  C CB  . SER A 1 70  ? -24.015 18.283 -11.744 1.000 17.100 ? 399 SER EEE CB  1 ? 
ATOM   546  O OG  . SER A 1 70  ? -24.663 18.432 -10.522 1.000 17.994 ? 399 SER EEE OG  1 ? 
ATOM   547  N N   . PHE A 1 71  ? -22.446 20.961 -12.395 1.000 14.622 ? 400 PHE EEE N   1 ? 
ATOM   548  C CA  . PHE A 1 71  ? -22.181 22.413 -12.354 1.000 13.575 ? 400 PHE EEE CA  1 ? 
ATOM   549  C C   . PHE A 1 71  ? -22.446 23.014 -13.729 1.000 13.576 ? 400 PHE EEE C   1 ? 
ATOM   550  O O   . PHE A 1 71  ? -22.674 22.272 -14.688 1.000 15.376 ? 400 PHE EEE O   1 ? 
ATOM   551  C CB  . PHE A 1 71  ? -20.733 22.654 -11.918 1.000 13.969 ? 400 PHE EEE CB  1 ? 
ATOM   552  C CG  . PHE A 1 71  ? -19.692 21.863 -12.674 1.000 15.541 ? 400 PHE EEE CG  1 ? 
ATOM   553  C CD1 . PHE A 1 71  ? -19.246 22.271 -13.926 1.000 15.611 ? 400 PHE EEE CD1 1 ? 
ATOM   554  C CD2 . PHE A 1 71  ? -19.184 20.689 -12.147 1.000 15.720 ? 400 PHE EEE CD2 1 ? 
ATOM   555  C CE1 . PHE A 1 71  ? -18.290 21.533 -14.618 1.000 16.407 ? 400 PHE EEE CE1 1 ? 
ATOM   556  C CE2 . PHE A 1 71  ? -18.215 19.964 -12.833 1.000 15.403 ? 400 PHE EEE CE2 1 ? 
ATOM   557  C CZ  . PHE A 1 71  ? -17.785 20.377 -14.067 1.000 16.597 ? 400 PHE EEE CZ  1 ? 
ATOM   558  N N   . VAL A 1 72  ? -22.358 24.340 -13.800 1.000 14.112 ? 401 VAL EEE N   1 ? 
ATOM   559  C CA  . VAL A 1 72  ? -22.499 25.119 -15.054 1.000 14.554 ? 401 VAL EEE CA  1 ? 
ATOM   560  C C   . VAL A 1 72  ? -21.173 25.834 -15.337 1.000 13.958 ? 401 VAL EEE C   1 ? 
ATOM   561  O O   . VAL A 1 72  ? -20.619 26.467 -14.406 1.000 14.144 ? 401 VAL EEE O   1 ? 
ATOM   562  C CB  . VAL A 1 72  ? -23.668 26.106 -14.953 1.000 15.524 ? 401 VAL EEE CB  1 ? 
ATOM   563  C CG1 . VAL A 1 72  ? -23.631 27.150 -16.056 1.000 16.271 ? 401 VAL EEE CG1 1 ? 
ATOM   564  C CG2 . VAL A 1 72  ? -24.984 25.355 -14.969 1.000 16.359 ? 401 VAL EEE CG2 1 ? 
ATOM   565  N N   . ILE A 1 73  ? -20.727 25.762 -16.585 1.000 14.311 ? 402 ILE EEE N   1 ? 
ATOM   566  C CA  . ILE A 1 73  ? -19.577 26.544 -17.097 1.000 14.236 ? 402 ILE EEE CA  1 ? 
ATOM   567  C C   . ILE A 1 73  ? -19.935 27.034 -18.497 1.000 14.952 ? 402 ILE EEE C   1 ? 
ATOM   568  O O   . ILE A 1 73  ? -21.034 26.742 -19.011 1.000 16.472 ? 402 ILE EEE O   1 ? 
ATOM   569  C CB  . ILE A 1 73  ? -18.293 25.688 -17.101 1.000 14.802 ? 402 ILE EEE CB  1 ? 
ATOM   570  C CG1 . ILE A 1 73  ? -18.488 24.394 -17.896 1.000 15.877 ? 402 ILE EEE CG1 1 ? 
ATOM   571  C CG2 . ILE A 1 73  ? -17.773 25.405 -15.691 1.000 14.681 ? 402 ILE EEE CG2 1 ? 
ATOM   572  C CD1 . ILE A 1 73  ? -17.238 23.562 -18.042 1.000 17.248 ? 402 ILE EEE CD1 1 ? 
ATOM   573  N N   . ARG A 1 74  ? -19.057 27.796 -19.118 1.000 14.106 ? 403 ARG EEE N   1 ? 
ATOM   574  C CA  . ARG A 1 74  ? -19.213 28.224 -20.522 1.000 15.499 ? 403 ARG EEE CA  1 ? 
ATOM   575  C C   . ARG A 1 74  ? -18.940 27.074 -21.489 1.000 16.066 ? 403 ARG EEE C   1 ? 
ATOM   576  O O   . ARG A 1 74  ? -18.114 26.201 -21.191 1.000 16.746 ? 403 ARG EEE O   1 ? 
ATOM   577  C CB  . ARG A 1 74  ? -18.218 29.322 -20.870 1.000 17.160 ? 403 ARG EEE CB  1 ? 
ATOM   578  C CG  . ARG A 1 74  ? -18.575 30.685 -20.323 1.000 18.878 ? 403 ARG EEE CG  1 ? 
ATOM   579  C CD  . ARG A 1 74  ? -17.352 31.580 -20.312 1.000 20.661 ? 403 ARG EEE CD  1 ? 
ATOM   580  N NE  . ARG A 1 74  ? -16.760 31.752 -21.637 1.000 22.080 ? 403 ARG EEE NE  1 ? 
ATOM   581  C CZ  . ARG A 1 74  ? -16.148 32.854 -22.051 1.000 23.140 ? 403 ARG EEE CZ  1 ? 
ATOM   582  N NH1 . ARG A 1 74  ? -16.035 33.895 -21.244 1.000 22.651 ? 403 ARG EEE NH1 1 ? 
ATOM   583  N NH2 . ARG A 1 74  ? -15.657 32.914 -23.281 1.000 25.475 ? 403 ARG EEE NH2 1 ? 
ATOM   584  N N   . GLY A 1 75  ? -19.547 27.132 -22.669 1.000 17.370 ? 404 GLY EEE N   1 ? 
ATOM   585  C CA  . GLY A 1 75  ? -19.330 26.130 -23.721 1.000 17.428 ? 404 GLY EEE CA  1 ? 
ATOM   586  C C   . GLY A 1 75  ? -17.862 25.966 -24.057 1.000 16.886 ? 404 GLY EEE C   1 ? 
ATOM   587  O O   . GLY A 1 75  ? -17.432 24.832 -24.170 1.000 18.153 ? 404 GLY EEE O   1 ? 
ATOM   588  N N   . ASP A 1 76  ? -17.130 27.065 -24.117 1.000 17.139 ? 405 ASP EEE N   1 ? 
ATOM   589  C CA  . ASP A 1 76  ? -15.703 27.030 -24.521 1.000 17.180 ? 405 ASP EEE CA  1 ? 
ATOM   590  C C   . ASP A 1 76  ? -14.814 26.565 -23.366 1.000 17.060 ? 405 ASP EEE C   1 ? 
ATOM   591  O O   . ASP A 1 76  ? -13.608 26.476 -23.598 1.000 19.304 ? 405 ASP EEE O   1 ? 
ATOM   592  C CB  . ASP A 1 76  ? -15.277 28.352 -25.153 1.000 18.781 ? 405 ASP EEE CB  1 ? 
ATOM   593  C CG  . ASP A 1 76  ? -15.302 29.575 -24.264 1.000 20.929 ? 405 ASP EEE CG  1 ? 
ATOM   594  O OD1 . ASP A 1 76  ? -15.407 29.425 -23.006 1.000 21.245 ? 405 ASP EEE OD1 1 ? 
ATOM   595  O OD2 . ASP A 1 76  ? -15.213 30.688 -24.838 1.000 24.140 ? 405 ASP EEE OD2 1 ? 
ATOM   596  N N   . GLU A 1 77  ? -15.366 26.297 -22.182 1.000 16.604 ? 406 GLU EEE N   1 ? 
ATOM   597  C CA  . GLU A 1 77  ? -14.616 25.709 -21.040 1.000 15.642 ? 406 GLU EEE CA  1 ? 
ATOM   598  C C   . GLU A 1 77  ? -14.872 24.207 -20.906 1.000 15.304 ? 406 GLU EEE C   1 ? 
ATOM   599  O O   . GLU A 1 77  ? -14.208 23.578 -20.057 1.000 16.331 ? 406 GLU EEE O   1 ? 
ATOM   600  C CB  . GLU A 1 77  ? -14.974 26.414 -19.737 1.000 15.402 ? 406 GLU EEE CB  1 ? 
ATOM   601  C CG  . GLU A 1 77  ? -14.605 27.887 -19.745 1.000 15.750 ? 406 GLU EEE CG  1 ? 
ATOM   602  C CD  . GLU A 1 77  ? -15.137 28.729 -18.596 1.000 16.986 ? 406 GLU EEE CD  1 ? 
ATOM   603  O OE1 . GLU A 1 77  ? -16.223 28.377 -18.062 1.000 16.886 ? 406 GLU EEE OE1 1 ? 
ATOM   604  O OE2 . GLU A 1 77  ? -14.487 29.755 -18.246 1.000 20.546 ? 406 GLU EEE OE2 1 ? 
ATOM   605  N N   . VAL A 1 78  ? -15.846 23.635 -21.623 1.000 16.496 ? 407 VAL EEE N   1 ? 
ATOM   606  C CA  . VAL A 1 78  ? -16.171 22.193 -21.437 1.000 16.911 ? 407 VAL EEE CA  1 ? 
ATOM   607  C C   . VAL A 1 78  ? -14.918 21.351 -21.763 1.000 17.567 ? 407 VAL EEE C   1 ? 
ATOM   608  O O   . VAL A 1 78  ? -14.723 20.321 -21.122 1.000 18.026 ? 407 VAL EEE O   1 ? 
ATOM   609  C CB  . VAL A 1 78  ? -17.419 21.787 -22.249 1.000 18.316 ? 407 VAL EEE CB  1 ? 
ATOM   610  C CG1 . VAL A 1 78  ? -17.655 20.277 -22.237 1.000 20.326 ? 407 VAL EEE CG1 1 ? 
ATOM   611  C CG2 . VAL A 1 78  ? -18.660 22.530 -21.759 1.000 18.551 ? 407 VAL EEE CG2 1 ? 
ATOM   612  N N   . ARG A 1 79  ? -14.078 21.798 -22.693 1.000 18.755 ? 408 ARG EEE N   1 ? 
ATOM   613  C CA  . ARG A 1 79  ? -12.814 21.087 -23.032 1.000 18.698 ? 408 ARG EEE CA  1 ? 
ATOM   614  C C   . ARG A 1 79  ? -11.918 20.941 -21.794 1.000 18.355 ? 408 ARG EEE C   1 ? 
ATOM   615  O O   . ARG A 1 79  ? -11.078 20.031 -21.809 1.000 19.894 ? 408 ARG EEE O   1 ? 
ATOM   616  C CB  . ARG A 1 79  ? -12.093 21.789 -24.183 1.000 21.505 ? 408 ARG EEE CB  1 ? 
ATOM   617  C CG  . ARG A 1 79  ? -11.742 23.238 -23.895 1.000 24.676 ? 408 ARG EEE CG  1 ? 
ATOM   618  C CD  . ARG A 1 79  ? -10.851 23.855 -24.944 1.000 29.303 ? 408 ARG EEE CD  1 ? 
ATOM   619  N NE  . ARG A 1 79  ? -9.502  23.347 -24.801 1.000 34.197 ? 408 ARG EEE NE  1 ? 
ATOM   620  C CZ  . ARG A 1 79  ? -8.620  23.725 -23.876 1.000 37.439 ? 408 ARG EEE CZ  1 ? 
ATOM   621  N NH1 . ARG A 1 79  ? -8.923  24.628 -22.952 1.000 36.375 ? 408 ARG EEE NH1 1 ? 
ATOM   622  N NH2 . ARG A 1 79  ? -7.418  23.174 -23.885 1.000 41.668 ? 408 ARG EEE NH2 1 ? 
ATOM   623  N N   . GLN A 1 80  ? -12.059 21.793 -20.774 1.000 17.186 ? 409 GLN EEE N   1 ? 
ATOM   624  C CA  . GLN A 1 80  ? -11.196 21.727 -19.565 1.000 17.802 ? 409 GLN EEE CA  1 ? 
ATOM   625  C C   . GLN A 1 80  ? -11.635 20.591 -18.638 1.000 18.042 ? 409 GLN EEE C   1 ? 
ATOM   626  O O   . GLN A 1 80  ? -10.878 20.264 -17.729 1.000 17.655 ? 409 GLN EEE O   1 ? 
ATOM   627  C CB  . GLN A 1 80  ? -11.167 23.058 -18.822 1.000 17.915 ? 409 GLN EEE CB  1 ? 
ATOM   628  C CG  . GLN A 1 80  ? -10.541 24.190 -19.614 1.000 17.469 ? 409 GLN EEE CG  1 ? 
ATOM   629  C CD  . GLN A 1 80  ? -10.435 25.465 -18.804 1.000 16.852 ? 409 GLN EEE CD  1 ? 
ATOM   630  O OE1 . GLN A 1 80  ? -10.182 25.441 -17.602 1.000 16.700 ? 409 GLN EEE OE1 1 ? 
ATOM   631  N NE2 . GLN A 1 80  ? -10.688 26.602 -19.444 1.000 18.383 ? 409 GLN EEE NE2 1 ? 
ATOM   632  N N   . ILE A 1 81  ? -12.845 20.056 -18.802 1.000 17.108 ? 410 ILE EEE N   1 ? 
ATOM   633  C CA  . ILE A 1 81  ? -13.353 18.971 -17.935 1.000 16.808 ? 410 ILE EEE CA  1 ? 
ATOM   634  C C   . ILE A 1 81  ? -12.908 17.650 -18.565 1.000 17.811 ? 410 ILE EEE C   1 ? 
ATOM   635  O O   . ILE A 1 81  ? -13.706 16.923 -19.169 1.000 19.261 ? 410 ILE EEE O   1 ? 
ATOM   636  C CB  . ILE A 1 81  ? -14.871 19.084 -17.751 1.000 16.614 ? 410 ILE EEE CB  1 ? 
ATOM   637  C CG1 . ILE A 1 81  ? -15.296 20.510 -17.395 1.000 17.022 ? 410 ILE EEE CG1 1 ? 
ATOM   638  C CG2 . ILE A 1 81  ? -15.336 18.074 -16.708 1.000 18.220 ? 410 ILE EEE CG2 1 ? 
ATOM   639  C CD1 . ILE A 1 81  ? -14.627 21.067 -16.171 1.000 17.457 ? 410 ILE EEE CD1 1 ? 
ATOM   640  N N   . ALA A 1 82  ? -11.606 17.396 -18.469 1.000 19.180 ? 411 ALA EEE N   1 ? 
ATOM   641  C CA  . ALA A 1 82  ? -10.943 16.206 -19.036 1.000 20.170 ? 411 ALA EEE CA  1 ? 
ATOM   642  C C   . ALA A 1 82  ? -9.633  16.049 -18.290 1.000 21.138 ? 411 ALA EEE C   1 ? 
ATOM   643  O O   . ALA A 1 82  ? -9.074  17.058 -17.858 1.000 21.964 ? 411 ALA EEE O   1 ? 
ATOM   644  C CB  . ALA A 1 82  ? -10.730 16.374 -20.524 1.000 21.202 ? 411 ALA EEE CB  1 ? 
ATOM   645  N N   . PRO A 1 83  ? -9.111  14.809 -18.148 1.000 21.626 ? 412 PRO EEE N   1 ? 
ATOM   646  C CA  . PRO A 1 83  ? -7.761  14.618 -17.630 1.000 22.972 ? 412 PRO EEE CA  1 ? 
ATOM   647  C C   . PRO A 1 83  ? -6.738  15.468 -18.394 1.000 23.330 ? 412 PRO EEE C   1 ? 
ATOM   648  O O   . PRO A 1 83  ? -6.823  15.592 -19.610 1.000 25.539 ? 412 PRO EEE O   1 ? 
ATOM   649  C CB  . PRO A 1 83  ? -7.500  13.120 -17.857 1.000 24.320 ? 412 PRO EEE CB  1 ? 
ATOM   650  C CG  . PRO A 1 83  ? -8.864  12.482 -17.913 1.000 25.590 ? 412 PRO EEE CG  1 ? 
ATOM   651  C CD  . PRO A 1 83  ? -9.749  13.536 -18.536 1.000 22.100 ? 412 PRO EEE CD  1 ? 
ATOM   652  N N   . GLY A 1 84  ? -5.769  16.022 -17.661 1.000 22.872 ? 413 GLY EEE N   1 ? 
ATOM   653  C CA  . GLY A 1 84  ? -4.561  16.626 -18.248 1.000 24.010 ? 413 GLY EEE CA  1 ? 
ATOM   654  C C   . GLY A 1 84  ? -4.792  18.015 -18.815 1.000 23.591 ? 413 GLY EEE C   1 ? 
ATOM   655  O O   . GLY A 1 84  ? -3.945  18.511 -19.562 1.000 30.576 ? 413 GLY EEE O   1 ? 
ATOM   656  N N   . GLN A 1 85  ? -5.897  18.664 -18.483 1.000 22.627 ? 414 GLN EEE N   1 ? 
ATOM   657  C CA  . GLN A 1 85  ? -6.210  20.003 -19.027 1.000 22.299 ? 414 GLN EEE CA  1 ? 
ATOM   658  C C   . GLN A 1 85  ? -5.774  21.079 -18.041 1.000 22.682 ? 414 GLN EEE C   1 ? 
ATOM   659  O O   . GLN A 1 85  ? -5.623  20.808 -16.814 1.000 26.385 ? 414 GLN EEE O   1 ? 
ATOM   660  C CB  . GLN A 1 85  ? -7.705  20.158 -19.298 1.000 23.675 ? 414 GLN EEE CB  1 ? 
ATOM   661  C CG  . GLN A 1 85  ? -8.235  19.120 -20.257 1.000 28.925 ? 414 GLN EEE CG  1 ? 
ATOM   662  C CD  . GLN A 1 85  ? -7.472  19.036 -21.552 1.000 31.933 ? 414 GLN EEE CD  1 ? 
ATOM   663  O OE1 . GLN A 1 85  ? -6.917  17.990 -21.888 1.000 40.464 ? 414 GLN EEE OE1 1 ? 
ATOM   664  N NE2 . GLN A 1 85  ? -7.428  20.132 -22.289 1.000 31.290 ? 414 GLN EEE NE2 1 ? 
ATOM   665  N N   . THR A 1 86  ? -5.594  22.268 -18.585 1.000 23.568 ? 415 THR EEE N   1 ? 
ATOM   666  C CA  . THR A 1 86  ? -5.261  23.489 -17.828 1.000 24.561 ? 415 THR EEE CA  1 ? 
ATOM   667  C C   . THR A 1 86  ? -6.226  24.600 -18.246 1.000 22.988 ? 415 THR EEE C   1 ? 
ATOM   668  O O   . THR A 1 86  ? -6.879  24.530 -19.311 1.000 24.557 ? 415 THR EEE O   1 ? 
ATOM   669  C CB  . THR A 1 86  ? -3.783  23.836 -18.045 1.000 28.214 ? 415 THR EEE CB  1 ? 
ATOM   670  O OG1 . THR A 1 86  ? -3.377  24.887 -17.165 1.000 36.494 ? 415 THR EEE OG1 1 ? 
ATOM   671  C CG2 . THR A 1 86  ? -3.526  24.249 -19.473 1.000 28.445 ? 415 THR EEE CG2 1 ? 
ATOM   672  N N   . GLY A 1 87  ? -6.263  25.631 -17.433 1.000 21.985 ? 416 GLY EEE N   1 ? 
ATOM   673  C CA  . GLY A 1 87  ? -7.115  26.807 -17.641 1.000 20.381 ? 416 GLY EEE CA  1 ? 
ATOM   674  C C   . GLY A 1 87  ? -7.806  27.133 -16.345 1.000 19.001 ? 416 GLY EEE C   1 ? 
ATOM   675  O O   . GLY A 1 87  ? -7.620  26.404 -15.368 1.000 18.292 ? 416 GLY EEE O   1 ? 
ATOM   676  N N   . LYS A 1 88  ? -8.560  28.218 -16.309 1.000 18.028 ? 417 LYS EEE N   1 ? 
ATOM   677  C CA  . LYS A 1 88  ? -9.090  28.705 -15.016 1.000 17.430 ? 417 LYS EEE CA  1 ? 
ATOM   678  C C   . LYS A 1 88  ? -10.001 27.647 -14.395 1.000 16.515 ? 417 LYS EEE C   1 ? 
ATOM   679  O O   . LYS A 1 88  ? -10.055 27.551 -13.155 1.000 15.833 ? 417 LYS EEE O   1 ? 
ATOM   680  C CB  . LYS A 1 88  ? -9.845  30.021 -15.195 1.000 19.906 ? 417 LYS EEE CB  1 ? 
ATOM   681  C CG  . LYS A 1 88  ? -9.060  31.183 -15.779 1.000 23.439 ? 417 LYS EEE CG  1 ? 
ATOM   682  C CD  . LYS A 1 88  ? -7.846  31.610 -15.005 1.000 26.743 ? 417 LYS EEE CD  1 ? 
ATOM   683  C CE  . LYS A 1 88  ? -7.050  32.652 -15.768 1.000 28.983 ? 417 LYS EEE CE  1 ? 
ATOM   684  N NZ  . LYS A 1 88  ? -5.807  32.985 -15.055 1.000 33.058 ? 417 LYS EEE NZ  1 ? 
ATOM   685  N N   . ILE A 1 89  ? -10.758 26.917 -15.214 1.000 15.986 ? 418 ILE EEE N   1 ? 
ATOM   686  C CA  . ILE A 1 89  ? -11.719 25.934 -14.646 1.000 15.846 ? 418 ILE EEE CA  1 ? 
ATOM   687  C C   . ILE A 1 89  ? -10.956 24.715 -14.115 1.000 16.001 ? 418 ILE EEE C   1 ? 
ATOM   688  O O   . ILE A 1 89  ? -11.124 24.382 -12.935 1.000 15.281 ? 418 ILE EEE O   1 ? 
ATOM   689  C CB  . ILE A 1 89  ? -12.831 25.574 -15.647 1.000 16.206 ? 418 ILE EEE CB  1 ? 
ATOM   690  C CG1 . ILE A 1 89  ? -13.582 26.837 -16.097 1.000 16.861 ? 418 ILE EEE CG1 1 ? 
ATOM   691  C CG2 . ILE A 1 89  ? -13.763 24.533 -15.044 1.000 17.809 ? 418 ILE EEE CG2 1 ? 
ATOM   692  C CD1 . ILE A 1 89  ? -14.094 27.717 -14.972 1.000 17.388 ? 418 ILE EEE CD1 1 ? 
ATOM   693  N N   . ALA A 1 90  ? -10.090 24.087 -14.916 1.000 15.851 ? 419 ALA EEE N   1 ? 
ATOM   694  C CA  . ALA A 1 90  ? -9.333  22.902 -14.452 1.000 16.349 ? 419 ALA EEE CA  1 ? 
ATOM   695  C C   . ALA A 1 90  ? -8.400  23.271 -13.288 1.000 16.209 ? 419 ALA EEE C   1 ? 
ATOM   696  O O   . ALA A 1 90  ? -8.273  22.477 -12.375 1.000 18.387 ? 419 ALA EEE O   1 ? 
ATOM   697  C CB  . ALA A 1 90  ? -8.543  22.315 -15.593 1.000 17.401 ? 419 ALA EEE CB  1 ? 
ATOM   698  N N   . ASP A 1 91  ? -7.781  24.448 -13.341 1.000 16.736 ? 420 ASP EEE N   1 ? 
ATOM   699  C CA  . ASP A 1 91  ? -6.768  24.864 -12.345 1.000 17.776 ? 420 ASP EEE CA  1 ? 
ATOM   700  C C   . ASP A 1 91  ? -7.454  25.268 -11.037 1.000 17.303 ? 420 ASP EEE C   1 ? 
ATOM   701  O O   . ASP A 1 91  ? -6.945  24.926 -9.966  1.000 17.493 ? 420 ASP EEE O   1 ? 
ATOM   702  C CB  . ASP A 1 91  ? -5.920  26.025 -12.871 1.000 19.233 ? 420 ASP EEE CB  1 ? 
ATOM   703  C CG  . ASP A 1 91  ? -5.054  25.693 -14.070 1.000 23.305 ? 420 ASP EEE CG  1 ? 
ATOM   704  O OD1 . ASP A 1 91  ? -4.957  24.501 -14.414 1.000 24.308 ? 420 ASP EEE OD1 1 ? 
ATOM   705  O OD2 . ASP A 1 91  ? -4.463  26.650 -14.634 1.000 27.307 ? 420 ASP EEE OD2 1 ? 
ATOM   706  N N   . TYR A 1 92  ? -8.540  26.045 -11.094 1.000 14.857 ? 421 TYR EEE N   1 ? 
ATOM   707  C CA  . TYR A 1 92  ? -9.049  26.721 -9.880  1.000 15.181 ? 421 TYR EEE CA  1 ? 
ATOM   708  C C   . TYR A 1 92  ? -10.461 26.297 -9.475  1.000 15.392 ? 421 TYR EEE C   1 ? 
ATOM   709  O O   . TYR A 1 92  ? -10.882 26.764 -8.412  1.000 15.976 ? 421 TYR EEE O   1 ? 
ATOM   710  C CB  . TYR A 1 92  ? -9.026  28.238 -10.073 1.000 15.623 ? 421 TYR EEE CB  1 ? 
ATOM   711  C CG  . TYR A 1 92  ? -7.682  28.846 -10.390 1.000 15.669 ? 421 TYR EEE CG  1 ? 
ATOM   712  C CD1 . TYR A 1 92  ? -6.497  28.254 -9.973  1.000 16.662 ? 421 TYR EEE CD1 1 ? 
ATOM   713  C CD2 . TYR A 1 92  ? -7.614  30.086 -10.999 1.000 16.531 ? 421 TYR EEE CD2 1 ? 
ATOM   714  C CE1 . TYR A 1 92  ? -5.277  28.854 -10.244 1.000 17.000 ? 421 TYR EEE CE1 1 ? 
ATOM   715  C CE2 . TYR A 1 92  ? -6.407  30.714 -11.241 1.000 17.947 ? 421 TYR EEE CE2 1 ? 
ATOM   716  C CZ  . TYR A 1 92  ? -5.240  30.104 -10.832 1.000 18.664 ? 421 TYR EEE CZ  1 ? 
ATOM   717  O OH  . TYR A 1 92  ? -4.064  30.749 -11.110 1.000 22.359 ? 421 TYR EEE OH  1 ? 
ATOM   718  N N   . ASN A 1 93  ? -11.142 25.466 -10.250 1.000 14.820 ? 422 ASN EEE N   1 ? 
ATOM   719  C CA  . ASN A 1 93  ? -12.586 25.202 -9.960  1.000 14.416 ? 422 ASN EEE CA  1 ? 
ATOM   720  C C   . ASN A 1 93  ? -12.920 23.706 -9.880  1.000 14.680 ? 422 ASN EEE C   1 ? 
ATOM   721  O O   . ASN A 1 93  ? -13.556 23.296 -8.902  1.000 15.450 ? 422 ASN EEE O   1 ? 
ATOM   722  C CB  . ASN A 1 93  ? -13.486 25.857 -11.007 1.000 14.595 ? 422 ASN EEE CB  1 ? 
ATOM   723  C CG  . ASN A 1 93  ? -13.472 27.365 -10.907 1.000 14.163 ? 422 ASN EEE CG  1 ? 
ATOM   724  O OD1 . ASN A 1 93  ? -14.326 27.944 -10.248 1.000 13.905 ? 422 ASN EEE OD1 1 ? 
ATOM   725  N ND2 . ASN A 1 93  ? -12.495 28.030 -11.514 1.000 14.467 ? 422 ASN EEE ND2 1 ? 
ATOM   726  N N   . TYR A 1 94  ? -12.560 22.910 -10.882 1.000 14.197 ? 423 TYR EEE N   1 ? 
ATOM   727  C CA  . TYR A 1 94  ? -12.903 21.473 -10.920 1.000 14.559 ? 423 TYR EEE CA  1 ? 
ATOM   728  C C   . TYR A 1 94  ? -11.830 20.730 -11.705 1.000 15.239 ? 423 TYR EEE C   1 ? 
ATOM   729  O O   . TYR A 1 94  ? -11.677 20.990 -12.911 1.000 16.529 ? 423 TYR EEE O   1 ? 
ATOM   730  C CB  . TYR A 1 94  ? -14.292 21.254 -11.530 1.000 14.331 ? 423 TYR EEE CB  1 ? 
ATOM   731  C CG  . TYR A 1 94  ? -14.739 19.815 -11.468 1.000 14.736 ? 423 TYR EEE CG  1 ? 
ATOM   732  C CD1 . TYR A 1 94  ? -15.361 19.312 -10.334 1.000 15.841 ? 423 TYR EEE CD1 1 ? 
ATOM   733  C CD2 . TYR A 1 94  ? -14.472 18.928 -12.498 1.000 15.533 ? 423 TYR EEE CD2 1 ? 
ATOM   734  C CE1 . TYR A 1 94  ? -15.726 17.975 -10.240 1.000 16.167 ? 423 TYR EEE CE1 1 ? 
ATOM   735  C CE2 . TYR A 1 94  ? -14.851 17.595 -12.432 1.000 16.790 ? 423 TYR EEE CE2 1 ? 
ATOM   736  C CZ  . TYR A 1 94  ? -15.489 17.114 -11.298 1.000 16.319 ? 423 TYR EEE CZ  1 ? 
ATOM   737  O OH  . TYR A 1 94  ? -15.842 15.791 -11.210 1.000 17.757 ? 423 TYR EEE OH  1 ? 
ATOM   738  N N   . LYS A 1 95  ? -11.123 19.825 -11.030 1.000 16.275 ? 424 LYS EEE N   1 ? 
ATOM   739  C CA  . LYS A 1 95  ? -9.936  19.145 -11.596 1.000 16.588 ? 424 LYS EEE CA  1 ? 
ATOM   740  C C   . LYS A 1 95  ? -10.143 17.629 -11.641 1.000 16.271 ? 424 LYS EEE C   1 ? 
ATOM   741  O O   . LYS A 1 95  ? -10.377 17.020 -10.597 1.000 18.670 ? 424 LYS EEE O   1 ? 
ATOM   742  C CB  . LYS A 1 95  ? -8.708  19.479 -10.760 1.000 17.151 ? 424 LYS EEE CB  1 ? 
ATOM   743  C CG  . LYS A 1 95  ? -7.426  18.805 -11.244 1.000 19.294 ? 424 LYS EEE CG  1 ? 
ATOM   744  C CD  . LYS A 1 95  ? -7.078  19.179 -12.655 1.000 21.792 ? 424 LYS EEE CD  1 ? 
ATOM   745  C CE  . LYS A 1 95  ? -5.721  18.705 -13.122 1.000 25.072 ? 424 LYS EEE CE  1 ? 
ATOM   746  N NZ  . LYS A 1 95  ? -5.499  19.121 -14.527 1.000 27.247 ? 424 LYS EEE NZ  1 ? 
ATOM   747  N N   . LEU A 1 96  ? -10.017 17.044 -12.827 1.000 18.818 ? 425 LEU EEE N   1 ? 
ATOM   748  C CA  . LEU A 1 96  ? -10.011 15.571 -12.982 1.000 19.791 ? 425 LEU EEE CA  1 ? 
ATOM   749  C C   . LEU A 1 96  ? -8.590  15.054 -12.877 1.000 21.443 ? 425 LEU EEE C   1 ? 
ATOM   750  O O   . LEU A 1 96  ? -7.668  15.684 -13.388 1.000 24.340 ? 425 LEU EEE O   1 ? 
ATOM   751  C CB  . LEU A 1 96  ? -10.614 15.207 -14.335 1.000 20.516 ? 425 LEU EEE CB  1 ? 
ATOM   752  C CG  . LEU A 1 96  ? -12.118 15.416 -14.425 1.000 20.467 ? 425 LEU EEE CG  1 ? 
ATOM   753  C CD1 . LEU A 1 96  ? -12.587 15.012 -15.810 1.000 22.437 ? 425 LEU EEE CD1 1 ? 
ATOM   754  C CD2 . LEU A 1 96  ? -12.843 14.642 -13.328 1.000 21.836 ? 425 LEU EEE CD2 1 ? 
ATOM   755  N N   . PRO A 1 97  ? -8.414  13.854 -12.292 1.000 21.471 ? 426 PRO EEE N   1 ? 
ATOM   756  C CA  . PRO A 1 97  ? -7.097  13.234 -12.205 1.000 23.717 ? 426 PRO EEE CA  1 ? 
ATOM   757  C C   . PRO A 1 97  ? -6.673  12.631 -13.544 1.000 24.289 ? 426 PRO EEE C   1 ? 
ATOM   758  O O   . PRO A 1 97  ? -7.510  12.288 -14.351 1.000 24.177 ? 426 PRO EEE O   1 ? 
ATOM   759  C CB  . PRO A 1 97  ? -7.296  12.150 -11.144 1.000 24.377 ? 426 PRO EEE CB  1 ? 
ATOM   760  C CG  . PRO A 1 97  ? -8.733  11.732 -11.341 1.000 23.662 ? 426 PRO EEE CG  1 ? 
ATOM   761  C CD  . PRO A 1 97  ? -9.460  13.017 -11.682 1.000 23.664 ? 426 PRO EEE CD  1 ? 
ATOM   762  N N   . ASP A 1 98  ? -5.364  12.435 -13.705 1.000 25.448 ? 427 ASP EEE N   1 ? 
ATOM   763  C CA  . ASP A 1 98  ? -4.794  11.805 -14.919 1.000 27.266 ? 427 ASP EEE CA  1 ? 
ATOM   764  C C   . ASP A 1 98  ? -5.384  10.404 -15.089 1.000 24.760 ? 427 ASP EEE C   1 ? 
ATOM   765  O O   . ASP A 1 98  ? -5.594  10.020 -16.242 1.000 31.744 ? 427 ASP EEE O   1 ? 
ATOM   766  C CB  . ASP A 1 98  ? -3.273  11.715 -14.851 1.000 29.571 ? 427 ASP EEE CB  1 ? 
ATOM   767  C CG  . ASP A 1 98  ? -2.565  13.051 -14.932 1.000 32.565 ? 427 ASP EEE CG  1 ? 
ATOM   768  O OD1 . ASP A 1 98  ? -3.224  14.054 -15.251 1.000 35.547 ? 427 ASP EEE OD1 1 ? 
ATOM   769  O OD2 . ASP A 1 98  ? -1.334  13.062 -14.699 1.000 38.258 ? 427 ASP EEE OD2 1 ? 
ATOM   770  N N   . ASP A 1 99  ? -5.635  9.681  -13.990 1.000 26.551 ? 428 ASP EEE N   1 ? 
ATOM   771  C CA  . ASP A 1 99  ? -6.067  8.253  -14.018 1.000 29.989 ? 428 ASP EEE CA  1 ? 
ATOM   772  C C   . ASP A 1 99  ? -7.594  8.164  -13.887 1.000 27.948 ? 428 ASP EEE C   1 ? 
ATOM   773  O O   . ASP A 1 99  ? -8.126  7.107  -13.458 1.000 28.518 ? 428 ASP EEE O   1 ? 
ATOM   774  C CB  . ASP A 1 99  ? -5.358  7.426  -12.943 1.000 33.019 ? 428 ASP EEE CB  1 ? 
ATOM   775  C CG  . ASP A 1 99  ? -5.730  7.812  -11.519 1.000 35.483 ? 428 ASP EEE CG  1 ? 
ATOM   776  O OD1 . ASP A 1 99  ? -6.417  8.839  -11.349 1.000 35.100 ? 428 ASP EEE OD1 1 ? 
ATOM   777  O OD2 . ASP A 1 99  ? -5.327  7.087  -10.592 1.000 40.133 ? 428 ASP EEE OD2 1 ? 
ATOM   778  N N   . PHE A 1 100 ? -8.293  9.228  -14.257 1.000 26.272 ? 429 PHE EEE N   1 ? 
ATOM   779  C CA  . PHE A 1 100 ? -9.772  9.294  -14.190 1.000 24.269 ? 429 PHE EEE CA  1 ? 
ATOM   780  C C   . PHE A 1 100 ? -10.400 8.083  -14.888 1.000 22.679 ? 429 PHE EEE C   1 ? 
ATOM   781  O O   . PHE A 1 100 ? -10.038 7.804  -16.046 1.000 24.964 ? 429 PHE EEE O   1 ? 
ATOM   782  C CB  . PHE A 1 100 ? -10.250 10.576 -14.860 1.000 23.708 ? 429 PHE EEE CB  1 ? 
ATOM   783  C CG  . PHE A 1 100 ? -11.739 10.770 -14.876 1.000 22.491 ? 429 PHE EEE CG  1 ? 
ATOM   784  C CD1 . PHE A 1 100 ? -12.487 10.714 -13.713 1.000 22.632 ? 429 PHE EEE CD1 1 ? 
ATOM   785  C CD2 . PHE A 1 100 ? -12.371 11.040 -16.074 1.000 22.317 ? 429 PHE EEE CD2 1 ? 
ATOM   786  C CE1 . PHE A 1 100 ? -13.862 10.907 -13.746 1.000 22.604 ? 429 PHE EEE CE1 1 ? 
ATOM   787  C CE2 . PHE A 1 100 ? -13.743 11.212 -16.107 1.000 23.220 ? 429 PHE EEE CE2 1 ? 
ATOM   788  C CZ  . PHE A 1 100 ? -14.476 11.165 -14.942 1.000 22.100 ? 429 PHE EEE CZ  1 ? 
ATOM   789  N N   . THR A 1 101 ? -11.330 7.410  -14.206 1.000 23.247 ? 430 THR EEE N   1 ? 
ATOM   790  C CA  . THR A 1 101 ? -12.243 6.402  -14.800 1.000 22.648 ? 430 THR EEE CA  1 ? 
ATOM   791  C C   . THR A 1 101 ? -13.662 6.960  -14.687 1.000 20.744 ? 430 THR EEE C   1 ? 
ATOM   792  O O   . THR A 1 101 ? -14.163 7.101  -13.559 1.000 21.646 ? 430 THR EEE O   1 ? 
ATOM   793  C CB  . THR A 1 101 ? -12.145 5.021  -14.133 1.000 24.136 ? 430 THR EEE CB  1 ? 
ATOM   794  O OG1 . THR A 1 101 ? -10.806 4.543  -14.255 1.000 26.519 ? 430 THR EEE OG1 1 ? 
ATOM   795  C CG2 . THR A 1 101 ? -13.099 4.017  -14.751 1.000 26.029 ? 430 THR EEE CG2 1 ? 
ATOM   796  N N   . GLY A 1 102 ? -14.277 7.303  -15.810 1.000 22.028 ? 431 GLY EEE N   1 ? 
ATOM   797  C CA  . GLY A 1 102 ? -15.579 7.975  -15.760 1.000 21.833 ? 431 GLY EEE CA  1 ? 
ATOM   798  C C   . GLY A 1 102 ? -15.951 8.613  -17.074 1.000 22.566 ? 431 GLY EEE C   1 ? 
ATOM   799  O O   . GLY A 1 102 ? -15.235 8.455  -18.083 1.000 24.550 ? 431 GLY EEE O   1 ? 
ATOM   800  N N   . CYS A 1 103 ? -17.089 9.292  -17.064 1.000 22.034 ? 432 CYS EEE N   1 ? 
ATOM   801  C CA  . CYS A 1 103 ? -17.643 9.942  -18.264 1.000 22.394 ? 432 CYS EEE CA  1 ? 
ATOM   802  C C   . CYS A 1 103 ? -17.961 11.392 -17.933 1.000 20.204 ? 432 CYS EEE C   1 ? 
ATOM   803  O O   . CYS A 1 103 ? -18.446 11.680 -16.820 1.000 23.742 ? 432 CYS EEE O   1 ? 
ATOM   804  C CB  . CYS A 1 103 ? -18.873 9.215  -18.788 1.000 25.816 ? 432 CYS EEE CB  1 ? 
ATOM   805  S SG  . CYS A 1 103 ? -18.565 7.467  -19.183 1.000 30.071 ? 432 CYS EEE SG  1 ? 
ATOM   806  N N   . VAL A 1 104 ? -17.706 12.253 -18.903 1.000 19.722 ? 433 VAL EEE N   1 ? 
ATOM   807  C CA  . VAL A 1 104 ? -18.026 13.700 -18.846 1.000 19.415 ? 433 VAL EEE CA  1 ? 
ATOM   808  C C   . VAL A 1 104 ? -19.155 13.931 -19.844 1.000 19.531 ? 433 VAL EEE C   1 ? 
ATOM   809  O O   . VAL A 1 104 ? -19.005 13.604 -21.040 1.000 20.407 ? 433 VAL EEE O   1 ? 
ATOM   810  C CB  . VAL A 1 104 ? -16.795 14.555 -19.176 1.000 19.961 ? 433 VAL EEE CB  1 ? 
ATOM   811  C CG1 . VAL A 1 104 ? -17.122 16.039 -19.209 1.000 21.309 ? 433 VAL EEE CG1 1 ? 
ATOM   812  C CG2 . VAL A 1 104 ? -15.653 14.267 -18.226 1.000 20.618 ? 433 VAL EEE CG2 1 ? 
ATOM   813  N N   . ILE A 1 105 ? -20.254 14.457 -19.337 1.000 18.137 ? 434 ILE EEE N   1 ? 
ATOM   814  C CA  . ILE A 1 105 ? -21.513 14.642 -20.106 1.000 18.311 ? 434 ILE EEE CA  1 ? 
ATOM   815  C C   . ILE A 1 105 ? -21.863 16.125 -20.053 1.000 18.664 ? 434 ILE EEE C   1 ? 
ATOM   816  O O   . ILE A 1 105 ? -21.826 16.703 -18.963 1.000 19.947 ? 434 ILE EEE O   1 ? 
ATOM   817  C CB  . ILE A 1 105 ? -22.619 13.735 -19.537 1.000 19.958 ? 434 ILE EEE CB  1 ? 
ATOM   818  C CG1 . ILE A 1 105 ? -22.164 12.275 -19.511 1.000 22.413 ? 434 ILE EEE CG1 1 ? 
ATOM   819  C CG2 . ILE A 1 105 ? -23.903 13.926 -20.324 1.000 20.524 ? 434 ILE EEE CG2 1 ? 
ATOM   820  C CD1 . ILE A 1 105 ? -22.981 11.400 -18.612 1.000 24.559 ? 434 ILE EEE CD1 1 ? 
ATOM   821  N N   . ALA A 1 106 ? -22.170 16.740 -21.186 1.000 18.215 ? 435 ALA EEE N   1 ? 
ATOM   822  C CA  . ALA A 1 106 ? -22.531 18.170 -21.178 1.000 18.616 ? 435 ALA EEE CA  1 ? 
ATOM   823  C C   . ALA A 1 106 ? -23.596 18.434 -22.231 1.000 19.483 ? 435 ALA EEE C   1 ? 
ATOM   824  O O   . ALA A 1 106 ? -23.652 17.722 -23.252 1.000 21.315 ? 435 ALA EEE O   1 ? 
ATOM   825  C CB  . ALA A 1 106 ? -21.336 19.063 -21.391 1.000 19.930 ? 435 ALA EEE CB  1 ? 
ATOM   826  N N   . TRP A 1 107 ? -24.362 19.484 -21.977 1.000 19.297 ? 436 TRP EEE N   1 ? 
ATOM   827  C CA  . TRP A 1 107 ? -25.387 19.978 -22.925 1.000 19.754 ? 436 TRP EEE CA  1 ? 
ATOM   828  C C   . TRP A 1 107 ? -25.552 21.485 -22.771 1.000 18.719 ? 436 TRP EEE C   1 ? 
ATOM   829  O O   . TRP A 1 107 ? -25.382 22.034 -21.662 1.000 18.333 ? 436 TRP EEE O   1 ? 
ATOM   830  C CB  . TRP A 1 107 ? -26.708 19.236 -22.736 1.000 21.898 ? 436 TRP EEE CB  1 ? 
ATOM   831  C CG  . TRP A 1 107 ? -27.393 19.442 -21.420 1.000 20.766 ? 436 TRP EEE CG  1 ? 
ATOM   832  C CD1 . TRP A 1 107 ? -28.434 20.291 -21.166 1.000 23.102 ? 436 TRP EEE CD1 1 ? 
ATOM   833  C CD2 . TRP A 1 107 ? -27.181 18.701 -20.209 1.000 20.702 ? 436 TRP EEE CD2 1 ? 
ATOM   834  N NE1 . TRP A 1 107 ? -28.848 20.158 -19.872 1.000 21.959 ? 436 TRP EEE NE1 1 ? 
ATOM   835  C CE2 . TRP A 1 107 ? -28.084 19.206 -19.255 1.000 21.242 ? 436 TRP EEE CE2 1 ? 
ATOM   836  C CE3 . TRP A 1 107 ? -26.253 17.730 -19.803 1.000 20.697 ? 436 TRP EEE CE3 1 ? 
ATOM   837  C CZ2 . TRP A 1 107 ? -28.136 18.722 -17.951 1.000 19.978 ? 436 TRP EEE CZ2 1 ? 
ATOM   838  C CZ3 . TRP A 1 107 ? -26.304 17.256 -18.506 1.000 20.309 ? 436 TRP EEE CZ3 1 ? 
ATOM   839  C CH2 . TRP A 1 107 ? -27.236 17.746 -17.592 1.000 21.089 ? 436 TRP EEE CH2 1 ? 
ATOM   840  N N   . ASN A 1 108 ? -25.921 22.111 -23.871 1.000 20.047 ? 437 ASN EEE N   1 ? 
ATOM   841  C CA  . ASN A 1 108 ? -26.174 23.563 -23.931 1.000 18.868 ? 437 ASN EEE CA  1 ? 
ATOM   842  C C   . ASN A 1 108 ? -27.384 23.865 -23.045 1.000 17.676 ? 437 ASN EEE C   1 ? 
ATOM   843  O O   . ASN A 1 108 ? -28.441 23.222 -23.218 1.000 20.331 ? 437 ASN EEE O   1 ? 
ATOM   844  C CB  . ASN A 1 108 ? -26.341 24.016 -25.378 1.000 19.757 ? 437 ASN EEE CB  1 ? 
ATOM   845  C CG  . ASN A 1 108 ? -26.477 25.515 -25.487 1.000 20.417 ? 437 ASN EEE CG  1 ? 
ATOM   846  O OD1 . ASN A 1 108 ? -27.425 26.084 -24.958 1.000 21.561 ? 437 ASN EEE OD1 1 ? 
ATOM   847  N ND2 . ASN A 1 108 ? -25.519 26.159 -26.138 1.000 19.301 ? 437 ASN EEE ND2 1 ? 
ATOM   848  N N   . SER A 1 109 ? -27.258 24.821 -22.135 1.000 16.964 ? 438 SER EEE N   1 ? 
ATOM   849  C CA  . SER A 1 109 ? -28.380 25.196 -21.238 1.000 16.817 ? 438 SER EEE CA  1 ? 
ATOM   850  C C   . SER A 1 109 ? -28.727 26.682 -21.392 1.000 16.257 ? 438 SER EEE C   1 ? 
ATOM   851  O O   . SER A 1 109 ? -29.329 27.230 -20.471 1.000 17.342 ? 438 SER EEE O   1 ? 
ATOM   852  C CB  . SER A 1 109 ? -28.085 24.837 -19.799 1.000 18.568 ? 438 SER EEE CB  1 ? 
ATOM   853  O OG  . SER A 1 109 ? -26.970 25.570 -19.311 1.000 17.469 ? 438 SER EEE OG  1 ? 
ATOM   854  N N   . ASN A 1 110 ? -28.444 27.296 -22.545 1.000 16.102 ? 439 ASN EEE N   1 ? 
ATOM   855  C CA  . ASN A 1 110 ? -28.739 28.734 -22.775 1.000 16.192 ? 439 ASN EEE CA  1 ? 
ATOM   856  C C   . ASN A 1 110 ? -30.229 29.005 -22.497 1.000 17.692 ? 439 ASN EEE C   1 ? 
ATOM   857  O O   . ASN A 1 110 ? -30.543 30.069 -21.970 1.000 18.282 ? 439 ASN EEE O   1 ? 
ATOM   858  C CB  . ASN A 1 110 ? -28.353 29.166 -24.191 1.000 18.018 ? 439 ASN EEE CB  1 ? 
ATOM   859  C CG  . ASN A 1 110 ? -28.028 30.642 -24.309 1.000 17.500 ? 439 ASN EEE CG  1 ? 
ATOM   860  O OD1 . ASN A 1 110 ? -27.461 31.240 -23.402 1.000 20.518 ? 439 ASN EEE OD1 1 ? 
ATOM   861  N ND2 . ASN A 1 110 ? -28.354 31.227 -25.449 1.000 19.356 ? 439 ASN EEE ND2 1 ? 
ATOM   862  N N   . ASN A 1 111 ? -31.106 28.088 -22.883 1.000 19.195 ? 440 ASN EEE N   1 ? 
ATOM   863  C CA  . ASN A 1 111 ? -32.566 28.304 -22.741 1.000 20.199 ? 440 ASN EEE CA  1 ? 
ATOM   864  C C   . ASN A 1 111 ? -32.998 28.391 -21.272 1.000 19.054 ? 440 ASN EEE C   1 ? 
ATOM   865  O O   . ASN A 1 111 ? -34.048 28.983 -21.018 1.000 22.612 ? 440 ASN EEE O   1 ? 
ATOM   866  C CB  . ASN A 1 111 ? -33.318 27.212 -23.488 1.000 20.827 ? 440 ASN EEE CB  1 ? 
ATOM   867  C CG  . ASN A 1 111 ? -33.164 25.838 -22.874 1.000 26.989 ? 440 ASN EEE CG  1 ? 
ATOM   868  O OD1 . ASN A 1 111 ? -32.090 25.476 -22.378 1.000 29.601 ? 440 ASN EEE OD1 1 ? 
ATOM   869  N ND2 . ASN A 1 111 ? -34.246 25.079 -22.880 1.000 36.228 ? 440 ASN EEE ND2 1 ? 
ATOM   870  N N   . LEU A 1 112 ? -32.256 27.807 -20.338 1.000 19.174 ? 441 LEU EEE N   1 ? 
ATOM   871  C CA  . LEU A 1 112 ? -32.586 27.789 -18.886 1.000 19.224 ? 441 LEU EEE CA  1 ? 
ATOM   872  C C   . LEU A 1 112 ? -31.708 28.746 -18.080 1.000 19.047 ? 441 LEU EEE C   1 ? 
ATOM   873  O O   . LEU A 1 112 ? -32.184 29.251 -17.051 1.000 21.728 ? 441 LEU EEE O   1 ? 
ATOM   874  C CB  . LEU A 1 112 ? -32.416 26.369 -18.358 1.000 22.140 ? 441 LEU EEE CB  1 ? 
ATOM   875  C CG  . LEU A 1 112 ? -33.317 25.321 -19.002 1.000 24.283 ? 441 LEU EEE CG  1 ? 
ATOM   876  C CD1 . LEU A 1 112 ? -33.175 24.003 -18.259 1.000 27.935 ? 441 LEU EEE CD1 1 ? 
ATOM   877  C CD2 . LEU A 1 112 ? -34.780 25.762 -19.031 1.000 25.877 ? 441 LEU EEE CD2 1 ? 
ATOM   878  N N   . ASP A 1 113 ? -30.441 28.904 -18.474 1.000 16.499 ? 442 ASP EEE N   1 ? 
ATOM   879  C CA  . ASP A 1 113 ? -29.419 29.532 -17.608 1.000 18.482 ? 442 ASP EEE CA  1 ? 
ATOM   880  C C   . ASP A 1 113 ? -28.981 30.910 -18.104 1.000 18.017 ? 442 ASP EEE C   1 ? 
ATOM   881  O O   . ASP A 1 113 ? -28.072 31.503 -17.507 1.000 18.112 ? 442 ASP EEE O   1 ? 
ATOM   882  C CB  . ASP A 1 113 ? -28.237 28.587 -17.501 1.000 17.280 ? 442 ASP EEE CB  1 ? 
ATOM   883  C CG  . ASP A 1 113 ? -28.524 27.390 -16.618 1.000 17.247 ? 442 ASP EEE CG  1 ? 
ATOM   884  O OD1 . ASP A 1 113 ? -29.275 27.554 -15.617 1.000 17.608 ? 442 ASP EEE OD1 1 ? 
ATOM   885  O OD2 . ASP A 1 113 ? -28.014 26.298 -16.934 1.000 18.710 ? 442 ASP EEE OD2 1 ? 
ATOM   886  N N   . SER A 1 114 ? -29.585 31.410 -19.161 1.000 17.933 ? 443 SER EEE N   1 ? 
ATOM   887  C CA  A SER A 1 114 ? -29.422 32.813 -19.587 0.500 19.127 ? 443 SER EEE CA  1 ? 
ATOM   888  C CA  B SER A 1 114 ? -29.426 32.819 -19.579 0.500 19.111 ? 443 SER EEE CA  1 ? 
ATOM   889  C C   . SER A 1 114 ? -30.821 33.411 -19.730 1.000 20.670 ? 443 SER EEE C   1 ? 
ATOM   890  O O   . SER A 1 114 ? -31.802 32.631 -19.809 1.000 25.773 ? 443 SER EEE O   1 ? 
ATOM   891  C CB  A SER A 1 114 ? -28.612 32.890 -20.860 0.500 20.026 ? 443 SER EEE CB  1 ? 
ATOM   892  C CB  B SER A 1 114 ? -28.679 32.933 -20.867 0.500 21.125 ? 443 SER EEE CB  1 ? 
ATOM   893  O OG  A SER A 1 114 ? -28.198 34.216 -21.120 0.500 20.004 ? 443 SER EEE OG  1 ? 
ATOM   894  O OG  B SER A 1 114 ? -29.600 32.789 -21.933 0.500 22.847 ? 443 SER EEE OG  1 ? 
ATOM   895  N N   . LYS A 1 115 ? -30.895 34.722 -19.740 1.000 20.665 ? 444 LYS EEE N   1 ? 
ATOM   896  C CA  . LYS A 1 115 ? -32.176 35.413 -19.956 1.000 21.091 ? 444 LYS EEE CA  1 ? 
ATOM   897  C C   . LYS A 1 115 ? -31.863 36.851 -20.303 1.000 19.693 ? 444 LYS EEE C   1 ? 
ATOM   898  O O   . LYS A 1 115 ? -30.732 37.311 -20.038 1.000 21.717 ? 444 LYS EEE O   1 ? 
ATOM   899  C CB  . LYS A 1 115 ? -33.040 35.344 -18.703 1.000 24.487 ? 444 LYS EEE CB  1 ? 
ATOM   900  C CG  . LYS A 1 115 ? -32.467 36.036 -17.485 1.000 27.813 ? 444 LYS EEE CG  1 ? 
ATOM   901  C CD  . LYS A 1 115 ? -33.217 35.696 -16.225 1.000 31.766 ? 444 LYS EEE CD  1 ? 
ATOM   902  C CE  . LYS A 1 115 ? -32.392 36.002 -14.999 1.000 37.578 ? 444 LYS EEE CE  1 ? 
ATOM   903  N NZ  . LYS A 1 115 ? -32.268 37.460 -14.783 1.000 41.845 ? 444 LYS EEE NZ  1 ? 
ATOM   904  N N   . VAL A 1 116 ? -32.846 37.537 -20.850 1.000 22.055 ? 445 VAL EEE N   1 ? 
ATOM   905  C CA  . VAL A 1 116 ? -32.702 38.975 -21.163 1.000 22.233 ? 445 VAL EEE CA  1 ? 
ATOM   906  C C   . VAL A 1 116 ? -32.430 39.702 -19.844 1.000 21.612 ? 445 VAL EEE C   1 ? 
ATOM   907  O O   . VAL A 1 116 ? -33.065 39.383 -18.831 1.000 25.032 ? 445 VAL EEE O   1 ? 
ATOM   908  C CB  . VAL A 1 116 ? -33.907 39.495 -21.955 1.000 23.451 ? 445 VAL EEE CB  1 ? 
ATOM   909  C CG1 . VAL A 1 116 ? -33.809 40.996 -22.165 1.000 24.575 ? 445 VAL EEE CG1 1 ? 
ATOM   910  C CG2 . VAL A 1 116 ? -34.002 38.762 -23.297 1.000 23.421 ? 445 VAL EEE CG2 1 ? 
ATOM   911  N N   . GLY A 1 117 ? -31.421 40.572 -19.843 1.000 22.640 ? 446 GLY EEE N   1 ? 
ATOM   912  C CA  . GLY A 1 117 ? -30.895 41.233 -18.628 1.000 24.005 ? 446 GLY EEE CA  1 ? 
ATOM   913  C C   . GLY A 1 117 ? -29.684 40.515 -18.049 1.000 23.533 ? 446 GLY EEE C   1 ? 
ATOM   914  O O   . GLY A 1 117 ? -29.052 41.056 -17.115 1.000 28.564 ? 446 GLY EEE O   1 ? 
ATOM   915  N N   . GLY A 1 118 ? -29.399 39.317 -18.540 1.000 19.495 ? 447 GLY EEE N   1 ? 
ATOM   916  C CA  . GLY A 1 118 ? -28.272 38.525 -18.043 1.000 18.620 ? 447 GLY EEE CA  1 ? 
ATOM   917  C C   . GLY A 1 118 ? -28.643 37.643 -16.858 1.000 19.158 ? 447 GLY EEE C   1 ? 
ATOM   918  O O   . GLY A 1 118 ? -29.554 37.990 -16.066 1.000 23.253 ? 447 GLY EEE O   1 ? 
ATOM   919  N N   . ASN A 1 119 ? -27.955 36.513 -16.734 1.000 16.808 ? 448 ASN EEE N   1 ? 
ATOM   920  C CA  . ASN A 1 119 ? -28.018 35.680 -15.513 1.000 15.432 ? 448 ASN EEE CA  1 ? 
ATOM   921  C C   . ASN A 1 119 ? -26.669 35.796 -14.809 1.000 15.676 ? 448 ASN EEE C   1 ? 
ATOM   922  O O   . ASN A 1 119 ? -25.677 35.296 -15.352 1.000 16.909 ? 448 ASN EEE O   1 ? 
ATOM   923  C CB  . ASN A 1 119 ? -28.383 34.228 -15.804 1.000 16.690 ? 448 ASN EEE CB  1 ? 
ATOM   924  C CG  . ASN A 1 119 ? -28.408 33.416 -14.538 1.000 16.661 ? 448 ASN EEE CG  1 ? 
ATOM   925  O OD1 . ASN A 1 119 ? -28.416 33.984 -13.445 1.000 20.741 ? 448 ASN EEE OD1 1 ? 
ATOM   926  N ND2 . ASN A 1 119 ? -28.392 32.101 -14.680 1.000 20.379 ? 448 ASN EEE ND2 1 ? 
ATOM   927  N N   . TYR A 1 120 ? -26.660 36.460 -13.668 1.000 15.674 ? 449 TYR EEE N   1 ? 
ATOM   928  C CA  . TYR A 1 120 ? -25.437 36.692 -12.873 1.000 15.428 ? 449 TYR EEE CA  1 ? 
ATOM   929  C C   . TYR A 1 120 ? -25.270 35.659 -11.752 1.000 15.272 ? 449 TYR EEE C   1 ? 
ATOM   930  O O   . TYR A 1 120 ? -24.256 35.715 -11.031 1.000 16.935 ? 449 TYR EEE O   1 ? 
ATOM   931  C CB  . TYR A 1 120 ? -25.392 38.139 -12.375 1.000 15.348 ? 449 TYR EEE CB  1 ? 
ATOM   932  C CG  . TYR A 1 120 ? -25.202 39.157 -13.470 1.000 15.717 ? 449 TYR EEE CG  1 ? 
ATOM   933  C CD1 . TYR A 1 120 ? -26.245 39.536 -14.306 1.000 17.340 ? 449 TYR EEE CD1 1 ? 
ATOM   934  C CD2 . TYR A 1 120 ? -23.946 39.672 -13.755 1.000 15.712 ? 449 TYR EEE CD2 1 ? 
ATOM   935  C CE1 . TYR A 1 120 ? -26.059 40.435 -15.342 1.000 17.631 ? 449 TYR EEE CE1 1 ? 
ATOM   936  C CE2 . TYR A 1 120 ? -23.752 40.604 -14.760 1.000 16.110 ? 449 TYR EEE CE2 1 ? 
ATOM   937  C CZ  . TYR A 1 120 ? -24.805 40.966 -15.585 1.000 16.361 ? 449 TYR EEE CZ  1 ? 
ATOM   938  O OH  . TYR A 1 120 ? -24.565 41.832 -16.607 1.000 19.469 ? 449 TYR EEE OH  1 ? 
ATOM   939  N N   . ASN A 1 121 ? -26.167 34.692 -11.615 1.000 15.824 ? 450 ASN EEE N   1 ? 
ATOM   940  C CA  . ASN A 1 121 ? -26.170 33.792 -10.443 1.000 17.094 ? 450 ASN EEE CA  1 ? 
ATOM   941  C C   . ASN A 1 121 ? -24.958 32.859 -10.452 1.000 15.446 ? 450 ASN EEE C   1 ? 
ATOM   942  O O   . ASN A 1 121 ? -24.530 32.488 -9.347  1.000 18.042 ? 450 ASN EEE O   1 ? 
ATOM   943  C CB  . ASN A 1 121 ? -27.454 32.986 -10.373 1.000 19.162 ? 450 ASN EEE CB  1 ? 
ATOM   944  C CG  . ASN A 1 121 ? -28.658 33.824 -10.031 1.000 23.577 ? 450 ASN EEE CG  1 ? 
ATOM   945  O OD1 . ASN A 1 121 ? -28.581 34.792 -9.286  1.000 29.501 ? 450 ASN EEE OD1 1 ? 
ATOM   946  N ND2 . ASN A 1 121 ? -29.779 33.416 -10.574 1.000 29.641 ? 450 ASN EEE ND2 1 ? 
ATOM   947  N N   . TYR A 1 122 ? -24.488 32.424 -11.629 1.000 14.644 ? 451 TYR EEE N   1 ? 
ATOM   948  C CA  . TYR A 1 122 ? -23.383 31.432 -11.705 1.000 14.826 ? 451 TYR EEE CA  1 ? 
ATOM   949  C C   . TYR A 1 122 ? -22.020 32.125 -11.597 1.000 14.453 ? 451 TYR EEE C   1 ? 
ATOM   950  O O   . TYR A 1 122 ? -21.755 33.092 -12.314 1.000 14.623 ? 451 TYR EEE O   1 ? 
ATOM   951  C CB  . TYR A 1 122 ? -23.456 30.615 -12.991 1.000 14.244 ? 451 TYR EEE CB  1 ? 
ATOM   952  C CG  . TYR A 1 122 ? -24.671 29.718 -13.077 1.000 14.671 ? 451 TYR EEE CG  1 ? 
ATOM   953  C CD1 . TYR A 1 122 ? -24.744 28.543 -12.354 1.000 16.062 ? 451 TYR EEE CD1 1 ? 
ATOM   954  C CD2 . TYR A 1 122 ? -25.724 30.021 -13.919 1.000 15.922 ? 451 TYR EEE CD2 1 ? 
ATOM   955  C CE1 . TYR A 1 122 ? -25.836 27.697 -12.430 1.000 17.689 ? 451 TYR EEE CE1 1 ? 
ATOM   956  C CE2 . TYR A 1 122 ? -26.833 29.187 -14.005 1.000 16.089 ? 451 TYR EEE CE2 1 ? 
ATOM   957  C CZ  . TYR A 1 122 ? -26.868 28.004 -13.288 1.000 16.416 ? 451 TYR EEE CZ  1 ? 
ATOM   958  O OH  . TYR A 1 122 ? -27.923 27.137 -13.349 1.000 18.316 ? 451 TYR EEE OH  1 ? 
ATOM   959  N N   . LEU A 1 123 ? -21.199 31.611 -10.686 1.000 14.465 ? 452 LEU EEE N   1 ? 
ATOM   960  C CA  . LEU A 1 123 ? -19.843 32.155 -10.416 1.000 13.253 ? 452 LEU EEE CA  1 ? 
ATOM   961  C C   . LEU A 1 123 ? -18.776 31.133 -10.779 1.000 13.456 ? 452 LEU EEE C   1 ? 
ATOM   962  O O   . LEU A 1 123 ? -19.030 29.912 -10.848 1.000 13.843 ? 452 LEU EEE O   1 ? 
ATOM   963  C CB  . LEU A 1 123 ? -19.726 32.502 -8.929  1.000 14.771 ? 452 LEU EEE CB  1 ? 
ATOM   964  C CG  . LEU A 1 123 ? -20.832 33.334 -8.283  1.000 14.924 ? 452 LEU EEE CG  1 ? 
ATOM   965  C CD1 . LEU A 1 123 ? -20.480 33.626 -6.815  1.000 16.702 ? 452 LEU EEE CD1 1 ? 
ATOM   966  C CD2 . LEU A 1 123 ? -21.056 34.626 -9.029  1.000 15.934 ? 452 LEU EEE CD2 1 ? 
ATOM   967  N N   . TYR A 1 124 ? -17.554 31.644 -10.884 1.000 14.374 ? 453 TYR EEE N   1 ? 
ATOM   968  C CA  . TYR A 1 124 ? -16.340 30.819 -11.050 1.000 14.025 ? 453 TYR EEE CA  1 ? 
ATOM   969  C C   . TYR A 1 124 ? -15.229 31.493 -10.242 1.000 13.162 ? 453 TYR EEE C   1 ? 
ATOM   970  O O   . TYR A 1 124 ? -15.276 32.697 -10.012 1.000 13.962 ? 453 TYR EEE O   1 ? 
ATOM   971  C CB  . TYR A 1 124 ? -15.989 30.662 -12.533 1.000 13.147 ? 453 TYR EEE CB  1 ? 
ATOM   972  C CG  . TYR A 1 124 ? -15.650 31.962 -13.211 1.000 14.979 ? 453 TYR EEE CG  1 ? 
ATOM   973  C CD1 . TYR A 1 124 ? -16.642 32.787 -13.713 1.000 15.435 ? 453 TYR EEE CD1 1 ? 
ATOM   974  C CD2 . TYR A 1 124 ? -14.346 32.441 -13.262 1.000 17.435 ? 453 TYR EEE CD2 1 ? 
ATOM   975  C CE1 . TYR A 1 124 ? -16.355 34.018 -14.284 1.000 16.210 ? 453 TYR EEE CE1 1 ? 
ATOM   976  C CE2 . TYR A 1 124 ? -14.046 33.665 -13.830 1.000 18.441 ? 453 TYR EEE CE2 1 ? 
ATOM   977  C CZ  . TYR A 1 124 ? -15.046 34.466 -14.337 1.000 17.584 ? 453 TYR EEE CZ  1 ? 
ATOM   978  O OH  . TYR A 1 124 ? -14.814 35.695 -14.869 1.000 19.874 ? 453 TYR EEE OH  1 ? 
ATOM   979  N N   . ARG A 1 125 ? -14.248 30.692 -9.837  1.000 14.137 ? 454 ARG EEE N   1 ? 
ATOM   980  C CA  . ARG A 1 125 ? -13.025 31.200 -9.186  1.000 13.653 ? 454 ARG EEE CA  1 ? 
ATOM   981  C C   . ARG A 1 125 ? -12.007 31.601 -10.258 1.000 13.010 ? 454 ARG EEE C   1 ? 
ATOM   982  O O   . ARG A 1 125 ? -11.697 30.783 -11.108 1.000 14.412 ? 454 ARG EEE O   1 ? 
ATOM   983  C CB  . ARG A 1 125 ? -12.455 30.140 -8.251  1.000 14.050 ? 454 ARG EEE CB  1 ? 
ATOM   984  C CG  . ARG A 1 125 ? -11.288 30.682 -7.440  1.000 13.824 ? 454 ARG EEE CG  1 ? 
ATOM   985  C CD  . ARG A 1 125 ? -10.744 29.700 -6.406  1.000 14.589 ? 454 ARG EEE CD  1 ? 
ATOM   986  N NE  . ARG A 1 125 ? -11.776 29.255 -5.488  1.000 14.369 ? 454 ARG EEE NE  1 ? 
ATOM   987  C CZ  . ARG A 1 125 ? -12.203 29.918 -4.420  1.000 15.214 ? 454 ARG EEE CZ  1 ? 
ATOM   988  N NH1 . ARG A 1 125 ? -11.605 31.025 -4.002  1.000 16.249 ? 454 ARG EEE NH1 1 ? 
ATOM   989  N NH2 . ARG A 1 125 ? -13.240 29.441 -3.747  1.000 16.093 ? 454 ARG EEE NH2 1 ? 
ATOM   990  N N   . LEU A 1 126 ? -11.563 32.855 -10.204 1.000 13.574 ? 455 LEU EEE N   1 ? 
ATOM   991  C CA  . LEU A 1 126 ? -10.635 33.414 -11.215 1.000 13.762 ? 455 LEU EEE CA  1 ? 
ATOM   992  C C   . LEU A 1 126 ? -9.204  33.422 -10.686 1.000 14.751 ? 455 LEU EEE C   1 ? 
ATOM   993  O O   . LEU A 1 126 ? -8.309  33.425 -11.525 1.000 15.805 ? 455 LEU EEE O   1 ? 
ATOM   994  C CB  . LEU A 1 126 ? -11.097 34.824 -11.604 1.000 14.576 ? 455 LEU EEE CB  1 ? 
ATOM   995  C CG  . LEU A 1 126 ? -10.276 35.526 -12.688 1.000 16.856 ? 455 LEU EEE CG  1 ? 
ATOM   996  C CD1 . LEU A 1 126 ? -10.122 34.654 -13.933 1.000 17.560 ? 455 LEU EEE CD1 1 ? 
ATOM   997  C CD2 . LEU A 1 126 ? -10.914 36.861 -13.048 1.000 18.655 ? 455 LEU EEE CD2 1 ? 
ATOM   998  N N   . PHE A 1 127 ? -9.006  33.448 -9.373  1.000 14.721 ? 456 PHE EEE N   1 ? 
ATOM   999  C CA  . PHE A 1 127 ? -7.674  33.622 -8.751  1.000 14.921 ? 456 PHE EEE CA  1 ? 
ATOM   1000 C C   . PHE A 1 127 ? -7.476  32.559 -7.680  1.000 15.905 ? 456 PHE EEE C   1 ? 
ATOM   1001 O O   . PHE A 1 127 ? -8.375  32.303 -6.881  1.000 15.997 ? 456 PHE EEE O   1 ? 
ATOM   1002 C CB  . PHE A 1 127 ? -7.535  35.017 -8.137  1.000 16.263 ? 456 PHE EEE CB  1 ? 
ATOM   1003 C CG  . PHE A 1 127 ? -7.768  36.148 -9.105  1.000 17.034 ? 456 PHE EEE CG  1 ? 
ATOM   1004 C CD1 . PHE A 1 127 ? -6.790  36.478 -10.029 1.000 18.462 ? 456 PHE EEE CD1 1 ? 
ATOM   1005 C CD2 . PHE A 1 127 ? -8.963  36.856 -9.125  1.000 17.716 ? 456 PHE EEE CD2 1 ? 
ATOM   1006 C CE1 . PHE A 1 127 ? -6.989  37.513 -10.923 1.000 19.469 ? 456 PHE EEE CE1 1 ? 
ATOM   1007 C CE2 . PHE A 1 127 ? -9.161  37.885 -10.033 1.000 18.571 ? 456 PHE EEE CE2 1 ? 
ATOM   1008 C CZ  . PHE A 1 127 ? -8.178  38.198 -10.941 1.000 20.268 ? 456 PHE EEE CZ  1 ? 
ATOM   1009 N N   . ARG A 1 128 ? -6.257  32.034 -7.586  1.000 16.942 ? 457 ARG EEE N   1 ? 
ATOM   1010 C CA  . ARG A 1 128 ? -5.891  31.070 -6.524  1.000 16.612 ? 457 ARG EEE CA  1 ? 
ATOM   1011 C C   . ARG A 1 128 ? -4.367  30.974 -6.476  1.000 17.355 ? 457 ARG EEE C   1 ? 
ATOM   1012 O O   . ARG A 1 128 ? -3.732  31.085 -7.525  1.000 19.143 ? 457 ARG EEE O   1 ? 
ATOM   1013 C CB  . ARG A 1 128 ? -6.566  29.714 -6.769  1.000 17.733 ? 457 ARG EEE CB  1 ? 
ATOM   1014 C CG  . ARG A 1 128 ? -6.705  28.859 -5.521  1.000 16.728 ? 457 ARG EEE CG  1 ? 
ATOM   1015 C CD  . ARG A 1 128 ? -7.463  27.584 -5.818  1.000 17.743 ? 457 ARG EEE CD  1 ? 
ATOM   1016 N NE  . ARG A 1 128 ? -7.783  26.874 -4.597  1.000 18.379 ? 457 ARG EEE NE  1 ? 
ATOM   1017 C CZ  . ARG A 1 128 ? -7.080  25.893 -4.061  1.000 19.851 ? 457 ARG EEE CZ  1 ? 
ATOM   1018 N NH1 . ARG A 1 128 ? -5.943  25.499 -4.626  1.000 21.733 ? 457 ARG EEE NH1 1 ? 
ATOM   1019 N NH2 . ARG A 1 128 ? -7.501  25.333 -2.937  1.000 21.192 ? 457 ARG EEE NH2 1 ? 
ATOM   1020 N N   . LYS A 1 129 ? -3.830  30.756 -5.287  1.000 17.781 ? 458 LYS EEE N   1 ? 
ATOM   1021 C CA  . LYS A 1 129 ? -2.370  30.724 -5.081  1.000 18.674 ? 458 LYS EEE CA  1 ? 
ATOM   1022 C C   . LYS A 1 129 ? -1.768  29.445 -5.665  1.000 19.830 ? 458 LYS EEE C   1 ? 
ATOM   1023 O O   . LYS A 1 129 ? -0.534  29.415 -5.897  1.000 24.470 ? 458 LYS EEE O   1 ? 
ATOM   1024 C CB  . LYS A 1 129 ? -2.070  30.845 -3.590  1.000 21.156 ? 458 LYS EEE CB  1 ? 
ATOM   1025 C CG  . LYS A 1 129 ? -2.316  32.232 -3.021  1.000 25.266 ? 458 LYS EEE CG  1 ? 
ATOM   1026 C CD  . LYS A 1 129 ? -2.201  32.265 -1.509  1.000 31.687 ? 458 LYS EEE CD  1 ? 
ATOM   1027 C CE  . LYS A 1 129 ? -0.782  32.127 -1.028  1.000 38.815 ? 458 LYS EEE CE  1 ? 
ATOM   1028 N NZ  . LYS A 1 129 ? -0.667  32.624 0.361   1.000 42.845 ? 458 LYS EEE NZ  1 ? 
ATOM   1029 N N   . SER A 1 130 ? -2.557  28.388 -5.786  1.000 20.080 ? 459 SER EEE N   1 ? 
ATOM   1030 C CA  . SER A 1 130 ? -2.101  27.088 -6.313  1.000 20.761 ? 459 SER EEE CA  1 ? 
ATOM   1031 C C   . SER A 1 130 ? -3.264  26.387 -6.996  1.000 19.093 ? 459 SER EEE C   1 ? 
ATOM   1032 O O   . SER A 1 130 ? -4.440  26.757 -6.745  1.000 18.797 ? 459 SER EEE O   1 ? 
ATOM   1033 C CB  . SER A 1 130 ? -1.531  26.212 -5.234  1.000 23.761 ? 459 SER EEE CB  1 ? 
ATOM   1034 O OG  . SER A 1 130 ? -2.538  25.851 -4.319  1.000 26.318 ? 459 SER EEE OG  1 ? 
ATOM   1035 N N   . ASN A 1 131 ? -2.949  25.379 -7.790  1.000 18.862 ? 460 ASN EEE N   1 ? 
ATOM   1036 C CA  . ASN A 1 131 ? -3.976  24.590 -8.501  1.000 19.011 ? 460 ASN EEE CA  1 ? 
ATOM   1037 C C   . ASN A 1 131 ? -4.691  23.636 -7.532  1.000 19.106 ? 460 ASN EEE C   1 ? 
ATOM   1038 O O   . ASN A 1 131 ? -4.099  23.137 -6.537  1.000 20.592 ? 460 ASN EEE O   1 ? 
ATOM   1039 C CB  . ASN A 1 131 ? -3.397  23.829 -9.688  1.000 20.199 ? 460 ASN EEE CB  1 ? 
ATOM   1040 C CG  . ASN A 1 131 ? -2.965  24.714 -10.845 1.000 21.604 ? 460 ASN EEE CG  1 ? 
ATOM   1041 O OD1 . ASN A 1 131 ? -3.054  25.938 -10.789 1.000 20.579 ? 460 ASN EEE OD1 1 ? 
ATOM   1042 N ND2 . ASN A 1 131 ? -2.505  24.087 -11.922 1.000 27.338 ? 460 ASN EEE ND2 1 ? 
ATOM   1043 N N   . LEU A 1 132 ? -5.967  23.381 -7.817  1.000 17.912 ? 461 LEU EEE N   1 ? 
ATOM   1044 C CA  . LEU A 1 132 ? -6.729  22.338 -7.098  1.000 17.994 ? 461 LEU EEE CA  1 ? 
ATOM   1045 C C   . LEU A 1 132 ? -6.088  20.965 -7.280  1.000 17.903 ? 461 LEU EEE C   1 ? 
ATOM   1046 O O   . LEU A 1 132 ? -5.636  20.657 -8.389  1.000 20.500 ? 461 LEU EEE O   1 ? 
ATOM   1047 C CB  . LEU A 1 132 ? -8.155  22.277 -7.633  1.000 18.080 ? 461 LEU EEE CB  1 ? 
ATOM   1048 C CG  . LEU A 1 132 ? -9.025  23.476 -7.288  1.000 19.348 ? 461 LEU EEE CG  1 ? 
ATOM   1049 C CD1 . LEU A 1 132 ? -10.388 23.278 -7.894  1.000 19.519 ? 461 LEU EEE CD1 1 ? 
ATOM   1050 C CD2 . LEU A 1 132 ? -9.143  23.676 -5.794  1.000 20.037 ? 461 LEU EEE CD2 1 ? 
ATOM   1051 N N   . LYS A 1 133 ? -6.183  20.153 -6.235  1.000 19.249 ? 462 LYS EEE N   1 ? 
ATOM   1052 C CA  . LYS A 1 133 ? -5.977  18.699 -6.324  1.000 20.661 ? 462 LYS EEE CA  1 ? 
ATOM   1053 C C   . LYS A 1 133 ? -7.176  18.093 -7.036  1.000 20.385 ? 462 LYS EEE C   1 ? 
ATOM   1054 O O   . LYS A 1 133 ? -8.263  18.678 -7.025  1.000 19.572 ? 462 LYS EEE O   1 ? 
ATOM   1055 C CB  . LYS A 1 133 ? -5.746  18.142 -4.922  1.000 21.755 ? 462 LYS EEE CB  1 ? 
ATOM   1056 C CG  . LYS A 1 133 ? -4.505  18.690 -4.236  1.000 24.082 ? 462 LYS EEE CG  1 ? 
ATOM   1057 C CD  . LYS A 1 133 ? -4.435  18.265 -2.799  1.000 30.855 ? 462 LYS EEE CD  1 ? 
ATOM   1058 C CE  . LYS A 1 133 ? -3.143  18.680 -2.135  1.000 38.096 ? 462 LYS EEE CE  1 ? 
ATOM   1059 N NZ  . LYS A 1 133 ? -3.165  18.388 -0.685  1.000 46.639 ? 462 LYS EEE NZ  1 ? 
ATOM   1060 N N   . PRO A 1 134 ? -7.035  16.925 -7.691  1.000 20.298 ? 463 PRO EEE N   1 ? 
ATOM   1061 C CA  . PRO A 1 134 ? -8.191  16.303 -8.329  1.000 20.452 ? 463 PRO EEE CA  1 ? 
ATOM   1062 C C   . PRO A 1 134 ? -9.319  16.094 -7.312  1.000 20.899 ? 463 PRO EEE C   1 ? 
ATOM   1063 O O   . PRO A 1 134 ? -9.075  15.643 -6.194  1.000 22.483 ? 463 PRO EEE O   1 ? 
ATOM   1064 C CB  . PRO A 1 134 ? -7.674  14.980 -8.894  1.000 22.727 ? 463 PRO EEE CB  1 ? 
ATOM   1065 C CG  . PRO A 1 134 ? -6.186  15.200 -9.021  1.000 25.074 ? 463 PRO EEE CG  1 ? 
ATOM   1066 C CD  . PRO A 1 134 ? -5.800  16.153 -7.908  1.000 22.785 ? 463 PRO EEE CD  1 ? 
ATOM   1067 N N   . PHE A 1 135 ? -10.531 16.477 -7.731  1.000 19.388 ? 464 PHE EEE N   1 ? 
ATOM   1068 C CA  . PHE A 1 135 ? -11.797 16.359 -6.962  1.000 19.232 ? 464 PHE EEE CA  1 ? 
ATOM   1069 C C   . PHE A 1 135 ? -11.766 17.208 -5.679  1.000 18.252 ? 464 PHE EEE C   1 ? 
ATOM   1070 O O   . PHE A 1 135 ? -12.597 17.012 -4.774  1.000 20.942 ? 464 PHE EEE O   1 ? 
ATOM   1071 C CB  . PHE A 1 135 ? -12.123 14.899 -6.648  1.000 20.131 ? 464 PHE EEE CB  1 ? 
ATOM   1072 C CG  . PHE A 1 135 ? -12.349 14.039 -7.863  1.000 21.060 ? 464 PHE EEE CG  1 ? 
ATOM   1073 C CD1 . PHE A 1 135 ? -13.339 14.362 -8.779  1.000 21.641 ? 464 PHE EEE CD1 1 ? 
ATOM   1074 C CD2 . PHE A 1 135 ? -11.592 12.891 -8.077  1.000 22.491 ? 464 PHE EEE CD2 1 ? 
ATOM   1075 C CE1 . PHE A 1 135 ? -13.543 13.573 -9.897  1.000 22.586 ? 464 PHE EEE CE1 1 ? 
ATOM   1076 C CE2 . PHE A 1 135 ? -11.814 12.091 -9.183  1.000 23.709 ? 464 PHE EEE CE2 1 ? 
ATOM   1077 C CZ  . PHE A 1 135 ? -12.789 12.435 -10.092 1.000 23.766 ? 464 PHE EEE CZ  1 ? 
ATOM   1078 N N   . GLU A 1 136 ? -10.862 18.181 -5.598  1.000 19.119 ? 465 GLU EEE N   1 ? 
ATOM   1079 C CA  . GLU A 1 136 ? -10.883 19.200 -4.521  1.000 19.724 ? 465 GLU EEE CA  1 ? 
ATOM   1080 C C   . GLU A 1 136 ? -11.989 20.221 -4.813  1.000 17.586 ? 465 GLU EEE C   1 ? 
ATOM   1081 O O   . GLU A 1 136 ? -12.205 20.578 -5.973  1.000 17.978 ? 465 GLU EEE O   1 ? 
ATOM   1082 C CB  . GLU A 1 136 ? -9.524  19.890 -4.409  1.000 21.126 ? 465 GLU EEE CB  1 ? 
ATOM   1083 C CG  . GLU A 1 136 ? -9.407  20.803 -3.196  1.000 21.829 ? 465 GLU EEE CG  1 ? 
ATOM   1084 C CD  . GLU A 1 136 ? -8.035  21.397 -2.911  1.000 23.698 ? 465 GLU EEE CD  1 ? 
ATOM   1085 O OE1 . GLU A 1 136 ? -7.135  21.236 -3.743  1.000 23.095 ? 465 GLU EEE OE1 1 ? 
ATOM   1086 O OE2 . GLU A 1 136 ? -7.888  22.050 -1.850  1.000 28.328 ? 465 GLU EEE OE2 1 ? 
ATOM   1087 N N   . ARG A 1 137 ? -12.664 20.676 -3.763  1.000 18.397 ? 466 ARG EEE N   1 ? 
ATOM   1088 C CA  . ARG A 1 137 ? -13.645 21.785 -3.840  1.000 18.314 ? 466 ARG EEE CA  1 ? 
ATOM   1089 C C   . ARG A 1 137 ? -13.142 22.893 -2.924  1.000 17.836 ? 466 ARG EEE C   1 ? 
ATOM   1090 O O   . ARG A 1 137 ? -12.763 22.609 -1.770  1.000 23.011 ? 466 ARG EEE O   1 ? 
ATOM   1091 C CB  . ARG A 1 137 ? -15.058 21.335 -3.462  1.000 19.468 ? 466 ARG EEE CB  1 ? 
ATOM   1092 C CG  . ARG A 1 137 ? -16.085 22.421 -3.727  1.000 21.169 ? 466 ARG EEE CG  1 ? 
ATOM   1093 C CD  . ARG A 1 137 ? -17.435 22.147 -3.115  1.000 24.803 ? 466 ARG EEE CD  1 ? 
ATOM   1094 N NE  . ARG A 1 137 ? -17.982 20.934 -3.639  1.000 25.278 ? 466 ARG EEE NE  1 ? 
ATOM   1095 C CZ  . ARG A 1 137 ? -18.092 19.767 -3.002  1.000 28.160 ? 466 ARG EEE CZ  1 ? 
ATOM   1096 N NH1 . ARG A 1 137 ? -17.664 19.623 -1.757  1.000 30.269 ? 466 ARG EEE NH1 1 ? 
ATOM   1097 N NH2 . ARG A 1 137 ? -18.633 18.734 -3.636  1.000 29.541 ? 466 ARG EEE NH2 1 ? 
ATOM   1098 N N   . ASP A 1 138 ? -13.054 24.099 -3.451  1.000 16.213 ? 467 ASP EEE N   1 ? 
ATOM   1099 C CA  . ASP A 1 138 ? -12.665 25.297 -2.671  1.000 16.960 ? 467 ASP EEE CA  1 ? 
ATOM   1100 C C   . ASP A 1 138 ? -13.840 26.267 -2.704  1.000 16.586 ? 467 ASP EEE C   1 ? 
ATOM   1101 O O   . ASP A 1 138 ? -14.158 26.759 -3.784  1.000 15.955 ? 467 ASP EEE O   1 ? 
ATOM   1102 C CB  . ASP A 1 138 ? -11.382 25.897 -3.244  1.000 18.641 ? 467 ASP EEE CB  1 ? 
ATOM   1103 C CG  . ASP A 1 138 ? -10.854 27.068 -2.437  1.000 19.273 ? 467 ASP EEE CG  1 ? 
ATOM   1104 O OD1 . ASP A 1 138 ? -11.530 27.472 -1.473  1.000 19.737 ? 467 ASP EEE OD1 1 ? 
ATOM   1105 O OD2 . ASP A 1 138 ? -9.764  27.570 -2.786  1.000 20.434 ? 467 ASP EEE OD2 1 ? 
ATOM   1106 N N   . ILE A 1 139 ? -14.476 26.496 -1.558  1.000 16.338 ? 468 ILE EEE N   1 ? 
ATOM   1107 C CA  . ILE A 1 139 ? -15.565 27.502 -1.442  1.000 14.934 ? 468 ILE EEE CA  1 ? 
ATOM   1108 C C   . ILE A 1 139 ? -15.107 28.696 -0.602  1.000 16.633 ? 468 ILE EEE C   1 ? 
ATOM   1109 O O   . ILE A 1 139 ? -15.959 29.498 -0.199  1.000 16.548 ? 468 ILE EEE O   1 ? 
ATOM   1110 C CB  . ILE A 1 139 ? -16.880 26.870 -0.926  1.000 16.196 ? 468 ILE EEE CB  1 ? 
ATOM   1111 C CG1 . ILE A 1 139 ? -16.767 26.296 0.489   1.000 18.562 ? 468 ILE EEE CG1 1 ? 
ATOM   1112 C CG2 . ILE A 1 139 ? -17.392 25.825 -1.909  1.000 18.311 ? 468 ILE EEE CG2 1 ? 
ATOM   1113 C CD1 . ILE A 1 139 ? -18.073 25.788 1.056   1.000 19.554 ? 468 ILE EEE CD1 1 ? 
ATOM   1114 N N   . SER A 1 140 ? -13.803 28.833 -0.348  1.000 17.395 ? 469 SER EEE N   1 ? 
ATOM   1115 C CA  . SER A 1 140 ? -13.260 29.972 0.429   1.000 17.250 ? 469 SER EEE CA  1 ? 
ATOM   1116 C C   . SER A 1 140 ? -13.324 31.273 -0.384  1.000 15.496 ? 469 SER EEE C   1 ? 
ATOM   1117 O O   . SER A 1 140 ? -13.425 31.240 -1.630  1.000 16.730 ? 469 SER EEE O   1 ? 
ATOM   1118 C CB  . SER A 1 140 ? -11.852 29.714 0.931   1.000 19.137 ? 469 SER EEE CB  1 ? 
ATOM   1119 O OG  . SER A 1 140 ? -10.955 29.647 -0.159  1.000 19.900 ? 469 SER EEE OG  1 ? 
ATOM   1120 N N   . THR A 1 141 ? -13.208 32.401 0.311   1.000 15.429 ? 470 THR EEE N   1 ? 
ATOM   1121 C CA  . THR A 1 141 ? -13.314 33.747 -0.297  1.000 17.397 ? 470 THR EEE CA  1 ? 
ATOM   1122 C C   . THR A 1 141 ? -12.270 34.674 0.324   1.000 17.396 ? 470 THR EEE C   1 ? 
ATOM   1123 O O   . THR A 1 141 ? -12.576 35.830 0.556   1.000 19.917 ? 470 THR EEE O   1 ? 
ATOM   1124 C CB  . THR A 1 141 ? -14.750 34.268 -0.153  1.000 19.419 ? 470 THR EEE CB  1 ? 
ATOM   1125 O OG1 . THR A 1 141 ? -15.104 34.181 1.226   1.000 21.946 ? 470 THR EEE OG1 1 ? 
ATOM   1126 C CG2 . THR A 1 141 ? -15.731 33.511 -1.023  1.000 20.979 ? 470 THR EEE CG2 1 ? 
ATOM   1127 N N   . GLU A 1 142 ? -11.055 34.177 0.534   1.000 18.098 ? 471 GLU EEE N   1 ? 
ATOM   1128 C CA  . GLU A 1 142 ? -9.907  35.007 0.961   1.000 19.077 ? 471 GLU EEE CA  1 ? 
ATOM   1129 C C   . GLU A 1 142 ? -9.600  36.020 -0.143  1.000 15.892 ? 471 GLU EEE C   1 ? 
ATOM   1130 O O   . GLU A 1 142 ? -9.599  35.651 -1.326  1.000 16.936 ? 471 GLU EEE O   1 ? 
ATOM   1131 C CB  . GLU A 1 142 ? -8.711  34.093 1.261   1.000 22.877 ? 471 GLU EEE CB  1 ? 
ATOM   1132 C CG  . GLU A 1 142 ? -7.371  34.765 1.462   1.000 29.618 ? 471 GLU EEE CG  1 ? 
ATOM   1133 C CD  . GLU A 1 142 ? -6.277  33.772 1.839   1.000 34.505 ? 471 GLU EEE CD  1 ? 
ATOM   1134 O OE1 . GLU A 1 142 ? -6.279  33.356 3.001   1.000 42.051 ? 471 GLU EEE OE1 1 ? 
ATOM   1135 O OE2 . GLU A 1 142 ? -5.448  33.370 0.956   1.000 34.573 ? 471 GLU EEE OE2 1 ? 
ATOM   1136 N N   . ILE A 1 143 ? -9.334  37.260 0.228   1.000 16.638 ? 472 ILE EEE N   1 ? 
ATOM   1137 C CA  . ILE A 1 143 ? -8.879  38.287 -0.747  1.000 16.377 ? 472 ILE EEE CA  1 ? 
ATOM   1138 C C   . ILE A 1 143 ? -7.516  37.855 -1.292  1.000 15.804 ? 472 ILE EEE C   1 ? 
ATOM   1139 O O   . ILE A 1 143 ? -6.618  37.497 -0.511  1.000 20.375 ? 472 ILE EEE O   1 ? 
ATOM   1140 C CB  . ILE A 1 143 ? -8.872  39.698 -0.132  1.000 16.727 ? 472 ILE EEE CB  1 ? 
ATOM   1141 C CG1 . ILE A 1 143 ? -10.264 40.094 0.381   1.000 17.059 ? 472 ILE EEE CG1 1 ? 
ATOM   1142 C CG2 . ILE A 1 143 ? -8.331  40.705 -1.133  1.000 19.124 ? 472 ILE EEE CG2 1 ? 
ATOM   1143 C CD1 . ILE A 1 143 ? -11.368 39.909 -0.630  1.000 17.346 ? 472 ILE EEE CD1 1 ? 
ATOM   1144 N N   . TYR A 1 144 ? -7.405  37.852 -2.609  1.000 15.556 ? 473 TYR EEE N   1 ? 
ATOM   1145 C CA  . TYR A 1 144 ? -6.232  37.356 -3.354  1.000 15.624 ? 473 TYR EEE CA  1 ? 
ATOM   1146 C C   . TYR A 1 144 ? -5.285  38.510 -3.613  1.000 16.272 ? 473 TYR EEE C   1 ? 
ATOM   1147 O O   . TYR A 1 144 ? -5.656  39.506 -4.228  1.000 17.053 ? 473 TYR EEE O   1 ? 
ATOM   1148 C CB  . TYR A 1 144 ? -6.666  36.732 -4.676  1.000 16.640 ? 473 TYR EEE CB  1 ? 
ATOM   1149 C CG  . TYR A 1 144 ? -5.519  36.285 -5.551  1.000 16.251 ? 473 TYR EEE CG  1 ? 
ATOM   1150 C CD1 . TYR A 1 144 ? -4.961  35.027 -5.392  1.000 17.157 ? 473 TYR EEE CD1 1 ? 
ATOM   1151 C CD2 . TYR A 1 144 ? -5.031  37.090 -6.569  1.000 17.052 ? 473 TYR EEE CD2 1 ? 
ATOM   1152 C CE1 . TYR A 1 144 ? -3.945  34.584 -6.214  1.000 17.185 ? 473 TYR EEE CE1 1 ? 
ATOM   1153 C CE2 . TYR A 1 144 ? -4.015  36.655 -7.412  1.000 17.383 ? 473 TYR EEE CE2 1 ? 
ATOM   1154 C CZ  . TYR A 1 144 ? -3.478  35.393 -7.227  1.000 17.746 ? 473 TYR EEE CZ  1 ? 
ATOM   1155 O OH  . TYR A 1 144 ? -2.480  34.900 -8.022  1.000 21.796 ? 473 TYR EEE OH  1 ? 
ATOM   1156 N N   . GLN A 1 145 ? -4.036  38.330 -3.191  1.000 17.219 ? 474 GLN EEE N   1 ? 
ATOM   1157 C CA  . GLN A 1 145 ? -3.007  39.369 -3.391  1.000 19.002 ? 474 GLN EEE CA  1 ? 
ATOM   1158 C C   . GLN A 1 145 ? -2.349  39.213 -4.761  1.000 19.669 ? 474 GLN EEE C   1 ? 
ATOM   1159 O O   . GLN A 1 145 ? -1.620  38.220 -4.983  1.000 20.535 ? 474 GLN EEE O   1 ? 
ATOM   1160 C CB  . GLN A 1 145 ? -1.959  39.276 -2.298  1.000 19.975 ? 474 GLN EEE CB  1 ? 
ATOM   1161 C CG  . GLN A 1 145 ? -0.958  40.422 -2.388  1.000 22.716 ? 474 GLN EEE CG  1 ? 
ATOM   1162 C CD  . GLN A 1 145 ? 0.233   40.171 -1.516  1.000 25.175 ? 474 GLN EEE CD  1 ? 
ATOM   1163 O OE1 . GLN A 1 145 ? 0.106   39.648 -0.415  1.000 27.469 ? 474 GLN EEE OE1 1 ? 
ATOM   1164 N NE2 . GLN A 1 145 ? 1.396   40.557 -2.018  1.000 28.672 ? 474 GLN EEE NE2 1 ? 
ATOM   1165 N N   . ALA A 1 146 ? -2.616  40.141 -5.674  1.000 19.690 ? 475 ALA EEE N   1 ? 
ATOM   1166 C CA  . ALA A 1 146 ? -2.057  40.084 -7.040  1.000 19.036 ? 475 ALA EEE CA  1 ? 
ATOM   1167 C C   . ALA A 1 146 ? -0.819  40.978 -7.120  1.000 20.173 ? 475 ALA EEE C   1 ? 
ATOM   1168 O O   . ALA A 1 146 ? 0.006   40.758 -7.994  1.000 19.252 ? 475 ALA EEE O   1 ? 
ATOM   1169 C CB  . ALA A 1 146 ? -3.095  40.483 -8.051  1.000 19.646 ? 475 ALA EEE CB  1 ? 
ATOM   1170 N N   . GLY A 1 147 ? -0.732  41.975 -6.250  1.000 22.324 ? 476 GLY EEE N   1 ? 
ATOM   1171 C CA  . GLY A 1 147 ? 0.327   42.976 -6.303  1.000 25.123 ? 476 GLY EEE CA  1 ? 
ATOM   1172 C C   . GLY A 1 147 ? 1.296   42.839 -5.149  1.000 25.157 ? 476 GLY EEE C   1 ? 
ATOM   1173 O O   . GLY A 1 147 ? 1.360   41.792 -4.475  1.000 29.393 ? 476 GLY EEE O   1 ? 
ATOM   1174 N N   . SER A 1 148 ? 2.011   43.911 -4.883  1.000 26.094 ? 477 SER EEE N   1 ? 
ATOM   1175 C CA  . SER A 1 148 ? 3.086   43.918 -3.878  1.000 27.003 ? 477 SER EEE CA  1 ? 
ATOM   1176 C C   . SER A 1 148 ? 2.548   44.239 -2.495  1.000 28.028 ? 477 SER EEE C   1 ? 
ATOM   1177 O O   . SER A 1 148 ? 3.243   43.934 -1.529  1.000 39.783 ? 477 SER EEE O   1 ? 
ATOM   1178 C CB  . SER A 1 148 ? 4.162   44.888 -4.254  1.000 29.737 ? 477 SER EEE CB  1 ? 
ATOM   1179 O OG  . SER A 1 148 ? 3.677   46.227 -4.238  1.000 30.489 ? 477 SER EEE OG  1 ? 
ATOM   1180 N N   . THR A 1 149 ? 1.386   44.884 -2.408  1.000 29.988 ? 478 THR EEE N   1 ? 
ATOM   1181 C CA  . THR A 1 149 ? 0.841   45.365 -1.120  1.000 33.334 ? 478 THR EEE CA  1 ? 
ATOM   1182 C C   . THR A 1 149 ? 0.002   44.253 -0.504  1.000 29.123 ? 478 THR EEE C   1 ? 
ATOM   1183 O O   . THR A 1 149 ? -0.889  43.704 -1.158  1.000 26.250 ? 478 THR EEE O   1 ? 
ATOM   1184 C CB  . THR A 1 149 ? 0.050   46.663 -1.286  1.000 36.745 ? 478 THR EEE CB  1 ? 
ATOM   1185 O OG1 . THR A 1 149 ? 0.856   47.572 -2.040  1.000 43.682 ? 478 THR EEE OG1 1 ? 
ATOM   1186 C CG2 . THR A 1 149 ? -0.294  47.286 0.051   1.000 39.643 ? 478 THR EEE CG2 1 ? 
ATOM   1187 N N   . PRO A 1 150 ? 0.274   43.881 0.767   1.000 31.989 ? 479 PRO EEE N   1 ? 
ATOM   1188 C CA  . PRO A 1 150 ? -0.606  42.973 1.493   1.000 30.687 ? 479 PRO EEE CA  1 ? 
ATOM   1189 C C   . PRO A 1 150 ? -2.038  43.519 1.520   1.000 27.514 ? 479 PRO EEE C   1 ? 
ATOM   1190 O O   . PRO A 1 150 ? -2.248  44.718 1.644   1.000 30.336 ? 479 PRO EEE O   1 ? 
ATOM   1191 C CB  . PRO A 1 150 ? -0.030  42.934 2.910   1.000 34.370 ? 479 PRO EEE CB  1 ? 
ATOM   1192 C CG  . PRO A 1 150 ? 1.429   43.314 2.736   1.000 36.745 ? 479 PRO EEE CG  1 ? 
ATOM   1193 C CD  . PRO A 1 150 ? 1.458   44.265 1.557   1.000 35.032 ? 479 PRO EEE CD  1 ? 
ATOM   1194 N N   . CYS A 1 151 ? -3.002  42.627 1.369   1.000 25.477 ? 480 CYS EEE N   1 ? 
ATOM   1195 C CA  . CYS A 1 151 ? -4.436  43.004 1.298   1.000 24.088 ? 480 CYS EEE CA  1 ? 
ATOM   1196 C C   . CYS A 1 151 ? -5.030  43.139 2.692   1.000 23.181 ? 480 CYS EEE C   1 ? 
ATOM   1197 O O   . CYS A 1 151 ? -5.924  43.980 2.862   1.000 23.399 ? 480 CYS EEE O   1 ? 
ATOM   1198 C CB  . CYS A 1 151 ? -5.175  41.985 0.457   1.000 24.739 ? 480 CYS EEE CB  1 ? 
ATOM   1199 S SG  . CYS A 1 151 ? -4.456  41.927 -1.207  1.000 26.288 ? 480 CYS EEE SG  1 ? 
ATOM   1200 N N   . ASN A 1 152 ? -4.541  42.369 3.661   1.000 25.969 ? 481 ASN EEE N   1 ? 
ATOM   1201 C CA  . ASN A 1 152 ? -5.072  42.426 5.051   1.000 27.817 ? 481 ASN EEE CA  1 ? 
ATOM   1202 C C   . ASN A 1 152 ? -6.594  42.222 5.000   1.000 25.763 ? 481 ASN EEE C   1 ? 
ATOM   1203 O O   . ASN A 1 152 ? -7.307  42.832 5.821   1.000 26.538 ? 481 ASN EEE O   1 ? 
ATOM   1204 C CB  . ASN A 1 152 ? -4.683  43.749 5.717   1.000 30.244 ? 481 ASN EEE CB  1 ? 
ATOM   1205 C CG  . ASN A 1 152 ? -3.182  43.962 5.764   1.000 33.522 ? 481 ASN EEE CG  1 ? 
ATOM   1206 O OD1 . ASN A 1 152 ? -2.430  43.039 6.066   1.000 36.642 ? 481 ASN EEE OD1 1 ? 
ATOM   1207 N ND2 . ASN A 1 152 ? -2.732  45.170 5.465   1.000 36.873 ? 481 ASN EEE ND2 1 ? 
ATOM   1208 N N   . GLY A 1 153 ? -7.072  41.405 4.055   1.000 23.146 ? 482 GLY EEE N   1 ? 
ATOM   1209 C CA  . GLY A 1 153 ? -8.492  41.010 3.973   1.000 23.351 ? 482 GLY EEE CA  1 ? 
ATOM   1210 C C   . GLY A 1 153 ? -9.372  42.052 3.307   1.000 21.025 ? 482 GLY EEE C   1 ? 
ATOM   1211 O O   . GLY A 1 153 ? -10.621 41.890 3.348   1.000 23.760 ? 482 GLY EEE O   1 ? 
ATOM   1212 N N   . VAL A 1 154 ? -8.778  43.081 2.709   1.000 19.032 ? 483 VAL EEE N   1 ? 
ATOM   1213 C CA  . VAL A 1 154 ? -9.512  44.237 2.122   1.000 18.173 ? 483 VAL EEE CA  1 ? 
ATOM   1214 C C   . VAL A 1 154 ? -9.474  44.159 0.597   1.000 16.544 ? 483 VAL EEE C   1 ? 
ATOM   1215 O O   . VAL A 1 154 ? -8.398  44.202 0.001   1.000 17.610 ? 483 VAL EEE O   1 ? 
ATOM   1216 C CB  . VAL A 1 154 ? -8.966  45.595 2.598   1.000 19.155 ? 483 VAL EEE CB  1 ? 
ATOM   1217 C CG1 . VAL A 1 154 ? -9.780  46.752 2.034   1.000 19.436 ? 483 VAL EEE CG1 1 ? 
ATOM   1218 C CG2 . VAL A 1 154 ? -8.913  45.690 4.114   1.000 20.382 ? 483 VAL EEE CG2 1 ? 
ATOM   1219 N N   . GLU A 1 155 ? -10.644 44.052 -0.010  1.000 15.643 ? 484 GLU EEE N   1 ? 
ATOM   1220 C CA  . GLU A 1 155 ? -10.816 44.116 -1.470  1.000 15.839 ? 484 GLU EEE CA  1 ? 
ATOM   1221 C C   . GLU A 1 155 ? -10.458 45.532 -1.925  1.000 15.393 ? 484 GLU EEE C   1 ? 
ATOM   1222 O O   . GLU A 1 155 ? -11.024 46.527 -1.406  1.000 17.274 ? 484 GLU EEE O   1 ? 
ATOM   1223 C CB  . GLU A 1 155 ? -12.247 43.713 -1.814  1.000 17.334 ? 484 GLU EEE CB  1 ? 
ATOM   1224 C CG  . GLU A 1 155 ? -12.514 43.600 -3.296  1.000 18.455 ? 484 GLU EEE CG  1 ? 
ATOM   1225 C CD  . GLU A 1 155 ? -13.915 43.107 -3.623  1.000 18.210 ? 484 GLU EEE CD  1 ? 
ATOM   1226 O OE1 . GLU A 1 155 ? -14.726 42.889 -2.656  1.000 20.706 ? 484 GLU EEE OE1 1 ? 
ATOM   1227 O OE2 . GLU A 1 155 ? -14.191 42.943 -4.827  1.000 17.859 ? 484 GLU EEE OE2 1 ? 
ATOM   1228 N N   . GLY A 1 156 ? -9.551  45.634 -2.887  1.000 16.056 ? 485 GLY EEE N   1 ? 
ATOM   1229 C CA  . GLY A 1 156 ? -9.139  46.947 -3.399  1.000 15.741 ? 485 GLY EEE CA  1 ? 
ATOM   1230 C C   . GLY A 1 156 ? -8.113  46.791 -4.498  1.000 15.598 ? 485 GLY EEE C   1 ? 
ATOM   1231 O O   . GLY A 1 156 ? -8.070  45.752 -5.152  1.000 16.280 ? 485 GLY EEE O   1 ? 
ATOM   1232 N N   . PHE A 1 157 ? -7.299  47.811 -4.697  1.000 17.153 ? 486 PHE EEE N   1 ? 
ATOM   1233 C CA  . PHE A 1 157 ? -6.293  47.816 -5.782  1.000 17.502 ? 486 PHE EEE CA  1 ? 
ATOM   1234 C C   . PHE A 1 157 ? -5.377  46.591 -5.651  1.000 17.005 ? 486 PHE EEE C   1 ? 
ATOM   1235 O O   . PHE A 1 157 ? -4.751  46.409 -4.588  1.000 18.423 ? 486 PHE EEE O   1 ? 
ATOM   1236 C CB  . PHE A 1 157 ? -5.513  49.116 -5.716  1.000 17.961 ? 486 PHE EEE CB  1 ? 
ATOM   1237 C CG  . PHE A 1 157 ? -4.462  49.208 -6.785  1.000 18.633 ? 486 PHE EEE CG  1 ? 
ATOM   1238 C CD1 . PHE A 1 157 ? -4.829  49.406 -8.105  1.000 21.522 ? 486 PHE EEE CD1 1 ? 
ATOM   1239 C CD2 . PHE A 1 157 ? -3.120  49.094 -6.481  1.000 22.244 ? 486 PHE EEE CD2 1 ? 
ATOM   1240 C CE1 . PHE A 1 157 ? -3.877  49.496 -9.103  1.000 21.832 ? 486 PHE EEE CE1 1 ? 
ATOM   1241 C CE2 . PHE A 1 157 ? -2.171  49.196 -7.481  1.000 22.442 ? 486 PHE EEE CE2 1 ? 
ATOM   1242 C CZ  . PHE A 1 157 ? -2.547  49.392 -8.786  1.000 22.563 ? 486 PHE EEE CZ  1 ? 
ATOM   1243 N N   . ASN A 1 158 ? -5.336  45.765 -6.702  1.000 17.662 ? 487 ASN EEE N   1 ? 
ATOM   1244 C CA  . ASN A 1 158 ? -4.532  44.517 -6.795  1.000 18.026 ? 487 ASN EEE CA  1 ? 
ATOM   1245 C C   . ASN A 1 158 ? -4.829  43.558 -5.637  1.000 17.552 ? 487 ASN EEE C   1 ? 
ATOM   1246 O O   . ASN A 1 158 ? -4.029  42.678 -5.355  1.000 18.272 ? 487 ASN EEE O   1 ? 
ATOM   1247 C CB  . ASN A 1 158 ? -3.046  44.840 -6.879  1.000 20.747 ? 487 ASN EEE CB  1 ? 
ATOM   1248 C CG  . ASN A 1 158 ? -2.661  45.485 -8.191  1.000 23.787 ? 487 ASN EEE CG  1 ? 
ATOM   1249 O OD1 . ASN A 1 158 ? -3.411  45.410 -9.175  1.000 26.831 ? 487 ASN EEE OD1 1 ? 
ATOM   1250 N ND2 . ASN A 1 158 ? -1.491  46.104 -8.206  1.000 27.530 ? 487 ASN EEE ND2 1 ? 
ATOM   1251 N N   . CYS A 1 159 ? -6.017  43.645 -5.051  1.000 16.185 ? 488 CYS EEE N   1 ? 
ATOM   1252 C CA  . CYS A 1 159 ? -6.455  42.800 -3.916  1.000 17.041 ? 488 CYS EEE CA  1 ? 
ATOM   1253 C C   . CYS A 1 159 ? -7.864  42.306 -4.229  1.000 15.796 ? 488 CYS EEE C   1 ? 
ATOM   1254 O O   . CYS A 1 159 ? -8.826  43.073 -4.052  1.000 16.241 ? 488 CYS EEE O   1 ? 
ATOM   1255 C CB  . CYS A 1 159 ? -6.406  43.594 -2.622  1.000 16.271 ? 488 CYS EEE CB  1 ? 
ATOM   1256 S SG  . CYS A 1 159 ? -4.722  43.856 -2.039  1.000 19.504 ? 488 CYS EEE SG  1 ? 
ATOM   1257 N N   . TYR A 1 160 ? -7.949  41.118 -4.793  1.000 14.737 ? 489 TYR EEE N   1 ? 
ATOM   1258 C CA  . TYR A 1 160 ? -9.150  40.674 -5.532  1.000 15.492 ? 489 TYR EEE CA  1 ? 
ATOM   1259 C C   . TYR A 1 160 ? -10.001 39.709 -4.725  1.000 15.701 ? 489 TYR EEE C   1 ? 
ATOM   1260 O O   . TYR A 1 160 ? -9.536  38.719 -4.173  1.000 15.951 ? 489 TYR EEE O   1 ? 
ATOM   1261 C CB  . TYR A 1 160 ? -8.749  39.986 -6.822  1.000 17.590 ? 489 TYR EEE CB  1 ? 
ATOM   1262 C CG  . TYR A 1 160 ? -7.934  40.845 -7.738  1.000 20.235 ? 489 TYR EEE CG  1 ? 
ATOM   1263 C CD1 . TYR A 1 160 ? -8.207  42.192 -7.913  1.000 26.154 ? 489 TYR EEE CD1 1 ? 
ATOM   1264 C CD2 . TYR A 1 160 ? -6.940  40.274 -8.491  1.000 21.073 ? 489 TYR EEE CD2 1 ? 
ATOM   1265 C CE1 . TYR A 1 160 ? -7.460  42.962 -8.780  1.000 29.421 ? 489 TYR EEE CE1 1 ? 
ATOM   1266 C CE2 . TYR A 1 160 ? -6.178  41.031 -9.354  1.000 24.272 ? 489 TYR EEE CE2 1 ? 
ATOM   1267 C CZ  . TYR A 1 160 ? -6.444  42.374 -9.503  1.000 26.703 ? 489 TYR EEE CZ  1 ? 
ATOM   1268 O OH  . TYR A 1 160 ? -5.716  43.108 -10.388 1.000 38.296 ? 489 TYR EEE OH  1 ? 
ATOM   1269 N N   . PHE A 1 161 ? -11.305 39.971 -4.727  1.000 15.579 ? 490 PHE EEE N   1 ? 
ATOM   1270 C CA  . PHE A 1 161 ? -12.239 38.902 -4.356  1.000 15.184 ? 490 PHE EEE CA  1 ? 
ATOM   1271 C C   . PHE A 1 161 ? -12.072 37.800 -5.395  1.000 13.385 ? 490 PHE EEE C   1 ? 
ATOM   1272 O O   . PHE A 1 161 ? -12.059 38.073 -6.598  1.000 15.733 ? 490 PHE EEE O   1 ? 
ATOM   1273 C CB  . PHE A 1 161 ? -13.663 39.450 -4.344  1.000 15.488 ? 490 PHE EEE CB  1 ? 
ATOM   1274 C CG  . PHE A 1 161 ? -14.675 38.546 -3.689  1.000 16.365 ? 490 PHE EEE CG  1 ? 
ATOM   1275 C CD1 . PHE A 1 161 ? -14.791 38.503 -2.310  1.000 16.494 ? 490 PHE EEE CD1 1 ? 
ATOM   1276 C CD2 . PHE A 1 161 ? -15.505 37.737 -4.453  1.000 16.576 ? 490 PHE EEE CD2 1 ? 
ATOM   1277 C CE1 . PHE A 1 161 ? -15.718 37.676 -1.701  1.000 18.921 ? 490 PHE EEE CE1 1 ? 
ATOM   1278 C CE2 . PHE A 1 161 ? -16.434 36.905 -3.840  1.000 17.457 ? 490 PHE EEE CE2 1 ? 
ATOM   1279 C CZ  . PHE A 1 161 ? -16.525 36.873 -2.467  1.000 18.234 ? 490 PHE EEE CZ  1 ? 
ATOM   1280 N N   . PRO A 1 162 ? -11.958 36.527 -4.981  1.000 14.454 ? 491 PRO EEE N   1 ? 
ATOM   1281 C CA  . PRO A 1 162 ? -11.512 35.509 -5.928  1.000 14.741 ? 491 PRO EEE CA  1 ? 
ATOM   1282 C C   . PRO A 1 162 ? -12.588 34.942 -6.855  1.000 14.485 ? 491 PRO EEE C   1 ? 
ATOM   1283 O O   . PRO A 1 162 ? -12.232 34.256 -7.808  1.000 14.866 ? 491 PRO EEE O   1 ? 
ATOM   1284 C CB  . PRO A 1 162 ? -10.920 34.431 -5.021  1.000 14.447 ? 491 PRO EEE CB  1 ? 
ATOM   1285 C CG  . PRO A 1 162 ? -11.695 34.568 -3.731  1.000 14.417 ? 491 PRO EEE CG  1 ? 
ATOM   1286 C CD  . PRO A 1 162 ? -11.953 36.057 -3.590  1.000 14.996 ? 491 PRO EEE CD  1 ? 
ATOM   1287 N N   . LEU A 1 163 ? -13.870 35.234 -6.567  1.000 14.136 ? 492 LEU EEE N   1 ? 
ATOM   1288 C CA  . LEU A 1 163 ? -14.990 34.712 -7.377  1.000 14.533 ? 492 LEU EEE CA  1 ? 
ATOM   1289 C C   . LEU A 1 163 ? -15.558 35.834 -8.247  1.000 13.552 ? 492 LEU EEE C   1 ? 
ATOM   1290 O O   . LEU A 1 163 ? -15.637 36.995 -7.792  1.000 15.321 ? 492 LEU EEE O   1 ? 
ATOM   1291 C CB  . LEU A 1 163 ? -16.111 34.153 -6.500  1.000 15.065 ? 492 LEU EEE CB  1 ? 
ATOM   1292 C CG  . LEU A 1 163 ? -15.715 33.148 -5.431  1.000 15.325 ? 492 LEU EEE CG  1 ? 
ATOM   1293 C CD1 . LEU A 1 163 ? -16.919 32.714 -4.621  1.000 16.322 ? 492 LEU EEE CD1 1 ? 
ATOM   1294 C CD2 . LEU A 1 163 ? -15.013 31.941 -6.012  1.000 16.827 ? 492 LEU EEE CD2 1 ? 
ATOM   1295 N N   . GLN A 1 164 ? -15.983 35.460 -9.449  1.000 13.895 ? 493 GLN EEE N   1 ? 
ATOM   1296 C CA  . GLN A 1 164 ? -16.621 36.406 -10.385 1.000 14.208 ? 493 GLN EEE CA  1 ? 
ATOM   1297 C C   . GLN A 1 164 ? -17.862 35.759 -11.007 1.000 13.829 ? 493 GLN EEE C   1 ? 
ATOM   1298 O O   . GLN A 1 164 ? -17.942 34.537 -11.079 1.000 13.910 ? 493 GLN EEE O   1 ? 
ATOM   1299 C CB  . GLN A 1 164 ? -15.643 36.836 -11.469 1.000 15.216 ? 493 GLN EEE CB  1 ? 
ATOM   1300 C CG  . GLN A 1 164 ? -14.381 37.449 -10.893 1.000 16.272 ? 493 GLN EEE CG  1 ? 
ATOM   1301 C CD  . GLN A 1 164 ? -13.812 38.538 -11.770 1.000 16.708 ? 493 GLN EEE CD  1 ? 
ATOM   1302 O OE1 . GLN A 1 164 ? -14.092 38.636 -12.983 1.000 19.461 ? 493 GLN EEE OE1 1 ? 
ATOM   1303 N NE2 . GLN A 1 164 ? -12.971 39.360 -11.161 1.000 16.306 ? 493 GLN EEE NE2 1 ? 
ATOM   1304 N N   . SER A 1 165 ? -18.782 36.593 -11.479 1.000 13.914 ? 494 SER EEE N   1 ? 
ATOM   1305 C CA  . SER A 1 165 ? -20.003 36.132 -12.168 1.000 14.194 ? 494 SER EEE CA  1 ? 
ATOM   1306 C C   . SER A 1 165 ? -19.760 35.962 -13.670 1.000 13.540 ? 494 SER EEE C   1 ? 
ATOM   1307 O O   . SER A 1 165 ? -19.183 36.874 -14.318 1.000 15.289 ? 494 SER EEE O   1 ? 
ATOM   1308 C CB  . SER A 1 165 ? -21.073 37.110 -11.919 1.000 15.030 ? 494 SER EEE CB  1 ? 
ATOM   1309 O OG  . SER A 1 165 ? -22.242 36.694 -12.606 1.000 15.459 ? 494 SER EEE OG  1 ? 
ATOM   1310 N N   . TYR A 1 166 ? -20.264 34.872 -14.236 1.000 13.395 ? 495 TYR EEE N   1 ? 
ATOM   1311 C CA  . TYR A 1 166 ? -20.326 34.719 -15.699 1.000 14.661 ? 495 TYR EEE CA  1 ? 
ATOM   1312 C C   . TYR A 1 166 ? -21.186 35.808 -16.354 1.000 16.146 ? 495 TYR EEE C   1 ? 
ATOM   1313 O O   . TYR A 1 166 ? -20.904 36.162 -17.493 1.000 16.414 ? 495 TYR EEE O   1 ? 
ATOM   1314 C CB  . TYR A 1 166 ? -20.866 33.340 -16.057 1.000 14.499 ? 495 TYR EEE CB  1 ? 
ATOM   1315 C CG  . TYR A 1 166 ? -19.878 32.215 -15.922 1.000 14.164 ? 495 TYR EEE CG  1 ? 
ATOM   1316 C CD1 . TYR A 1 166 ? -18.834 32.094 -16.825 1.000 14.997 ? 495 TYR EEE CD1 1 ? 
ATOM   1317 C CD2 . TYR A 1 166 ? -20.004 31.244 -14.949 1.000 15.033 ? 495 TYR EEE CD2 1 ? 
ATOM   1318 C CE1 . TYR A 1 166 ? -17.946 31.029 -16.758 1.000 15.219 ? 495 TYR EEE CE1 1 ? 
ATOM   1319 C CE2 . TYR A 1 166 ? -19.138 30.161 -14.872 1.000 15.233 ? 495 TYR EEE CE2 1 ? 
ATOM   1320 C CZ  . TYR A 1 166 ? -18.110 30.044 -15.797 1.000 14.287 ? 495 TYR EEE CZ  1 ? 
ATOM   1321 O OH  . TYR A 1 166 ? -17.258 28.972 -15.695 1.000 15.992 ? 495 TYR EEE OH  1 ? 
ATOM   1322 N N   . GLY A 1 167 ? -22.270 36.271 -15.706 1.000 16.113 ? 496 GLY EEE N   1 ? 
ATOM   1323 C CA  . GLY A 1 167 ? -23.177 37.254 -16.334 1.000 16.830 ? 496 GLY EEE CA  1 ? 
ATOM   1324 C C   . GLY A 1 167 ? -23.633 36.798 -17.721 1.000 16.761 ? 496 GLY EEE C   1 ? 
ATOM   1325 O O   . GLY A 1 167 ? -23.540 37.574 -18.666 1.000 17.201 ? 496 GLY EEE O   1 ? 
ATOM   1326 N N   . PHE A 1 168 ? -24.106 35.558 -17.848 1.000 16.482 ? 497 PHE EEE N   1 ? 
ATOM   1327 C CA  . PHE A 1 168 ? -24.493 34.967 -19.152 1.000 16.255 ? 497 PHE EEE CA  1 ? 
ATOM   1328 C C   . PHE A 1 168 ? -25.516 35.859 -19.858 1.000 17.213 ? 497 PHE EEE C   1 ? 
ATOM   1329 O O   . PHE A 1 168 ? -26.507 36.226 -19.239 1.000 19.755 ? 497 PHE EEE O   1 ? 
ATOM   1330 C CB  . PHE A 1 168 ? -25.082 33.576 -18.984 1.000 15.867 ? 497 PHE EEE CB  1 ? 
ATOM   1331 C CG  . PHE A 1 168 ? -24.092 32.545 -18.519 1.000 14.754 ? 497 PHE EEE CG  1 ? 
ATOM   1332 C CD1 . PHE A 1 168 ? -23.071 32.158 -19.371 1.000 14.699 ? 497 PHE EEE CD1 1 ? 
ATOM   1333 C CD2 . PHE A 1 168 ? -24.196 31.951 -17.274 1.000 14.320 ? 497 PHE EEE CD2 1 ? 
ATOM   1334 C CE1 . PHE A 1 168 ? -22.175 31.180 -18.973 1.000 14.251 ? 497 PHE EEE CE1 1 ? 
ATOM   1335 C CE2 . PHE A 1 168 ? -23.292 30.980 -16.869 1.000 14.698 ? 497 PHE EEE CE2 1 ? 
ATOM   1336 C CZ  . PHE A 1 168 ? -22.276 30.599 -17.723 1.000 14.874 ? 497 PHE EEE CZ  1 ? 
ATOM   1337 N N   . GLN A 1 169 ? -25.242 36.202 -21.115 1.000 17.568 ? 498 GLN EEE N   1 ? 
ATOM   1338 C CA  . GLN A 1 169 ? -26.121 37.048 -21.955 1.000 19.865 ? 498 GLN EEE CA  1 ? 
ATOM   1339 C C   . GLN A 1 169 ? -26.611 36.193 -23.107 1.000 20.272 ? 498 GLN EEE C   1 ? 
ATOM   1340 O O   . GLN A 1 169 ? -25.834 35.560 -23.802 1.000 21.045 ? 498 GLN EEE O   1 ? 
ATOM   1341 C CB  . GLN A 1 169 ? -25.397 38.290 -22.466 1.000 19.529 ? 498 GLN EEE CB  1 ? 
ATOM   1342 C CG  . GLN A 1 169 ? -25.110 39.324 -21.386 1.000 19.604 ? 498 GLN EEE CG  1 ? 
ATOM   1343 C CD  . GLN A 1 169 ? -26.355 39.992 -20.854 1.000 20.854 ? 498 GLN EEE CD  1 ? 
ATOM   1344 O OE1 . GLN A 1 169 ? -27.470 39.725 -21.318 1.000 22.751 ? 498 GLN EEE OE1 1 ? 
ATOM   1345 N NE2 . GLN A 1 169 ? -26.185 40.848 -19.857 1.000 21.494 ? 498 GLN EEE NE2 1 ? 
ATOM   1346 N N   . PRO A 1 170 ? -27.934 36.158 -23.342 1.000 22.113 ? 499 PRO EEE N   1 ? 
ATOM   1347 C CA  . PRO A 1 170 ? -28.514 35.138 -24.215 1.000 24.961 ? 499 PRO EEE CA  1 ? 
ATOM   1348 C C   . PRO A 1 170 ? -28.084 35.217 -25.688 1.000 25.996 ? 499 PRO EEE C   1 ? 
ATOM   1349 O O   . PRO A 1 170 ? -28.116 34.167 -26.356 1.000 29.006 ? 499 PRO EEE O   1 ? 
ATOM   1350 C CB  . PRO A 1 170 ? -30.023 35.366 -24.028 1.000 27.036 ? 499 PRO EEE CB  1 ? 
ATOM   1351 C CG  . PRO A 1 170 ? -30.166 36.771 -23.495 1.000 25.164 ? 499 PRO EEE CG  1 ? 
ATOM   1352 C CD  . PRO A 1 170 ? -28.921 37.024 -22.686 1.000 22.700 ? 499 PRO EEE CD  1 ? 
ATOM   1353 N N   . THR A 1 171 ? -27.710 36.403 -26.182 1.000 25.931 ? 500 THR EEE N   1 ? 
ATOM   1354 C CA  . THR A 1 171 ? -27.375 36.616 -27.616 1.000 27.443 ? 500 THR EEE CA  1 ? 
ATOM   1355 C C   . THR A 1 171 ? -25.897 36.331 -27.883 1.000 25.437 ? 500 THR EEE C   1 ? 
ATOM   1356 O O   . THR A 1 171 ? -25.511 36.389 -29.053 1.000 26.809 ? 500 THR EEE O   1 ? 
ATOM   1357 C CB  . THR A 1 171 ? -27.712 38.033 -28.091 1.000 30.584 ? 500 THR EEE CB  1 ? 
ATOM   1358 O OG1 . THR A 1 171 ? -26.892 38.966 -27.388 1.000 32.177 ? 500 THR EEE OG1 1 ? 
ATOM   1359 C CG2 . THR A 1 171 ? -29.172 38.383 -27.904 1.000 31.889 ? 500 THR EEE CG2 1 ? 
ATOM   1360 N N   . ASN A 1 172 ? -25.082 36.084 -26.853 1.000 23.354 ? 501 ASN EEE N   1 ? 
ATOM   1361 C CA  . ASN A 1 172 ? -23.677 35.674 -27.089 1.000 23.275 ? 501 ASN EEE CA  1 ? 
ATOM   1362 C C   . ASN A 1 172 ? -23.650 34.335 -27.825 1.000 21.052 ? 501 ASN EEE C   1 ? 
ATOM   1363 O O   . ASN A 1 172 ? -24.564 33.521 -27.642 1.000 22.900 ? 501 ASN EEE O   1 ? 
ATOM   1364 C CB  . ASN A 1 172 ? -22.882 35.591 -25.790 1.000 22.075 ? 501 ASN EEE CB  1 ? 
ATOM   1365 C CG  . ASN A 1 172 ? -22.543 36.946 -25.199 1.000 22.814 ? 501 ASN EEE CG  1 ? 
ATOM   1366 O OD1 . ASN A 1 172 ? -22.591 37.961 -25.894 1.000 27.054 ? 501 ASN EEE OD1 1 ? 
ATOM   1367 N ND2 . ASN A 1 172 ? -22.187 36.966 -23.922 1.000 22.754 ? 501 ASN EEE ND2 1 ? 
ATOM   1368 N N   . GLY A 1 173 ? -22.587 34.101 -28.595 1.000 20.292 ? 502 GLY EEE N   1 ? 
ATOM   1369 C CA  . GLY A 1 173 ? -22.362 32.848 -29.323 1.000 20.941 ? 502 GLY EEE CA  1 ? 
ATOM   1370 C C   . GLY A 1 173 ? -22.102 31.656 -28.414 1.000 18.538 ? 502 GLY EEE C   1 ? 
ATOM   1371 O O   . GLY A 1 173 ? -21.877 31.816 -27.204 1.000 18.979 ? 502 GLY EEE O   1 ? 
ATOM   1372 N N   . VAL A 1 174 ? -22.124 30.474 -28.999 1.000 19.172 ? 503 VAL EEE N   1 ? 
ATOM   1373 C CA  . VAL A 1 174 ? -22.181 29.180 -28.265 1.000 19.507 ? 503 VAL EEE CA  1 ? 
ATOM   1374 C C   . VAL A 1 174 ? -21.014 29.045 -27.270 1.000 18.938 ? 503 VAL EEE C   1 ? 
ATOM   1375 O O   . VAL A 1 174 ? -21.237 28.514 -26.176 1.000 19.622 ? 503 VAL EEE O   1 ? 
ATOM   1376 C CB  . VAL A 1 174 ? -22.266 28.021 -29.269 1.000 22.797 ? 503 VAL EEE CB  1 ? 
ATOM   1377 C CG1 . VAL A 1 174 ? -21.027 27.901 -30.131 1.000 22.223 ? 503 VAL EEE CG1 1 ? 
ATOM   1378 C CG2 . VAL A 1 174 ? -22.607 26.709 -28.589 1.000 28.430 ? 503 VAL EEE CG2 1 ? 
ATOM   1379 N N   . GLY A 1 175 ? -19.810 29.508 -27.601 1.000 17.410 ? 504 GLY EEE N   1 ? 
ATOM   1380 C CA  . GLY A 1 175 ? -18.675 29.370 -26.667 1.000 17.965 ? 504 GLY EEE CA  1 ? 
ATOM   1381 C C   . GLY A 1 175 ? -18.900 30.109 -25.359 1.000 17.229 ? 504 GLY EEE C   1 ? 
ATOM   1382 O O   . GLY A 1 175 ? -18.308 29.718 -24.336 1.000 19.177 ? 504 GLY EEE O   1 ? 
ATOM   1383 N N   . TYR A 1 176 ? -19.711 31.170 -25.371 1.000 16.848 ? 505 TYR EEE N   1 ? 
ATOM   1384 C CA  . TYR A 1 176 ? -20.004 31.979 -24.165 1.000 17.663 ? 505 TYR EEE CA  1 ? 
ATOM   1385 C C   . TYR A 1 176 ? -21.211 31.436 -23.403 1.000 17.774 ? 505 TYR EEE C   1 ? 
ATOM   1386 O O   . TYR A 1 176 ? -21.459 31.855 -22.269 1.000 18.359 ? 505 TYR EEE O   1 ? 
ATOM   1387 C CB  . TYR A 1 176 ? -20.405 33.393 -24.552 1.000 20.401 ? 505 TYR EEE CB  1 ? 
ATOM   1388 C CG  . TYR A 1 176 ? -19.445 34.155 -25.412 1.000 22.850 ? 505 TYR EEE CG  1 ? 
ATOM   1389 C CD1 . TYR A 1 176 ? -18.331 34.751 -24.862 1.000 21.091 ? 505 TYR EEE CD1 1 ? 
ATOM   1390 C CD2 . TYR A 1 176 ? -19.680 34.325 -26.772 1.000 23.926 ? 505 TYR EEE CD2 1 ? 
ATOM   1391 C CE1 . TYR A 1 176 ? -17.481 35.530 -25.638 1.000 23.869 ? 505 TYR EEE CE1 1 ? 
ATOM   1392 C CE2 . TYR A 1 176 ? -18.822 35.061 -27.564 1.000 24.685 ? 505 TYR EEE CE2 1 ? 
ATOM   1393 C CZ  . TYR A 1 176 ? -17.737 35.690 -26.983 1.000 25.315 ? 505 TYR EEE CZ  1 ? 
ATOM   1394 O OH  . TYR A 1 176 ? -16.904 36.439 -27.750 1.000 29.644 ? 505 TYR EEE OH  1 ? 
ATOM   1395 N N   . GLN A 1 177 ? -21.991 30.593 -24.046 1.000 16.554 ? 506 GLN EEE N   1 ? 
ATOM   1396 C CA  . GLN A 1 177 ? -23.293 30.174 -23.477 1.000 15.641 ? 506 GLN EEE CA  1 ? 
ATOM   1397 C C   . GLN A 1 177 ? -23.069 29.202 -22.324 1.000 16.106 ? 506 GLN EEE C   1 ? 
ATOM   1398 O O   . GLN A 1 177 ? -22.078 28.464 -22.289 1.000 17.218 ? 506 GLN EEE O   1 ? 
ATOM   1399 C CB  . GLN A 1 177 ? -24.160 29.578 -24.577 1.000 16.450 ? 506 GLN EEE CB  1 ? 
ATOM   1400 C CG  . GLN A 1 177 ? -24.632 30.633 -25.565 1.000 17.629 ? 506 GLN EEE CG  1 ? 
ATOM   1401 C CD  . GLN A 1 177 ? -25.413 30.043 -26.709 1.000 16.370 ? 506 GLN EEE CD  1 ? 
ATOM   1402 O OE1 . GLN A 1 177 ? -25.849 28.896 -26.665 1.000 18.102 ? 506 GLN EEE OE1 1 ? 
ATOM   1403 N NE2 . GLN A 1 177 ? -25.554 30.829 -27.760 1.000 17.537 ? 506 GLN EEE NE2 1 ? 
ATOM   1404 N N   . PRO A 1 178 ? -24.004 29.149 -21.354 1.000 14.793 ? 507 PRO EEE N   1 ? 
ATOM   1405 C CA  . PRO A 1 178 ? -23.939 28.173 -20.278 1.000 13.648 ? 507 PRO EEE CA  1 ? 
ATOM   1406 C C   . PRO A 1 178 ? -24.164 26.756 -20.807 1.000 14.193 ? 507 PRO EEE C   1 ? 
ATOM   1407 O O   . PRO A 1 178 ? -25.049 26.523 -21.656 1.000 16.525 ? 507 PRO EEE O   1 ? 
ATOM   1408 C CB  . PRO A 1 178 ? -25.006 28.616 -19.289 1.000 14.902 ? 507 PRO EEE CB  1 ? 
ATOM   1409 C CG  . PRO A 1 178 ? -26.017 29.282 -20.192 1.000 15.682 ? 507 PRO EEE CG  1 ? 
ATOM   1410 C CD  . PRO A 1 178 ? -25.201 30.005 -21.254 1.000 14.563 ? 507 PRO EEE CD  1 ? 
ATOM   1411 N N   . TYR A 1 179 ? -23.393 25.836 -20.249 1.000 15.055 ? 508 TYR EEE N   1 ? 
ATOM   1412 C CA  . TYR A 1 179 ? -23.489 24.379 -20.438 1.000 15.955 ? 508 TYR EEE CA  1 ? 
ATOM   1413 C C   . TYR A 1 179 ? -23.636 23.780 -19.050 1.000 15.710 ? 508 TYR EEE C   1 ? 
ATOM   1414 O O   . TYR A 1 179 ? -22.900 24.147 -18.118 1.000 16.878 ? 508 TYR EEE O   1 ? 
ATOM   1415 C CB  . TYR A 1 179 ? -22.269 23.833 -21.185 1.000 17.361 ? 508 TYR EEE CB  1 ? 
ATOM   1416 C CG  . TYR A 1 179 ? -22.407 23.982 -22.675 1.000 18.497 ? 508 TYR EEE CG  1 ? 
ATOM   1417 C CD1 . TYR A 1 179 ? -22.426 25.242 -23.260 1.000 17.047 ? 508 TYR EEE CD1 1 ? 
ATOM   1418 C CD2 . TYR A 1 179 ? -22.551 22.871 -23.500 1.000 18.904 ? 508 TYR EEE CD2 1 ? 
ATOM   1419 C CE1 . TYR A 1 179 ? -22.633 25.406 -24.617 1.000 19.869 ? 508 TYR EEE CE1 1 ? 
ATOM   1420 C CE2 . TYR A 1 179 ? -22.742 23.021 -24.865 1.000 19.498 ? 508 TYR EEE CE2 1 ? 
ATOM   1421 C CZ  . TYR A 1 179 ? -22.767 24.292 -25.427 1.000 20.161 ? 508 TYR EEE CZ  1 ? 
ATOM   1422 O OH  . TYR A 1 179 ? -23.007 24.475 -26.766 1.000 23.626 ? 508 TYR EEE OH  1 ? 
ATOM   1423 N N   . ARG A 1 180 ? -24.583 22.861 -18.929 1.000 15.942 ? 509 ARG EEE N   1 ? 
ATOM   1424 C CA  . ARG A 1 180 ? -24.713 21.986 -17.748 1.000 15.427 ? 509 ARG EEE CA  1 ? 
ATOM   1425 C C   . ARG A 1 180 ? -23.797 20.785 -17.989 1.000 16.521 ? 509 ARG EEE C   1 ? 
ATOM   1426 O O   . ARG A 1 180 ? -23.767 20.240 -19.116 1.000 17.612 ? 509 ARG EEE O   1 ? 
ATOM   1427 C CB  . ARG A 1 180 ? -26.180 21.627 -17.516 1.000 16.916 ? 509 ARG EEE CB  1 ? 
ATOM   1428 C CG  . ARG A 1 180 ? -26.931 22.802 -16.919 1.000 17.002 ? 509 ARG EEE CG  1 ? 
ATOM   1429 C CD  . ARG A 1 180 ? -28.394 22.542 -16.736 1.000 18.256 ? 509 ARG EEE CD  1 ? 
ATOM   1430 N NE  . ARG A 1 180 ? -29.008 23.736 -16.200 1.000 17.681 ? 509 ARG EEE NE  1 ? 
ATOM   1431 C CZ  . ARG A 1 180 ? -30.179 23.776 -15.567 1.000 20.277 ? 509 ARG EEE CZ  1 ? 
ATOM   1432 N NH1 . ARG A 1 180 ? -30.879 22.672 -15.351 1.000 24.495 ? 509 ARG EEE NH1 1 ? 
ATOM   1433 N NH2 . ARG A 1 180 ? -30.627 24.932 -15.121 1.000 21.165 ? 509 ARG EEE NH2 1 ? 
ATOM   1434 N N   . VAL A 1 181 ? -23.035 20.443 -16.958 1.000 16.909 ? 510 VAL EEE N   1 ? 
ATOM   1435 C CA  . VAL A 1 181 ? -22.051 19.346 -17.000 1.000 16.537 ? 510 VAL EEE CA  1 ? 
ATOM   1436 C C   . VAL A 1 181 ? -22.380 18.372 -15.877 1.000 15.630 ? 510 VAL EEE C   1 ? 
ATOM   1437 O O   . VAL A 1 181 ? -22.607 18.810 -14.741 1.000 15.851 ? 510 VAL EEE O   1 ? 
ATOM   1438 C CB  . VAL A 1 181 ? -20.625 19.900 -16.876 1.000 16.546 ? 510 VAL EEE CB  1 ? 
ATOM   1439 C CG1 . VAL A 1 181 ? -19.622 18.762 -16.948 1.000 18.653 ? 510 VAL EEE CG1 1 ? 
ATOM   1440 C CG2 . VAL A 1 181 ? -20.348 20.934 -17.948 1.000 18.002 ? 510 VAL EEE CG2 1 ? 
ATOM   1441 N N   . VAL A 1 182 ? -22.342 17.090 -16.215 1.000 17.028 ? 511 VAL EEE N   1 ? 
ATOM   1442 C CA  . VAL A 1 182 ? -22.377 15.978 -15.246 1.000 17.455 ? 511 VAL EEE CA  1 ? 
ATOM   1443 C C   . VAL A 1 182 ? -21.142 15.117 -15.470 1.000 18.157 ? 511 VAL EEE C   1 ? 
ATOM   1444 O O   . VAL A 1 182 ? -20.897 14.671 -16.603 1.000 18.958 ? 511 VAL EEE O   1 ? 
ATOM   1445 C CB  . VAL A 1 182 ? -23.666 15.149 -15.339 1.000 19.087 ? 511 VAL EEE CB  1 ? 
ATOM   1446 C CG1 . VAL A 1 182 ? -23.590 13.963 -14.381 1.000 19.957 ? 511 VAL EEE CG1 1 ? 
ATOM   1447 C CG2 . VAL A 1 182 ? -24.892 16.008 -15.063 1.000 19.734 ? 511 VAL EEE CG2 1 ? 
ATOM   1448 N N   . VAL A 1 183 ? -20.378 14.946 -14.401 1.000 17.278 ? 512 VAL EEE N   1 ? 
ATOM   1449 C CA  . VAL A 1 183 ? -19.196 14.055 -14.423 1.000 17.965 ? 512 VAL EEE CA  1 ? 
ATOM   1450 C C   . VAL A 1 183 ? -19.569 12.818 -13.606 1.000 17.608 ? 512 VAL EEE C   1 ? 
ATOM   1451 O O   . VAL A 1 183 ? -19.836 12.962 -12.405 1.000 19.468 ? 512 VAL EEE O   1 ? 
ATOM   1452 C CB  . VAL A 1 183 ? -17.947 14.749 -13.866 1.000 17.918 ? 512 VAL EEE CB  1 ? 
ATOM   1453 C CG1 . VAL A 1 183 ? -16.770 13.787 -13.909 1.000 18.812 ? 512 VAL EEE CG1 1 ? 
ATOM   1454 C CG2 . VAL A 1 183 ? -17.618 16.028 -14.617 1.000 18.008 ? 512 VAL EEE CG2 1 ? 
ATOM   1455 N N   . LEU A 1 184 ? -19.549 11.649 -14.236 1.000 18.710 ? 513 LEU EEE N   1 ? 
ATOM   1456 C CA  . LEU A 1 184 ? -19.743 10.349 -13.560 1.000 19.486 ? 513 LEU EEE CA  1 ? 
ATOM   1457 C C   . LEU A 1 184 ? -18.358 9.761  -13.315 1.000 19.949 ? 513 LEU EEE C   1 ? 
ATOM   1458 O O   . LEU A 1 184 ? -17.682 9.476  -14.302 1.000 23.079 ? 513 LEU EEE O   1 ? 
ATOM   1459 C CB  . LEU A 1 184 ? -20.595 9.424  -14.434 1.000 20.756 ? 513 LEU EEE CB  1 ? 
ATOM   1460 C CG  . LEU A 1 184 ? -21.984 9.940  -14.798 1.000 21.828 ? 513 LEU EEE CG  1 ? 
ATOM   1461 C CD1 . LEU A 1 184 ? -22.719 8.895  -15.618 1.000 23.201 ? 513 LEU EEE CD1 1 ? 
ATOM   1462 C CD2 . LEU A 1 184 ? -22.789 10.303 -13.554 1.000 21.976 ? 513 LEU EEE CD2 1 ? 
ATOM   1463 N N   . SER A 1 185 ? -17.979 9.612  -12.049 1.000 20.140 ? 514 SER EEE N   1 ? 
ATOM   1464 C CA  . SER A 1 185 ? -16.744 8.916  -11.604 1.000 22.322 ? 514 SER EEE CA  1 ? 
ATOM   1465 C C   . SER A 1 185 ? -17.125 7.496  -11.211 1.000 21.902 ? 514 SER EEE C   1 ? 
ATOM   1466 O O   . SER A 1 185 ? -17.978 7.347  -10.341 1.000 22.668 ? 514 SER EEE O   1 ? 
ATOM   1467 C CB  . SER A 1 185 ? -16.099 9.625  -10.445 1.000 24.853 ? 514 SER EEE CB  1 ? 
ATOM   1468 O OG  . SER A 1 185 ? -15.557 10.859 -10.845 1.000 30.768 ? 514 SER EEE OG  1 ? 
ATOM   1469 N N   . PHE A 1 186 ? -16.511 6.505  -11.840 1.000 23.080 ? 515 PHE EEE N   1 ? 
ATOM   1470 C CA  . PHE A 1 186 ? -16.765 5.076  -11.568 1.000 24.120 ? 515 PHE EEE CA  1 ? 
ATOM   1471 C C   . PHE A 1 186 ? -15.696 4.591  -10.606 1.000 23.761 ? 515 PHE EEE C   1 ? 
ATOM   1472 O O   . PHE A 1 186 ? -14.534 4.558  -11.010 1.000 26.763 ? 515 PHE EEE O   1 ? 
ATOM   1473 C CB  . PHE A 1 186 ? -16.756 4.290  -12.873 1.000 25.360 ? 515 PHE EEE CB  1 ? 
ATOM   1474 C CG  . PHE A 1 186 ? -17.772 4.757  -13.877 1.000 25.084 ? 515 PHE EEE CG  1 ? 
ATOM   1475 C CD1 . PHE A 1 186 ? -19.082 4.989  -13.502 1.000 29.275 ? 515 PHE EEE CD1 1 ? 
ATOM   1476 C CD2 . PHE A 1 186 ? -17.417 4.936  -15.202 1.000 28.001 ? 515 PHE EEE CD2 1 ? 
ATOM   1477 C CE1 . PHE A 1 186 ? -20.020 5.394  -14.438 1.000 31.222 ? 515 PHE EEE CE1 1 ? 
ATOM   1478 C CE2 . PHE A 1 186 ? -18.353 5.350  -16.133 1.000 28.766 ? 515 PHE EEE CE2 1 ? 
ATOM   1479 C CZ  . PHE A 1 186 ? -19.651 5.585  -15.745 1.000 28.770 ? 515 PHE EEE CZ  1 ? 
ATOM   1480 N N   . GLU A 1 187 ? -16.081 4.285  -9.372  1.000 24.083 ? 516 GLU EEE N   1 ? 
ATOM   1481 C CA  . GLU A 1 187 ? -15.135 3.863  -8.317  1.000 25.278 ? 516 GLU EEE CA  1 ? 
ATOM   1482 C C   . GLU A 1 187 ? -14.850 2.364  -8.447  1.000 24.960 ? 516 GLU EEE C   1 ? 
ATOM   1483 O O   . GLU A 1 187 ? -15.786 1.591  -8.702  1.000 25.372 ? 516 GLU EEE O   1 ? 
ATOM   1484 C CB  . GLU A 1 187 ? -15.703 4.219  -6.956  1.000 27.096 ? 516 GLU EEE CB  1 ? 
ATOM   1485 C CG  . GLU A 1 187 ? -14.681 4.111  -5.861  1.000 28.555 ? 516 GLU EEE CG  1 ? 
ATOM   1486 C CD  . GLU A 1 187 ? -15.324 4.261  -4.506  1.000 29.840 ? 516 GLU EEE CD  1 ? 
ATOM   1487 O OE1 . GLU A 1 187 ? -16.115 3.352  -4.124  1.000 29.986 ? 516 GLU EEE OE1 1 ? 
ATOM   1488 O OE2 . GLU A 1 187 ? -15.061 5.288  -3.868  1.000 32.330 ? 516 GLU EEE OE2 1 ? 
ATOM   1489 N N   . LEU A 1 188 ? -13.586 1.995  -8.232  1.000 26.342 ? 517 LEU EEE N   1 ? 
ATOM   1490 C CA  . LEU A 1 188 ? -13.023 0.649  -8.489  1.000 30.749 ? 517 LEU EEE CA  1 ? 
ATOM   1491 C C   . LEU A 1 188 ? -12.263 0.149  -7.260  1.000 28.952 ? 517 LEU EEE C   1 ? 
ATOM   1492 O O   . LEU A 1 188 ? -11.174 -0.415 -7.440  1.000 33.070 ? 517 LEU EEE O   1 ? 
ATOM   1493 C CB  . LEU A 1 188 ? -12.057 0.767  -9.669  1.000 33.843 ? 517 LEU EEE CB  1 ? 
ATOM   1494 C CG  . LEU A 1 188 ? -12.657 1.257  -10.977 1.000 36.468 ? 517 LEU EEE CG  1 ? 
ATOM   1495 C CD1 . LEU A 1 188 ? -11.565 1.671  -11.945 1.000 37.561 ? 517 LEU EEE CD1 1 ? 
ATOM   1496 C CD2 . LEU A 1 188 ? -13.525 0.175  -11.575 1.000 37.928 ? 517 LEU EEE CD2 1 ? 
ATOM   1497 N N   . LEU A 1 189 ? -12.811 0.311  -6.059  1.000 28.191 ? 518 LEU EEE N   1 ? 
ATOM   1498 C CA  . LEU A 1 189 ? -12.149 -0.201 -4.833  1.000 28.345 ? 518 LEU EEE CA  1 ? 
ATOM   1499 C C   . LEU A 1 189 ? -12.133 -1.727 -4.890  1.000 27.527 ? 518 LEU EEE C   1 ? 
ATOM   1500 O O   . LEU A 1 189 ? -12.972 -2.320 -5.604  1.000 30.722 ? 518 LEU EEE O   1 ? 
ATOM   1501 C CB  . LEU A 1 189 ? -12.884 0.292  -3.587  1.000 30.015 ? 518 LEU EEE CB  1 ? 
ATOM   1502 C CG  . LEU A 1 189 ? -12.886 1.806  -3.388  1.000 32.198 ? 518 LEU EEE CG  1 ? 
ATOM   1503 C CD1 . LEU A 1 189 ? -13.573 2.168  -2.083  1.000 33.749 ? 518 LEU EEE CD1 1 ? 
ATOM   1504 C CD2 . LEU A 1 189 ? -11.471 2.361  -3.437  1.000 35.268 ? 518 LEU EEE CD2 1 ? 
ATOM   1505 N N   . HIS A 1 190 ? -11.192 -2.354 -4.191  1.000 29.469 ? 519 HIS EEE N   1 ? 
ATOM   1506 C CA  . HIS A 1 190 ? -11.174 -3.831 -4.028  1.000 30.796 ? 519 HIS EEE CA  1 ? 
ATOM   1507 C C   . HIS A 1 190 ? -12.198 -4.182 -2.942  1.000 30.547 ? 519 HIS EEE C   1 ? 
ATOM   1508 O O   . HIS A 1 190 ? -11.803 -4.428 -1.799  1.000 33.929 ? 519 HIS EEE O   1 ? 
ATOM   1509 C CB  . HIS A 1 190 ? -9.733  -4.314 -3.814  1.000 33.994 ? 519 HIS EEE CB  1 ? 
ATOM   1510 C CG  . HIS A 1 190 ? -8.822  -3.954 -4.942  1.000 36.309 ? 519 HIS EEE CG  1 ? 
ATOM   1511 N ND1 . HIS A 1 190 ? -9.022  -4.414 -6.233  1.000 38.255 ? 519 HIS EEE ND1 1 ? 
ATOM   1512 C CD2 . HIS A 1 190 ? -7.711  -3.182 -4.981  1.000 37.757 ? 519 HIS EEE CD2 1 ? 
ATOM   1513 C CE1 . HIS A 1 190 ? -8.074  -3.941 -7.019  1.000 36.988 ? 519 HIS EEE CE1 1 ? 
ATOM   1514 N NE2 . HIS A 1 190 ? -7.255  -3.176 -6.272  1.000 38.119 ? 519 HIS EEE NE2 1 ? 
ATOM   1515 N N   . ALA A 1 191 ? -13.485 -4.148 -3.299  1.000 28.005 ? 520 ALA EEE N   1 ? 
ATOM   1516 C CA  . ALA A 1 191 ? -14.636 -4.298 -2.378  1.000 27.931 ? 520 ALA EEE CA  1 ? 
ATOM   1517 C C   . ALA A 1 191 ? -15.825 -4.793 -3.186  1.000 27.324 ? 520 ALA EEE C   1 ? 
ATOM   1518 O O   . ALA A 1 191 ? -15.777 -4.745 -4.409  1.000 28.466 ? 520 ALA EEE O   1 ? 
ATOM   1519 C CB  . ALA A 1 191 ? -14.959 -2.977 -1.720  1.000 28.544 ? 520 ALA EEE CB  1 ? 
ATOM   1520 N N   . PRO A 1 192 ? -16.925 -5.232 -2.534  1.000 29.260 ? 521 PRO EEE N   1 ? 
ATOM   1521 C CA  . PRO A 1 192 ? -18.161 -5.544 -3.252  1.000 29.407 ? 521 PRO EEE CA  1 ? 
ATOM   1522 C C   . PRO A 1 192 ? -18.589 -4.376 -4.156  1.000 28.944 ? 521 PRO EEE C   1 ? 
ATOM   1523 O O   . PRO A 1 192 ? -18.507 -3.229 -3.773  1.000 30.309 ? 521 PRO EEE O   1 ? 
ATOM   1524 C CB  . PRO A 1 192 ? -19.164 -5.832 -2.122  1.000 30.561 ? 521 PRO EEE CB  1 ? 
ATOM   1525 C CG  . PRO A 1 192 ? -18.295 -6.309 -0.982  1.000 31.505 ? 521 PRO EEE CG  1 ? 
ATOM   1526 C CD  . PRO A 1 192 ? -17.030 -5.485 -1.087  1.000 30.811 ? 521 PRO EEE CD  1 ? 
ATOM   1527 N N   . ALA A 1 193 ? -19.018 -4.693 -5.369  1.000 28.410 ? 522 ALA EEE N   1 ? 
ATOM   1528 C CA  . ALA A 1 193 ? -19.422 -3.691 -6.375  1.000 29.879 ? 522 ALA EEE CA  1 ? 
ATOM   1529 C C   . ALA A 1 193 ? -20.944 -3.667 -6.452  1.000 31.135 ? 522 ALA EEE C   1 ? 
ATOM   1530 O O   . ALA A 1 193 ? -21.506 -4.670 -6.922  1.000 36.380 ? 522 ALA EEE O   1 ? 
ATOM   1531 C CB  . ALA A 1 193 ? -18.787 -4.015 -7.697  1.000 32.073 ? 522 ALA EEE CB  1 ? 
ATOM   1532 N N   . THR A 1 194 ? -21.545 -2.537 -6.059  1.000 30.281 ? 523 THR EEE N   1 ? 
ATOM   1533 C CA  . THR A 1 194 ? -22.968 -2.373 -5.655  1.000 33.477 ? 523 THR EEE CA  1 ? 
ATOM   1534 C C   . THR A 1 194 ? -23.775 -1.570 -6.689  1.000 28.585 ? 523 THR EEE C   1 ? 
ATOM   1535 O O   . THR A 1 194 ? -25.032 -1.491 -6.545  1.000 32.149 ? 523 THR EEE O   1 ? 
ATOM   1536 C CB  . THR A 1 194 ? -23.015 -1.699 -4.277  1.000 40.009 ? 523 THR EEE CB  1 ? 
ATOM   1537 O OG1 . THR A 1 194 ? -24.336 -1.884 -3.787  1.000 50.389 ? 523 THR EEE OG1 1 ? 
ATOM   1538 C CG2 . THR A 1 194 ? -22.652 -0.228 -4.296  1.000 40.215 ? 523 THR EEE CG2 1 ? 
ATOM   1539 N N   . VAL A 1 195 ? -23.116 -0.984 -7.685  1.000 24.746 ? 524 VAL EEE N   1 ? 
ATOM   1540 C CA  . VAL A 1 195 ? -23.776 -0.221 -8.781  1.000 25.380 ? 524 VAL EEE CA  1 ? 
ATOM   1541 C C   . VAL A 1 195 ? -23.520 -0.962 -10.087 1.000 26.904 ? 524 VAL EEE C   1 ? 
ATOM   1542 O O   . VAL A 1 195 ? -22.375 -0.983 -10.545 1.000 27.798 ? 524 VAL EEE O   1 ? 
ATOM   1543 C CB  . VAL A 1 195 ? -23.291 1.234  -8.874  1.000 28.300 ? 524 VAL EEE CB  1 ? 
ATOM   1544 C CG1 . VAL A 1 195 ? -24.145 2.011  -9.858  1.000 27.116 ? 524 VAL EEE CG1 1 ? 
ATOM   1545 C CG2 . VAL A 1 195 ? -23.284 1.899  -7.516  1.000 30.698 ? 524 VAL EEE CG2 1 ? 
ATOM   1546 N N   . CYS A 1 196 ? -24.569 -1.540 -10.660 1.000 28.808 ? 525 CYS EEE N   1 ? 
ATOM   1547 C CA  . CYS A 1 196 ? -24.467 -2.392 -11.864 1.000 29.632 ? 525 CYS EEE CA  1 ? 
ATOM   1548 C C   . CYS A 1 196 ? -25.384 -1.879 -12.969 1.000 31.823 ? 525 CYS EEE C   1 ? 
ATOM   1549 O O   . CYS A 1 196 ? -26.238 -1.004 -12.705 1.000 30.282 ? 525 CYS EEE O   1 ? 
ATOM   1550 C CB  . CYS A 1 196 ? -24.833 -3.832 -11.536 1.000 33.445 ? 525 CYS EEE CB  1 ? 
ATOM   1551 S SG  . CYS A 1 196 ? -23.720 -4.559 -10.308 1.000 36.400 ? 525 CYS EEE SG  1 ? 
ATOM   1552 N N   . GLY A 1 197 ? -25.154 -2.402 -14.169 1.000 31.798 ? 526 GLY EEE N   1 ? 
ATOM   1553 C CA  . GLY A 1 197 ? -26.069 -2.277 -15.311 1.000 34.208 ? 526 GLY EEE CA  1 ? 
ATOM   1554 C C   . GLY A 1 197 ? -27.254 -3.221 -15.145 1.000 35.944 ? 526 GLY EEE C   1 ? 
ATOM   1555 O O   . GLY A 1 197 ? -27.357 -3.944 -14.152 1.000 41.464 ? 526 GLY EEE O   1 ? 
ATOM   1556 N N   . PRO A 1 198 ? -28.186 -3.233 -16.116 1.000 36.751 ? 527 PRO EEE N   1 ? 
ATOM   1557 C CA  . PRO A 1 198 ? -29.363 -4.101 -16.054 1.000 39.879 ? 527 PRO EEE CA  1 ? 
ATOM   1558 C C   . PRO A 1 198 ? -28.981 -5.571 -16.292 1.000 40.562 ? 527 PRO EEE C   1 ? 
ATOM   1559 O O   . PRO A 1 198 ? -29.342 -6.466 -15.548 1.000 48.901 ? 527 PRO EEE O   1 ? 
ATOM   1560 C CB  . PRO A 1 198 ? -30.274 -3.574 -17.174 1.000 39.879 ? 527 PRO EEE CB  1 ? 
ATOM   1561 C CG  . PRO A 1 198 ? -29.649 -2.269 -17.621 1.000 38.325 ? 527 PRO EEE CG  1 ? 
ATOM   1562 C CD  . PRO A 1 198 ? -28.168 -2.409 -17.333 1.000 36.187 ? 527 PRO EEE CD  1 ? 
ATOM   1563 N N   . GLN B 2 1   ? -1.625  46.473 -16.331 1.000 49.313 ? 1   GLN FFF N   1 ? 
ATOM   1564 C CA  . GLN B 2 1   ? -2.332  47.598 -15.658 1.000 41.419 ? 1   GLN FFF CA  1 ? 
ATOM   1565 C C   . GLN B 2 1   ? -3.707  47.794 -16.304 1.000 35.375 ? 1   GLN FFF C   1 ? 
ATOM   1566 O O   . GLN B 2 1   ? -3.941  47.299 -17.429 1.000 35.441 ? 1   GLN FFF O   1 ? 
ATOM   1567 C CB  . GLN B 2 1   ? -1.533  48.894 -15.782 1.000 46.883 ? 1   GLN FFF CB  1 ? 
ATOM   1568 C CG  . GLN B 2 1   ? -1.546  49.453 -17.195 1.000 50.973 ? 1   GLN FFF CG  1 ? 
ATOM   1569 C CD  . GLN B 2 1   ? -0.733  50.711 -17.356 1.000 58.456 ? 1   GLN FFF CD  1 ? 
ATOM   1570 O OE1 . GLN B 2 1   ? 0.164   51.012 -16.572 1.000 64.182 ? 1   GLN FFF OE1 1 ? 
ATOM   1571 N NE2 . GLN B 2 1   ? -1.041  51.454 -18.408 1.000 68.703 ? 1   GLN FFF NE2 1 ? 
ATOM   1572 N N   . VAL B 2 2   ? -4.587  48.521 -15.628 1.000 31.766 ? 2   VAL FFF N   1 ? 
ATOM   1573 C CA  . VAL B 2 2   ? -6.002  48.681 -16.069 1.000 29.202 ? 2   VAL FFF CA  1 ? 
ATOM   1574 C C   . VAL B 2 2   ? -6.106  49.815 -17.093 1.000 28.702 ? 2   VAL FFF C   1 ? 
ATOM   1575 O O   . VAL B 2 2   ? -5.566  50.897 -16.832 1.000 31.171 ? 2   VAL FFF O   1 ? 
ATOM   1576 C CB  . VAL B 2 2   ? -6.922  48.933 -14.866 1.000 31.055 ? 2   VAL FFF CB  1 ? 
ATOM   1577 C CG1 . VAL B 2 2   ? -8.313  49.353 -15.306 1.000 31.258 ? 2   VAL FFF CG1 1 ? 
ATOM   1578 C CG2 . VAL B 2 2   ? -6.978  47.714 -13.952 1.000 32.888 ? 2   VAL FFF CG2 1 ? 
ATOM   1579 N N   . GLN B 2 3   ? -6.820  49.571 -18.199 1.000 28.747 ? 3   GLN FFF N   1 ? 
ATOM   1580 C CA  . GLN B 2 3   ? -7.182  50.611 -19.191 1.000 32.321 ? 3   GLN FFF CA  1 ? 
ATOM   1581 C C   . GLN B 2 3   ? -8.685  50.528 -19.450 1.000 29.220 ? 3   GLN FFF C   1 ? 
ATOM   1582 O O   . GLN B 2 3   ? -9.243  49.401 -19.478 1.000 30.882 ? 3   GLN FFF O   1 ? 
ATOM   1583 C CB  . GLN B 2 3   ? -6.367  50.448 -20.477 1.000 35.996 ? 3   GLN FFF CB  1 ? 
ATOM   1584 C CG  . GLN B 2 3   ? -4.866  50.635 -20.279 1.000 42.891 ? 3   GLN FFF CG  1 ? 
ATOM   1585 C CD  . GLN B 2 3   ? -4.493  52.032 -19.838 1.000 49.159 ? 3   GLN FFF CD  1 ? 
ATOM   1586 O OE1 . GLN B 2 3   ? -3.704  52.226 -18.913 1.000 54.222 ? 3   GLN FFF OE1 1 ? 
ATOM   1587 N NE2 . GLN B 2 3   ? -5.068  53.028 -20.496 1.000 55.052 ? 3   GLN FFF NE2 1 ? 
ATOM   1588 N N   . LEU B 2 4   ? -9.322  51.685 -19.588 1.000 27.896 ? 4   LEU FFF N   1 ? 
ATOM   1589 C CA  . LEU B 2 4   ? -10.729 51.785 -20.036 1.000 28.431 ? 4   LEU FFF CA  1 ? 
ATOM   1590 C C   . LEU B 2 4   ? -10.680 52.416 -21.425 1.000 30.298 ? 4   LEU FFF C   1 ? 
ATOM   1591 O O   . LEU B 2 4   ? -10.199 53.572 -21.546 1.000 33.774 ? 4   LEU FFF O   1 ? 
ATOM   1592 C CB  . LEU B 2 4   ? -11.558 52.571 -19.015 1.000 26.931 ? 4   LEU FFF CB  1 ? 
ATOM   1593 C CG  . LEU B 2 4   ? -11.595 51.958 -17.610 1.000 27.824 ? 4   LEU FFF CG  1 ? 
ATOM   1594 C CD1 . LEU B 2 4   ? -12.268 52.884 -16.604 1.000 27.516 ? 4   LEU FFF CD1 1 ? 
ATOM   1595 C CD2 . LEU B 2 4   ? -12.287 50.600 -17.602 1.000 30.139 ? 4   LEU FFF CD2 1 ? 
ATOM   1596 N N   . VAL B 2 5   ? -11.006 51.604 -22.435 1.000 29.768 ? 5   VAL FFF N   1 ? 
ATOM   1597 C CA  . VAL B 2 5   ? -11.061 52.005 -23.869 1.000 28.488 ? 5   VAL FFF CA  1 ? 
ATOM   1598 C C   . VAL B 2 5   ? -12.502 52.444 -24.141 1.000 24.967 ? 5   VAL FFF C   1 ? 
ATOM   1599 O O   . VAL B 2 5   ? -13.433 51.593 -24.113 1.000 28.471 ? 5   VAL FFF O   1 ? 
ATOM   1600 C CB  . VAL B 2 5   ? -10.600 50.853 -24.787 1.000 30.938 ? 5   VAL FFF CB  1 ? 
ATOM   1601 C CG1 . VAL B 2 5   ? -10.724 51.216 -26.253 1.000 33.921 ? 5   VAL FFF CG1 1 ? 
ATOM   1602 C CG2 . VAL B 2 5   ? -9.168  50.418 -24.456 1.000 32.929 ? 5   VAL FFF CG2 1 ? 
ATOM   1603 N N   . GLU B 2 6   ? -12.703 53.740 -24.310 1.000 27.609 ? 6   GLU FFF N   1 ? 
ATOM   1604 C CA  . GLU B 2 6   ? -14.039 54.338 -24.589 1.000 27.170 ? 6   GLU FFF CA  1 ? 
ATOM   1605 C C   . GLU B 2 6   ? -14.230 54.490 -26.106 1.000 28.977 ? 6   GLU FFF C   1 ? 
ATOM   1606 O O   . GLU B 2 6   ? -13.261 54.776 -26.824 1.000 27.223 ? 6   GLU FFF O   1 ? 
ATOM   1607 C CB  . GLU B 2 6   ? -14.168 55.712 -23.938 1.000 30.215 ? 6   GLU FFF CB  1 ? 
ATOM   1608 C CG  . GLU B 2 6   ? -14.027 55.735 -22.429 1.000 29.660 ? 6   GLU FFF CG  1 ? 
ATOM   1609 C CD  . GLU B 2 6   ? -14.031 57.154 -21.866 1.000 31.458 ? 6   GLU FFF CD  1 ? 
ATOM   1610 O OE1 . GLU B 2 6   ? -13.733 58.069 -22.637 1.000 38.653 ? 6   GLU FFF OE1 1 ? 
ATOM   1611 O OE2 . GLU B 2 6   ? -14.384 57.360 -20.696 1.000 28.558 ? 6   GLU FFF OE2 1 ? 
ATOM   1612 N N   . SER B 2 7   ? -15.452 54.330 -26.599 1.000 28.666 ? 7   SER FFF N   1 ? 
ATOM   1613 C CA  . SER B 2 7   ? -15.789 54.653 -28.007 1.000 26.788 ? 7   SER FFF CA  1 ? 
ATOM   1614 C C   . SER B 2 7   ? -17.241 55.111 -28.066 1.000 25.233 ? 7   SER FFF C   1 ? 
ATOM   1615 O O   . SER B 2 7   ? -17.956 54.983 -27.065 1.000 29.593 ? 7   SER FFF O   1 ? 
ATOM   1616 C CB  . SER B 2 7   ? -15.499 53.497 -28.945 1.000 29.191 ? 7   SER FFF CB  1 ? 
ATOM   1617 O OG  . SER B 2 7   ? -15.270 53.949 -30.292 1.000 33.540 ? 7   SER FFF OG  1 ? 
ATOM   1618 N N   . GLY B 2 8   ? -17.637 55.693 -29.191 1.000 25.731 ? 8   GLY FFF N   1 ? 
ATOM   1619 C CA  . GLY B 2 8   ? -18.988 56.266 -29.324 1.000 27.183 ? 8   GLY FFF CA  1 ? 
ATOM   1620 C C   . GLY B 2 8   ? -19.020 57.736 -28.942 1.000 31.430 ? 8   GLY FFF C   1 ? 
ATOM   1621 O O   . GLY B 2 8   ? -17.925 58.325 -28.683 1.000 32.898 ? 8   GLY FFF O   1 ? 
ATOM   1622 N N   . GLY B 2 9   ? -20.228 58.302 -28.860 1.000 32.789 ? 9   GLY FFF N   1 ? 
ATOM   1623 C CA  . GLY B 2 9   ? -20.443 59.737 -28.578 1.000 36.540 ? 9   GLY FFF CA  1 ? 
ATOM   1624 C C   . GLY B 2 9   ? -20.413 60.591 -29.842 1.000 36.837 ? 9   GLY FFF C   1 ? 
ATOM   1625 O O   . GLY B 2 9   ? -20.687 60.060 -30.933 1.000 40.733 ? 9   GLY FFF O   1 ? 
ATOM   1626 N N   . GLY B 2 10  ? -20.100 61.883 -29.703 1.000 37.447 ? 10  GLY FFF N   1 ? 
ATOM   1627 C CA  . GLY B 2 10  ? -20.136 62.867 -30.804 1.000 37.067 ? 10  GLY FFF CA  1 ? 
ATOM   1628 C C   . GLY B 2 10  ? -21.399 63.713 -30.755 1.000 39.066 ? 10  GLY FFF C   1 ? 
ATOM   1629 O O   . GLY B 2 10  ? -21.984 63.871 -29.659 1.000 37.953 ? 10  GLY FFF O   1 ? 
ATOM   1630 N N   . SER B 2 11  ? -21.815 64.247 -31.902 1.000 40.384 ? 11  SER FFF N   1 ? 
ATOM   1631 C CA  . SER B 2 11  ? -22.980 65.157 -32.025 1.000 43.579 ? 11  SER FFF CA  1 ? 
ATOM   1632 C C   . SER B 2 11  ? -24.242 64.349 -32.339 1.000 46.354 ? 11  SER FFF C   1 ? 
ATOM   1633 O O   . SER B 2 11  ? -24.141 63.358 -33.092 1.000 52.293 ? 11  SER FFF O   1 ? 
ATOM   1634 C CB  . SER B 2 11  ? -22.718 66.214 -33.057 1.000 46.183 ? 11  SER FFF CB  1 ? 
ATOM   1635 O OG  . SER B 2 11  ? -21.577 66.982 -32.696 1.000 52.379 ? 11  SER FFF OG  1 ? 
ATOM   1636 N N   . VAL B 2 12  ? -25.376 64.754 -31.764 1.000 42.515 ? 12  VAL FFF N   1 ? 
ATOM   1637 C CA  . VAL B 2 12  ? -26.722 64.169 -32.047 1.000 47.213 ? 12  VAL FFF CA  1 ? 
ATOM   1638 C C   . VAL B 2 12  ? -27.775 65.272 -31.870 1.000 50.669 ? 12  VAL FFF C   1 ? 
ATOM   1639 O O   . VAL B 2 12  ? -27.514 66.217 -31.108 1.000 48.819 ? 12  VAL FFF O   1 ? 
ATOM   1640 C CB  . VAL B 2 12  ? -26.997 62.949 -31.143 1.000 49.684 ? 12  VAL FFF CB  1 ? 
ATOM   1641 C CG1 . VAL B 2 12  ? -27.093 63.336 -29.671 1.000 49.877 ? 12  VAL FFF CG1 1 ? 
ATOM   1642 C CG2 . VAL B 2 12  ? -28.232 62.169 -31.577 1.000 51.723 ? 12  VAL FFF CG2 1 ? 
ATOM   1643 N N   . GLN B 2 13  ? -28.908 65.175 -32.573 1.000 53.487 ? 13  GLN FFF N   1 ? 
ATOM   1644 C CA  . GLN B 2 13  ? -30.053 66.112 -32.415 1.000 53.093 ? 13  GLN FFF CA  1 ? 
ATOM   1645 C C   . GLN B 2 13  ? -30.842 65.724 -31.159 1.000 48.287 ? 13  GLN FFF C   1 ? 
ATOM   1646 O O   . GLN B 2 13  ? -30.820 64.538 -30.809 1.000 47.646 ? 13  GLN FFF O   1 ? 
ATOM   1647 C CB  . GLN B 2 13  ? -30.938 66.103 -33.661 1.000 59.197 ? 13  GLN FFF CB  1 ? 
ATOM   1648 C CG  . GLN B 2 13  ? -30.279 66.767 -34.859 1.000 63.646 ? 13  GLN FFF CG  1 ? 
ATOM   1649 C CD  . GLN B 2 13  ? -31.142 66.721 -36.096 1.000 68.189 ? 13  GLN FFF CD  1 ? 
ATOM   1650 O OE1 . GLN B 2 13  ? -32.057 65.905 -36.216 1.000 74.863 ? 13  GLN FFF OE1 1 ? 
ATOM   1651 N NE2 . GLN B 2 13  ? -30.852 67.608 -37.034 1.000 76.361 ? 13  GLN FFF NE2 1 ? 
ATOM   1652 N N   . ALA B 2 14  ? -31.508 66.702 -30.530 1.000 47.409 ? 14  ALA FFF N   1 ? 
ATOM   1653 C CA  . ALA B 2 14  ? -32.361 66.555 -29.324 1.000 44.257 ? 14  ALA FFF CA  1 ? 
ATOM   1654 C C   . ALA B 2 14  ? -33.483 65.552 -29.593 1.000 47.036 ? 14  ALA FFF C   1 ? 
ATOM   1655 O O   . ALA B 2 14  ? -34.164 65.691 -30.626 1.000 50.647 ? 14  ALA FFF O   1 ? 
ATOM   1656 C CB  . ALA B 2 14  ? -32.942 67.884 -28.918 1.000 46.537 ? 14  ALA FFF CB  1 ? 
ATOM   1657 N N   . GLY B 2 15  ? -33.701 64.627 -28.658 1.000 48.963 ? 15  GLY FFF N   1 ? 
ATOM   1658 C CA  . GLY B 2 15  ? -34.646 63.503 -28.800 1.000 49.971 ? 15  GLY FFF CA  1 ? 
ATOM   1659 C C   . GLY B 2 15  ? -33.985 62.297 -29.446 1.000 48.178 ? 15  GLY FFF C   1 ? 
ATOM   1660 O O   . GLY B 2 15  ? -34.591 61.225 -29.416 1.000 49.615 ? 15  GLY FFF O   1 ? 
ATOM   1661 N N   . GLY B 2 16  ? -32.791 62.467 -30.026 1.000 49.090 ? 16  GLY FFF N   1 ? 
ATOM   1662 C CA  . GLY B 2 16  ? -32.006 61.382 -30.648 1.000 43.960 ? 16  GLY FFF CA  1 ? 
ATOM   1663 C C   . GLY B 2 16  ? -31.426 60.436 -29.609 1.000 45.071 ? 16  GLY FFF C   1 ? 
ATOM   1664 O O   . GLY B 2 16  ? -31.751 60.587 -28.402 1.000 47.598 ? 16  GLY FFF O   1 ? 
ATOM   1665 N N   . SER B 2 17  ? -30.599 59.486 -30.057 1.000 42.784 ? 17  SER FFF N   1 ? 
ATOM   1666 C CA  . SER B 2 17  ? -29.978 58.435 -29.211 1.000 35.264 ? 17  SER FFF CA  1 ? 
ATOM   1667 C C   . SER B 2 17  ? -28.512 58.245 -29.585 1.000 35.525 ? 17  SER FFF C   1 ? 
ATOM   1668 O O   . SER B 2 17  ? -28.147 58.472 -30.758 1.000 37.706 ? 17  SER FFF O   1 ? 
ATOM   1669 C CB  . SER B 2 17  ? -30.740 57.132 -29.308 1.000 43.496 ? 17  SER FFF CB  1 ? 
ATOM   1670 O OG  . SER B 2 17  ? -31.949 57.184 -28.550 1.000 47.522 ? 17  SER FFF OG  1 ? 
ATOM   1671 N N   . LEU B 2 18  ? -27.716 57.845 -28.590 1.000 34.502 ? 18  LEU FFF N   1 ? 
ATOM   1672 C CA  A LEU B 2 18  ? -26.273 57.528 -28.743 0.500 35.391 ? 18  LEU FFF CA  1 ? 
ATOM   1673 C CA  B LEU B 2 18  ? -26.272 57.534 -28.738 0.500 35.689 ? 18  LEU FFF CA  1 ? 
ATOM   1674 C C   . LEU B 2 18  ? -25.977 56.288 -27.902 1.000 33.061 ? 18  LEU FFF C   1 ? 
ATOM   1675 O O   . LEU B 2 18  ? -26.748 56.031 -26.964 1.000 33.999 ? 18  LEU FFF O   1 ? 
ATOM   1676 C CB  A LEU B 2 18  ? -25.432 58.722 -28.280 0.500 36.639 ? 18  LEU FFF CB  1 ? 
ATOM   1677 C CB  B LEU B 2 18  ? -25.459 58.741 -28.258 0.500 38.523 ? 18  LEU FFF CB  1 ? 
ATOM   1678 C CG  A LEU B 2 18  ? -25.282 59.862 -29.287 0.500 38.877 ? 18  LEU FFF CG  1 ? 
ATOM   1679 C CG  B LEU B 2 18  ? -24.399 59.254 -29.231 0.500 41.823 ? 18  LEU FFF CG  1 ? 
ATOM   1680 C CD1 A LEU B 2 18  ? -24.509 61.022 -28.677 0.500 39.733 ? 18  LEU FFF CD1 1 ? 
ATOM   1681 C CD1 B LEU B 2 18  ? -24.926 59.257 -30.660 0.500 44.311 ? 18  LEU FFF CD1 1 ? 
ATOM   1682 C CD2 A LEU B 2 18  ? -24.600 59.378 -30.560 0.500 41.577 ? 18  LEU FFF CD2 1 ? 
ATOM   1683 C CD2 B LEU B 2 18  ? -23.934 60.646 -28.831 0.500 42.694 ? 18  LEU FFF CD2 1 ? 
ATOM   1684 N N   . THR B 2 19  ? -24.918 55.556 -28.250 1.000 31.410 ? 19  THR FFF N   1 ? 
ATOM   1685 C CA  . THR B 2 19  ? -24.426 54.423 -27.432 1.000 28.172 ? 19  THR FFF CA  1 ? 
ATOM   1686 C C   . THR B 2 19  ? -22.942 54.606 -27.215 1.000 26.142 ? 19  THR FFF C   1 ? 
ATOM   1687 O O   . THR B 2 19  ? -22.179 54.611 -28.230 1.000 31.944 ? 19  THR FFF O   1 ? 
ATOM   1688 C CB  . THR B 2 19  ? -24.748 53.066 -28.072 1.000 26.692 ? 19  THR FFF CB  1 ? 
ATOM   1689 O OG1 . THR B 2 19  ? -26.172 52.997 -28.158 1.000 31.516 ? 19  THR FFF OG1 1 ? 
ATOM   1690 C CG2 . THR B 2 19  ? -24.248 51.897 -27.252 1.000 29.794 ? 19  THR FFF CG2 1 ? 
ATOM   1691 N N   . LEU B 2 20  ? -22.569 54.753 -25.944 1.000 27.010 ? 20  LEU FFF N   1 ? 
ATOM   1692 C CA  . LEU B 2 20  ? -21.172 54.782 -25.493 1.000 28.312 ? 20  LEU FFF CA  1 ? 
ATOM   1693 C C   . LEU B 2 20  ? -20.833 53.347 -25.122 1.000 24.967 ? 20  LEU FFF C   1 ? 
ATOM   1694 O O   . LEU B 2 20  ? -21.685 52.670 -24.528 1.000 30.633 ? 20  LEU FFF O   1 ? 
ATOM   1695 C CB  . LEU B 2 20  ? -21.052 55.719 -24.292 1.000 31.459 ? 20  LEU FFF CB  1 ? 
ATOM   1696 C CG  . LEU B 2 20  ? -21.703 57.092 -24.448 1.000 35.278 ? 20  LEU FFF CG  1 ? 
ATOM   1697 C CD1 . LEU B 2 20  ? -21.529 57.909 -23.179 1.000 35.663 ? 20  LEU FFF CD1 1 ? 
ATOM   1698 C CD2 . LEU B 2 20  ? -21.144 57.827 -25.653 1.000 36.694 ? 20  LEU FFF CD2 1 ? 
ATOM   1699 N N   . SER B 2 21  ? -19.632 52.918 -25.492 1.000 29.013 ? 21  SER FFF N   1 ? 
ATOM   1700 C CA  . SER B 2 21  ? -19.082 51.612 -25.087 1.000 29.712 ? 21  SER FFF CA  1 ? 
ATOM   1701 C C   . SER B 2 21  ? -17.873 51.894 -24.206 1.000 29.806 ? 21  SER FFF C   1 ? 
ATOM   1702 O O   . SER B 2 21  ? -17.128 52.881 -24.436 1.000 28.449 ? 21  SER FFF O   1 ? 
ATOM   1703 C CB  . SER B 2 21  ? -18.748 50.735 -26.261 1.000 32.109 ? 21  SER FFF CB  1 ? 
ATOM   1704 O OG  . SER B 2 21  ? -17.702 51.296 -27.042 1.000 35.182 ? 21  SER FFF OG  1 ? 
ATOM   1705 N N   . CYS B 2 22  ? -17.733 51.087 -23.179 1.000 27.087 ? 22  CYS FFF N   1 ? 
ATOM   1706 C CA  . CYS B 2 22  ? -16.511 51.064 -22.374 1.000 26.611 ? 22  CYS FFF CA  1 ? 
ATOM   1707 C C   . CYS B 2 22  ? -15.997 49.629 -22.315 1.000 24.242 ? 22  CYS FFF C   1 ? 
ATOM   1708 O O   . CYS B 2 22  ? -16.729 48.749 -21.846 1.000 23.984 ? 22  CYS FFF O   1 ? 
ATOM   1709 C CB  . CYS B 2 22  ? -16.821 51.642 -21.009 1.000 25.740 ? 22  CYS FFF CB  1 ? 
ATOM   1710 S SG  . CYS B 2 22  ? -15.337 51.733 -20.004 1.000 27.238 ? 22  CYS FFF SG  1 ? 
ATOM   1711 N N   . VAL B 2 23  ? -14.786 49.413 -22.812 1.000 24.815 ? 23  VAL FFF N   1 ? 
ATOM   1712 C CA  . VAL B 2 23  ? -14.103 48.098 -22.782 1.000 25.229 ? 23  VAL FFF CA  1 ? 
ATOM   1713 C C   . VAL B 2 23  ? -12.970 48.213 -21.784 1.000 25.343 ? 23  VAL FFF C   1 ? 
ATOM   1714 O O   . VAL B 2 23  ? -12.182 49.156 -21.888 1.000 28.401 ? 23  VAL FFF O   1 ? 
ATOM   1715 C CB  . VAL B 2 23  ? -13.583 47.647 -24.158 1.000 25.293 ? 23  VAL FFF CB  1 ? 
ATOM   1716 C CG1 . VAL B 2 23  ? -13.012 46.244 -24.043 1.000 26.942 ? 23  VAL FFF CG1 1 ? 
ATOM   1717 C CG2 . VAL B 2 23  ? -14.702 47.691 -25.188 1.000 29.617 ? 23  VAL FFF CG2 1 ? 
ATOM   1718 N N   . ALA B 2 24  ? -12.970 47.320 -20.814 1.000 25.141 ? 24  ALA FFF N   1 ? 
ATOM   1719 C CA  . ALA B 2 24  ? -11.918 47.265 -19.791 1.000 25.808 ? 24  ALA FFF CA  1 ? 
ATOM   1720 C C   . ALA B 2 24  ? -10.851 46.279 -20.262 1.000 25.017 ? 24  ALA FFF C   1 ? 
ATOM   1721 O O   . ALA B 2 24  ? -11.180 45.278 -20.935 1.000 25.672 ? 24  ALA FFF O   1 ? 
ATOM   1722 C CB  . ALA B 2 24  ? -12.536 46.897 -18.478 1.000 26.146 ? 24  ALA FFF CB  1 ? 
ATOM   1723 N N   . SER B 2 25  ? -9.595  46.574 -19.948 1.000 23.695 ? 25  SER FFF N   1 ? 
ATOM   1724 C CA  . SER B 2 25  ? -8.470  45.629 -20.104 1.000 26.448 ? 25  SER FFF CA  1 ? 
ATOM   1725 C C   . SER B 2 25  ? -7.646  45.673 -18.820 1.000 22.502 ? 25  SER FFF C   1 ? 
ATOM   1726 O O   . SER B 2 25  ? -7.707  46.702 -18.124 1.000 27.622 ? 25  SER FFF O   1 ? 
ATOM   1727 C CB  . SER B 2 25  ? -7.641  45.936 -21.322 1.000 30.181 ? 25  SER FFF CB  1 ? 
ATOM   1728 O OG  . SER B 2 25  ? -7.039  47.204 -21.219 1.000 35.750 ? 25  SER FFF OG  1 ? 
ATOM   1729 N N   . GLY B 2 26  ? -6.978  44.566 -18.508 1.000 23.626 ? 26  GLY FFF N   1 ? 
ATOM   1730 C CA  . GLY B 2 26  ? -6.154  44.403 -17.305 1.000 24.860 ? 26  GLY FFF CA  1 ? 
ATOM   1731 C C   . GLY B 2 26  ? -6.993  44.053 -16.103 1.000 25.074 ? 26  GLY FFF C   1 ? 
ATOM   1732 O O   . GLY B 2 26  ? -6.453  43.983 -14.999 1.000 27.406 ? 26  GLY FFF O   1 ? 
ATOM   1733 N N   . VAL B 2 27  ? -8.288  43.855 -16.337 1.000 23.750 ? 27  VAL FFF N   1 ? 
ATOM   1734 C CA  . VAL B 2 27  ? -9.292  43.385 -15.351 1.000 22.310 ? 27  VAL FFF CA  1 ? 
ATOM   1735 C C   . VAL B 2 27  ? -10.332 42.584 -16.141 1.000 22.055 ? 27  VAL FFF C   1 ? 
ATOM   1736 O O   . VAL B 2 27  ? -10.489 42.838 -17.335 1.000 24.256 ? 27  VAL FFF O   1 ? 
ATOM   1737 C CB  . VAL B 2 27  ? -9.919  44.576 -14.611 1.000 26.255 ? 27  VAL FFF CB  1 ? 
ATOM   1738 C CG1 . VAL B 2 27  ? -10.621 45.510 -15.583 1.000 28.880 ? 27  VAL FFF CG1 1 ? 
ATOM   1739 C CG2 . VAL B 2 27  ? -10.858 44.142 -13.503 1.000 26.863 ? 27  VAL FFF CG2 1 ? 
ATOM   1740 N N   . THR B 2 28  ? -10.938 41.590 -15.513 1.000 19.351 ? 28  THR FFF N   1 ? 
ATOM   1741 C CA  . THR B 2 28  ? -12.044 40.820 -16.111 1.000 18.493 ? 28  THR FFF CA  1 ? 
ATOM   1742 C C   . THR B 2 28  ? -13.333 41.286 -15.445 1.000 17.004 ? 28  THR FFF C   1 ? 
ATOM   1743 O O   . THR B 2 28  ? -13.403 41.204 -14.214 1.000 17.919 ? 28  THR FFF O   1 ? 
ATOM   1744 C CB  . THR B 2 28  ? -11.820 39.314 -15.902 1.000 19.856 ? 28  THR FFF CB  1 ? 
ATOM   1745 O OG1 . THR B 2 28  ? -10.577 38.981 -16.519 1.000 22.881 ? 28  THR FFF OG1 1 ? 
ATOM   1746 C CG2 . THR B 2 28  ? -12.921 38.469 -16.486 1.000 21.207 ? 28  THR FFF CG2 1 ? 
ATOM   1747 N N   . LEU B 2 29  ? -14.311 41.757 -16.215 1.000 16.074 ? 29  LEU FFF N   1 ? 
ATOM   1748 C CA  . LEU B 2 29  ? -15.599 42.120 -15.582 1.000 17.143 ? 29  LEU FFF CA  1 ? 
ATOM   1749 C C   . LEU B 2 29  ? -16.237 40.872 -14.981 1.000 16.612 ? 29  LEU FFF C   1 ? 
ATOM   1750 O O   . LEU B 2 29  ? -16.042 39.766 -15.507 1.000 17.258 ? 29  LEU FFF O   1 ? 
ATOM   1751 C CB  . LEU B 2 29  ? -16.526 42.757 -16.611 1.000 17.944 ? 29  LEU FFF CB  1 ? 
ATOM   1752 C CG  . LEU B 2 29  ? -16.049 44.088 -17.188 1.000 20.989 ? 29  LEU FFF CG  1 ? 
ATOM   1753 C CD1 . LEU B 2 29  ? -17.155 44.715 -18.017 1.000 22.539 ? 29  LEU FFF CD1 1 ? 
ATOM   1754 C CD2 . LEU B 2 29  ? -15.596 45.052 -16.103 1.000 21.568 ? 29  LEU FFF CD2 1 ? 
ATOM   1755 N N   . GLY B 2 30  ? -17.010 41.087 -13.925 1.000 14.985 ? 30  GLY FFF N   1 ? 
ATOM   1756 C CA  . GLY B 2 30  ? -17.675 39.992 -13.206 1.000 14.591 ? 30  GLY FFF CA  1 ? 
ATOM   1757 C C   . GLY B 2 30  ? -17.586 40.128 -11.713 1.000 14.347 ? 30  GLY FFF C   1 ? 
ATOM   1758 O O   . GLY B 2 30  ? -18.250 39.353 -11.018 1.000 14.326 ? 30  GLY FFF O   1 ? 
ATOM   1759 N N   . ARG B 2 31  ? -16.749 41.030 -11.202 1.000 14.820 ? 31  ARG FFF N   1 ? 
ATOM   1760 C CA  . ARG B 2 31  ? -16.777 41.320 -9.753  1.000 14.480 ? 31  ARG FFF CA  1 ? 
ATOM   1761 C C   . ARG B 2 31  ? -17.068 42.799 -9.492  1.000 14.981 ? 31  ARG FFF C   1 ? 
ATOM   1762 O O   . ARG B 2 31  ? -17.750 43.086 -8.516  1.000 16.017 ? 31  ARG FFF O   1 ? 
ATOM   1763 C CB  . ARG B 2 31  ? -15.456 40.900 -9.092  1.000 14.623 ? 31  ARG FFF CB  1 ? 
ATOM   1764 C CG  . ARG B 2 31  ? -15.368 41.256 -7.616  1.000 15.126 ? 31  ARG FFF CG  1 ? 
ATOM   1765 C CD  . ARG B 2 31  ? -16.501 40.698 -6.766  1.000 15.169 ? 31  ARG FFF CD  1 ? 
ATOM   1766 N NE  . ARG B 2 31  ? -16.395 41.117 -5.387  1.000 16.291 ? 31  ARG FFF NE  1 ? 
ATOM   1767 C CZ  . ARG B 2 31  ? -17.218 40.757 -4.417  1.000 16.608 ? 31  ARG FFF CZ  1 ? 
ATOM   1768 N NH1 . ARG B 2 31  ? -18.247 39.973 -4.703  1.000 17.617 ? 31  ARG FFF NH1 1 ? 
ATOM   1769 N NH2 . ARG B 2 31  ? -17.033 41.222 -3.194  1.000 17.650 ? 31  ARG FFF NH2 1 ? 
ATOM   1770 N N   . HIS B 2 32  ? -16.478 43.707 -10.252 1.000 15.311 ? 32  HIS FFF N   1 ? 
ATOM   1771 C CA  . HIS B 2 32  ? -16.404 45.124 -9.848  1.000 15.966 ? 32  HIS FFF CA  1 ? 
ATOM   1772 C C   . HIS B 2 32  ? -17.586 45.935 -10.364 1.000 16.403 ? 32  HIS FFF C   1 ? 
ATOM   1773 O O   . HIS B 2 32  ? -18.215 45.572 -11.382 1.000 15.799 ? 32  HIS FFF O   1 ? 
ATOM   1774 C CB  . HIS B 2 32  ? -15.094 45.743 -10.310 1.000 16.643 ? 32  HIS FFF CB  1 ? 
ATOM   1775 C CG  . HIS B 2 32  ? -13.934 44.988 -9.764  1.000 18.180 ? 32  HIS FFF CG  1 ? 
ATOM   1776 N ND1 . HIS B 2 32  ? -13.158 44.184 -10.557 1.000 18.898 ? 32  HIS FFF ND1 1 ? 
ATOM   1777 C CD2 . HIS B 2 32  ? -13.534 44.791 -8.490  1.000 18.856 ? 32  HIS FFF CD2 1 ? 
ATOM   1778 C CE1 . HIS B 2 32  ? -12.230 43.617 -9.815  1.000 21.886 ? 32  HIS FFF CE1 1 ? 
ATOM   1779 N NE2 . HIS B 2 32  ? -12.443 43.963 -8.537  1.000 22.071 ? 32  HIS FFF NE2 1 ? 
ATOM   1780 N N   . ALA B 2 33  ? -17.854 47.022 -9.659  1.000 17.080 ? 33  ALA FFF N   1 ? 
ATOM   1781 C CA  . ALA B 2 33  ? -18.795 48.075 -10.091 1.000 17.781 ? 33  ALA FFF CA  1 ? 
ATOM   1782 C C   . ALA B 2 33  ? -18.125 48.914 -11.180 1.000 18.324 ? 33  ALA FFF C   1 ? 
ATOM   1783 O O   . ALA B 2 33  ? -16.911 49.252 -11.062 1.000 18.209 ? 33  ALA FFF O   1 ? 
ATOM   1784 C CB  . ALA B 2 33  ? -19.166 48.923 -8.908  1.000 19.022 ? 33  ALA FFF CB  1 ? 
ATOM   1785 N N   . ILE B 2 34  ? -18.865 49.222 -12.225 1.000 18.040 ? 34  ILE FFF N   1 ? 
ATOM   1786 C CA  . ILE B 2 34  ? -18.370 50.032 -13.358 1.000 18.295 ? 34  ILE FFF CA  1 ? 
ATOM   1787 C C   . ILE B 2 34  ? -19.528 50.906 -13.805 1.000 19.463 ? 34  ILE FFF C   1 ? 
ATOM   1788 O O   . ILE B 2 34  ? -20.715 50.465 -13.774 1.000 20.445 ? 34  ILE FFF O   1 ? 
ATOM   1789 C CB  . ILE B 2 34  ? -17.778 49.159 -14.488 1.000 19.149 ? 34  ILE FFF CB  1 ? 
ATOM   1790 C CG1 . ILE B 2 34  ? -17.127 50.013 -15.582 1.000 18.898 ? 34  ILE FFF CG1 1 ? 
ATOM   1791 C CG2 . ILE B 2 34  ? -18.819 48.217 -15.064 1.000 19.767 ? 34  ILE FFF CG2 1 ? 
ATOM   1792 C CD1 . ILE B 2 34  ? -16.334 49.225 -16.606 1.000 20.590 ? 34  ILE FFF CD1 1 ? 
ATOM   1793 N N   . GLY B 2 35  ? -19.220 52.126 -14.187 1.000 20.960 ? 35  GLY FFF N   1 ? 
ATOM   1794 C CA  . GLY B 2 35  ? -20.290 53.052 -14.542 1.000 21.752 ? 35  GLY FFF CA  1 ? 
ATOM   1795 C C   . GLY B 2 35  ? -19.790 54.271 -15.270 1.000 21.761 ? 35  GLY FFF C   1 ? 
ATOM   1796 O O   . GLY B 2 35  ? -18.661 54.285 -15.798 1.000 22.557 ? 35  GLY FFF O   1 ? 
ATOM   1797 N N   . TRP B 2 36  ? -20.689 55.232 -15.335 1.000 24.143 ? 36  TRP FFF N   1 ? 
ATOM   1798 C CA  . TRP B 2 36  ? -20.550 56.470 -16.118 1.000 24.557 ? 36  TRP FFF CA  1 ? 
ATOM   1799 C C   . TRP B 2 36  ? -20.713 57.665 -15.198 1.000 23.567 ? 36  TRP FFF C   1 ? 
ATOM   1800 O O   . TRP B 2 36  ? -21.596 57.646 -14.329 1.000 22.650 ? 36  TRP FFF O   1 ? 
ATOM   1801 C CB  . TRP B 2 36  ? -21.619 56.477 -17.201 1.000 28.663 ? 36  TRP FFF CB  1 ? 
ATOM   1802 C CG  . TRP B 2 36  ? -21.419 55.339 -18.149 1.000 32.976 ? 36  TRP FFF CG  1 ? 
ATOM   1803 C CD1 . TRP B 2 36  ? -21.898 54.057 -18.077 1.000 33.721 ? 36  TRP FFF CD1 1 ? 
ATOM   1804 C CD2 . TRP B 2 36  ? -20.535 55.376 -19.270 1.000 32.041 ? 36  TRP FFF CD2 1 ? 
ATOM   1805 N NE1 . TRP B 2 36  ? -21.406 53.312 -19.119 1.000 31.136 ? 36  TRP FFF NE1 1 ? 
ATOM   1806 C CE2 . TRP B 2 36  ? -20.590 54.106 -19.880 1.000 34.125 ? 36  TRP FFF CE2 1 ? 
ATOM   1807 C CE3 . TRP B 2 36  ? -19.765 56.393 -19.846 1.000 30.293 ? 36  TRP FFF CE3 1 ? 
ATOM   1808 C CZ2 . TRP B 2 36  ? -19.894 53.817 -21.051 1.000 32.622 ? 36  TRP FFF CZ2 1 ? 
ATOM   1809 C CZ3 . TRP B 2 36  ? -19.063 56.098 -20.988 1.000 32.929 ? 36  TRP FFF CZ3 1 ? 
ATOM   1810 C CH2 . TRP B 2 36  ? -19.129 54.830 -21.579 1.000 38.026 ? 36  TRP FFF CH2 1 ? 
ATOM   1811 N N   . PHE B 2 37  ? -19.838 58.641 -15.397 1.000 23.585 ? 37  PHE FFF N   1 ? 
ATOM   1812 C CA  . PHE B 2 37  ? -19.934 60.003 -14.847 1.000 23.351 ? 37  PHE FFF CA  1 ? 
ATOM   1813 C C   . PHE B 2 37  ? -20.024 60.949 -16.034 1.000 22.829 ? 37  PHE FFF C   1 ? 
ATOM   1814 O O   . PHE B 2 37  ? -19.642 60.571 -17.160 1.000 24.471 ? 37  PHE FFF O   1 ? 
ATOM   1815 C CB  . PHE B 2 37  ? -18.698 60.331 -14.001 1.000 22.301 ? 37  PHE FFF CB  1 ? 
ATOM   1816 C CG  . PHE B 2 37  ? -18.655 59.640 -12.662 1.000 22.658 ? 37  PHE FFF CG  1 ? 
ATOM   1817 C CD1 . PHE B 2 37  ? -18.429 58.277 -12.582 1.000 21.493 ? 37  PHE FFF CD1 1 ? 
ATOM   1818 C CD2 . PHE B 2 37  ? -18.861 60.348 -11.483 1.000 23.271 ? 37  PHE FFF CD2 1 ? 
ATOM   1819 C CE1 . PHE B 2 37  ? -18.416 57.631 -11.353 1.000 23.226 ? 37  PHE FFF CE1 1 ? 
ATOM   1820 C CE2 . PHE B 2 37  ? -18.834 59.706 -10.252 1.000 25.697 ? 37  PHE FFF CE2 1 ? 
ATOM   1821 C CZ  . PHE B 2 37  ? -18.620 58.344 -10.188 1.000 23.839 ? 37  PHE FFF CZ  1 ? 
ATOM   1822 N N   . ARG B 2 38  ? -20.438 62.180 -15.783 1.000 23.543 ? 38  ARG FFF N   1 ? 
ATOM   1823 C CA  . ARG B 2 38  ? -20.334 63.218 -16.830 1.000 23.456 ? 38  ARG FFF CA  1 ? 
ATOM   1824 C C   . ARG B 2 38  ? -19.998 64.555 -16.179 1.000 22.654 ? 38  ARG FFF C   1 ? 
ATOM   1825 O O   . ARG B 2 38  ? -20.317 64.767 -14.984 1.000 24.059 ? 38  ARG FFF O   1 ? 
ATOM   1826 C CB  . ARG B 2 38  ? -21.614 63.306 -17.660 1.000 25.364 ? 38  ARG FFF CB  1 ? 
ATOM   1827 C CG  . ARG B 2 38  ? -22.807 63.805 -16.871 1.000 25.725 ? 38  ARG FFF CG  1 ? 
ATOM   1828 C CD  . ARG B 2 38  ? -24.050 63.756 -17.722 1.000 29.189 ? 38  ARG FFF CD  1 ? 
ATOM   1829 N NE  . ARG B 2 38  ? -25.224 64.053 -16.924 1.000 29.495 ? 38  ARG FFF NE  1 ? 
ATOM   1830 C CZ  . ARG B 2 38  ? -26.466 64.128 -17.406 1.000 33.215 ? 38  ARG FFF CZ  1 ? 
ATOM   1831 N NH1 . ARG B 2 38  ? -26.711 63.905 -18.689 1.000 32.873 ? 38  ARG FFF NH1 1 ? 
ATOM   1832 N NH2 . ARG B 2 38  ? -27.464 64.413 -16.590 1.000 36.816 ? 38  ARG FFF NH2 1 ? 
ATOM   1833 N N   . GLN B 2 39  ? -19.398 65.427 -16.976 1.000 22.422 ? 39  GLN FFF N   1 ? 
ATOM   1834 C CA  . GLN B 2 39  ? -19.147 66.822 -16.578 1.000 22.761 ? 39  GLN FFF CA  1 ? 
ATOM   1835 C C   . GLN B 2 39  ? -19.686 67.738 -17.675 1.000 22.821 ? 39  GLN FFF C   1 ? 
ATOM   1836 O O   . GLN B 2 39  ? -19.111 67.774 -18.768 1.000 22.738 ? 39  GLN FFF O   1 ? 
ATOM   1837 C CB  . GLN B 2 39  ? -17.664 67.032 -16.311 1.000 23.868 ? 39  GLN FFF CB  1 ? 
ATOM   1838 C CG  . GLN B 2 39  ? -17.385 68.438 -15.809 1.000 25.462 ? 39  GLN FFF CG  1 ? 
ATOM   1839 C CD  . GLN B 2 39  ? -15.999 68.563 -15.239 1.000 28.613 ? 39  GLN FFF CD  1 ? 
ATOM   1840 O OE1 . GLN B 2 39  ? -15.249 67.598 -15.198 1.000 36.536 ? 39  GLN FFF OE1 1 ? 
ATOM   1841 N NE2 . GLN B 2 39  ? -15.680 69.736 -14.734 1.000 30.965 ? 39  GLN FFF NE2 1 ? 
ATOM   1842 N N   . ALA B 2 40  ? -20.776 68.422 -17.359 1.000 24.253 ? 40  ALA FFF N   1 ? 
ATOM   1843 C CA  . ALA B 2 40  ? -21.437 69.414 -18.234 1.000 24.480 ? 40  ALA FFF CA  1 ? 
ATOM   1844 C C   . ALA B 2 40  ? -20.855 70.792 -17.956 1.000 24.539 ? 40  ALA FFF C   1 ? 
ATOM   1845 O O   . ALA B 2 40  ? -20.368 71.056 -16.859 1.000 23.664 ? 40  ALA FFF O   1 ? 
ATOM   1846 C CB  . ALA B 2 40  ? -22.918 69.409 -17.974 1.000 25.217 ? 40  ALA FFF CB  1 ? 
ATOM   1847 N N   . PRO B 2 41  ? -20.933 71.723 -18.930 1.000 24.120 ? 41  PRO FFF N   1 ? 
ATOM   1848 C CA  . PRO B 2 41  ? -20.436 73.079 -18.724 1.000 22.958 ? 41  PRO FFF CA  1 ? 
ATOM   1849 C C   . PRO B 2 41  ? -21.025 73.699 -17.452 1.000 23.785 ? 41  PRO FFF C   1 ? 
ATOM   1850 O O   . PRO B 2 41  ? -22.227 73.636 -17.255 1.000 25.382 ? 41  PRO FFF O   1 ? 
ATOM   1851 C CB  . PRO B 2 41  ? -20.890 73.819 -19.980 1.000 26.710 ? 41  PRO FFF CB  1 ? 
ATOM   1852 C CG  . PRO B 2 41  ? -20.930 72.728 -21.035 1.000 26.949 ? 41  PRO FFF CG  1 ? 
ATOM   1853 C CD  . PRO B 2 41  ? -21.449 71.514 -20.297 1.000 26.652 ? 41  PRO FFF CD  1 ? 
ATOM   1854 N N   . GLY B 2 42  ? -20.165 74.258 -16.609 1.000 24.631 ? 42  GLY FFF N   1 ? 
ATOM   1855 C CA  . GLY B 2 42  ? -20.571 74.972 -15.389 1.000 25.272 ? 42  GLY FFF CA  1 ? 
ATOM   1856 C C   . GLY B 2 42  ? -21.003 74.068 -14.256 1.000 25.634 ? 42  GLY FFF C   1 ? 
ATOM   1857 O O   . GLY B 2 42  ? -21.464 74.613 -13.237 1.000 27.861 ? 42  GLY FFF O   1 ? 
ATOM   1858 N N   . LYS B 2 43  ? -20.858 72.749 -14.396 1.000 25.070 ? 43  LYS FFF N   1 ? 
ATOM   1859 C CA  . LYS B 2 43  ? -21.322 71.792 -13.366 1.000 27.525 ? 43  LYS FFF CA  1 ? 
ATOM   1860 C C   . LYS B 2 43  ? -20.170 70.889 -12.922 1.000 24.445 ? 43  LYS FFF C   1 ? 
ATOM   1861 O O   . LYS B 2 43  ? -19.253 70.575 -13.728 1.000 24.814 ? 43  LYS FFF O   1 ? 
ATOM   1862 C CB  . LYS B 2 43  ? -22.484 70.952 -13.894 1.000 29.798 ? 43  LYS FFF CB  1 ? 
ATOM   1863 C CG  . LYS B 2 43  ? -23.787 71.714 -14.078 1.000 36.414 ? 43  LYS FFF CG  1 ? 
ATOM   1864 C CD  . LYS B 2 43  ? -24.974 70.796 -14.217 1.000 42.411 ? 43  LYS FFF CD  1 ? 
ATOM   1865 C CE  . LYS B 2 43  ? -26.250 71.394 -13.662 1.000 49.739 ? 43  LYS FFF CE  1 ? 
ATOM   1866 N NZ  . LYS B 2 43  ? -26.458 72.782 -14.139 1.000 56.654 ? 43  LYS FFF NZ  1 ? 
ATOM   1867 N N   . GLU B 2 44  ? -20.225 70.471 -11.671 1.000 27.898 ? 44  GLU FFF N   1 ? 
ATOM   1868 C CA  . GLU B 2 44  ? -19.262 69.488 -11.126 1.000 28.419 ? 44  GLU FFF CA  1 ? 
ATOM   1869 C C   . GLU B 2 44  ? -19.500 68.146 -11.820 1.000 26.977 ? 44  GLU FFF C   1 ? 
ATOM   1870 O O   . GLU B 2 44  ? -20.660 67.836 -12.180 1.000 25.209 ? 44  GLU FFF O   1 ? 
ATOM   1871 C CB  . GLU B 2 44  ? -19.424 69.371 -9.613  1.000 32.565 ? 44  GLU FFF CB  1 ? 
ATOM   1872 C CG  . GLU B 2 44  ? -18.990 70.608 -8.867  1.000 36.523 ? 44  GLU FFF CG  1 ? 
ATOM   1873 C CD  . GLU B 2 44  ? -18.853 70.388 -7.373  1.000 40.717 ? 44  GLU FFF CD  1 ? 
ATOM   1874 O OE1 . GLU B 2 44  ? -17.806 69.860 -6.955  1.000 48.198 ? 44  GLU FFF OE1 1 ? 
ATOM   1875 O OE2 . GLU B 2 44  ? -19.806 70.719 -6.639  1.000 50.726 ? 44  GLU FFF OE2 1 ? 
ATOM   1876 N N   . ARG B 2 45  ? -18.434 67.382 -12.017 1.000 26.118 ? 45  ARG FFF N   1 ? 
ATOM   1877 C CA  . ARG B 2 45  ? -18.530 65.980 -12.474 1.000 25.312 ? 45  ARG FFF CA  1 ? 
ATOM   1878 C C   . ARG B 2 45  ? -19.515 65.251 -11.556 1.000 25.597 ? 45  ARG FFF C   1 ? 
ATOM   1879 O O   . ARG B 2 45  ? -19.427 65.418 -10.323 1.000 27.755 ? 45  ARG FFF O   1 ? 
ATOM   1880 C CB  . ARG B 2 45  ? -17.156 65.312 -12.467 1.000 29.161 ? 45  ARG FFF CB  1 ? 
ATOM   1881 C CG  . ARG B 2 45  ? -17.168 63.937 -13.116 1.000 30.926 ? 45  ARG FFF CG  1 ? 
ATOM   1882 C CD  . ARG B 2 45  ? -15.788 63.341 -13.281 1.000 35.573 ? 45  ARG FFF CD  1 ? 
ATOM   1883 N NE  . ARG B 2 45  ? -14.889 64.266 -13.946 1.000 38.485 ? 45  ARG FFF NE  1 ? 
ATOM   1884 C CZ  . ARG B 2 45  ? -13.704 63.948 -14.459 1.000 41.009 ? 45  ARG FFF CZ  1 ? 
ATOM   1885 N NH1 . ARG B 2 45  ? -13.259 62.705 -14.401 1.000 39.316 ? 45  ARG FFF NH1 1 ? 
ATOM   1886 N NH2 . ARG B 2 45  ? -12.975 64.885 -15.044 1.000 44.503 ? 45  ARG FFF NH2 1 ? 
ATOM   1887 N N   . GLU B 2 46  ? -20.426 64.469 -12.128 1.000 24.590 ? 46  GLU FFF N   1 ? 
ATOM   1888 C CA  . GLU B 2 46  ? -21.454 63.753 -11.339 1.000 25.607 ? 46  GLU FFF CA  1 ? 
ATOM   1889 C C   . GLU B 2 46  ? -21.689 62.341 -11.886 1.000 24.919 ? 46  GLU FFF C   1 ? 
ATOM   1890 O O   . GLU B 2 46  ? -21.384 62.067 -13.080 1.000 23.028 ? 46  GLU FFF O   1 ? 
ATOM   1891 C CB  . GLU B 2 46  ? -22.783 64.505 -11.326 1.000 29.142 ? 46  GLU FFF CB  1 ? 
ATOM   1892 C CG  . GLU B 2 46  ? -23.373 64.712 -12.702 1.000 32.161 ? 46  GLU FFF CG  1 ? 
ATOM   1893 C CD  . GLU B 2 46  ? -24.589 65.619 -12.725 1.000 39.061 ? 46  GLU FFF CD  1 ? 
ATOM   1894 O OE1 . GLU B 2 46  ? -24.590 66.630 -11.998 1.000 44.979 ? 46  GLU FFF OE1 1 ? 
ATOM   1895 O OE2 . GLU B 2 46  ? -25.524 65.318 -13.479 1.000 44.074 ? 46  GLU FFF OE2 1 ? 
ATOM   1896 N N   . ARG B 2 47  ? -22.225 61.495 -11.007 1.000 27.425 ? 47  ARG FFF N   1 ? 
ATOM   1897 C CA  . ARG B 2 47  ? -22.708 60.123 -11.298 1.000 29.024 ? 47  ARG FFF CA  1 ? 
ATOM   1898 C C   . ARG B 2 47  ? -23.830 60.194 -12.335 1.000 27.202 ? 47  ARG FFF C   1 ? 
ATOM   1899 O O   . ARG B 2 47  ? -24.669 61.097 -12.247 1.000 29.398 ? 47  ARG FFF O   1 ? 
ATOM   1900 C CB  . ARG B 2 47  ? -23.208 59.466 -10.007 1.000 29.260 ? 47  ARG FFF CB  1 ? 
ATOM   1901 C CG  . ARG B 2 47  ? -22.102 59.016 -9.067  1.000 30.653 ? 47  ARG FFF CG  1 ? 
ATOM   1902 C CD  . ARG B 2 47  ? -22.610 58.437 -7.754  1.000 31.810 ? 47  ARG FFF CD  1 ? 
ATOM   1903 N NE  . ARG B 2 47  ? -21.511 57.942 -6.936  1.000 33.303 ? 47  ARG FFF NE  1 ? 
ATOM   1904 C CZ  . ARG B 2 47  ? -20.969 56.728 -7.036  1.000 34.471 ? 47  ARG FFF CZ  1 ? 
ATOM   1905 N NH1 . ARG B 2 47  ? -21.433 55.869 -7.921  1.000 34.117 ? 47  ARG FFF NH1 1 ? 
ATOM   1906 N NH2 . ARG B 2 47  ? -19.960 56.374 -6.251  1.000 37.421 ? 47  ARG FFF NH2 1 ? 
ATOM   1907 N N   . VAL B 2 48  ? -23.804 59.279 -13.301 1.000 27.281 ? 48  VAL FFF N   1 ? 
ATOM   1908 C CA  . VAL B 2 48  ? -24.897 59.082 -14.293 1.000 26.412 ? 48  VAL FFF CA  1 ? 
ATOM   1909 C C   . VAL B 2 48  ? -25.570 57.743 -13.996 1.000 26.305 ? 48  VAL FFF C   1 ? 
ATOM   1910 O O   . VAL B 2 48  ? -26.815 57.702 -13.770 1.000 29.423 ? 48  VAL FFF O   1 ? 
ATOM   1911 C CB  . VAL B 2 48  ? -24.340 59.152 -15.726 1.000 27.457 ? 48  VAL FFF CB  1 ? 
ATOM   1912 C CG1 . VAL B 2 48  ? -25.373 58.725 -16.753 1.000 29.055 ? 48  VAL FFF CG1 1 ? 
ATOM   1913 C CG2 . VAL B 2 48  ? -23.795 60.541 -16.044 1.000 29.353 ? 48  VAL FFF CG2 1 ? 
ATOM   1914 N N   . SER B 2 49  ? -24.779 56.677 -14.001 1.000 26.332 ? 49  SER FFF N   1 ? 
ATOM   1915 C CA  . SER B 2 49  ? -25.293 55.297 -13.863 1.000 27.791 ? 49  SER FFF CA  1 ? 
ATOM   1916 C C   . SER B 2 49  ? -24.154 54.359 -13.502 1.000 25.473 ? 49  SER FFF C   1 ? 
ATOM   1917 O O   . SER B 2 49  ? -23.008 54.629 -13.890 1.000 25.739 ? 49  SER FFF O   1 ? 
ATOM   1918 C CB  . SER B 2 49  ? -25.972 54.834 -15.124 1.000 29.979 ? 49  SER FFF CB  1 ? 
ATOM   1919 O OG  . SER B 2 49  ? -26.605 53.583 -14.909 1.000 34.818 ? 49  SER FFF OG  1 ? 
ATOM   1920 N N   . CYS B 2 50  ? -24.498 53.263 -12.847 1.000 24.531 ? 50  CYS FFF N   1 ? 
ATOM   1921 C CA  . CYS B 2 50  ? -23.520 52.240 -12.421 1.000 22.419 ? 50  CYS FFF CA  1 ? 
ATOM   1922 C C   . CYS B 2 50  ? -24.167 50.855 -12.477 1.000 21.590 ? 50  CYS FFF C   1 ? 
ATOM   1923 O O   . CYS B 2 50  ? -25.401 50.706 -12.248 1.000 22.749 ? 50  CYS FFF O   1 ? 
ATOM   1924 C CB  . CYS B 2 50  ? -23.014 52.555 -11.021 1.000 21.881 ? 50  CYS FFF CB  1 ? 
ATOM   1925 S SG  . CYS B 2 50  ? -21.650 51.492 -10.475 1.000 24.672 ? 50  CYS FFF SG  1 ? 
ATOM   1926 N N   . ILE B 2 51  ? -23.352 49.860 -12.794 1.000 19.495 ? 51  ILE FFF N   1 ? 
ATOM   1927 C CA  . ILE B 2 51  ? -23.769 48.436 -12.743 1.000 20.974 ? 51  ILE FFF CA  1 ? 
ATOM   1928 C C   . ILE B 2 51  ? -22.750 47.654 -11.928 1.000 19.371 ? 51  ILE FFF C   1 ? 
ATOM   1929 O O   . ILE B 2 51  ? -21.545 47.821 -12.133 1.000 18.798 ? 51  ILE FFF O   1 ? 
ATOM   1930 C CB  . ILE B 2 51  ? -23.969 47.848 -14.147 1.000 21.699 ? 51  ILE FFF CB  1 ? 
ATOM   1931 C CG1 . ILE B 2 51  ? -24.567 46.443 -14.036 1.000 22.193 ? 51  ILE FFF CG1 1 ? 
ATOM   1932 C CG2 . ILE B 2 51  ? -22.698 47.887 -14.979 1.000 21.625 ? 51  ILE FFF CG2 1 ? 
ATOM   1933 C CD1 . ILE B 2 51  ? -25.102 45.911 -15.330 1.000 23.767 ? 51  ILE FFF CD1 1 ? 
ATOM   1934 N N   . ARG B 2 52  ? -23.260 46.824 -11.033 1.000 17.828 ? 52  ARG FFF N   1 ? 
ATOM   1935 C CA  . ARG B 2 52  ? -22.477 45.827 -10.294 1.000 17.633 ? 52  ARG FFF CA  1 ? 
ATOM   1936 C C   . ARG B 2 52  ? -22.277 44.634 -11.215 1.000 16.992 ? 52  ARG FFF C   1 ? 
ATOM   1937 O O   . ARG B 2 52  ? -23.259 43.933 -11.483 1.000 17.856 ? 52  ARG FFF O   1 ? 
ATOM   1938 C CB  . ARG B 2 52  ? -23.247 45.441 -9.038  1.000 18.302 ? 52  ARG FFF CB  1 ? 
ATOM   1939 C CG  . ARG B 2 52  ? -23.406 46.589 -8.062  1.000 19.900 ? 52  ARG FFF CG  1 ? 
ATOM   1940 C CD  . ARG B 2 52  ? -24.540 46.364 -7.096  1.000 22.678 ? 52  ARG FFF CD  1 ? 
ATOM   1941 N NE  . ARG B 2 52  ? -24.404 45.100 -6.426  1.000 23.885 ? 52  ARG FFF NE  1 ? 
ATOM   1942 C CZ  . ARG B 2 52  ? -23.733 44.881 -5.300  1.000 28.397 ? 52  ARG FFF CZ  1 ? 
ATOM   1943 N NH1 . ARG B 2 52  ? -23.160 45.875 -4.639  1.000 30.097 ? 52  ARG FFF NH1 1 ? 
ATOM   1944 N NH2 . ARG B 2 52  ? -23.671 43.653 -4.814  1.000 31.808 ? 52  ARG FFF NH2 1 ? 
ATOM   1945 N N   . THR B 2 53  ? -21.076 44.389 -11.730 1.000 15.796 ? 53  THR FFF N   1 ? 
ATOM   1946 C CA  . THR B 2 53  ? -20.889 43.246 -12.656 1.000 15.012 ? 53  THR FFF CA  1 ? 
ATOM   1947 C C   . THR B 2 53  ? -20.934 41.907 -11.916 1.000 14.067 ? 53  THR FFF C   1 ? 
ATOM   1948 O O   . THR B 2 53  ? -20.962 40.878 -12.601 1.000 14.563 ? 53  THR FFF O   1 ? 
ATOM   1949 C CB  . THR B 2 53  ? -19.666 43.397 -13.564 1.000 15.848 ? 53  THR FFF CB  1 ? 
ATOM   1950 O OG1 . THR B 2 53  ? -18.456 43.259 -12.812 1.000 15.370 ? 53  THR FFF OG1 1 ? 
ATOM   1951 C CG2 . THR B 2 53  ? -19.708 44.702 -14.320 1.000 16.811 ? 53  THR FFF CG2 1 ? 
ATOM   1952 N N   . PHE B 2 54  ? -20.967 41.898 -10.577 1.000 14.119 ? 54  PHE FFF N   1 ? 
ATOM   1953 C CA  . PHE B 2 54  ? -21.088 40.649 -9.802  1.000 14.947 ? 54  PHE FFF CA  1 ? 
ATOM   1954 C C   . PHE B 2 54  ? -22.523 40.117 -9.859  1.000 15.750 ? 54  PHE FFF C   1 ? 
ATOM   1955 O O   . PHE B 2 54  ? -22.701 38.891 -9.789  1.000 15.997 ? 54  PHE FFF O   1 ? 
ATOM   1956 C CB  . PHE B 2 54  ? -20.628 40.861 -8.365  1.000 14.847 ? 54  PHE FFF CB  1 ? 
ATOM   1957 C CG  . PHE B 2 54  ? -20.484 39.597 -7.567  1.000 15.579 ? 54  PHE FFF CG  1 ? 
ATOM   1958 C CD1 . PHE B 2 54  ? -19.478 38.688 -7.846  1.000 15.179 ? 54  PHE FFF CD1 1 ? 
ATOM   1959 C CD2 . PHE B 2 54  ? -21.336 39.324 -6.508  1.000 16.591 ? 54  PHE FFF CD2 1 ? 
ATOM   1960 C CE1 . PHE B 2 54  ? -19.304 37.548 -7.081  1.000 16.366 ? 54  PHE FFF CE1 1 ? 
ATOM   1961 C CE2 . PHE B 2 54  ? -21.180 38.173 -5.753  1.000 18.615 ? 54  PHE FFF CE2 1 ? 
ATOM   1962 C CZ  . PHE B 2 54  ? -20.159 37.289 -6.034  1.000 17.912 ? 54  PHE FFF CZ  1 ? 
ATOM   1963 N N   . ASP B 2 55  ? -23.519 41.005 -9.913  1.000 16.987 ? 55  ASP FFF N   1 ? 
ATOM   1964 C CA  . ASP B 2 55  ? -24.922 40.549 -9.745  1.000 18.004 ? 55  ASP FFF CA  1 ? 
ATOM   1965 C C   . ASP B 2 55  ? -25.867 41.280 -10.709 1.000 17.540 ? 55  ASP FFF C   1 ? 
ATOM   1966 O O   . ASP B 2 55  ? -27.091 40.971 -10.670 1.000 20.281 ? 55  ASP FFF O   1 ? 
ATOM   1967 C CB  . ASP B 2 55  ? -25.335 40.616 -8.275  1.000 19.294 ? 55  ASP FFF CB  1 ? 
ATOM   1968 C CG  . ASP B 2 55  ? -25.319 41.995 -7.647  1.000 21.919 ? 55  ASP FFF CG  1 ? 
ATOM   1969 O OD1 . ASP B 2 55  ? -25.239 42.980 -8.389  1.000 21.737 ? 55  ASP FFF OD1 1 ? 
ATOM   1970 O OD2 . ASP B 2 55  ? -25.454 42.062 -6.391  1.000 29.117 ? 55  ASP FFF OD2 1 ? 
ATOM   1971 N N   . GLY B 2 56  ? -25.358 42.190 -11.541 1.000 18.326 ? 56  GLY FFF N   1 ? 
ATOM   1972 C CA  . GLY B 2 56  ? -26.134 42.854 -12.603 1.000 19.825 ? 56  GLY FFF CA  1 ? 
ATOM   1973 C C   . GLY B 2 56  ? -27.009 43.983 -12.090 1.000 20.467 ? 56  GLY FFF C   1 ? 
ATOM   1974 O O   . GLY B 2 56  ? -27.759 44.561 -12.897 1.000 23.336 ? 56  GLY FFF O   1 ? 
ATOM   1975 N N   . ILE B 2 57  ? -26.962 44.294 -10.796 1.000 19.229 ? 57  ILE FFF N   1 ? 
ATOM   1976 C CA  . ILE B 2 57  ? -27.869 45.328 -10.226 1.000 20.890 ? 57  ILE FFF CA  1 ? 
ATOM   1977 C C   . ILE B 2 57  ? -27.399 46.717 -10.670 1.000 23.609 ? 57  ILE FFF C   1 ? 
ATOM   1978 O O   . ILE B 2 57  ? -26.207 47.026 -10.519 1.000 22.020 ? 57  ILE FFF O   1 ? 
ATOM   1979 C CB  . ILE B 2 57  ? -27.970 45.194 -8.701  1.000 24.975 ? 57  ILE FFF CB  1 ? 
ATOM   1980 C CG1 . ILE B 2 57  ? -28.601 43.856 -8.312  1.000 25.661 ? 57  ILE FFF CG1 1 ? 
ATOM   1981 C CG2 . ILE B 2 57  ? -28.731 46.370 -8.112  1.000 25.140 ? 57  ILE FFF CG2 1 ? 
ATOM   1982 C CD1 . ILE B 2 57  ? -28.466 43.533 -6.848  1.000 31.075 ? 57  ILE FFF CD1 1 ? 
ATOM   1983 N N   . THR B 2 58  ? -28.311 47.511 -11.231 1.000 25.257 ? 58  THR FFF N   1 ? 
ATOM   1984 C CA  . THR B 2 58  ? -28.033 48.839 -11.824 1.000 25.623 ? 58  THR FFF CA  1 ? 
ATOM   1985 C C   . THR B 2 58  ? -28.527 49.940 -10.892 1.000 27.655 ? 58  THR FFF C   1 ? 
ATOM   1986 O O   . THR B 2 58  ? -29.478 49.709 -10.106 1.000 29.721 ? 58  THR FFF O   1 ? 
ATOM   1987 C CB  . THR B 2 58  ? -28.669 48.982 -13.208 1.000 25.889 ? 58  THR FFF CB  1 ? 
ATOM   1988 O OG1 . THR B 2 58  ? -30.087 48.870 -13.078 1.000 28.482 ? 58  THR FFF OG1 1 ? 
ATOM   1989 C CG2 . THR B 2 58  ? -28.172 47.938 -14.182 1.000 27.935 ? 58  THR FFF CG2 1 ? 
ATOM   1990 N N   . SER B 2 59  ? -27.929 51.117 -11.021 1.000 27.654 ? 59  SER FFF N   1 ? 
ATOM   1991 C CA  . SER B 2 59  ? -28.293 52.308 -10.223 1.000 29.404 ? 59  SER FFF CA  1 ? 
ATOM   1992 C C   . SER B 2 59  ? -28.225 53.544 -11.114 1.000 30.106 ? 59  SER FFF C   1 ? 
ATOM   1993 O O   . SER B 2 59  ? -27.454 53.554 -12.112 1.000 25.827 ? 59  SER FFF O   1 ? 
ATOM   1994 C CB  . SER B 2 59  ? -27.446 52.421 -8.985  1.000 28.760 ? 59  SER FFF CB  1 ? 
ATOM   1995 O OG  . SER B 2 59  ? -26.079 52.470 -9.318  1.000 33.009 ? 59  SER FFF OG  1 ? 
ATOM   1996 N N   . TYR B 2 60  ? -29.078 54.511 -10.794 1.000 32.031 ? 60  TYR FFF N   1 ? 
ATOM   1997 C CA  . TYR B 2 60  ? -29.315 55.723 -11.612 1.000 35.120 ? 60  TYR FFF CA  1 ? 
ATOM   1998 C C   . TYR B 2 60  ? -29.459 56.912 -10.666 1.000 35.774 ? 60  TYR FFF C   1 ? 
ATOM   1999 O O   . TYR B 2 60  ? -29.600 56.712 -9.441  1.000 37.909 ? 60  TYR FFF O   1 ? 
ATOM   2000 C CB  . TYR B 2 60  ? -30.544 55.532 -12.509 1.000 35.239 ? 60  TYR FFF CB  1 ? 
ATOM   2001 C CG  . TYR B 2 60  ? -30.423 54.379 -13.480 1.000 34.616 ? 60  TYR FFF CG  1 ? 
ATOM   2002 C CD1 . TYR B 2 60  ? -29.820 54.549 -14.716 1.000 34.468 ? 60  TYR FFF CD1 1 ? 
ATOM   2003 C CD2 . TYR B 2 60  ? -30.877 53.111 -13.154 1.000 34.910 ? 60  TYR FFF CD2 1 ? 
ATOM   2004 C CE1 . TYR B 2 60  ? -29.654 53.494 -15.595 1.000 37.961 ? 60  TYR FFF CE1 1 ? 
ATOM   2005 C CE2 . TYR B 2 60  ? -30.737 52.048 -14.033 1.000 36.012 ? 60  TYR FFF CE2 1 ? 
ATOM   2006 C CZ  . TYR B 2 60  ? -30.127 52.240 -15.260 1.000 36.290 ? 60  TYR FFF CZ  1 ? 
ATOM   2007 O OH  . TYR B 2 60  ? -29.974 51.211 -16.143 1.000 36.946 ? 60  TYR FFF OH  1 ? 
ATOM   2008 N N   . VAL B 2 61  ? -29.331 58.107 -11.224 1.000 40.932 ? 61  VAL FFF N   1 ? 
ATOM   2009 C CA  . VAL B 2 61  ? -29.649 59.389 -10.535 1.000 42.859 ? 61  VAL FFF CA  1 ? 
ATOM   2010 C C   . VAL B 2 61  ? -30.956 59.906 -11.137 1.000 45.254 ? 61  VAL FFF C   1 ? 
ATOM   2011 O O   . VAL B 2 61  ? -31.349 59.403 -12.201 1.000 47.516 ? 61  VAL FFF O   1 ? 
ATOM   2012 C CB  . VAL B 2 61  ? -28.486 60.396 -10.640 1.000 41.326 ? 61  VAL FFF CB  1 ? 
ATOM   2013 C CG1 . VAL B 2 61  ? -27.259 59.888 -9.898  1.000 40.118 ? 61  VAL FFF CG1 1 ? 
ATOM   2014 C CG2 . VAL B 2 61  ? -28.142 60.749 -12.081 1.000 42.496 ? 61  VAL FFF CG2 1 ? 
ATOM   2015 N N   . GLU B 2 62  ? -31.609 60.846 -10.462 1.000 49.463 ? 62  GLU FFF N   1 ? 
ATOM   2016 C CA  . GLU B 2 62  ? -32.960 61.353 -10.826 1.000 52.590 ? 62  GLU FFF CA  1 ? 
ATOM   2017 C C   . GLU B 2 62  ? -33.032 61.706 -12.319 1.000 51.880 ? 62  GLU FFF C   1 ? 
ATOM   2018 O O   . GLU B 2 62  ? -34.055 61.354 -12.955 1.000 54.838 ? 62  GLU FFF O   1 ? 
ATOM   2019 C CB  . GLU B 2 62  ? -33.304 62.560 -9.954  1.000 58.920 ? 62  GLU FFF CB  1 ? 
ATOM   2020 C CG  . GLU B 2 62  ? -33.444 62.225 -8.476  1.000 64.340 ? 62  GLU FFF CG  1 ? 
ATOM   2021 C CD  . GLU B 2 62  ? -34.473 61.153 -8.158  1.000 69.523 ? 62  GLU FFF CD  1 ? 
ATOM   2022 O OE1 . GLU B 2 62  ? -35.628 61.520 -7.863  1.000 73.340 ? 62  GLU FFF OE1 1 ? 
ATOM   2023 O OE2 . GLU B 2 62  ? -34.117 59.953 -8.203  1.000 76.892 ? 62  GLU FFF OE2 1 ? 
ATOM   2024 N N   . SER B 2 63  ? -31.998 62.353 -12.873 1.000 45.295 ? 63  SER FFF N   1 ? 
ATOM   2025 C CA  . SER B 2 63  ? -32.058 63.001 -14.211 1.000 45.177 ? 63  SER FFF CA  1 ? 
ATOM   2026 C C   . SER B 2 63  ? -31.941 61.987 -15.359 1.000 46.044 ? 63  SER FFF C   1 ? 
ATOM   2027 O O   . SER B 2 63  ? -32.305 62.374 -16.486 1.000 49.210 ? 63  SER FFF O   1 ? 
ATOM   2028 C CB  . SER B 2 63  ? -31.044 64.114 -14.336 1.000 46.146 ? 63  SER FFF CB  1 ? 
ATOM   2029 O OG  . SER B 2 63  ? -29.725 63.622 -14.471 1.000 46.705 ? 63  SER FFF OG  1 ? 
ATOM   2030 N N   . THR B 2 64  ? -31.493 60.749 -15.095 1.000 44.710 ? 64  THR FFF N   1 ? 
ATOM   2031 C CA  . THR B 2 64  ? -31.068 59.756 -16.129 1.000 43.375 ? 64  THR FFF CA  1 ? 
ATOM   2032 C C   . THR B 2 64  ? -31.997 58.533 -16.191 1.000 45.971 ? 64  THR FFF C   1 ? 
ATOM   2033 O O   . THR B 2 64  ? -32.066 57.921 -17.286 1.000 45.430 ? 64  THR FFF O   1 ? 
ATOM   2034 C CB  . THR B 2 64  ? -29.615 59.319 -15.905 1.000 42.716 ? 64  THR FFF CB  1 ? 
ATOM   2035 O OG1 . THR B 2 64  ? -29.502 58.572 -14.691 1.000 45.808 ? 64  THR FFF OG1 1 ? 
ATOM   2036 C CG2 . THR B 2 64  ? -28.684 60.508 -15.857 1.000 46.680 ? 64  THR FFF CG2 1 ? 
ATOM   2037 N N   . LYS B 2 65  ? -32.636 58.155 -15.076 1.000 45.088 ? 65  LYS FFF N   1 ? 
ATOM   2038 C CA  . LYS B 2 65  ? -33.643 57.057 -14.997 1.000 49.767 ? 65  LYS FFF CA  1 ? 
ATOM   2039 C C   . LYS B 2 65  ? -34.577 57.054 -16.217 1.000 49.175 ? 65  LYS FFF C   1 ? 
ATOM   2040 O O   . LYS B 2 65  ? -35.212 58.092 -16.488 1.000 52.273 ? 65  LYS FFF O   1 ? 
ATOM   2041 C CB  . LYS B 2 65  ? -34.556 57.237 -13.784 1.000 54.734 ? 65  LYS FFF CB  1 ? 
ATOM   2042 C CG  . LYS B 2 65  ? -33.958 56.892 -12.432 1.000 53.464 ? 65  LYS FFF CG  1 ? 
ATOM   2043 C CD  . LYS B 2 65  ? -34.868 57.351 -11.302 1.000 61.910 ? 65  LYS FFF CD  1 ? 
ATOM   2044 C CE  . LYS B 2 65  ? -34.749 56.501 -10.054 1.000 67.182 ? 65  LYS FFF CE  1 ? 
ATOM   2045 N NZ  . LYS B 2 65  ? -33.343 56.403 -9.589  1.000 66.167 ? 65  LYS FFF NZ  1 ? 
ATOM   2046 N N   . GLY B 2 66  ? -34.704 55.902 -16.882 1.000 42.850 ? 66  GLY FFF N   1 ? 
ATOM   2047 C CA  . GLY B 2 66  ? -35.698 55.661 -17.944 1.000 40.678 ? 66  GLY FFF CA  1 ? 
ATOM   2048 C C   . GLY B 2 66  ? -35.116 55.901 -19.322 1.000 42.427 ? 66  GLY FFF C   1 ? 
ATOM   2049 O O   . GLY B 2 66  ? -35.280 55.025 -20.197 1.000 48.902 ? 66  GLY FFF O   1 ? 
ATOM   2050 N N   . ARG B 2 67  ? -34.450 57.041 -19.504 1.000 39.045 ? 67  ARG FFF N   1 ? 
ATOM   2051 C CA  . ARG B 2 67  ? -33.867 57.497 -20.793 1.000 40.544 ? 67  ARG FFF CA  1 ? 
ATOM   2052 C C   . ARG B 2 67  ? -32.568 56.745 -21.063 1.000 37.954 ? 67  ARG FFF C   1 ? 
ATOM   2053 O O   . ARG B 2 67  ? -32.251 56.514 -22.256 1.000 37.115 ? 67  ARG FFF O   1 ? 
ATOM   2054 C CB  . ARG B 2 67  ? -33.550 58.998 -20.742 1.000 43.581 ? 67  ARG FFF CB  1 ? 
ATOM   2055 C CG  . ARG B 2 67  ? -34.735 59.871 -20.362 1.000 47.724 ? 67  ARG FFF CG  1 ? 
ATOM   2056 C CD  . ARG B 2 67  ? -34.451 61.347 -20.570 1.000 48.355 ? 67  ARG FFF CD  1 ? 
ATOM   2057 N NE  . ARG B 2 67  ? -33.409 61.872 -19.691 1.000 43.870 ? 67  ARG FFF NE  1 ? 
ATOM   2058 C CZ  . ARG B 2 67  ? -32.336 62.565 -20.080 1.000 41.945 ? 67  ARG FFF CZ  1 ? 
ATOM   2059 N NH1 . ARG B 2 67  ? -32.102 62.810 -21.360 1.000 40.372 ? 67  ARG FFF NH1 1 ? 
ATOM   2060 N NH2 . ARG B 2 67  ? -31.476 62.990 -19.172 1.000 40.659 ? 67  ARG FFF NH2 1 ? 
ATOM   2061 N N   . PHE B 2 68  ? -31.800 56.479 -20.001 1.000 37.754 ? 68  PHE FFF N   1 ? 
ATOM   2062 C CA  . PHE B 2 68  ? -30.513 55.751 -20.066 1.000 39.697 ? 68  PHE FFF CA  1 ? 
ATOM   2063 C C   . PHE B 2 68  ? -30.682 54.376 -19.418 1.000 38.105 ? 68  PHE FFF C   1 ? 
ATOM   2064 O O   . PHE B 2 68  ? -31.374 54.192 -18.400 1.000 37.530 ? 68  PHE FFF O   1 ? 
ATOM   2065 C CB  . PHE B 2 68  ? -29.386 56.506 -19.365 1.000 39.025 ? 68  PHE FFF CB  1 ? 
ATOM   2066 C CG  . PHE B 2 68  ? -29.146 57.934 -19.785 1.000 38.681 ? 68  PHE FFF CG  1 ? 
ATOM   2067 C CD1 . PHE B 2 68  ? -29.787 58.517 -20.872 1.000 38.916 ? 68  PHE FFF CD1 1 ? 
ATOM   2068 C CD2 . PHE B 2 68  ? -28.242 58.699 -19.070 1.000 41.920 ? 68  PHE FFF CD2 1 ? 
ATOM   2069 C CE1 . PHE B 2 68  ? -29.540 59.836 -21.214 1.000 41.001 ? 68  PHE FFF CE1 1 ? 
ATOM   2070 C CE2 . PHE B 2 68  ? -27.995 60.017 -19.411 1.000 43.734 ? 68  PHE FFF CE2 1 ? 
ATOM   2071 C CZ  . PHE B 2 68  ? -28.651 60.587 -20.477 1.000 42.832 ? 68  PHE FFF CZ  1 ? 
ATOM   2072 N N   . THR B 2 69  ? -30.054 53.389 -20.019 1.000 35.532 ? 69  THR FFF N   1 ? 
ATOM   2073 C CA  . THR B 2 69  ? -30.017 52.033 -19.440 1.000 36.034 ? 69  THR FFF CA  1 ? 
ATOM   2074 C C   . THR B 2 69  ? -28.568 51.597 -19.533 1.000 34.469 ? 69  THR FFF C   1 ? 
ATOM   2075 O O   . THR B 2 69  ? -27.972 51.741 -20.622 1.000 33.450 ? 69  THR FFF O   1 ? 
ATOM   2076 C CB  . THR B 2 69  ? -31.050 51.128 -20.110 1.000 38.880 ? 69  THR FFF CB  1 ? 
ATOM   2077 O OG1 . THR B 2 69  ? -30.775 51.145 -21.510 1.000 52.120 ? 69  THR FFF OG1 1 ? 
ATOM   2078 C CG2 . THR B 2 69  ? -32.476 51.587 -19.883 1.000 36.882 ? 69  THR FFF CG2 1 ? 
ATOM   2079 N N   . ILE B 2 70  ? -28.007 51.261 -18.376 1.000 32.462 ? 70  ILE FFF N   1 ? 
ATOM   2080 C CA  A ILE B 2 70  ? -26.653 50.659 -18.244 0.500 32.142 ? 70  ILE FFF CA  1 ? 
ATOM   2081 C CA  B ILE B 2 70  ? -26.655 50.658 -18.297 0.500 30.877 ? 70  ILE FFF CA  1 ? 
ATOM   2082 C C   . ILE B 2 70  ? -26.818 49.140 -18.350 1.000 30.031 ? 70  ILE FFF C   1 ? 
ATOM   2083 O O   . ILE B 2 70  ? -27.788 48.599 -17.752 1.000 29.545 ? 70  ILE FFF O   1 ? 
ATOM   2084 C CB  A ILE B 2 70  ? -25.981 51.100 -16.923 0.500 31.855 ? 70  ILE FFF CB  1 ? 
ATOM   2085 C CB  B ILE B 2 70  ? -25.885 51.123 -17.048 0.500 28.839 ? 70  ILE FFF CB  1 ? 
ATOM   2086 C CG1 A ILE B 2 70  ? -24.480 50.815 -16.925 0.500 34.030 ? 70  ILE FFF CG1 1 ? 
ATOM   2087 C CG1 B ILE B 2 70  ? -24.412 50.742 -17.168 0.500 27.404 ? 70  ILE FFF CG1 1 ? 
ATOM   2088 C CG2 A ILE B 2 70  ? -26.650 50.478 -15.705 0.500 32.611 ? 70  ILE FFF CG2 1 ? 
ATOM   2089 C CG2 B ILE B 2 70  ? -26.503 50.596 -15.759 0.500 29.792 ? 70  ILE FFF CG2 1 ? 
ATOM   2090 C CD1 A ILE B 2 70  ? -23.794 51.210 -18.192 0.500 33.248 ? 70  ILE FFF CD1 1 ? 
ATOM   2091 C CD1 B ILE B 2 70  ? -23.532 51.477 -16.190 0.500 25.075 ? 70  ILE FFF CD1 1 ? 
ATOM   2092 N N   . SER B 2 71  ? -25.919 48.494 -19.071 1.000 27.278 ? 71  SER FFF N   1 ? 
ATOM   2093 C CA  A SER B 2 71  ? -25.876 47.017 -19.181 0.500 25.120 ? 71  SER FFF CA  1 ? 
ATOM   2094 C CA  B SER B 2 71  ? -25.870 47.015 -19.143 0.500 27.388 ? 71  SER FFF CA  1 ? 
ATOM   2095 C C   . SER B 2 71  ? -24.416 46.570 -19.247 1.000 25.712 ? 71  SER FFF C   1 ? 
ATOM   2096 O O   . SER B 2 71  ? -23.580 47.383 -19.682 1.000 26.480 ? 71  SER FFF O   1 ? 
ATOM   2097 C CB  A SER B 2 71  ? -26.673 46.540 -20.365 0.500 23.630 ? 71  SER FFF CB  1 ? 
ATOM   2098 C CB  B SER B 2 71  ? -26.694 46.491 -20.279 0.500 30.655 ? 71  SER FFF CB  1 ? 
ATOM   2099 O OG  A SER B 2 71  ? -26.083 46.936 -21.594 0.500 21.677 ? 71  SER FFF OG  1 ? 
ATOM   2100 O OG  B SER B 2 71  ? -28.025 46.234 -19.850 0.500 36.617 ? 71  SER FFF OG  1 ? 
ATOM   2101 N N   . SER B 2 72  ? -24.153 45.341 -18.825 1.000 24.436 ? 72  SER FFF N   1 ? 
ATOM   2102 C CA  . SER B 2 72  ? -22.830 44.703 -18.982 1.000 21.742 ? 72  SER FFF CA  1 ? 
ATOM   2103 C C   . SER B 2 72  ? -22.976 43.470 -19.864 1.000 21.467 ? 72  SER FFF C   1 ? 
ATOM   2104 O O   . SER B 2 72  ? -24.040 42.809 -19.821 1.000 21.756 ? 72  SER FFF O   1 ? 
ATOM   2105 C CB  . SER B 2 72  ? -22.217 44.336 -17.655 1.000 21.614 ? 72  SER FFF CB  1 ? 
ATOM   2106 O OG  . SER B 2 72  ? -20.864 43.920 -17.846 1.000 23.951 ? 72  SER FFF OG  1 ? 
ATOM   2107 N N   . ASN B 2 73  ? -21.919 43.174 -20.601 1.000 20.218 ? 73  ASN FFF N   1 ? 
ATOM   2108 C CA  . ASN B 2 73  ? -21.668 41.863 -21.227 1.000 19.932 ? 73  ASN FFF CA  1 ? 
ATOM   2109 C C   . ASN B 2 73  ? -20.345 41.361 -20.668 1.000 18.833 ? 73  ASN FFF C   1 ? 
ATOM   2110 O O   . ASN B 2 73  ? -19.269 41.669 -21.251 1.000 20.041 ? 73  ASN FFF O   1 ? 
ATOM   2111 C CB  . ASN B 2 73  ? -21.699 41.946 -22.756 1.000 20.760 ? 73  ASN FFF CB  1 ? 
ATOM   2112 C CG  . ASN B 2 73  ? -21.829 40.577 -23.380 1.000 20.947 ? 73  ASN FFF CG  1 ? 
ATOM   2113 O OD1 . ASN B 2 73  ? -21.426 39.577 -22.776 1.000 22.879 ? 73  ASN FFF OD1 1 ? 
ATOM   2114 N ND2 . ASN B 2 73  ? -22.415 40.525 -24.565 1.000 25.848 ? 73  ASN FFF ND2 1 ? 
ATOM   2115 N N   . ASN B 2 74  ? -20.399 40.669 -19.540 1.000 17.365 ? 74  ASN FFF N   1 ? 
ATOM   2116 C CA  . ASN B 2 74  ? -19.159 40.327 -18.801 1.000 17.566 ? 74  ASN FFF CA  1 ? 
ATOM   2117 C C   . ASN B 2 74  ? -18.179 39.582 -19.716 1.000 18.222 ? 74  ASN FFF C   1 ? 
ATOM   2118 O O   . ASN B 2 74  ? -16.948 39.881 -19.679 1.000 19.079 ? 74  ASN FFF O   1 ? 
ATOM   2119 C CB  . ASN B 2 74  ? -19.455 39.510 -17.543 1.000 16.261 ? 74  ASN FFF CB  1 ? 
ATOM   2120 C CG  . ASN B 2 74  ? -20.078 40.303 -16.410 1.000 15.619 ? 74  ASN FFF CG  1 ? 
ATOM   2121 O OD1 . ASN B 2 74  ? -20.336 41.512 -16.530 1.000 17.902 ? 74  ASN FFF OD1 1 ? 
ATOM   2122 N ND2 . ASN B 2 74  ? -20.347 39.608 -15.306 1.000 14.993 ? 74  ASN FFF ND2 1 ? 
ATOM   2123 N N   . ALA B 2 75  ? -18.662 38.650 -20.523 1.000 18.472 ? 75  ALA FFF N   1 ? 
ATOM   2124 C CA  . ALA B 2 75  ? -17.806 37.830 -21.412 1.000 19.620 ? 75  ALA FFF CA  1 ? 
ATOM   2125 C C   . ALA B 2 75  ? -17.043 38.714 -22.408 1.000 19.853 ? 75  ALA FFF C   1 ? 
ATOM   2126 O O   . ALA B 2 75  ? -15.964 38.293 -22.834 1.000 22.693 ? 75  ALA FFF O   1 ? 
ATOM   2127 C CB  . ALA B 2 75  ? -18.632 36.801 -22.119 1.000 21.982 ? 75  ALA FFF CB  1 ? 
ATOM   2128 N N   . MET B 2 76  ? -17.597 39.866 -22.771 1.000 20.882 ? 76  MET FFF N   1 ? 
ATOM   2129 C CA  A MET B 2 76  ? -17.021 40.822 -23.755 0.500 21.591 ? 76  MET FFF CA  1 ? 
ATOM   2130 C CA  B MET B 2 76  ? -16.959 40.777 -23.759 0.500 23.196 ? 76  MET FFF CA  1 ? 
ATOM   2131 C C   . MET B 2 76  ? -16.195 41.891 -23.028 1.000 21.832 ? 76  MET FFF C   1 ? 
ATOM   2132 O O   . MET B 2 76  ? -15.568 42.738 -23.715 1.000 22.774 ? 76  MET FFF O   1 ? 
ATOM   2133 C CB  A MET B 2 76  ? -18.139 41.495 -24.564 0.500 22.789 ? 76  MET FFF CB  1 ? 
ATOM   2134 C CB  B MET B 2 76  ? -18.008 41.353 -24.720 0.500 26.976 ? 76  MET FFF CB  1 ? 
ATOM   2135 C CG  A MET B 2 76  ? -19.049 40.508 -25.270 0.500 22.424 ? 76  MET FFF CG  1 ? 
ATOM   2136 C CG  B MET B 2 76  ? -18.709 40.273 -25.534 0.500 30.909 ? 76  MET FFF CG  1 ? 
ATOM   2137 S SD  A MET B 2 76  ? -18.097 39.296 -26.212 0.500 23.485 ? 76  MET FFF SD  1 ? 
ATOM   2138 S SD  B MET B 2 76  ? -19.726 40.921 -26.882 0.500 37.619 ? 76  MET FFF SD  1 ? 
ATOM   2139 C CE  A MET B 2 76  ? -17.359 40.360 -27.438 0.500 22.311 ? 76  MET FFF CE  1 ? 
ATOM   2140 C CE  B MET B 2 76  ? -18.742 42.321 -27.405 0.500 37.806 ? 76  MET FFF CE  1 ? 
ATOM   2141 N N   . ASN B 2 77  ? -16.176 41.856 -21.697 1.000 19.562 ? 77  ASN FFF N   1 ? 
ATOM   2142 C CA  . ASN B 2 77  ? -15.512 42.903 -20.874 1.000 19.537 ? 77  ASN FFF CA  1 ? 
ATOM   2143 C C   . ASN B 2 77  ? -15.987 44.305 -21.274 1.000 19.646 ? 77  ASN FFF C   1 ? 
ATOM   2144 O O   . ASN B 2 77  ? -15.194 45.270 -21.201 1.000 21.871 ? 77  ASN FFF O   1 ? 
ATOM   2145 C CB  . ASN B 2 77  ? -13.993 42.824 -21.016 1.000 20.505 ? 77  ASN FFF CB  1 ? 
ATOM   2146 C CG  . ASN B 2 77  ? -13.335 42.439 -19.721 1.000 22.413 ? 77  ASN FFF CG  1 ? 
ATOM   2147 O OD1 . ASN B 2 77  ? -13.841 41.586 -18.986 1.000 22.075 ? 77  ASN FFF OD1 1 ? 
ATOM   2148 N ND2 . ASN B 2 77  ? -12.211 43.087 -19.441 1.000 24.022 ? 77  ASN FFF ND2 1 ? 
ATOM   2149 N N   . THR B 2 78  ? -17.255 44.430 -21.659 1.000 20.365 ? 78  THR FFF N   1 ? 
ATOM   2150 C CA  . THR B 2 78  ? -17.803 45.680 -22.204 1.000 22.107 ? 78  THR FFF CA  1 ? 
ATOM   2151 C C   . THR B 2 78  ? -19.051 46.061 -21.426 1.000 22.593 ? 78  THR FFF C   1 ? 
ATOM   2152 O O   . THR B 2 78  ? -19.881 45.185 -21.155 1.000 23.880 ? 78  THR FFF O   1 ? 
ATOM   2153 C CB  . THR B 2 78  ? -18.110 45.560 -23.701 1.000 24.531 ? 78  THR FFF CB  1 ? 
ATOM   2154 O OG1 . THR B 2 78  ? -16.938 45.103 -24.373 1.000 26.383 ? 78  THR FFF OG1 1 ? 
ATOM   2155 C CG2 . THR B 2 78  ? -18.557 46.875 -24.298 1.000 27.044 ? 78  THR FFF CG2 1 ? 
ATOM   2156 N N   . VAL B 2 79  ? -19.170 47.342 -21.131 1.000 24.287 ? 79  VAL FFF N   1 ? 
ATOM   2157 C CA  . VAL B 2 79  ? -20.414 47.945 -20.606 1.000 24.324 ? 79  VAL FFF CA  1 ? 
ATOM   2158 C C   . VAL B 2 79  ? -20.874 49.009 -21.594 1.000 26.576 ? 79  VAL FFF C   1 ? 
ATOM   2159 O O   . VAL B 2 79  ? -20.061 49.549 -22.406 1.000 25.989 ? 79  VAL FFF O   1 ? 
ATOM   2160 C CB  . VAL B 2 79  ? -20.242 48.490 -19.182 1.000 26.950 ? 79  VAL FFF CB  1 ? 
ATOM   2161 C CG1 . VAL B 2 79  ? -19.910 47.350 -18.227 1.000 26.674 ? 79  VAL FFF CG1 1 ? 
ATOM   2162 C CG2 . VAL B 2 79  ? -19.202 49.598 -19.107 1.000 26.843 ? 79  VAL FFF CG2 1 ? 
ATOM   2163 N N   . TYR B 2 80  ? -22.171 49.220 -21.554 1.000 27.723 ? 80  TYR FFF N   1 ? 
ATOM   2164 C CA  . TYR B 2 80  ? -22.927 50.011 -22.538 1.000 30.078 ? 80  TYR FFF CA  1 ? 
ATOM   2165 C C   . TYR B 2 80  ? -23.773 51.013 -21.788 1.000 30.326 ? 80  TYR FFF C   1 ? 
ATOM   2166 O O   . TYR B 2 80  ? -24.411 50.644 -20.787 1.000 30.150 ? 80  TYR FFF O   1 ? 
ATOM   2167 C CB  . TYR B 2 80  ? -23.866 49.115 -23.334 1.000 30.983 ? 80  TYR FFF CB  1 ? 
ATOM   2168 C CG  . TYR B 2 80  ? -23.140 48.026 -24.068 1.000 32.517 ? 80  TYR FFF CG  1 ? 
ATOM   2169 C CD1 . TYR B 2 80  ? -22.536 48.288 -25.283 1.000 32.422 ? 80  TYR FFF CD1 1 ? 
ATOM   2170 C CD2 . TYR B 2 80  ? -23.017 46.753 -23.530 1.000 33.697 ? 80  TYR FFF CD2 1 ? 
ATOM   2171 C CE1 . TYR B 2 80  ? -21.865 47.299 -25.976 1.000 34.566 ? 80  TYR FFF CE1 1 ? 
ATOM   2172 C CE2 . TYR B 2 80  ? -22.339 45.752 -24.211 1.000 36.189 ? 80  TYR FFF CE2 1 ? 
ATOM   2173 C CZ  . TYR B 2 80  ? -21.747 46.035 -25.432 1.000 35.473 ? 80  TYR FFF CZ  1 ? 
ATOM   2174 O OH  . TYR B 2 80  ? -21.062 45.079 -26.122 1.000 42.340 ? 80  TYR FFF OH  1 ? 
ATOM   2175 N N   . LEU B 2 81  ? -23.767 52.235 -22.294 1.000 33.540 ? 81  LEU FFF N   1 ? 
ATOM   2176 C CA  . LEU B 2 81  ? -24.739 53.261 -21.900 1.000 32.708 ? 81  LEU FFF CA  1 ? 
ATOM   2177 C C   . LEU B 2 81  ? -25.479 53.677 -23.167 1.000 34.217 ? 81  LEU FFF C   1 ? 
ATOM   2178 O O   . LEU B 2 81  ? -24.824 54.285 -24.101 1.000 29.259 ? 81  LEU FFF O   1 ? 
ATOM   2179 C CB  . LEU B 2 81  ? -24.038 54.440 -21.239 1.000 31.385 ? 81  LEU FFF CB  1 ? 
ATOM   2180 C CG  . LEU B 2 81  ? -24.979 55.467 -20.621 1.000 31.787 ? 81  LEU FFF CG  1 ? 
ATOM   2181 C CD1 . LEU B 2 81  ? -25.754 54.880 -19.453 1.000 32.497 ? 81  LEU FFF CD1 1 ? 
ATOM   2182 C CD2 . LEU B 2 81  ? -24.201 56.692 -20.181 1.000 30.826 ? 81  LEU FFF CD2 1 ? 
ATOM   2183 N N   . GLN B 2 82  ? -26.714 53.176 -23.230 1.000 34.135 ? 82  GLN FFF N   1 ? 
ATOM   2184 C CA  A GLN B 2 82  ? -27.720 53.519 -24.262 0.500 34.284 ? 82  GLN FFF CA  1 ? 
ATOM   2185 C CA  B GLN B 2 82  ? -27.718 53.521 -24.270 0.500 34.775 ? 82  GLN FFF CA  1 ? 
ATOM   2186 C C   . GLN B 2 82  ? -28.396 54.812 -23.817 1.000 36.346 ? 82  GLN FFF C   1 ? 
ATOM   2187 O O   . GLN B 2 82  ? -29.090 54.766 -22.757 1.000 33.553 ? 82  GLN FFF O   1 ? 
ATOM   2188 C CB  A GLN B 2 82  ? -28.753 52.399 -24.420 0.500 35.483 ? 82  GLN FFF CB  1 ? 
ATOM   2189 C CB  B GLN B 2 82  ? -28.741 52.394 -24.465 0.500 38.199 ? 82  GLN FFF CB  1 ? 
ATOM   2190 C CG  A GLN B 2 82  ? -29.762 52.670 -25.526 0.500 35.397 ? 82  GLN FFF CG  1 ? 
ATOM   2191 C CG  B GLN B 2 82  ? -29.804 52.693 -25.522 0.500 40.500 ? 82  GLN FFF CG  1 ? 
ATOM   2192 C CD  A GLN B 2 82  ? -29.043 53.175 -26.750 0.500 35.053 ? 82  GLN FFF CD  1 ? 
ATOM   2193 C CD  B GLN B 2 82  ? -30.917 51.672 -25.580 0.500 43.440 ? 82  GLN FFF CD  1 ? 
ATOM   2194 O OE1 A GLN B 2 82  ? -27.895 52.803 -26.993 0.500 30.915 ? 82  GLN FFF OE1 1 ? 
ATOM   2195 O OE1 B GLN B 2 82  ? -30.847 50.602 -24.982 0.500 49.091 ? 82  GLN FFF OE1 1 ? 
ATOM   2196 N NE2 A GLN B 2 82  ? -29.700 54.048 -27.504 0.500 34.123 ? 82  GLN FFF NE2 1 ? 
ATOM   2197 N NE2 B GLN B 2 82  ? -31.961 51.988 -26.323 0.500 44.654 ? 82  GLN FFF NE2 1 ? 
ATOM   2198 N N   . MET B 2 83  ? -28.176 55.889 -24.578 1.000 34.768 ? 83  MET FFF N   1 ? 
ATOM   2199 C CA  A MET B 2 83  ? -28.687 57.241 -24.241 0.500 37.044 ? 83  MET FFF CA  1 ? 
ATOM   2200 C CA  B MET B 2 83  ? -28.674 57.245 -24.246 0.500 36.228 ? 83  MET FFF CA  1 ? 
ATOM   2201 C C   . MET B 2 83  ? -29.808 57.603 -25.217 1.000 35.752 ? 83  MET FFF C   1 ? 
ATOM   2202 O O   . MET B 2 83  ? -29.496 57.819 -26.416 1.000 36.751 ? 83  MET FFF O   1 ? 
ATOM   2203 C CB  A MET B 2 83  ? -27.575 58.288 -24.315 0.500 37.390 ? 83  MET FFF CB  1 ? 
ATOM   2204 C CB  B MET B 2 83  ? -27.524 58.253 -24.334 0.500 35.894 ? 83  MET FFF CB  1 ? 
ATOM   2205 C CG  A MET B 2 83  ? -26.677 58.300 -23.098 0.500 38.262 ? 83  MET FFF CG  1 ? 
ATOM   2206 C CG  B MET B 2 83  ? -26.211 57.698 -23.789 0.500 35.376 ? 83  MET FFF CG  1 ? 
ATOM   2207 S SD  A MET B 2 83  ? -25.608 59.751 -23.153 0.500 40.243 ? 83  MET FFF SD  1 ? 
ATOM   2208 S SD  B MET B 2 83  ? -25.193 58.983 -23.063 0.500 39.196 ? 83  MET FFF SD  1 ? 
ATOM   2209 C CE  A MET B 2 83  ? -24.501 59.233 -24.464 0.500 34.754 ? 83  MET FFF CE  1 ? 
ATOM   2210 C CE  B MET B 2 83  ? -26.331 59.480 -21.773 0.500 28.221 ? 83  MET FFF CE  1 ? 
ATOM   2211 N N   . ASN B 2 84  ? -31.047 57.632 -24.701 1.000 34.674 ? 84  ASN FFF N   1 ? 
ATOM   2212 C CA  . ASN B 2 84  ? -32.309 57.967 -25.421 1.000 41.229 ? 84  ASN FFF CA  1 ? 
ATOM   2213 C C   . ASN B 2 84  ? -32.910 59.271 -24.887 1.000 43.544 ? 84  ASN FFF C   1 ? 
ATOM   2214 O O   . ASN B 2 84  ? -32.536 59.690 -23.786 1.000 48.453 ? 84  ASN FFF O   1 ? 
ATOM   2215 C CB  . ASN B 2 84  ? -33.406 56.909 -25.248 1.000 44.469 ? 84  ASN FFF CB  1 ? 
ATOM   2216 C CG  . ASN B 2 84  ? -33.014 55.529 -25.726 1.000 44.020 ? 84  ASN FFF CG  1 ? 
ATOM   2217 O OD1 . ASN B 2 84  ? -32.252 55.385 -26.681 1.000 50.463 ? 84  ASN FFF OD1 1 ? 
ATOM   2218 N ND2 . ASN B 2 84  ? -33.518 54.505 -25.057 1.000 53.384 ? 84  ASN FFF ND2 1 ? 
ATOM   2219 N N   . SER B 2 85  ? -33.872 59.848 -25.613 1.000 46.288 ? 85  SER FFF N   1 ? 
ATOM   2220 C CA  . SER B 2 85  ? -34.610 61.073 -25.203 1.000 46.814 ? 85  SER FFF CA  1 ? 
ATOM   2221 C C   . SER B 2 85  ? -33.602 62.142 -24.763 1.000 43.803 ? 85  SER FFF C   1 ? 
ATOM   2222 O O   . SER B 2 85  ? -33.823 62.787 -23.708 1.000 42.278 ? 85  SER FFF O   1 ? 
ATOM   2223 C CB  . SER B 2 85  ? -35.604 60.762 -24.108 1.000 48.557 ? 85  SER FFF CB  1 ? 
ATOM   2224 O OG  . SER B 2 85  ? -36.699 60.004 -24.610 1.000 54.893 ? 85  SER FFF OG  1 ? 
ATOM   2225 N N   . LEU B 2 86  ? -32.521 62.303 -25.535 1.000 44.047 ? 86  LEU FFF N   1 ? 
ATOM   2226 C CA  . LEU B 2 86  ? -31.395 63.222 -25.199 1.000 38.068 ? 86  LEU FFF CA  1 ? 
ATOM   2227 C C   . LEU B 2 86  ? -31.884 64.674 -25.321 1.000 38.731 ? 86  LEU FFF C   1 ? 
ATOM   2228 O O   . LEU B 2 86  ? -32.739 64.967 -26.194 1.000 44.431 ? 86  LEU FFF O   1 ? 
ATOM   2229 C CB  . LEU B 2 86  ? -30.190 62.936 -26.107 1.000 41.677 ? 86  LEU FFF CB  1 ? 
ATOM   2230 C CG  . LEU B 2 86  ? -29.318 61.742 -25.700 1.000 40.928 ? 86  LEU FFF CG  1 ? 
ATOM   2231 C CD1 . LEU B 2 86  ? -28.347 61.347 -26.810 1.000 42.491 ? 86  LEU FFF CD1 1 ? 
ATOM   2232 C CD2 . LEU B 2 86  ? -28.547 62.039 -24.421 1.000 41.527 ? 86  LEU FFF CD2 1 ? 
ATOM   2233 N N   . LYS B 2 87  ? -31.404 65.529 -24.417 1.000 40.136 ? 87  LYS FFF N   1 ? 
ATOM   2234 C CA  . LYS B 2 87  ? -31.746 66.972 -24.331 1.000 38.710 ? 87  LYS FFF CA  1 ? 
ATOM   2235 C C   . LYS B 2 87  ? -30.447 67.771 -24.340 1.000 38.620 ? 87  LYS FFF C   1 ? 
ATOM   2236 O O   . LYS B 2 87  ? -29.396 67.259 -23.966 1.000 39.004 ? 87  LYS FFF O   1 ? 
ATOM   2237 C CB  . LYS B 2 87  ? -32.511 67.296 -23.045 1.000 42.324 ? 87  LYS FFF CB  1 ? 
ATOM   2238 C CG  . LYS B 2 87  ? -33.735 66.439 -22.751 1.000 46.367 ? 87  LYS FFF CG  1 ? 
ATOM   2239 C CD  . LYS B 2 87  ? -34.321 66.744 -21.386 1.000 52.867 ? 87  LYS FFF CD  1 ? 
ATOM   2240 C CE  . LYS B 2 87  ? -35.683 66.124 -21.149 1.000 56.697 ? 87  LYS FFF CE  1 ? 
ATOM   2241 N NZ  . LYS B 2 87  ? -35.600 64.655 -20.970 1.000 58.748 ? 87  LYS FFF NZ  1 ? 
ATOM   2242 N N   . PRO B 2 88  ? -30.494 69.051 -24.764 1.000 36.606 ? 88  PRO FFF N   1 ? 
ATOM   2243 C CA  . PRO B 2 88  ? -29.310 69.908 -24.797 1.000 37.041 ? 88  PRO FFF CA  1 ? 
ATOM   2244 C C   . PRO B 2 88  ? -28.504 69.865 -23.488 1.000 36.036 ? 88  PRO FFF C   1 ? 
ATOM   2245 O O   . PRO B 2 88  ? -27.277 69.834 -23.569 1.000 35.557 ? 88  PRO FFF O   1 ? 
ATOM   2246 C CB  . PRO B 2 88  ? -29.928 71.286 -25.063 1.000 37.497 ? 88  PRO FFF CB  1 ? 
ATOM   2247 C CG  . PRO B 2 88  ? -31.140 70.971 -25.914 1.000 37.546 ? 88  PRO FFF CG  1 ? 
ATOM   2248 C CD  . PRO B 2 88  ? -31.701 69.720 -25.284 1.000 37.200 ? 88  PRO FFF CD  1 ? 
ATOM   2249 N N   . GLU B 2 89  ? -29.197 69.825 -22.340 1.000 37.487 ? 89  GLU FFF N   1 ? 
ATOM   2250 C CA  . GLU B 2 89  ? -28.589 69.815 -20.978 1.000 38.468 ? 89  GLU FFF CA  1 ? 
ATOM   2251 C C   . GLU B 2 89  ? -27.810 68.512 -20.730 1.000 34.830 ? 89  GLU FFF C   1 ? 
ATOM   2252 O O   . GLU B 2 89  ? -27.132 68.456 -19.701 1.000 36.178 ? 89  GLU FFF O   1 ? 
ATOM   2253 C CB  . GLU B 2 89  ? -29.612 69.907 -19.840 1.000 43.647 ? 89  GLU FFF CB  1 ? 
ATOM   2254 C CG  . GLU B 2 89  ? -30.729 70.894 -20.058 1.000 48.449 ? 89  GLU FFF CG  1 ? 
ATOM   2255 C CD  . GLU B 2 89  ? -31.925 70.275 -20.761 1.000 51.811 ? 89  GLU FFF CD  1 ? 
ATOM   2256 O OE1 . GLU B 2 89  ? -32.226 70.704 -21.884 1.000 52.372 ? 89  GLU FFF OE1 1 ? 
ATOM   2257 O OE2 . GLU B 2 89  ? -32.521 69.339 -20.193 1.000 60.633 ? 89  GLU FFF OE2 1 ? 
ATOM   2258 N N   . ASP B 2 90  ? -27.949 67.495 -21.592 1.000 34.785 ? 90  ASP FFF N   1 ? 
ATOM   2259 C CA  . ASP B 2 90  ? -27.176 66.224 -21.536 1.000 32.948 ? 90  ASP FFF CA  1 ? 
ATOM   2260 C C   . ASP B 2 90  ? -25.798 66.410 -22.184 1.000 30.316 ? 90  ASP FFF C   1 ? 
ATOM   2261 O O   . ASP B 2 90  ? -24.988 65.480 -22.092 1.000 30.000 ? 90  ASP FFF O   1 ? 
ATOM   2262 C CB  . ASP B 2 90  ? -27.926 65.070 -22.208 1.000 33.835 ? 90  ASP FFF CB  1 ? 
ATOM   2263 C CG  . ASP B 2 90  ? -29.169 64.651 -21.447 1.000 35.700 ? 90  ASP FFF CG  1 ? 
ATOM   2264 O OD1 . ASP B 2 90  ? -29.095 64.577 -20.200 1.000 37.680 ? 90  ASP FFF OD1 1 ? 
ATOM   2265 O OD2 . ASP B 2 90  ? -30.203 64.396 -22.105 1.000 42.737 ? 90  ASP FFF OD2 1 ? 
ATOM   2266 N N   . THR B 2 91  ? -25.554 67.559 -22.820 1.000 28.495 ? 91  THR FFF N   1 ? 
ATOM   2267 C CA  . THR B 2 91  ? -24.246 67.908 -23.421 1.000 28.881 ? 91  THR FFF CA  1 ? 
ATOM   2268 C C   . THR B 2 91  ? -23.228 67.924 -22.292 1.000 28.027 ? 91  THR FFF C   1 ? 
ATOM   2269 O O   . THR B 2 91  ? -23.465 68.635 -21.292 1.000 27.916 ? 91  THR FFF O   1 ? 
ATOM   2270 C CB  . THR B 2 91  ? -24.262 69.255 -24.155 1.000 28.138 ? 91  THR FFF CB  1 ? 
ATOM   2271 O OG1 . THR B 2 91  ? -25.184 69.172 -25.239 1.000 30.447 ? 91  THR FFF OG1 1 ? 
ATOM   2272 C CG2 . THR B 2 91  ? -22.899 69.656 -24.681 1.000 31.285 ? 91  THR FFF CG2 1 ? 
ATOM   2273 N N   . ALA B 2 92  ? -22.156 67.157 -22.455 1.000 26.924 ? 92  ALA FFF N   1 ? 
ATOM   2274 C CA  . ALA B 2 92  ? -21.163 66.910 -21.392 1.000 25.751 ? 92  ALA FFF CA  1 ? 
ATOM   2275 C C   . ALA B 2 92  ? -20.058 66.006 -21.927 1.000 25.925 ? 92  ALA FFF C   1 ? 
ATOM   2276 O O   . ALA B 2 92  ? -20.243 65.360 -22.983 1.000 28.016 ? 92  ALA FFF O   1 ? 
ATOM   2277 C CB  . ALA B 2 92  ? -21.850 66.305 -20.191 1.000 25.555 ? 92  ALA FFF CB  1 ? 
ATOM   2278 N N   . VAL B 2 93  ? -18.945 65.963 -21.207 1.000 24.187 ? 93  VAL FFF N   1 ? 
ATOM   2279 C CA  . VAL B 2 93  ? -17.936 64.879 -21.366 1.000 24.441 ? 93  VAL FFF CA  1 ? 
ATOM   2280 C C   . VAL B 2 93  ? -18.389 63.720 -20.486 1.000 24.152 ? 93  VAL FFF C   1 ? 
ATOM   2281 O O   . VAL B 2 93  ? -18.669 63.949 -19.285 1.000 25.134 ? 93  VAL FFF O   1 ? 
ATOM   2282 C CB  . VAL B 2 93  ? -16.523 65.351 -21.001 1.000 24.842 ? 93  VAL FFF CB  1 ? 
ATOM   2283 C CG1 . VAL B 2 93  ? -15.501 64.226 -21.147 1.000 26.111 ? 93  VAL FFF CG1 1 ? 
ATOM   2284 C CG2 . VAL B 2 93  ? -16.122 66.566 -21.824 1.000 25.858 ? 93  VAL FFF CG2 1 ? 
ATOM   2285 N N   . TYR B 2 94  ? -18.481 62.531 -21.073 1.000 23.995 ? 94  TYR FFF N   1 ? 
ATOM   2286 C CA  . TYR B 2 94  ? -18.908 61.297 -20.380 1.000 24.482 ? 94  TYR FFF CA  1 ? 
ATOM   2287 C C   . TYR B 2 94  ? -17.676 60.442 -20.149 1.000 23.190 ? 94  TYR FFF C   1 ? 
ATOM   2288 O O   . TYR B 2 94  ? -16.908 60.245 -21.101 1.000 25.667 ? 94  TYR FFF O   1 ? 
ATOM   2289 C CB  . TYR B 2 94  ? -19.960 60.557 -21.198 1.000 25.217 ? 94  TYR FFF CB  1 ? 
ATOM   2290 C CG  . TYR B 2 94  ? -21.306 61.222 -21.143 1.000 25.556 ? 94  TYR FFF CG  1 ? 
ATOM   2291 C CD1 . TYR B 2 94  ? -21.534 62.409 -21.814 1.000 26.338 ? 94  TYR FFF CD1 1 ? 
ATOM   2292 C CD2 . TYR B 2 94  ? -22.325 60.708 -20.369 1.000 28.978 ? 94  TYR FFF CD2 1 ? 
ATOM   2293 C CE1 . TYR B 2 94  ? -22.765 63.039 -21.759 1.000 24.983 ? 94  TYR FFF CE1 1 ? 
ATOM   2294 C CE2 . TYR B 2 94  ? -23.562 61.323 -20.299 1.000 28.812 ? 94  TYR FFF CE2 1 ? 
ATOM   2295 C CZ  . TYR B 2 94  ? -23.775 62.503 -20.981 1.000 26.329 ? 94  TYR FFF CZ  1 ? 
ATOM   2296 O OH  . TYR B 2 94  ? -24.991 63.112 -20.903 1.000 28.927 ? 94  TYR FFF OH  1 ? 
ATOM   2297 N N   . PHE B 2 95  ? -17.501 59.988 -18.913 1.000 23.358 ? 95  PHE FFF N   1 ? 
ATOM   2298 C CA  . PHE B 2 95  ? -16.340 59.189 -18.481 1.000 24.590 ? 95  PHE FFF CA  1 ? 
ATOM   2299 C C   . PHE B 2 95  ? -16.839 57.843 -17.986 1.000 23.727 ? 95  PHE FFF C   1 ? 
ATOM   2300 O O   . PHE B 2 95  ? -17.717 57.792 -17.114 1.000 25.802 ? 95  PHE FFF O   1 ? 
ATOM   2301 C CB  . PHE B 2 95  ? -15.602 59.853 -17.324 1.000 25.160 ? 95  PHE FFF CB  1 ? 
ATOM   2302 C CG  . PHE B 2 95  ? -15.113 61.250 -17.580 1.000 24.465 ? 95  PHE FFF CG  1 ? 
ATOM   2303 C CD1 . PHE B 2 95  ? -15.930 62.336 -17.310 1.000 28.090 ? 95  PHE FFF CD1 1 ? 
ATOM   2304 C CD2 . PHE B 2 95  ? -13.837 61.480 -18.071 1.000 26.498 ? 95  PHE FFF CD2 1 ? 
ATOM   2305 C CE1 . PHE B 2 95  ? -15.467 63.628 -17.507 1.000 26.245 ? 95  PHE FFF CE1 1 ? 
ATOM   2306 C CE2 . PHE B 2 95  ? -13.378 62.771 -18.272 1.000 26.626 ? 95  PHE FFF CE2 1 ? 
ATOM   2307 C CZ  . PHE B 2 95  ? -14.196 63.839 -17.996 1.000 27.410 ? 95  PHE FFF CZ  1 ? 
ATOM   2308 N N   . CYS B 2 96  ? -16.246 56.792 -18.525 1.000 23.159 ? 96  CYS FFF N   1 ? 
ATOM   2309 C CA  . CYS B 2 96  ? -16.308 55.442 -17.938 1.000 23.870 ? 96  CYS FFF CA  1 ? 
ATOM   2310 C C   . CYS B 2 96  ? -15.438 55.443 -16.674 1.000 20.937 ? 96  CYS FFF C   1 ? 
ATOM   2311 O O   . CYS B 2 96  ? -14.354 56.056 -16.688 1.000 22.106 ? 96  CYS FFF O   1 ? 
ATOM   2312 C CB  . CYS B 2 96  ? -15.860 54.419 -18.971 1.000 26.125 ? 96  CYS FFF CB  1 ? 
ATOM   2313 S SG  . CYS B 2 96  ? -16.014 52.735 -18.354 1.000 30.038 ? 96  CYS FFF SG  1 ? 
ATOM   2314 N N   . ALA B 2 97  ? -15.886 54.782 -15.616 1.000 19.611 ? 97  ALA FFF N   1 ? 
ATOM   2315 C CA  . ALA B 2 97  ? -15.145 54.720 -14.338 1.000 20.003 ? 97  ALA FFF CA  1 ? 
ATOM   2316 C C   . ALA B 2 97  ? -15.344 53.346 -13.701 1.000 19.450 ? 97  ALA FFF C   1 ? 
ATOM   2317 O O   . ALA B 2 97  ? -16.480 52.867 -13.652 1.000 21.201 ? 97  ALA FFF O   1 ? 
ATOM   2318 C CB  . ALA B 2 97  ? -15.571 55.837 -13.426 1.000 22.736 ? 97  ALA FFF CB  1 ? 
ATOM   2319 N N   . LEU B 2 98  ? -14.250 52.739 -13.266 1.000 18.311 ? 98  LEU FFF N   1 ? 
ATOM   2320 C CA  . LEU B 2 98  ? -14.213 51.367 -12.722 1.000 18.655 ? 98  LEU FFF CA  1 ? 
ATOM   2321 C C   . LEU B 2 98  ? -13.797 51.430 -11.250 1.000 19.078 ? 98  LEU FFF C   1 ? 
ATOM   2322 O O   . LEU B 2 98  ? -12.816 52.113 -10.926 1.000 19.610 ? 98  LEU FFF O   1 ? 
ATOM   2323 C CB  . LEU B 2 98  ? -13.233 50.537 -13.552 1.000 20.281 ? 98  LEU FFF CB  1 ? 
ATOM   2324 C CG  . LEU B 2 98  ? -12.962 49.114 -13.075 1.000 19.958 ? 98  LEU FFF CG  1 ? 
ATOM   2325 C CD1 . LEU B 2 98  ? -14.211 48.241 -13.106 1.000 20.373 ? 98  LEU FFF CD1 1 ? 
ATOM   2326 C CD2 . LEU B 2 98  ? -11.892 48.493 -13.941 1.000 21.608 ? 98  LEU FFF CD2 1 ? 
ATOM   2327 N N   . GLY B 2 99  ? -14.541 50.743 -10.396 1.000 18.548 ? 99  GLY FFF N   1 ? 
ATOM   2328 C CA  . GLY B 2 99  ? -14.248 50.611 -8.970  1.000 19.150 ? 99  GLY FFF CA  1 ? 
ATOM   2329 C C   . GLY B 2 99  ? -13.250 49.498 -8.724  1.000 19.658 ? 99  GLY FFF C   1 ? 
ATOM   2330 O O   . GLY B 2 99  ? -13.012 48.662 -9.628  1.000 21.281 ? 99  GLY FFF O   1 ? 
ATOM   2331 N N   . VAL B 2 100 ? -12.772 49.422 -7.491  1.000 20.086 ? 100 VAL FFF N   1 ? 
ATOM   2332 C CA  . VAL B 2 100 ? -11.952 48.266 -7.025  1.000 20.393 ? 100 VAL FFF CA  1 ? 
ATOM   2333 C C   . VAL B 2 100 ? -12.751 47.430 -6.020  1.000 19.339 ? 100 VAL FFF C   1 ? 
ATOM   2334 O O   . VAL B 2 100 ? -12.185 46.533 -5.415  1.000 19.927 ? 100 VAL FFF O   1 ? 
ATOM   2335 C CB  . VAL B 2 100 ? -10.595 48.689 -6.448  1.000 22.279 ? 100 VAL FFF CB  1 ? 
ATOM   2336 C CG1 . VAL B 2 100 ? -9.682  49.209 -7.540  1.000 22.041 ? 100 VAL FFF CG1 1 ? 
ATOM   2337 C CG2 . VAL B 2 100 ? -10.777 49.693 -5.328  1.000 22.957 ? 100 VAL FFF CG2 1 ? 
ATOM   2338 N N   . THR B 2 101 ? -14.056 47.662 -5.913  1.000 18.536 ? 101 THR FFF N   1 ? 
ATOM   2339 C CA  . THR B 2 101 ? -14.964 46.835 -5.082  1.000 19.417 ? 101 THR FFF CA  1 ? 
ATOM   2340 C C   . THR B 2 101 ? -16.188 46.467 -5.919  1.000 17.588 ? 101 THR FFF C   1 ? 
ATOM   2341 O O   . THR B 2 101 ? -16.301 46.950 -7.057  1.000 18.184 ? 101 THR FFF O   1 ? 
ATOM   2342 C CB  . THR B 2 101 ? -15.409 47.557 -3.803  1.000 20.739 ? 101 THR FFF CB  1 ? 
ATOM   2343 O OG1 . THR B 2 101 ? -16.433 48.505 -4.107  1.000 22.854 ? 101 THR FFF OG1 1 ? 
ATOM   2344 C CG2 . THR B 2 101 ? -14.255 48.241 -3.106  1.000 22.511 ? 101 THR FFF CG2 1 ? 
ATOM   2345 N N   . ALA B 2 102 ? -17.077 45.673 -5.331  1.000 17.436 ? 102 ALA FFF N   1 ? 
ATOM   2346 C CA  . ALA B 2 102 ? -18.336 45.247 -5.982  1.000 17.571 ? 102 ALA FFF CA  1 ? 
ATOM   2347 C C   . ALA B 2 102 ? -19.418 46.318 -5.867  1.000 19.263 ? 102 ALA FFF C   1 ? 
ATOM   2348 O O   . ALA B 2 102 ? -20.410 46.162 -6.594  1.000 20.365 ? 102 ALA FFF O   1 ? 
ATOM   2349 C CB  . ALA B 2 102 ? -18.822 43.953 -5.388  1.000 18.402 ? 102 ALA FFF CB  1 ? 
ATOM   2350 N N   . ALA B 2 103 ? -19.251 47.348 -5.029  1.000 20.364 ? 103 ALA FFF N   1 ? 
ATOM   2351 C CA  . ALA B 2 103 ? -20.360 48.265 -4.669  1.000 22.402 ? 103 ALA FFF CA  1 ? 
ATOM   2352 C C   . ALA B 2 103 ? -20.322 49.496 -5.573  1.000 23.507 ? 103 ALA FFF C   1 ? 
ATOM   2353 O O   . ALA B 2 103 ? -19.267 50.156 -5.650  1.000 24.391 ? 103 ALA FFF O   1 ? 
ATOM   2354 C CB  . ALA B 2 103 ? -20.269 48.660 -3.218  1.000 24.207 ? 103 ALA FFF CB  1 ? 
ATOM   2355 N N   . CYS B 2 104 ? -21.445 49.796 -6.234  1.000 23.026 ? 104 CYS FFF N   1 ? 
ATOM   2356 C CA  . CYS B 2 104 ? -21.624 51.028 -7.035  1.000 24.874 ? 104 CYS FFF CA  1 ? 
ATOM   2357 C C   . CYS B 2 104 ? -21.530 52.269 -6.140  1.000 26.908 ? 104 CYS FFF C   1 ? 
ATOM   2358 O O   . CYS B 2 104 ? -21.041 53.311 -6.633  1.000 29.740 ? 104 CYS FFF O   1 ? 
ATOM   2359 C CB  . CYS B 2 104 ? -22.933 50.979 -7.807  1.000 25.645 ? 104 CYS FFF CB  1 ? 
ATOM   2360 S SG  . CYS B 2 104 ? -22.730 50.134 -9.394  1.000 27.468 ? 104 CYS FFF SG  1 ? 
ATOM   2361 N N   . SER B 2 105 ? -21.956 52.159 -4.877  1.000 26.427 ? 105 SER FFF N   1 ? 
ATOM   2362 C CA  . SER B 2 105 ? -21.967 53.290 -3.915  1.000 26.734 ? 105 SER FFF CA  1 ? 
ATOM   2363 C C   . SER B 2 105 ? -20.529 53.695 -3.544  1.000 26.513 ? 105 SER FFF C   1 ? 
ATOM   2364 O O   . SER B 2 105 ? -20.330 54.836 -3.065  1.000 28.674 ? 105 SER FFF O   1 ? 
ATOM   2365 C CB  . SER B 2 105 ? -22.797 52.974 -2.701  1.000 26.797 ? 105 SER FFF CB  1 ? 
ATOM   2366 O OG  . SER B 2 105 ? -22.425 51.741 -2.104  1.000 30.429 ? 105 SER FFF OG  1 ? 
ATOM   2367 N N   . ASP B 2 106 ? -19.547 52.822 -3.774  1.000 25.938 ? 106 ASP FFF N   1 ? 
ATOM   2368 C CA  . ASP B 2 106 ? -18.125 53.161 -3.503  1.000 27.090 ? 106 ASP FFF CA  1 ? 
ATOM   2369 C C   . ASP B 2 106 ? -17.592 54.112 -4.583  1.000 27.228 ? 106 ASP FFF C   1 ? 
ATOM   2370 O O   . ASP B 2 106 ? -18.178 54.202 -5.681  1.000 31.157 ? 106 ASP FFF O   1 ? 
ATOM   2371 C CB  . ASP B 2 106 ? -17.273 51.901 -3.347  1.000 28.680 ? 106 ASP FFF CB  1 ? 
ATOM   2372 C CG  . ASP B 2 106 ? -17.541 51.129 -2.060  1.000 30.453 ? 106 ASP FFF CG  1 ? 
ATOM   2373 O OD1 . ASP B 2 106 ? -18.116 51.717 -1.108  1.000 29.846 ? 106 ASP FFF OD1 1 ? 
ATOM   2374 O OD2 . ASP B 2 106 ? -17.137 49.956 -1.994  1.000 34.063 ? 106 ASP FFF OD2 1 ? 
ATOM   2375 N N   . ASN B 2 107 ? -16.474 54.770 -4.282  1.000 30.171 ? 107 ASN FFF N   1 ? 
ATOM   2376 C CA  . ASN B 2 107 ? -15.830 55.778 -5.160  1.000 30.398 ? 107 ASN FFF CA  1 ? 
ATOM   2377 C C   . ASN B 2 107 ? -15.133 55.074 -6.327  1.000 27.366 ? 107 ASN FFF C   1 ? 
ATOM   2378 O O   . ASN B 2 107 ? -14.500 54.040 -6.158  1.000 28.365 ? 107 ASN FFF O   1 ? 
ATOM   2379 C CB  . ASN B 2 107 ? -14.819 56.638 -4.397  1.000 35.457 ? 107 ASN FFF CB  1 ? 
ATOM   2380 C CG  . ASN B 2 107 ? -15.379 57.323 -3.164  1.000 39.883 ? 107 ASN FFF CG  1 ? 
ATOM   2381 O OD1 . ASN B 2 107 ? -16.585 57.534 -3.035  1.000 42.517 ? 107 ASN FFF OD1 1 ? 
ATOM   2382 N ND2 . ASN B 2 107 ? -14.499 57.673 -2.241  1.000 46.202 ? 107 ASN FFF ND2 1 ? 
ATOM   2383 N N   . PRO B 2 108 ? -15.183 55.626 -7.552  1.000 27.758 ? 108 PRO FFF N   1 ? 
ATOM   2384 C CA  . PRO B 2 108 ? -14.423 55.072 -8.674  1.000 27.319 ? 108 PRO FFF CA  1 ? 
ATOM   2385 C C   . PRO B 2 108 ? -12.907 55.177 -8.466  1.000 26.229 ? 108 PRO FFF C   1 ? 
ATOM   2386 O O   . PRO B 2 108 ? -12.457 56.114 -7.826  1.000 29.850 ? 108 PRO FFF O   1 ? 
ATOM   2387 C CB  . PRO B 2 108 ? -14.881 55.935 -9.857  1.000 31.812 ? 108 PRO FFF CB  1 ? 
ATOM   2388 C CG  . PRO B 2 108 ? -15.335 57.225 -9.203  1.000 32.554 ? 108 PRO FFF CG  1 ? 
ATOM   2389 C CD  . PRO B 2 108 ? -16.010 56.778 -7.931  1.000 32.366 ? 108 PRO FFF CD  1 ? 
ATOM   2390 N N   . TYR B 2 109 ? -12.154 54.229 -9.026  1.000 25.869 ? 109 TYR FFF N   1 ? 
ATOM   2391 C CA  . TYR B 2 109 ? -10.678 54.163 -8.892  1.000 25.559 ? 109 TYR FFF CA  1 ? 
ATOM   2392 C C   . TYR B 2 109 ? -9.992  54.448 -10.233 1.000 24.090 ? 109 TYR FFF C   1 ? 
ATOM   2393 O O   . TYR B 2 109 ? -9.024  55.227 -10.258 1.000 27.175 ? 109 TYR FFF O   1 ? 
ATOM   2394 C CB  . TYR B 2 109 ? -10.277 52.794 -8.360  1.000 26.154 ? 109 TYR FFF CB  1 ? 
ATOM   2395 C CG  . TYR B 2 109 ? -8.870  52.750 -7.852  1.000 26.706 ? 109 TYR FFF CG  1 ? 
ATOM   2396 C CD1 . TYR B 2 109 ? -7.803  52.569 -8.720  1.000 27.776 ? 109 TYR FFF CD1 1 ? 
ATOM   2397 C CD2 . TYR B 2 109 ? -8.613  52.895 -6.504  1.000 26.009 ? 109 TYR FFF CD2 1 ? 
ATOM   2398 C CE1 . TYR B 2 109 ? -6.505  52.501 -8.250  1.000 29.738 ? 109 TYR FFF CE1 1 ? 
ATOM   2399 C CE2 . TYR B 2 109 ? -7.317  52.839 -6.020  1.000 27.120 ? 109 TYR FFF CE2 1 ? 
ATOM   2400 C CZ  . TYR B 2 109 ? -6.267  52.645 -6.895  1.000 28.703 ? 109 TYR FFF CZ  1 ? 
ATOM   2401 O OH  . TYR B 2 109 ? -4.997  52.583 -6.411  1.000 32.799 ? 109 TYR FFF OH  1 ? 
ATOM   2402 N N   . PHE B 2 110 ? -10.477 53.826 -11.311 1.000 20.764 ? 110 PHE FFF N   1 ? 
ATOM   2403 C CA  . PHE B 2 110 ? -9.927  53.967 -12.678 1.000 20.192 ? 110 PHE FFF CA  1 ? 
ATOM   2404 C C   . PHE B 2 110 ? -10.892 54.785 -13.535 1.000 21.377 ? 110 PHE FFF C   1 ? 
ATOM   2405 O O   . PHE B 2 110 ? -12.100 54.615 -13.408 1.000 21.812 ? 110 PHE FFF O   1 ? 
ATOM   2406 C CB  . PHE B 2 110 ? -9.667  52.617 -13.339 1.000 21.408 ? 110 PHE FFF CB  1 ? 
ATOM   2407 C CG  . PHE B 2 110 ? -8.830  51.655 -12.535 1.000 21.509 ? 110 PHE FFF CG  1 ? 
ATOM   2408 C CD1 . PHE B 2 110 ? -7.444  51.754 -12.520 1.000 23.301 ? 110 PHE FFF CD1 1 ? 
ATOM   2409 C CD2 . PHE B 2 110 ? -9.427  50.635 -11.807 1.000 21.976 ? 110 PHE FFF CD2 1 ? 
ATOM   2410 C CE1 . PHE B 2 110 ? -6.683  50.856 -11.785 1.000 24.307 ? 110 PHE FFF CE1 1 ? 
ATOM   2411 C CE2 . PHE B 2 110 ? -8.660  49.732 -11.086 1.000 22.920 ? 110 PHE FFF CE2 1 ? 
ATOM   2412 C CZ  . PHE B 2 110 ? -7.292  49.837 -11.092 1.000 23.553 ? 110 PHE FFF CZ  1 ? 
ATOM   2413 N N   . TRP B 2 111 ? -10.343 55.663 -14.361 1.000 23.469 ? 111 TRP FFF N   1 ? 
ATOM   2414 C CA  . TRP B 2 111 ? -11.104 56.611 -15.199 1.000 22.952 ? 111 TRP FFF CA  1 ? 
ATOM   2415 C C   . TRP B 2 111 ? -10.704 56.483 -16.668 1.000 23.457 ? 111 TRP FFF C   1 ? 
ATOM   2416 O O   . TRP B 2 111 ? -9.503  56.386 -16.964 1.000 26.112 ? 111 TRP FFF O   1 ? 
ATOM   2417 C CB  . TRP B 2 111 ? -10.855 58.035 -14.701 1.000 24.962 ? 111 TRP FFF CB  1 ? 
ATOM   2418 C CG  . TRP B 2 111 ? -11.453 58.330 -13.363 1.000 25.031 ? 111 TRP FFF CG  1 ? 
ATOM   2419 C CD1 . TRP B 2 111 ? -10.866 58.189 -12.140 1.000 27.719 ? 111 TRP FFF CD1 1 ? 
ATOM   2420 C CD2 . TRP B 2 111 ? -12.757 58.871 -13.116 1.000 24.904 ? 111 TRP FFF CD2 1 ? 
ATOM   2421 N NE1 . TRP B 2 111 ? -11.727 58.578 -11.150 1.000 28.059 ? 111 TRP FFF NE1 1 ? 
ATOM   2422 C CE2 . TRP B 2 111 ? -12.905 58.986 -11.720 1.000 26.373 ? 111 TRP FFF CE2 1 ? 
ATOM   2423 C CE3 . TRP B 2 111 ? -13.834 59.220 -13.935 1.000 26.313 ? 111 TRP FFF CE3 1 ? 
ATOM   2424 C CZ2 . TRP B 2 111 ? -14.066 59.494 -11.139 1.000 28.229 ? 111 TRP FFF CZ2 1 ? 
ATOM   2425 C CZ3 . TRP B 2 111 ? -14.985 59.700 -13.357 1.000 28.236 ? 111 TRP FFF CZ3 1 ? 
ATOM   2426 C CH2 . TRP B 2 111 ? -15.102 59.828 -11.978 1.000 28.565 ? 111 TRP FFF CH2 1 ? 
ATOM   2427 N N   . GLY B 2 112 ? -11.678 56.531 -17.573 1.000 24.433 ? 112 GLY FFF N   1 ? 
ATOM   2428 C CA  . GLY B 2 112 ? -11.409 56.731 -19.008 1.000 25.408 ? 112 GLY FFF CA  1 ? 
ATOM   2429 C C   . GLY B 2 112 ? -11.028 58.175 -19.303 1.000 24.981 ? 112 GLY FFF C   1 ? 
ATOM   2430 O O   . GLY B 2 112 ? -11.225 59.033 -18.434 1.000 27.197 ? 112 GLY FFF O   1 ? 
ATOM   2431 N N   . GLN B 2 113 ? -10.552 58.444 -20.519 1.000 29.395 ? 113 GLN FFF N   1 ? 
ATOM   2432 C CA  . GLN B 2 113 ? -10.127 59.799 -20.963 1.000 30.759 ? 113 GLN FFF CA  1 ? 
ATOM   2433 C C   . GLN B 2 113 ? -11.358 60.701 -21.109 1.000 31.330 ? 113 GLN FFF C   1 ? 
ATOM   2434 O O   . GLN B 2 113 ? -11.197 61.942 -21.055 1.000 38.099 ? 113 GLN FFF O   1 ? 
ATOM   2435 C CB  . GLN B 2 113 ? -9.363  59.705 -22.284 1.000 37.189 ? 113 GLN FFF CB  1 ? 
ATOM   2436 C CG  . GLN B 2 113 ? -7.987  59.068 -22.149 1.000 43.208 ? 113 GLN FFF CG  1 ? 
ATOM   2437 C CD  . GLN B 2 113 ? -6.890  60.099 -22.052 1.000 50.032 ? 113 GLN FFF CD  1 ? 
ATOM   2438 O OE1 . GLN B 2 113 ? -6.955  61.032 -21.252 1.000 60.687 ? 113 GLN FFF OE1 1 ? 
ATOM   2439 N NE2 . GLN B 2 113 ? -5.866  59.936 -22.875 1.000 56.660 ? 113 GLN FFF NE2 1 ? 
ATOM   2440 N N   . GLY B 2 114 ? -12.531 60.099 -21.325 1.000 29.207 ? 114 GLY FFF N   1 ? 
ATOM   2441 C CA  . GLY B 2 114 ? -13.801 60.818 -21.531 1.000 29.785 ? 114 GLY FFF CA  1 ? 
ATOM   2442 C C   . GLY B 2 114 ? -14.114 61.036 -23.004 1.000 29.117 ? 114 GLY FFF C   1 ? 
ATOM   2443 O O   . GLY B 2 114 ? -13.180 61.137 -23.826 1.000 32.218 ? 114 GLY FFF O   1 ? 
ATOM   2444 N N   . THR B 2 115 ? -15.400 61.082 -23.328 1.000 27.418 ? 115 THR FFF N   1 ? 
ATOM   2445 C CA  . THR B 2 115 ? -15.926 61.277 -24.703 1.000 28.046 ? 115 THR FFF CA  1 ? 
ATOM   2446 C C   . THR B 2 115 ? -16.906 62.450 -24.705 1.000 27.400 ? 115 THR FFF C   1 ? 
ATOM   2447 O O   . THR B 2 115 ? -17.848 62.442 -23.874 1.000 26.329 ? 115 THR FFF O   1 ? 
ATOM   2448 C CB  . THR B 2 115 ? -16.601 60.012 -25.248 1.000 30.974 ? 115 THR FFF CB  1 ? 
ATOM   2449 O OG1 . THR B 2 115 ? -16.993 60.301 -26.587 1.000 35.818 ? 115 THR FFF OG1 1 ? 
ATOM   2450 C CG2 . THR B 2 115 ? -17.825 59.567 -24.481 1.000 34.477 ? 115 THR FFF CG2 1 ? 
ATOM   2451 N N   . GLN B 2 116 ? -16.687 63.424 -25.590 1.000 30.044 ? 116 GLN FFF N   1 ? 
ATOM   2452 C CA  . GLN B 2 116 ? -17.640 64.549 -25.783 1.000 29.813 ? 116 GLN FFF CA  1 ? 
ATOM   2453 C C   . GLN B 2 116 ? -18.952 64.013 -26.375 1.000 31.854 ? 116 GLN FFF C   1 ? 
ATOM   2454 O O   . GLN B 2 116 ? -18.914 63.302 -27.405 1.000 33.992 ? 116 GLN FFF O   1 ? 
ATOM   2455 C CB  . GLN B 2 116 ? -17.061 65.635 -26.685 1.000 30.907 ? 116 GLN FFF CB  1 ? 
ATOM   2456 C CG  . GLN B 2 116 ? -17.957 66.866 -26.799 1.000 32.100 ? 116 GLN FFF CG  1 ? 
ATOM   2457 C CD  . GLN B 2 116 ? -18.101 67.629 -25.500 1.000 32.594 ? 116 GLN FFF CD  1 ? 
ATOM   2458 O OE1 . GLN B 2 116 ? -17.119 67.918 -24.826 1.000 34.055 ? 116 GLN FFF OE1 1 ? 
ATOM   2459 N NE2 . GLN B 2 116 ? -19.323 68.006 -25.149 1.000 30.082 ? 116 GLN FFF NE2 1 ? 
ATOM   2460 N N   . VAL B 2 117 ? -20.067 64.381 -25.746 1.000 28.820 ? 117 VAL FFF N   1 ? 
ATOM   2461 C CA  . VAL B 2 117 ? -21.455 64.223 -26.269 1.000 32.465 ? 117 VAL FFF CA  1 ? 
ATOM   2462 C C   . VAL B 2 117 ? -22.052 65.627 -26.390 1.000 34.097 ? 117 VAL FFF C   1 ? 
ATOM   2463 O O   . VAL B 2 117 ? -22.066 66.341 -25.384 1.000 33.626 ? 117 VAL FFF O   1 ? 
ATOM   2464 C CB  . VAL B 2 117 ? -22.300 63.330 -25.344 1.000 34.106 ? 117 VAL FFF CB  1 ? 
ATOM   2465 C CG1 . VAL B 2 117 ? -23.787 63.446 -25.627 1.000 37.539 ? 117 VAL FFF CG1 1 ? 
ATOM   2466 C CG2 . VAL B 2 117 ? -21.832 61.882 -25.399 1.000 33.121 ? 117 VAL FFF CG2 1 ? 
ATOM   2467 N N   . THR B 2 118 ? -22.518 66.014 -27.575 1.000 35.005 ? 118 THR FFF N   1 ? 
ATOM   2468 C CA  . THR B 2 118 ? -23.115 67.354 -27.807 1.000 36.384 ? 118 THR FFF CA  1 ? 
ATOM   2469 C C   . THR B 2 118 ? -24.513 67.155 -28.396 1.000 36.791 ? 118 THR FFF C   1 ? 
ATOM   2470 O O   . THR B 2 118 ? -24.617 66.529 -29.475 1.000 43.337 ? 118 THR FFF O   1 ? 
ATOM   2471 C CB  . THR B 2 118 ? -22.190 68.215 -28.672 1.000 37.537 ? 118 THR FFF CB  1 ? 
ATOM   2472 O OG1 . THR B 2 118 ? -20.919 68.265 -28.021 1.000 39.312 ? 118 THR FFF OG1 1 ? 
ATOM   2473 C CG2 . THR B 2 118 ? -22.732 69.609 -28.889 1.000 39.296 ? 118 THR FFF CG2 1 ? 
ATOM   2474 N N   . VAL B 2 119 ? -25.539 67.638 -27.690 1.000 36.705 ? 119 VAL FFF N   1 ? 
ATOM   2475 C CA  . VAL B 2 119 ? -26.971 67.494 -28.080 1.000 40.658 ? 119 VAL FFF CA  1 ? 
ATOM   2476 C C   . VAL B 2 119 ? -27.491 68.862 -28.534 1.000 43.416 ? 119 VAL FFF C   1 ? 
ATOM   2477 O O   . VAL B 2 119 ? -27.501 69.791 -27.696 1.000 43.617 ? 119 VAL FFF O   1 ? 
ATOM   2478 C CB  . VAL B 2 119 ? -27.817 66.932 -26.927 1.000 39.655 ? 119 VAL FFF CB  1 ? 
ATOM   2479 C CG1 . VAL B 2 119 ? -29.261 66.714 -27.345 1.000 39.653 ? 119 VAL FFF CG1 1 ? 
ATOM   2480 C CG2 . VAL B 2 119 ? -27.216 65.652 -26.369 1.000 37.682 ? 119 VAL FFF CG2 1 ? 
ATOM   2481 N N   . SER B 2 120 ? -27.909 68.963 -29.802 1.000 48.227 ? 120 SER FFF N   1 ? 
ATOM   2482 C CA  . SER B 2 120 ? -28.405 70.205 -30.459 1.000 51.948 ? 120 SER FFF CA  1 ? 
ATOM   2483 C C   . SER B 2 120 ? -29.926 70.297 -30.327 1.000 53.539 ? 120 SER FFF C   1 ? 
ATOM   2484 O O   . SER B 2 120 ? -30.588 69.277 -30.545 1.000 57.465 ? 120 SER FFF O   1 ? 
ATOM   2485 C CB  . SER B 2 120 ? -27.990 70.255 -31.904 1.000 55.710 ? 120 SER FFF CB  1 ? 
ATOM   2486 O OG  . SER B 2 120 ? -26.583 70.401 -32.008 1.000 61.121 ? 120 SER FFF OG  1 ? 
ATOM   2487 N N   . SER B 2 121 ? -30.455 71.493 -30.043 1.000 59.490 ? 121 SER FFF N   1 ? 
ATOM   2488 C CA  . SER B 2 121 ? -31.887 71.737 -29.719 1.000 61.613 ? 121 SER FFF CA  1 ? 
ATOM   2489 C C   . SER B 2 121 ? -32.764 71.553 -30.966 1.000 64.279 ? 121 SER FFF C   1 ? 
ATOM   2490 O O   . SER B 2 121 ? -32.298 71.166 -32.038 1.000 62.763 ? 121 SER FFF O   1 ? 
ATOM   2491 C CB  . SER B 2 121 ? -32.075 73.105 -29.117 1.000 67.145 ? 121 SER FFF CB  1 ? 
ATOM   2492 O OG  . SER B 2 121 ? -33.366 73.229 -28.539 1.000 74.434 ? 121 SER FFF OG  1 ? 
HETATM 2493 C C1  . NAG C 3 .   ? -34.780 13.752 -17.913 1.000 46.973 ? 601 NAG EEE C1  1 ? 
HETATM 2494 C C2  . NAG C 3 .   ? -34.644 12.256 -18.049 1.000 50.253 ? 601 NAG EEE C2  1 ? 
HETATM 2495 C C3  . NAG C 3 .   ? -35.210 11.736 -19.366 1.000 53.533 ? 601 NAG EEE C3  1 ? 
HETATM 2496 C C4  . NAG C 3 .   ? -36.519 12.400 -19.774 1.000 57.191 ? 601 NAG EEE C4  1 ? 
HETATM 2497 C C5  . NAG C 3 .   ? -36.409 13.910 -19.670 1.000 54.787 ? 601 NAG EEE C5  1 ? 
HETATM 2498 C C6  . NAG C 3 .   ? -37.691 14.640 -20.055 1.000 56.668 ? 601 NAG EEE C6  1 ? 
HETATM 2499 C C7  . NAG C 3 .   ? -32.790 11.060 -17.059 1.000 42.196 ? 601 NAG EEE C7  1 ? 
HETATM 2500 C C8  . NAG C 3 .   ? -31.332 10.745 -17.132 1.000 42.161 ? 601 NAG EEE C8  1 ? 
HETATM 2501 N N2  . NAG C 3 .   ? -33.228 11.927 -17.959 1.000 44.727 ? 601 NAG EEE N2  1 ? 
HETATM 2502 O O3  . NAG C 3 .   ? -35.438 10.340 -19.217 1.000 57.578 ? 601 NAG EEE O3  1 ? 
HETATM 2503 O O4  . NAG C 3 .   ? -36.816 12.015 -21.114 1.000 64.063 ? 601 NAG EEE O4  1 ? 
HETATM 2504 O O5  . NAG C 3 .   ? -36.096 14.173 -18.306 1.000 52.636 ? 601 NAG EEE O5  1 ? 
HETATM 2505 O O6  . NAG C 3 .   ? -38.675 14.410 -19.037 1.000 56.136 ? 601 NAG EEE O6  1 ? 
HETATM 2506 O O7  . NAG C 3 .   ? -33.540 10.538 -16.244 1.000 43.694 ? 601 NAG EEE O7  1 ? 
HETATM 2507 C C   . ACT D 4 .   ? -14.913 16.050 -1.438  1.000 41.094 ? 602 ACT EEE C   1 ? 
HETATM 2508 O O   . ACT D 4 .   ? -15.704 15.100 -1.553  1.000 48.833 ? 602 ACT EEE O   1 ? 
HETATM 2509 O OXT . ACT D 4 .   ? -15.200 17.132 -0.905  1.000 50.968 ? 602 ACT EEE OXT 1 ? 
HETATM 2510 C CH3 . ACT D 4 .   ? -13.513 15.877 -1.974  1.000 34.959 ? 602 ACT EEE CH3 1 ? 
HETATM 2511 O O   . HOH E 5 .   ? -34.724 8.787  -17.626 1.000 82.146 ? 701 HOH EEE O   1 ? 
HETATM 2512 O O   . HOH E 5 .   ? -32.322 39.770 -15.648 1.000 69.282 ? 702 HOH EEE O   1 ? 
HETATM 2513 O O   . HOH E 5 .   ? -29.743 40.967 -21.677 1.000 32.559 ? 703 HOH EEE O   1 ? 
HETATM 2514 O O   . HOH E 5 .   ? -19.665 3.805  -28.688 1.000 48.451 ? 704 HOH EEE O   1 ? 
HETATM 2515 O O   . HOH E 5 .   ? -4.321  37.994 0.495   1.000 38.033 ? 705 HOH EEE O   1 ? 
HETATM 2516 O O   . HOH E 5 .   ? -17.510 12.465 -10.466 1.000 25.267 ? 706 HOH EEE O   1 ? 
HETATM 2517 O O   . HOH E 5 .   ? -31.238 23.093 -21.898 1.000 36.089 ? 707 HOH EEE O   1 ? 
HETATM 2518 O O   . HOH E 5 .   ? -30.060 2.213  -3.528  1.000 52.769 ? 708 HOH EEE O   1 ? 
HETATM 2519 O O   . HOH E 5 .   ? -32.584 16.907 -8.219  1.000 51.576 ? 709 HOH EEE O   1 ? 
HETATM 2520 O O   . HOH E 5 .   ? -10.683 14.472 -24.100 1.000 52.012 ? 710 HOH EEE O   1 ? 
HETATM 2521 O O   . HOH E 5 .   ? -27.805 39.272 -24.967 1.000 29.657 ? 711 HOH EEE O   1 ? 
HETATM 2522 O O   . HOH E 5 .   ? -27.633 27.872 -28.283 1.000 33.668 ? 712 HOH EEE O   1 ? 
HETATM 2523 O O   . HOH E 5 .   ? -6.592  34.660 -13.196 1.000 23.589 ? 713 HOH EEE O   1 ? 
HETATM 2524 O O   . HOH E 5 .   ? -16.823 37.189 -15.664 1.000 26.191 ? 714 HOH EEE O   1 ? 
HETATM 2525 O O   . HOH E 5 .   ? -23.345 24.197 -4.574  1.000 37.617 ? 715 HOH EEE O   1 ? 
HETATM 2526 O O   . HOH E 5 .   ? -1.696  16.100 -15.904 1.000 49.802 ? 716 HOH EEE O   1 ? 
HETATM 2527 O O   . HOH E 5 .   ? -5.405  29.073 -15.084 1.000 35.662 ? 717 HOH EEE O   1 ? 
HETATM 2528 O O   . HOH E 5 .   ? -8.046  18.182 -15.701 1.000 38.409 ? 718 HOH EEE O   1 ? 
HETATM 2529 O O   . HOH E 5 .   ? -12.881 6.721  -4.285  1.000 57.020 ? 719 HOH EEE O   1 ? 
HETATM 2530 O O   . HOH E 5 .   ? -29.433 21.504 -24.981 1.000 33.422 ? 720 HOH EEE O   1 ? 
HETATM 2531 O O   . HOH E 5 .   ? -22.041 -0.068 -14.223 1.000 52.449 ? 721 HOH EEE O   1 ? 
HETATM 2532 O O   . HOH E 5 .   ? -19.571 32.519 -2.245  1.000 30.621 ? 722 HOH EEE O   1 ? 
HETATM 2533 O O   . HOH E 5 .   ? -20.374 34.055 -21.229 1.000 24.891 ? 723 HOH EEE O   1 ? 
HETATM 2534 O O   . HOH E 5 .   ? -14.648 31.899 -16.672 1.000 27.725 ? 724 HOH EEE O   1 ? 
HETATM 2535 O O   . HOH E 5 .   ? -8.076  33.896 -2.633  1.000 20.286 ? 725 HOH EEE O   1 ? 
HETATM 2536 O O   . HOH E 5 .   ? -12.087 42.241 -6.311  1.000 19.003 ? 726 HOH EEE O   1 ? 
HETATM 2537 O O   . HOH E 5 .   ? -11.256 26.669 -22.347 1.000 24.407 ? 727 HOH EEE O   1 ? 
HETATM 2538 O O   . HOH E 5 .   ? -31.213 19.798 -15.813 1.000 35.805 ? 728 HOH EEE O   1 ? 
HETATM 2539 O O   . HOH E 5 .   ? -28.096 19.975 -9.163  1.000 26.554 ? 729 HOH EEE O   1 ? 
HETATM 2540 O O   . HOH E 5 .   ? -27.481 17.811 -10.742 1.000 22.620 ? 730 HOH EEE O   1 ? 
HETATM 2541 O O   . HOH E 5 .   ? -20.686 20.116 -25.205 1.000 34.369 ? 731 HOH EEE O   1 ? 
HETATM 2542 O O   . HOH E 5 .   ? -4.894  21.912 -13.679 1.000 28.974 ? 732 HOH EEE O   1 ? 
HETATM 2543 O O   . HOH E 5 .   ? -10.557 23.279 -0.380  1.000 58.094 ? 733 HOH EEE O   1 ? 
HETATM 2544 O O   . HOH E 5 .   ? -13.876 24.331 -6.237  1.000 16.304 ? 734 HOH EEE O   1 ? 
HETATM 2545 O O   . HOH E 5 .   ? -19.422 0.414  -1.836  1.000 56.184 ? 735 HOH EEE O   1 ? 
HETATM 2546 O O   . HOH E 5 .   ? -4.035  31.186 -14.106 1.000 36.854 ? 736 HOH EEE O   1 ? 
HETATM 2547 O O   . HOH E 5 .   ? -8.795  31.850 -4.254  1.000 16.048 ? 737 HOH EEE O   1 ? 
HETATM 2548 O O   . HOH E 5 .   ? 3.996   48.152 -2.370  1.000 55.450 ? 738 HOH EEE O   1 ? 
HETATM 2549 O O   . HOH E 5 .   ? -24.083 39.213 -27.766 1.000 41.588 ? 739 HOH EEE O   1 ? 
HETATM 2550 O O   . HOH E 5 .   ? -25.145 10.980 -25.711 1.000 41.925 ? 740 HOH EEE O   1 ? 
HETATM 2551 O O   . HOH E 5 .   ? -31.708 10.408 -3.820  1.000 64.216 ? 741 HOH EEE O   1 ? 
HETATM 2552 O O   . HOH E 5 .   ? -19.016 34.939 -18.991 1.000 23.798 ? 742 HOH EEE O   1 ? 
HETATM 2553 O O   . HOH E 5 .   ? -12.909 26.995 -6.637  1.000 16.451 ? 743 HOH EEE O   1 ? 
HETATM 2554 O O   . HOH E 5 .   ? -1.692  36.656 -9.925  1.000 33.630 ? 744 HOH EEE O   1 ? 
HETATM 2555 O O   . HOH E 5 .   ? -5.473  15.677 -14.977 1.000 27.137 ? 745 HOH EEE O   1 ? 
HETATM 2556 O O   . HOH E 5 .   ? -30.170 39.691 -14.048 1.000 36.442 ? 746 HOH EEE O   1 ? 
HETATM 2557 O O   . HOH E 5 .   ? -8.380  29.858 -2.344  1.000 21.654 ? 747 HOH EEE O   1 ? 
HETATM 2558 O O   . HOH E 5 .   ? -26.403 43.594 -17.540 1.000 23.408 ? 748 HOH EEE O   1 ? 
HETATM 2559 O O   . HOH E 5 .   ? -8.043  8.996  -17.447 1.000 34.032 ? 749 HOH EEE O   1 ? 
HETATM 2560 O O   . HOH E 5 .   ? -5.078  47.393 -2.080  1.000 36.736 ? 750 HOH EEE O   1 ? 
HETATM 2561 O O   . HOH E 5 .   ? -23.939 33.600 -14.139 1.000 19.671 ? 751 HOH EEE O   1 ? 
HETATM 2562 O O   . HOH E 5 .   ? -5.379  33.787 -1.726  1.000 20.369 ? 752 HOH EEE O   1 ? 
HETATM 2563 O O   . HOH E 5 .   ? -22.956 40.214 -18.407 1.000 19.146 ? 753 HOH EEE O   1 ? 
HETATM 2564 O O   . HOH E 5 .   ? -24.290 33.686 -6.919  1.000 43.722 ? 754 HOH EEE O   1 ? 
HETATM 2565 O O   . HOH E 5 .   ? -12.210 26.814 -25.905 1.000 24.911 ? 755 HOH EEE O   1 ? 
HETATM 2566 O O   . HOH E 5 .   ? -29.641 26.662 -11.293 1.000 21.725 ? 756 HOH EEE O   1 ? 
HETATM 2567 O O   . HOH E 5 .   ? -1.587  43.532 -3.783  1.000 21.759 ? 757 HOH EEE O   1 ? 
HETATM 2568 O O   . HOH E 5 .   ? -1.167  35.690 -4.066  1.000 21.274 ? 758 HOH EEE O   1 ? 
HETATM 2569 O O   . HOH E 5 .   ? -14.233 15.476 -21.482 1.000 24.250 ? 759 HOH EEE O   1 ? 
HETATM 2570 O O   . HOH E 5 .   ? -16.551 31.991 1.998   1.000 27.129 ? 760 HOH EEE O   1 ? 
HETATM 2571 O O   . HOH E 5 .   ? -20.853 28.293 -12.379 1.000 14.875 ? 761 HOH EEE O   1 ? 
HETATM 2572 O O   . HOH E 5 .   ? -10.631 18.196 -23.795 1.000 32.178 ? 762 HOH EEE O   1 ? 
HETATM 2573 O O   . HOH E 5 .   ? -7.868  14.135 -21.685 1.000 41.353 ? 763 HOH EEE O   1 ? 
HETATM 2574 O O   . HOH E 5 .   ? -19.760 -8.586 -17.433 1.000 31.074 ? 764 HOH EEE O   1 ? 
HETATM 2575 O O   . HOH E 5 .   ? -10.658 49.223 -1.025  1.000 33.247 ? 765 HOH EEE O   1 ? 
HETATM 2576 O O   . HOH E 5 .   ? -0.093  38.819 -9.939  1.000 28.620 ? 766 HOH EEE O   1 ? 
HETATM 2577 O O   . HOH E 5 .   ? -2.356  27.970 -12.503 1.000 41.631 ? 767 HOH EEE O   1 ? 
HETATM 2578 O O   . HOH E 5 .   ? -18.725 -2.020 -1.314  1.000 39.779 ? 768 HOH EEE O   1 ? 
HETATM 2579 O O   . HOH E 5 .   ? -8.894  8.453  -10.218 1.000 46.699 ? 769 HOH EEE O   1 ? 
HETATM 2580 O O   . HOH E 5 .   ? 0.993   31.706 -6.001  1.000 47.623 ? 770 HOH EEE O   1 ? 
HETATM 2581 O O   . HOH E 5 .   ? -30.704 -2.044 -4.914  1.000 43.733 ? 771 HOH EEE O   1 ? 
HETATM 2582 O O   . HOH E 5 .   ? -25.418 33.053 -22.716 1.000 24.622 ? 772 HOH EEE O   1 ? 
HETATM 2583 O O   . HOH E 5 .   ? -30.389 18.965 -24.314 1.000 46.016 ? 773 HOH EEE O   1 ? 
HETATM 2584 O O   . HOH E 5 .   ? -13.195 46.681 0.300   1.000 21.691 ? 774 HOH EEE O   1 ? 
HETATM 2585 O O   . HOH E 5 .   ? -10.912 19.357 -15.008 1.000 21.615 ? 775 HOH EEE O   1 ? 
HETATM 2586 O O   . HOH E 5 .   ? -6.936  46.527 -0.364  1.000 27.339 ? 776 HOH EEE O   1 ? 
HETATM 2587 O O   . HOH E 5 .   ? -4.889  46.801 -11.061 1.000 35.252 ? 777 HOH EEE O   1 ? 
HETATM 2588 O O   . HOH E 5 .   ? -12.069 5.547  -10.219 1.000 43.150 ? 778 HOH EEE O   1 ? 
HETATM 2589 O O   . HOH E 5 .   ? -13.432 11.698 -5.356  1.000 34.817 ? 779 HOH EEE O   1 ? 
HETATM 2590 O O   . HOH E 5 .   ? -4.924  22.902 -3.580  1.000 28.884 ? 780 HOH EEE O   1 ? 
HETATM 2591 O O   . HOH E 5 .   ? -24.370 16.362 -8.699  1.000 19.154 ? 781 HOH EEE O   1 ? 
HETATM 2592 O O   . HOH E 5 .   ? -9.652  5.285  -11.844 1.000 35.213 ? 782 HOH EEE O   1 ? 
HETATM 2593 O O   . HOH E 5 .   ? -9.071  16.133 -3.462  1.000 41.350 ? 783 HOH EEE O   1 ? 
HETATM 2594 O O   . HOH E 5 .   ? -3.360  19.398 -9.358  1.000 36.331 ? 784 HOH EEE O   1 ? 
HETATM 2595 O O   . HOH E 5 .   ? -15.182 23.377 -24.907 1.000 22.476 ? 785 HOH EEE O   1 ? 
HETATM 2596 O O   . HOH E 5 .   ? -10.317 44.727 -6.426  1.000 20.707 ? 786 HOH EEE O   1 ? 
HETATM 2597 O O   . HOH E 5 .   ? -16.825 44.707 -2.514  1.000 22.040 ? 787 HOH EEE O   1 ? 
HETATM 2598 O O   . HOH E 5 .   ? -26.508 27.793 -8.379  1.000 36.770 ? 788 HOH EEE O   1 ? 
HETATM 2599 O O   . HOH E 5 .   ? -11.739 29.329 -18.304 1.000 40.643 ? 789 HOH EEE O   1 ? 
HETATM 2600 O O   . HOH E 5 .   ? -1.905  30.090 -9.483  1.000 33.388 ? 790 HOH EEE O   1 ? 
HETATM 2601 O O   . HOH E 5 .   ? -10.269 32.099 -1.290  1.000 20.282 ? 791 HOH EEE O   1 ? 
HETATM 2602 O O   . HOH E 5 .   ? -14.569 37.356 1.765   1.000 33.348 ? 792 HOH EEE O   1 ? 
HETATM 2603 O O   . HOH E 5 .   ? -30.926 21.877 -19.172 1.000 43.012 ? 793 HOH EEE O   1 ? 
HETATM 2604 O O   . HOH E 5 .   ? -12.136 40.071 -8.540  1.000 19.943 ? 794 HOH EEE O   1 ? 
HETATM 2605 O O   . HOH E 5 .   ? -31.089 6.722  -25.705 1.000 50.573 ? 795 HOH EEE O   1 ? 
HETATM 2606 O O   . HOH E 5 .   ? -5.830  21.807 -10.925 1.000 20.302 ? 796 HOH EEE O   1 ? 
HETATM 2607 O O   . HOH E 5 .   ? -14.864 42.528 0.109   1.000 26.223 ? 797 HOH EEE O   1 ? 
HETATM 2608 O O   . HOH E 5 .   ? -10.073 -2.479 -8.980  1.000 48.181 ? 798 HOH EEE O   1 ? 
HETATM 2609 O O   . HOH E 5 .   ? -27.483 33.405 -28.980 1.000 46.800 ? 799 HOH EEE O   1 ? 
HETATM 2610 O O   . HOH E 5 .   ? -15.923 7.818  -24.783 1.000 40.798 ? 800 HOH EEE O   1 ? 
HETATM 2611 O O   . HOH E 5 .   ? -23.310 30.150 -6.465  1.000 53.081 ? 801 HOH EEE O   1 ? 
HETATM 2612 O O   . HOH E 5 .   ? -30.813 29.306 -14.027 1.000 29.185 ? 802 HOH EEE O   1 ? 
HETATM 2613 O O   . HOH E 5 .   ? -0.742  33.825 -6.073  1.000 26.041 ? 803 HOH EEE O   1 ? 
HETATM 2614 O O   . HOH E 5 .   ? -18.339 30.930 -29.555 1.000 26.104 ? 804 HOH EEE O   1 ? 
HETATM 2615 O O   . HOH E 5 .   ? -29.001 37.553 -12.512 1.000 21.429 ? 805 HOH EEE O   1 ? 
HETATM 2616 O O   . HOH E 5 .   ? -25.464 20.922 -9.427  1.000 19.453 ? 806 HOH EEE O   1 ? 
HETATM 2617 O O   . HOH E 5 .   ? -22.759 34.860 -22.109 1.000 26.815 ? 807 HOH EEE O   1 ? 
HETATM 2618 O O   . HOH E 5 .   ? -29.784 40.881 -22.484 1.000 33.128 ? 808 HOH EEE O   1 ? 
HETATM 2619 O O   . HOH E 5 .   ? -21.479 37.701 -20.617 1.000 20.315 ? 809 HOH EEE O   1 ? 
HETATM 2620 O O   . HOH E 5 .   ? -15.995 -7.178 -5.863  1.000 27.682 ? 810 HOH EEE O   1 ? 
HETATM 2621 O O   . HOH E 5 .   ? -12.339 19.188 -8.451  1.000 20.539 ? 811 HOH EEE O   1 ? 
HETATM 2622 O O   . HOH E 5 .   ? -26.876 37.021 -8.794  1.000 31.478 ? 812 HOH EEE O   1 ? 
HETATM 2623 O O   . HOH E 5 .   ? -6.819  46.390 -9.056  1.000 24.576 ? 813 HOH EEE O   1 ? 
HETATM 2624 O O   . HOH E 5 .   ? -3.889  27.754 -2.669  1.000 36.595 ? 814 HOH EEE O   1 ? 
HETATM 2625 O O   . HOH E 5 .   ? -21.243 2.284  -1.219  1.000 52.190 ? 815 HOH EEE O   1 ? 
HETATM 2626 O O   . HOH E 5 .   ? -3.079  46.468 -0.466  1.000 50.533 ? 816 HOH EEE O   1 ? 
HETATM 2627 O O   . HOH E 5 .   ? -5.655  22.277 -21.580 1.000 43.671 ? 817 HOH EEE O   1 ? 
HETATM 2628 O O   . HOH E 5 .   ? -30.296 25.922 -24.807 1.000 29.001 ? 818 HOH EEE O   1 ? 
HETATM 2629 O O   . HOH E 5 .   ? -5.552  31.158 -3.014  1.000 24.612 ? 819 HOH EEE O   1 ? 
HETATM 2630 O O   . HOH E 5 .   ? 0.253   46.264 -5.919  1.000 34.371 ? 820 HOH EEE O   1 ? 
HETATM 2631 O O   . HOH E 5 .   ? -4.347  33.235 -9.681  1.000 19.195 ? 821 HOH EEE O   1 ? 
HETATM 2632 O O   . HOH E 5 .   ? -9.140  29.493 -18.828 1.000 49.269 ? 822 HOH EEE O   1 ? 
HETATM 2633 O O   . HOH E 5 .   ? -9.311  -0.931 -2.516  1.000 39.697 ? 823 HOH EEE O   1 ? 
HETATM 2634 O O   . HOH E 5 .   ? -25.991 20.811 -26.460 1.000 35.353 ? 824 HOH EEE O   1 ? 
HETATM 2635 O O   . HOH E 5 .   ? -21.336 36.546 -29.521 1.000 38.153 ? 825 HOH EEE O   1 ? 
HETATM 2636 O O   . HOH E 5 .   ? -2.352  39.594 1.122   1.000 35.570 ? 826 HOH EEE O   1 ? 
HETATM 2637 O O   . HOH E 5 .   ? -9.212  37.631 3.107   1.000 32.356 ? 827 HOH EEE O   1 ? 
HETATM 2638 O O   . HOH E 5 .   ? -16.086 33.925 -18.329 1.000 33.854 ? 828 HOH EEE O   1 ? 
HETATM 2639 O O   . HOH E 5 .   ? -32.223 26.869 -12.311 1.000 37.376 ? 829 HOH EEE O   1 ? 
HETATM 2640 O O   . HOH E 5 .   ? -3.696  13.284 -11.463 1.000 38.992 ? 830 HOH EEE O   1 ? 
HETATM 2641 O O   . HOH E 5 .   ? -11.510 3.996  -7.758  1.000 35.518 ? 831 HOH EEE O   1 ? 
HETATM 2642 O O   . HOH E 5 .   ? -12.227 19.250 -1.241  1.000 27.355 ? 832 HOH EEE O   1 ? 
HETATM 2643 O O   . HOH E 5 .   ? -12.951 32.132 3.222   1.000 21.993 ? 833 HOH EEE O   1 ? 
HETATM 2644 O O   . HOH E 5 .   ? -25.071 29.658 -7.916  1.000 53.726 ? 834 HOH EEE O   1 ? 
HETATM 2645 O O   . HOH E 5 .   ? -7.592  50.103 -2.873  1.000 24.524 ? 835 HOH EEE O   1 ? 
HETATM 2646 O O   . HOH E 5 .   ? -18.632 13.683 -27.032 1.000 36.645 ? 836 HOH EEE O   1 ? 
HETATM 2647 O O   . HOH E 5 .   ? -29.618 29.843 -27.721 1.000 41.769 ? 837 HOH EEE O   1 ? 
HETATM 2648 O O   . HOH E 5 .   ? -23.584 -0.130 -22.054 1.000 41.328 ? 838 HOH EEE O   1 ? 
HETATM 2649 O O   . HOH E 5 .   ? -14.694 17.846 -22.724 1.000 31.617 ? 839 HOH EEE O   1 ? 
HETATM 2650 O O   . HOH E 5 .   ? -2.599  40.159 3.870   1.000 33.670 ? 840 HOH EEE O   1 ? 
HETATM 2651 O O   . HOH E 5 .   ? -25.032 12.003 -2.116  1.000 37.889 ? 841 HOH EEE O   1 ? 
HETATM 2652 O O   . HOH E 5 .   ? -13.798 34.702 3.830   1.000 31.602 ? 842 HOH EEE O   1 ? 
HETATM 2653 O O   . HOH E 5 .   ? -22.348 18.396 -2.900  1.000 32.840 ? 843 HOH EEE O   1 ? 
HETATM 2654 O O   . HOH E 5 .   ? -3.279  35.636 -2.152  1.000 19.569 ? 844 HOH EEE O   1 ? 
HETATM 2655 O O   . HOH E 5 .   ? -1.614  25.001 -14.621 1.000 60.010 ? 845 HOH EEE O   1 ? 
HETATM 2656 O O   . HOH E 5 .   ? -23.740 27.019 -6.257  1.000 29.528 ? 846 HOH EEE O   1 ? 
HETATM 2657 O O   . HOH E 5 .   ? -11.504 8.171  -11.323 1.000 42.950 ? 847 HOH EEE O   1 ? 
HETATM 2658 O O   . HOH E 5 .   ? -28.141 43.104 -19.690 1.000 32.909 ? 848 HOH EEE O   1 ? 
HETATM 2659 O O   . HOH E 5 .   ? -29.426 30.702 -12.220 1.000 25.174 ? 849 HOH EEE O   1 ? 
HETATM 2660 O O   . HOH E 5 .   ? -5.196  -0.971 -6.195  1.000 67.685 ? 850 HOH EEE O   1 ? 
HETATM 2661 O O   . HOH E 5 .   ? 3.878   41.079 -0.371  1.000 67.662 ? 851 HOH EEE O   1 ? 
HETATM 2662 O O   . HOH E 5 .   ? -23.731 30.596 -31.563 1.000 33.149 ? 852 HOH EEE O   1 ? 
HETATM 2663 O O   . HOH E 5 .   ? -26.884 30.085 -30.400 1.000 52.101 ? 853 HOH EEE O   1 ? 
HETATM 2664 O O   . HOH E 5 .   ? -32.082 34.947 -9.284  1.000 60.212 ? 854 HOH EEE O   1 ? 
HETATM 2665 O O   . HOH E 5 .   ? -23.274 37.922 -30.487 1.000 56.496 ? 855 HOH EEE O   1 ? 
HETATM 2666 O O   . HOH E 5 .   ? -17.122 12.007 -2.094  1.000 39.422 ? 856 HOH EEE O   1 ? 
HETATM 2667 O O   . HOH E 5 .   ? -26.977 10.334 -2.263  1.000 48.896 ? 857 HOH EEE O   1 ? 
HETATM 2668 O O   . HOH E 5 .   ? -30.944 35.502 -12.526 1.000 40.308 ? 858 HOH EEE O   1 ? 
HETATM 2669 O O   . HOH E 5 .   ? -28.081 5.659  -5.057  1.000 36.892 ? 859 HOH EEE O   1 ? 
HETATM 2670 O O   . HOH E 5 .   ? -27.023 -5.687 -17.858 1.000 52.357 ? 860 HOH EEE O   1 ? 
HETATM 2671 O O   . HOH E 5 .   ? -3.780  10.463 -11.553 1.000 46.896 ? 861 HOH EEE O   1 ? 
HETATM 2672 O O   . HOH E 5 .   ? -31.586 32.224 -16.372 1.000 35.248 ? 862 HOH EEE O   1 ? 
HETATM 2673 O O   . HOH E 5 .   ? -34.111 10.001 -10.006 1.000 45.162 ? 863 HOH EEE O   1 ? 
HETATM 2674 O O   . HOH E 5 .   ? -22.639 -7.119 -14.914 1.000 43.592 ? 864 HOH EEE O   1 ? 
HETATM 2675 O O   . HOH E 5 .   ? -8.122  5.215  -16.245 1.000 51.712 ? 865 HOH EEE O   1 ? 
HETATM 2676 O O   . HOH E 5 .   ? -12.581 34.877 -17.088 1.000 42.753 ? 866 HOH EEE O   1 ? 
HETATM 2677 O O   . HOH E 5 .   ? -9.152  6.675  -21.782 1.000 45.767 ? 867 HOH EEE O   1 ? 
HETATM 2678 O O   . HOH E 5 .   ? 1.522   26.986 -6.711  1.000 51.144 ? 868 HOH EEE O   1 ? 
HETATM 2679 O O   . HOH E 5 .   ? -14.243 10.687 -7.583  1.000 52.507 ? 869 HOH EEE O   1 ? 
HETATM 2680 O O   . HOH E 5 .   ? -15.622 18.421 -24.876 1.000 52.870 ? 870 HOH EEE O   1 ? 
HETATM 2681 O O   . HOH E 5 .   ? -20.038 -7.322 -8.449  1.000 49.672 ? 871 HOH EEE O   1 ? 
HETATM 2682 O O   . HOH E 5 .   ? -27.036 15.840 -8.576  1.000 32.855 ? 872 HOH EEE O   1 ? 
HETATM 2683 O O   . HOH E 5 .   ? -21.174 20.444 -1.425  1.000 59.728 ? 873 HOH EEE O   1 ? 
HETATM 2684 O O   . HOH E 5 .   ? -12.521 16.932 -23.907 1.000 54.050 ? 874 HOH EEE O   1 ? 
HETATM 2685 O O   . HOH E 5 .   ? -32.316 18.305 -26.122 1.000 54.951 ? 875 HOH EEE O   1 ? 
HETATM 2686 O O   . HOH E 5 .   ? -4.226  34.740 -12.076 1.000 30.330 ? 876 HOH EEE O   1 ? 
HETATM 2687 O O   . HOH E 5 .   ? -1.332  27.736 -1.232  1.000 58.499 ? 877 HOH EEE O   1 ? 
HETATM 2688 O O   . HOH E 5 .   ? 2.218   27.652 -3.931  1.000 61.798 ? 878 HOH EEE O   1 ? 
HETATM 2689 O O   . HOH E 5 .   ? -16.102 20.873 -25.869 1.000 49.815 ? 879 HOH EEE O   1 ? 
HETATM 2690 O O   . HOH E 5 .   ? -12.150 32.626 -16.864 1.000 40.712 ? 880 HOH EEE O   1 ? 
HETATM 2691 O O   . HOH E 5 .   ? -5.748  29.375 -1.898  1.000 43.809 ? 881 HOH EEE O   1 ? 
HETATM 2692 O O   . HOH E 5 .   ? -19.420 21.752 -26.537 1.000 55.041 ? 882 HOH EEE O   1 ? 
HETATM 2693 O O   . HOH E 5 .   ? -7.938  49.061 -0.242  1.000 31.857 ? 883 HOH EEE O   1 ? 
HETATM 2694 O O   . HOH E 5 .   ? -7.008  36.950 -14.611 1.000 27.166 ? 884 HOH EEE O   1 ? 
HETATM 2695 O O   . HOH E 5 .   ? -27.174 -5.064 -6.666  1.000 68.086 ? 885 HOH EEE O   1 ? 
HETATM 2696 O O   . HOH E 5 .   ? -13.497 9.245  -3.534  1.000 59.466 ? 886 HOH EEE O   1 ? 
HETATM 2697 O O   . HOH E 5 .   ? -29.559 34.969 -30.332 1.000 52.338 ? 887 HOH EEE O   1 ? 
HETATM 2698 O O   . HOH E 5 .   ? -13.354 25.281 -27.815 1.000 27.872 ? 888 HOH EEE O   1 ? 
HETATM 2699 O O   . HOH E 5 .   ? -30.324 40.341 -24.668 1.000 34.337 ? 889 HOH EEE O   1 ? 
HETATM 2700 O O   . HOH E 5 .   ? -4.252  12.183 -9.272  1.000 54.541 ? 890 HOH EEE O   1 ? 
HETATM 2701 O O   . HOH E 5 .   ? -7.587  8.584  -20.011 1.000 46.959 ? 891 HOH EEE O   1 ? 
HETATM 2702 O O   . HOH E 5 .   ? 1.141   35.657 -2.515  1.000 35.718 ? 892 HOH EEE O   1 ? 
HETATM 2703 O O   . HOH E 5 .   ? -23.879 35.620 -6.114  1.000 32.368 ? 893 HOH EEE O   1 ? 
HETATM 2704 O O   . HOH E 5 .   ? -30.946 33.199 -29.889 1.000 83.649 ? 894 HOH EEE O   1 ? 
HETATM 2705 O O   . HOH E 5 .   ? -14.541 40.177 1.505   1.000 33.121 ? 895 HOH EEE O   1 ? 
HETATM 2706 O O   . HOH E 5 .   ? -7.120  11.534 -21.894 1.000 51.946 ? 896 HOH EEE O   1 ? 
HETATM 2707 O O   . HOH E 5 .   ? -23.534 -8.125 -4.508  1.000 59.181 ? 897 HOH EEE O   1 ? 
HETATM 2708 O O   . HOH E 5 .   ? -12.091 20.818 -27.809 1.000 44.651 ? 898 HOH EEE O   1 ? 
HETATM 2709 O O   . HOH E 5 .   ? -19.990 35.064 -3.155  1.000 33.777 ? 899 HOH EEE O   1 ? 
HETATM 2710 O O   . HOH E 5 .   ? -23.144 28.144 -33.108 1.000 64.391 ? 900 HOH EEE O   1 ? 
HETATM 2711 O O   . HOH E 5 .   ? -22.483 35.066 -3.906  1.000 35.619 ? 901 HOH EEE O   1 ? 
HETATM 2712 O O   . HOH E 5 .   ? -22.366 40.182 -31.772 1.000 41.528 ? 902 HOH EEE O   1 ? 
HETATM 2713 O O   . HOH F 5 .   ? -2.895  52.744 -7.348  1.000 51.921 ? 201 HOH FFF O   1 ? 
HETATM 2714 O O   . HOH F 5 .   ? -3.217  52.196 -4.901  1.000 52.524 ? 202 HOH FFF O   1 ? 
HETATM 2715 O O   . HOH F 5 .   ? -12.193 57.788 -3.094  1.000 64.780 ? 203 HOH FFF O   1 ? 
HETATM 2716 O O   . HOH F 5 .   ? -29.931 49.939 -7.687  1.000 50.252 ? 204 HOH FFF O   1 ? 
HETATM 2717 O O   . HOH F 5 .   ? -17.313 48.616 0.092   1.000 46.874 ? 205 HOH FFF O   1 ? 
HETATM 2718 O O   . HOH F 5 .   ? -28.260 54.484 -29.503 1.000 60.170 ? 206 HOH FFF O   1 ? 
HETATM 2719 O O   . HOH F 5 .   ? -30.735 53.890 -29.812 1.000 67.105 ? 207 HOH FFF O   1 ? 
HETATM 2720 O O   . HOH F 5 .   ? -35.836 52.571 -20.665 1.000 35.273 ? 208 HOH FFF O   1 ? 
HETATM 2721 O O   . HOH F 5 .   ? -31.423 49.181 -15.522 1.000 40.748 ? 209 HOH FFF O   1 ? 
HETATM 2722 O O   . HOH F 5 .   ? -22.690 43.086 -26.083 1.000 45.008 ? 210 HOH FFF O   1 ? 
HETATM 2723 O O   . HOH F 5 .   ? -20.785 52.368 -0.209  1.000 31.820 ? 211 HOH FFF O   1 ? 
HETATM 2724 O O   . HOH F 5 .   ? -28.424 38.793 -10.145 1.000 29.349 ? 212 HOH FFF O   1 ? 
HETATM 2725 O O   . HOH F 5 .   ? -11.975 64.132 -22.255 1.000 54.469 ? 213 HOH FFF O   1 ? 
HETATM 2726 O O   . HOH F 5 .   ? -14.569 36.118 -22.405 1.000 28.362 ? 214 HOH FFF O   1 ? 
HETATM 2727 O O   . HOH F 5 .   ? -11.474 58.518 -8.174  1.000 45.077 ? 215 HOH FFF O   1 ? 
HETATM 2728 O O   . HOH F 5 .   ? -35.072 60.476 -15.380 1.000 52.696 ? 216 HOH FFF O   1 ? 
HETATM 2729 O O   . HOH F 5 .   ? -4.395  46.677 -19.966 1.000 39.933 ? 217 HOH FFF O   1 ? 
HETATM 2730 O O   . HOH F 5 .   ? -3.995  44.863 -14.472 1.000 42.865 ? 218 HOH FFF O   1 ? 
HETATM 2731 O O   . HOH F 5 .   ? -24.224 49.767 -2.120  1.000 36.907 ? 219 HOH FFF O   1 ? 
HETATM 2732 O O   . HOH F 5 .   ? -22.995 68.416 -10.801 1.000 39.121 ? 220 HOH FFF O   1 ? 
HETATM 2733 O O   . HOH F 5 .   ? 0.420   45.940 -14.670 1.000 57.527 ? 221 HOH FFF O   1 ? 
HETATM 2734 O O   . HOH F 5 .   ? -17.843 71.809 -15.662 1.000 25.132 ? 222 HOH FFF O   1 ? 
HETATM 2735 O O   . HOH F 5 .   ? -13.985 51.429 -5.721  1.000 31.188 ? 223 HOH FFF O   1 ? 
HETATM 2736 O O   . HOH F 5 .   ? -10.589 43.124 -22.447 1.000 37.055 ? 224 HOH FFF O   1 ? 
HETATM 2737 O O   . HOH F 5 .   ? -14.664 42.746 -12.392 1.000 17.836 ? 225 HOH FFF O   1 ? 
HETATM 2738 O O   . HOH F 5 .   ? -21.854 74.732 -10.565 1.000 38.844 ? 226 HOH FFF O   1 ? 
HETATM 2739 O O   . HOH F 5 .   ? -25.058 70.806 -20.965 1.000 34.343 ? 227 HOH FFF O   1 ? 
HETATM 2740 O O   . HOH F 5 .   ? -29.367 41.397 -12.130 1.000 47.549 ? 228 HOH FFF O   1 ? 
HETATM 2741 O O   . HOH F 5 .   ? -10.125 36.458 -17.484 1.000 40.261 ? 229 HOH FFF O   1 ? 
HETATM 2742 O O   . HOH F 5 .   ? -7.202  42.408 -20.183 1.000 45.447 ? 230 HOH FFF O   1 ? 
HETATM 2743 O O   . HOH F 5 .   ? -29.203 46.340 -17.100 1.000 34.231 ? 231 HOH FFF O   1 ? 
HETATM 2744 O O   . HOH F 5 .   ? -28.249 44.170 -15.578 1.000 28.400 ? 232 HOH FFF O   1 ? 
HETATM 2745 O O   . HOH F 5 .   ? -16.361 69.651 -22.820 1.000 34.627 ? 233 HOH FFF O   1 ? 
HETATM 2746 O O   . HOH F 5 .   ? -11.350 46.754 -10.742 1.000 23.788 ? 234 HOH FFF O   1 ? 
HETATM 2747 O O   . HOH F 5 .   ? -20.233 44.289 -8.752  1.000 17.863 ? 235 HOH FFF O   1 ? 
HETATM 2748 O O   . HOH F 5 .   ? -18.406 69.849 -20.476 1.000 28.785 ? 236 HOH FFF O   1 ? 
HETATM 2749 O O   . HOH F 5 .   ? -24.141 37.080 -8.248  1.000 22.206 ? 237 HOH FFF O   1 ? 
HETATM 2750 O O   . HOH F 5 .   ? -15.938 68.324 -8.339  1.000 44.009 ? 238 HOH FFF O   1 ? 
HETATM 2751 O O   . HOH F 5 .   ? -10.204 61.209 -17.002 1.000 48.392 ? 239 HOH FFF O   1 ? 
HETATM 2752 O O   . HOH F 5 .   ? -8.708  57.296 -8.378  1.000 50.764 ? 240 HOH FFF O   1 ? 
HETATM 2753 O O   . HOH F 5 .   ? -17.222 65.794 -8.616  1.000 43.146 ? 241 HOH FFF O   1 ? 
HETATM 2754 O O   . HOH F 5 .   ? -14.294 38.955 -19.965 1.000 30.173 ? 242 HOH FFF O   1 ? 
HETATM 2755 O O   . HOH F 5 .   ? -12.983 43.179 -24.775 1.000 32.833 ? 243 HOH FFF O   1 ? 
HETATM 2756 O O   . HOH F 5 .   ? -27.664 49.277 -21.996 1.000 37.928 ? 244 HOH FFF O   1 ? 
HETATM 2757 O O   . HOH F 5 .   ? -14.916 50.862 -26.427 1.000 31.375 ? 245 HOH FFF O   1 ? 
HETATM 2758 O O   . HOH F 5 .   ? -24.377 72.646 -18.848 1.000 37.420 ? 246 HOH FFF O   1 ? 
HETATM 2759 O O   . HOH F 5 .   ? -8.536  39.327 -14.552 1.000 29.157 ? 247 HOH FFF O   1 ? 
HETATM 2760 O O   . HOH F 5 .   ? -16.249 50.170 -6.429  1.000 25.259 ? 248 HOH FFF O   1 ? 
HETATM 2761 O O   . HOH F 5 .   ? -26.004 49.348 -8.850  1.000 27.466 ? 249 HOH FFF O   1 ? 
HETATM 2762 O O   . HOH F 5 .   ? -14.468 63.057 -27.387 1.000 46.021 ? 250 HOH FFF O   1 ? 
HETATM 2763 O O   . HOH F 5 .   ? -18.604 40.388 -0.927  1.000 47.050 ? 251 HOH FFF O   1 ? 
HETATM 2764 O O   . HOH F 5 .   ? -22.355 62.417 -8.264  1.000 43.105 ? 252 HOH FFF O   1 ? 
HETATM 2765 O O   . HOH F 5 .   ? -24.355 40.014 -4.652  1.000 38.239 ? 253 HOH FFF O   1 ? 
HETATM 2766 O O   . HOH F 5 .   ? -10.678 40.549 -12.803 1.000 28.008 ? 254 HOH FFF O   1 ? 
HETATM 2767 O O   . HOH F 5 .   ? -11.428 53.956 -28.940 1.000 41.366 ? 255 HOH FFF O   1 ? 
HETATM 2768 O O   . HOH F 5 .   ? -7.466  56.052 -14.057 1.000 40.180 ? 256 HOH FFF O   1 ? 
HETATM 2769 O O   . HOH F 5 .   ? -25.833 43.043 -22.114 1.000 38.938 ? 257 HOH FFF O   1 ? 
HETATM 2770 O O   . HOH F 5 .   ? -19.863 39.176 -2.400  1.000 36.277 ? 258 HOH FFF O   1 ? 
HETATM 2771 O O   . HOH F 5 .   ? -22.034 67.627 -14.783 1.000 27.033 ? 259 HOH FFF O   1 ? 
HETATM 2772 O O   . HOH F 5 .   ? -8.033  54.207 -18.746 1.000 41.767 ? 260 HOH FFF O   1 ? 
HETATM 2773 O O   . HOH F 5 .   ? -13.474 39.889 -22.875 1.000 40.894 ? 261 HOH FFF O   1 ? 
HETATM 2774 O O   . HOH F 5 .   ? -17.752 52.343 -7.954  1.000 37.739 ? 262 HOH FFF O   1 ? 
HETATM 2775 O O   . HOH F 5 .   ? -22.231 71.611 -9.784  1.000 42.354 ? 263 HOH FFF O   1 ? 
HETATM 2776 O O   . HOH F 5 .   ? -16.860 44.480 -27.292 1.000 33.058 ? 264 HOH FFF O   1 ? 
HETATM 2777 O O   . HOH F 5 .   ? -23.931 48.977 -4.789  1.000 28.493 ? 265 HOH FFF O   1 ? 
HETATM 2778 O O   . HOH F 5 .   ? -6.925  41.921 -12.876 1.000 46.481 ? 266 HOH FFF O   1 ? 
HETATM 2779 O O   . HOH F 5 .   ? -19.906 63.919 -34.204 1.000 47.362 ? 267 HOH FFF O   1 ? 
HETATM 2780 O O   . HOH F 5 .   ? -10.229 55.292 -25.066 1.000 43.715 ? 268 HOH FFF O   1 ? 
HETATM 2781 O O   . HOH F 5 .   ? -31.063 46.262 -11.272 1.000 33.697 ? 269 HOH FFF O   1 ? 
HETATM 2782 O O   . HOH F 5 .   ? -22.293 56.610 -30.503 1.000 44.414 ? 270 HOH FFF O   1 ? 
HETATM 2783 O O   . HOH F 5 .   ? -26.300 68.996 -16.783 1.000 46.537 ? 271 HOH FFF O   1 ? 
HETATM 2784 O O   . HOH F 5 .   ? -13.876 67.244 -12.244 1.000 48.354 ? 272 HOH FFF O   1 ? 
HETATM 2785 O O   . HOH F 5 .   ? -5.295  51.902 -3.188  1.000 38.974 ? 273 HOH FFF O   1 ? 
HETATM 2786 O O   . HOH F 5 .   ? -7.554  53.691 -16.308 1.000 55.106 ? 274 HOH FFF O   1 ? 
HETATM 2787 O O   . HOH F 5 .   ? -12.576 38.378 -22.478 1.000 60.759 ? 275 HOH FFF O   1 ? 
HETATM 2788 O O   . HOH F 5 .   ? -17.527 53.108 -10.331 1.000 44.130 ? 276 HOH FFF O   1 ? 
HETATM 2789 O O   . HOH F 5 .   ? -24.898 55.719 -9.992  1.000 46.388 ? 277 HOH FFF O   1 ? 
HETATM 2790 O O   . HOH F 5 .   ? -37.796 61.519 -27.612 1.000 60.656 ? 278 HOH FFF O   1 ? 
HETATM 2791 O O   . HOH F 5 .   ? -9.438  45.872 -8.816  1.000 31.735 ? 279 HOH FFF O   1 ? 
HETATM 2792 O O   . HOH F 5 .   ? -25.923 41.225 -24.320 1.000 37.348 ? 280 HOH FFF O   1 ? 
HETATM 2793 O O   . HOH F 5 .   ? -19.350 43.884 -1.591  1.000 36.185 ? 281 HOH FFF O   1 ? 
HETATM 2794 O O   . HOH F 5 .   ? -23.223 41.866 -28.277 1.000 48.268 ? 282 HOH FFF O   1 ? 
HETATM 2795 O O   . HOH F 5 .   ? 1.289   48.688 -13.328 1.000 40.746 ? 283 HOH FFF O   1 ? 
HETATM 2796 O O   . HOH F 5 .   ? -15.952 46.320 -0.270  1.000 24.426 ? 284 HOH FFF O   1 ? 
HETATM 2797 O O   . HOH F 5 .   ? -12.928 49.201 -27.826 1.000 45.467 ? 285 HOH FFF O   1 ? 
HETATM 2798 O O   . HOH F 5 .   ? -13.166 44.211 -27.295 1.000 20.138 ? 286 HOH FFF O   1 ? 
HETATM 2799 O O   . HOH F 5 .   ? -2.476  51.202 -12.233 1.000 44.216 ? 287 HOH FFF O   1 ? 
HETATM 2800 O O   . HOH F 5 .   ? -19.712 46.011 0.808   1.000 47.201 ? 288 HOH FFF 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   . ILE A 3   ? 0.738 0.958 0.794 -0.147 0.048  -0.056 332 ILE EEE N   
2    C CA  . ILE A 3   ? 0.646 0.939 0.798 -0.153 0.028  -0.039 332 ILE EEE CA  
3    C C   . ILE A 3   ? 0.554 0.794 0.752 -0.113 -0.059 0.016  332 ILE EEE C   
4    O O   . ILE A 3   ? 0.531 0.773 0.843 -0.137 -0.058 -0.003 332 ILE EEE O   
5    C CB  . ILE A 3   ? 0.724 1.051 0.815 -0.154 0.002  -0.062 332 ILE EEE CB  
6    C CG1 . ILE A 3   ? 0.727 1.119 0.845 -0.158 0.027  -0.090 332 ILE EEE CG1 
7    C CG2 . ILE A 3   ? 0.758 1.068 0.869 -0.155 -0.004 -0.081 332 ILE EEE CG2 
8    C CD1 . ILE A 3   ? 0.704 1.184 0.874 -0.164 -0.023 -0.109 332 ILE EEE CD1 
9    N N   . THR A 4   ? 0.450 0.619 0.782 -0.103 -0.041 0.085  333 THR EEE N   
10   C CA  . THR A 4   ? 0.393 0.506 0.755 -0.058 -0.053 0.057  333 THR EEE CA  
11   C C   . THR A 4   ? 0.288 0.467 0.676 -0.112 -0.067 0.022  333 THR EEE C   
12   O O   . THR A 4   ? 0.266 0.471 0.693 -0.079 -0.039 0.005  333 THR EEE O   
13   C CB  . THR A 4   ? 0.483 0.524 0.815 -0.009 -0.018 0.027  333 THR EEE CB  
14   O OG1 . THR A 4   ? 0.740 0.499 0.909 0.003  -0.037 0.033  333 THR EEE OG1 
15   C CG2 . THR A 4   ? 0.530 0.584 0.844 -0.014 0.031  0.021  333 THR EEE CG2 
16   N N   . ASN A 5   ? 0.186 0.484 0.621 -0.091 -0.062 0.057  334 ASN EEE N   
17   C CA  . ASN A 5   ? 0.266 0.472 0.597 -0.083 -0.034 0.059  334 ASN EEE CA  
18   C C   . ASN A 5   ? 0.276 0.440 0.584 -0.063 -0.017 0.024  334 ASN EEE C   
19   O O   . ASN A 5   ? 0.296 0.344 0.582 -0.044 -0.008 0.033  334 ASN EEE O   
20   C CB  . ASN A 5   ? 0.344 0.537 0.594 -0.072 -0.045 0.034  334 ASN EEE CB  
21   C CG  . ASN A 5   ? 0.452 0.639 0.615 -0.054 -0.016 0.057  334 ASN EEE CG  
22   O OD1 . ASN A 5   ? 0.500 0.756 0.646 -0.124 0.038  0.069  334 ASN EEE OD1 
23   N ND2 . ASN A 5   ? 0.529 0.719 0.617 -0.016 -0.042 0.035  334 ASN EEE ND2 
24   N N   . LEU A 6   ? 0.296 0.394 0.593 -0.067 -0.011 0.026  335 LEU EEE N   
25   C CA  . LEU A 6   ? 0.262 0.424 0.580 -0.078 -0.029 0.024  335 LEU EEE CA  
26   C C   . LEU A 6   ? 0.287 0.400 0.534 -0.059 -0.007 -0.018 335 LEU EEE C   
27   O O   . LEU A 6   ? 0.267 0.385 0.543 -0.067 0.031  -0.024 335 LEU EEE O   
28   C CB  . LEU A 6   ? 0.251 0.517 0.633 -0.030 -0.031 0.011  335 LEU EEE CB  
29   C CG  . LEU A 6   ? 0.294 0.604 0.687 -0.074 0.001  0.015  335 LEU EEE CG  
30   C CD1 . LEU A 6   ? 0.344 0.640 0.738 -0.050 0.022  -0.014 335 LEU EEE CD1 
31   C CD2 . LEU A 6   ? 0.360 0.669 0.753 -0.018 -0.059 -0.004 335 LEU EEE CD2 
32   N N   . CYS A 7   ? 0.313 0.334 0.495 -0.059 0.008  0.011  336 CYS EEE N   
33   C CA  . CYS A 7   ? 0.308 0.331 0.501 -0.058 0.004  0.024  336 CYS EEE CA  
34   C C   . CYS A 7   ? 0.229 0.353 0.475 -0.041 0.000  0.025  336 CYS EEE C   
35   O O   . CYS A 7   ? 0.319 0.321 0.496 -0.055 -0.056 0.029  336 CYS EEE O   
36   C CB  . CYS A 7   ? 0.306 0.363 0.483 -0.048 0.009  0.024  336 CYS EEE CB  
37   S SG  . CYS A 7   ? 0.311 0.347 0.521 -0.051 0.011  0.007  336 CYS EEE SG  
38   N N   . PRO A 8   ? 0.263 0.369 0.530 -0.024 0.025  0.004  337 PRO EEE N   
39   C CA  . PRO A 8   ? 0.308 0.341 0.529 -0.034 0.001  0.016  337 PRO EEE CA  
40   C C   . PRO A 8   ? 0.271 0.341 0.535 -0.032 0.007  0.003  337 PRO EEE C   
41   O O   . PRO A 8   ? 0.300 0.341 0.589 -0.039 0.060  -0.018 337 PRO EEE O   
42   C CB  . PRO A 8   ? 0.337 0.390 0.527 -0.017 0.015  0.028  337 PRO EEE CB  
43   C CG  . PRO A 8   ? 0.318 0.384 0.514 0.002  0.039  -0.001 337 PRO EEE CG  
44   C CD  . PRO A 8   ? 0.315 0.347 0.508 -0.012 0.026  0.027  337 PRO EEE CD  
45   N N   . PHE A 9   ? 0.298 0.306 0.528 -0.052 -0.002 0.018  338 PHE EEE N   
46   C CA  . PHE A 9   ? 0.312 0.351 0.542 -0.030 0.032  0.028  338 PHE EEE CA  
47   C C   . PHE A 9   ? 0.327 0.366 0.523 -0.032 0.009  0.037  338 PHE EEE C   
48   O O   . PHE A 9   ? 0.337 0.352 0.524 -0.028 0.051  0.018  338 PHE EEE O   
49   C CB  . PHE A 9   ? 0.353 0.344 0.563 -0.045 0.014  0.006  338 PHE EEE CB  
50   C CG  . PHE A 9   ? 0.341 0.373 0.583 -0.043 0.035  0.028  338 PHE EEE CG  
51   C CD1 . PHE A 9   ? 0.373 0.399 0.611 -0.038 -0.001 0.018  338 PHE EEE CD1 
52   C CD2 . PHE A 9   ? 0.364 0.381 0.637 -0.064 0.029  0.007  338 PHE EEE CD2 
53   C CE1 . PHE A 9   ? 0.346 0.425 0.628 -0.058 0.008  0.016  338 PHE EEE CE1 
54   C CE2 . PHE A 9   ? 0.393 0.390 0.626 -0.048 -0.017 -0.038 338 PHE EEE CE2 
55   C CZ  . PHE A 9   ? 0.336 0.424 0.651 -0.037 0.015  -0.006 338 PHE EEE CZ  
56   N N   . GLY A 10  ? 0.323 0.368 0.533 -0.034 0.007  0.028  339 GLY EEE N   
57   C CA  . GLY A 10  ? 0.288 0.422 0.582 -0.029 0.006  0.039  339 GLY EEE CA  
58   C C   . GLY A 10  ? 0.219 0.428 0.582 -0.049 0.007  0.047  339 GLY EEE C   
59   O O   . GLY A 10  ? 0.164 0.449 0.662 -0.071 -0.025 0.066  339 GLY EEE O   
60   N N   . GLU A 11  ? 0.242 0.397 0.555 -0.026 0.053  0.045  340 GLU EEE N   
61   C CA  . GLU A 11  ? 0.242 0.399 0.594 -0.026 0.056  0.034  340 GLU EEE CA  
62   C C   . GLU A 11  ? 0.228 0.356 0.528 0.012  0.086  0.021  340 GLU EEE C   
63   O O   . GLU A 11  ? 0.224 0.350 0.596 -0.005 0.091  0.036  340 GLU EEE O   
64   C CB  . GLU A 11  ? 0.277 0.457 0.605 -0.020 0.052  0.056  340 GLU EEE CB  
65   C CG  . GLU A 11  ? 0.331 0.531 0.672 -0.083 0.067  0.040  340 GLU EEE CG  
66   C CD  . GLU A 11  ? 0.439 0.600 0.688 -0.108 0.075  0.074  340 GLU EEE CD  
67   O OE1 . GLU A 11  ? 0.474 0.646 0.784 -0.064 0.031  0.022  340 GLU EEE OE1 
68   O OE2 . GLU A 11  ? 0.393 0.774 0.764 -0.152 0.120  0.049  340 GLU EEE OE2 
69   N N   . VAL A 12  ? 0.189 0.332 0.475 0.026  0.051  0.052  341 VAL EEE N   
70   C CA  . VAL A 12  ? 0.208 0.338 0.440 -0.007 0.013  0.059  341 VAL EEE CA  
71   C C   . VAL A 12  ? 0.172 0.326 0.396 0.027  -0.004 0.008  341 VAL EEE C   
72   O O   . VAL A 12  ? 0.207 0.339 0.416 -0.023 -0.032 0.025  341 VAL EEE O   
73   C CB  . VAL A 12  ? 0.256 0.375 0.465 0.030  0.003  0.072  341 VAL EEE CB  
74   C CG1 . VAL A 12  ? 0.197 0.412 0.432 0.044  -0.042 0.086  341 VAL EEE CG1 
75   C CG2 . VAL A 12  ? 0.253 0.411 0.444 0.001  0.025  0.090  341 VAL EEE CG2 
76   N N   . PHE A 13  ? 0.170 0.330 0.406 -0.002 -0.014 0.006  342 PHE EEE N   
77   C CA  . PHE A 13  ? 0.194 0.341 0.404 0.033  -0.027 0.005  342 PHE EEE CA  
78   C C   . PHE A 13  ? 0.201 0.350 0.457 0.035  -0.026 0.024  342 PHE EEE C   
79   O O   . PHE A 13  ? 0.207 0.395 0.446 0.038  0.007  0.050  342 PHE EEE O   
80   C CB  . PHE A 13  ? 0.223 0.360 0.419 -0.012 -0.040 -0.013 342 PHE EEE CB  
81   C CG  . PHE A 13  ? 0.239 0.323 0.374 -0.004 -0.026 -0.015 342 PHE EEE CG  
82   C CD1 . PHE A 13  ? 0.222 0.362 0.407 -0.013 -0.019 0.021  342 PHE EEE CD1 
83   C CD2 . PHE A 13  ? 0.207 0.296 0.366 -0.014 -0.041 -0.022 342 PHE EEE CD2 
84   C CE1 . PHE A 13  ? 0.272 0.325 0.410 0.007  0.010  -0.012 342 PHE EEE CE1 
85   C CE2 . PHE A 13  ? 0.210 0.308 0.378 -0.010 -0.029 -0.035 342 PHE EEE CE2 
86   C CZ  . PHE A 13  ? 0.219 0.339 0.398 0.005  -0.020 -0.016 342 PHE EEE CZ  
87   N N   . ASN A 14  ? 0.207 0.392 0.476 0.026  -0.023 0.047  343 ASN EEE N   
88   C CA  . ASN A 14  ? 0.190 0.413 0.504 0.021  -0.031 0.023  343 ASN EEE CA  
89   C C   . ASN A 14  ? 0.169 0.369 0.481 0.011  -0.046 0.039  343 ASN EEE C   
90   O O   . ASN A 14  ? 0.136 0.517 0.585 -0.005 -0.006 0.021  343 ASN EEE O   
91   C CB  . ASN A 14  ? 0.184 0.453 0.548 0.024  -0.085 0.026  343 ASN EEE CB  
92   C CG  . ASN A 14  ? 0.228 0.585 0.541 0.024  -0.112 0.017  343 ASN EEE CG  
93   O OD1 . ASN A 14  ? 0.308 0.668 0.570 -0.038 -0.085 -0.000 343 ASN EEE OD1 
94   N ND2 . ASN A 14  ? 0.260 0.612 0.623 0.011  -0.061 -0.019 343 ASN EEE ND2 
95   N N   . ALA A 15  ? 0.146 0.342 0.481 -0.024 -0.025 0.052  344 ALA EEE N   
96   C CA  . ALA A 15  ? 0.161 0.371 0.501 -0.022 -0.005 0.037  344 ALA EEE CA  
97   C C   . ALA A 15  ? 0.160 0.395 0.523 -0.005 -0.032 0.047  344 ALA EEE C   
98   O O   . ALA A 15  ? 0.210 0.388 0.523 0.059  -0.023 0.053  344 ALA EEE O   
99   C CB  . ALA A 15  ? 0.166 0.388 0.498 -0.023 -0.017 0.043  344 ALA EEE CB  
100  N N   . THR A 16  ? 0.171 0.395 0.624 -0.036 -0.014 -0.008 345 THR EEE N   
101  C CA  A THR A 16  ? 0.198 0.444 0.663 -0.006 -0.007 0.026  345 THR EEE CA  
102  C CA  B THR A 16  ? 0.240 0.428 0.648 -0.015 -0.020 0.027  345 THR EEE CA  
103  C C   . THR A 16  ? 0.265 0.454 0.627 -0.039 -0.059 0.036  345 THR EEE C   
104  O O   . THR A 16  ? 0.347 0.417 0.730 -0.045 -0.170 0.053  345 THR EEE O   
105  C CB  A THR A 16  ? 0.225 0.520 0.704 0.018  0.027  0.018  345 THR EEE CB  
106  C CB  B THR A 16  ? 0.293 0.466 0.666 0.022  0.012  0.023  345 THR EEE CB  
107  O OG1 A THR A 16  ? 0.126 0.553 0.808 0.058  0.045  -0.008 345 THR EEE OG1 
108  O OG1 B THR A 16  ? 0.310 0.516 0.652 0.055  0.067  0.038  345 THR EEE OG1 
109  C CG2 A THR A 16  ? 0.251 0.546 0.695 0.027  0.072  0.020  345 THR EEE CG2 
110  C CG2 B THR A 16  ? 0.325 0.482 0.684 0.018  -0.014 0.001  345 THR EEE CG2 
111  N N   . ARG A 17  ? 0.171 0.353 0.577 -0.019 -0.002 0.027  346 ARG EEE N   
112  C CA  . ARG A 17  ? 0.113 0.360 0.533 -0.008 0.045  0.040  346 ARG EEE CA  
113  C C   . ARG A 17  ? 0.139 0.304 0.382 -0.001 0.020  0.025  346 ARG EEE C   
114  O O   . ARG A 17  ? 0.143 0.333 0.429 -0.016 0.069  0.044  346 ARG EEE O   
115  C CB  . ARG A 17  ? 0.245 0.409 0.557 0.019  0.042  0.044  346 ARG EEE CB  
116  C CG  . ARG A 17  ? 0.251 0.551 0.689 0.045  0.033  0.042  346 ARG EEE CG  
117  C CD  . ARG A 17  ? 0.392 0.598 0.755 0.006  0.097  0.089  346 ARG EEE CD  
118  N NE  . ARG A 17  ? 0.506 0.710 0.882 0.101  0.131  0.073  346 ARG EEE NE  
119  C CZ  . ARG A 17  ? 0.584 0.749 0.893 0.048  0.166  0.166  346 ARG EEE CZ  
120  N NH1 . ARG A 17  ? 0.582 0.844 0.952 0.008  0.222  0.151  346 ARG EEE NH1 
121  N NH2 . ARG A 17  ? 0.548 0.842 0.980 0.031  0.145  0.157  346 ARG EEE NH2 
122  N N   . PHE A 18  ? 0.135 0.259 0.353 -0.009 0.003  0.017  347 PHE EEE N   
123  C CA  . PHE A 18  ? 0.127 0.257 0.316 -0.014 -0.013 0.005  347 PHE EEE CA  
124  C C   . PHE A 18  ? 0.134 0.251 0.273 0.003  -0.001 0.002  347 PHE EEE C   
125  O O   . PHE A 18  ? 0.085 0.254 0.303 -0.011 -0.013 0.013  347 PHE EEE O   
126  C CB  . PHE A 18  ? 0.136 0.288 0.312 -0.027 -0.029 0.020  347 PHE EEE CB  
127  C CG  . PHE A 18  ? 0.186 0.292 0.307 -0.031 -0.013 0.020  347 PHE EEE CG  
128  C CD1 . PHE A 18  ? 0.229 0.321 0.330 -0.083 0.003  0.002  347 PHE EEE CD1 
129  C CD2 . PHE A 18  ? 0.210 0.277 0.327 0.006  -0.050 0.016  347 PHE EEE CD2 
130  C CE1 . PHE A 18  ? 0.268 0.347 0.288 -0.065 -0.016 -0.023 347 PHE EEE CE1 
131  C CE2 . PHE A 18  ? 0.268 0.300 0.329 -0.001 -0.058 0.007  347 PHE EEE CE2 
132  C CZ  . PHE A 18  ? 0.301 0.299 0.333 -0.040 -0.036 -0.003 347 PHE EEE CZ  
133  N N   . ALA A 19  ? 0.137 0.253 0.274 0.001  0.002  0.021  348 ALA EEE N   
134  C CA  . ALA A 19  ? 0.162 0.246 0.258 -0.007 -0.001 0.018  348 ALA EEE CA  
135  C C   . ALA A 19  ? 0.104 0.223 0.218 0.010  -0.015 0.003  348 ALA EEE C   
136  O O   . ALA A 19  ? 0.111 0.236 0.229 -0.005 -0.014 -0.009 348 ALA EEE O   
137  C CB  . ALA A 19  ? 0.148 0.266 0.258 -0.005 0.002  0.036  348 ALA EEE CB  
138  N N   . SER A 20  ? 0.110 0.228 0.224 -0.016 0.031  0.001  349 SER EEE N   
139  C CA  . SER A 20  ? 0.110 0.234 0.211 -0.011 0.036  0.011  349 SER EEE CA  
140  C C   . SER A 20  ? 0.144 0.219 0.190 -0.006 0.022  0.013  349 SER EEE C   
141  O O   . SER A 20  ? 0.087 0.249 0.212 -0.007 0.001  0.023  349 SER EEE O   
142  C CB  . SER A 20  ? 0.127 0.219 0.224 -0.002 0.014  0.009  349 SER EEE CB  
143  O OG  . SER A 20  ? 0.139 0.221 0.263 0.009  -0.002 0.006  349 SER EEE OG  
144  N N   . VAL A 21  ? 0.121 0.236 0.185 -0.009 0.011  0.002  350 VAL EEE N   
145  C CA  . VAL A 21  ? 0.131 0.221 0.179 -0.002 -0.000 -0.011 350 VAL EEE CA  
146  C C   . VAL A 21  ? 0.140 0.212 0.172 -0.010 0.008  -0.004 350 VAL EEE C   
147  O O   . VAL A 21  ? 0.101 0.233 0.208 0.000  -0.011 -0.000 350 VAL EEE O   
148  C CB  . VAL A 21  ? 0.143 0.217 0.181 0.001  0.001  -0.005 350 VAL EEE CB  
149  C CG1 . VAL A 21  ? 0.089 0.221 0.173 0.005  0.009  0.002  350 VAL EEE CG1 
150  C CG2 . VAL A 21  ? 0.141 0.209 0.211 -0.007 -0.009 -0.026 350 VAL EEE CG2 
151  N N   . TYR A 22  ? 0.131 0.227 0.185 -0.014 0.009  -0.002 351 TYR EEE N   
152  C CA  . TYR A 22  ? 0.145 0.234 0.183 0.003  -0.001 0.007  351 TYR EEE CA  
153  C C   . TYR A 22  ? 0.121 0.228 0.201 -0.000 0.013  0.007  351 TYR EEE C   
154  O O   . TYR A 22  ? 0.158 0.238 0.202 -0.004 -0.001 0.011  351 TYR EEE O   
155  C CB  . TYR A 22  ? 0.117 0.237 0.180 -0.008 -0.015 0.012  351 TYR EEE CB  
156  C CG  . TYR A 22  ? 0.159 0.231 0.179 -0.012 0.007  0.007  351 TYR EEE CG  
157  C CD1 . TYR A 22  ? 0.156 0.238 0.199 -0.008 0.020  0.005  351 TYR EEE CD1 
158  C CD2 . TYR A 22  ? 0.156 0.269 0.179 -0.010 0.016  0.017  351 TYR EEE CD2 
159  C CE1 . TYR A 22  ? 0.159 0.252 0.234 0.019  0.036  0.011  351 TYR EEE CE1 
160  C CE2 . TYR A 22  ? 0.219 0.269 0.208 0.003  0.047  0.016  351 TYR EEE CE2 
161  C CZ  . TYR A 22  ? 0.202 0.268 0.226 0.008  0.068  0.012  351 TYR EEE CZ  
162  O OH  . TYR A 22  ? 0.278 0.291 0.321 0.005  0.154  -0.004 351 TYR EEE OH  
163  N N   . ALA A 23  ? 0.115 0.228 0.210 0.001  -0.000 0.003  352 ALA EEE N   
164  C CA  . ALA A 23  ? 0.183 0.217 0.201 0.004  0.009  0.012  352 ALA EEE CA  
165  C C   . ALA A 23  ? 0.161 0.228 0.213 -0.010 0.010  0.008  352 ALA EEE C   
166  O O   . ALA A 23  ? 0.142 0.268 0.246 -0.026 -0.008 -0.006 352 ALA EEE O   
167  C CB  . ALA A 23  ? 0.174 0.227 0.222 -0.001 0.023  0.012  352 ALA EEE CB  
168  N N   . TRP A 24  ? 0.134 0.219 0.233 -0.005 -0.008 -0.006 353 TRP EEE N   
169  C CA  . TRP A 24  ? 0.154 0.225 0.220 0.004  -0.016 0.002  353 TRP EEE CA  
170  C C   . TRP A 24  ? 0.145 0.223 0.242 -0.009 -0.007 0.003  353 TRP EEE C   
171  O O   . TRP A 24  ? 0.151 0.243 0.264 -0.038 -0.013 0.039  353 TRP EEE O   
172  C CB  . TRP A 24  ? 0.141 0.216 0.228 0.006  -0.022 -0.006 353 TRP EEE CB  
173  C CG  . TRP A 24  ? 0.128 0.234 0.233 -0.002 -0.008 0.006  353 TRP EEE CG  
174  C CD1 . TRP A 24  ? 0.144 0.220 0.242 -0.006 -0.018 0.010  353 TRP EEE CD1 
175  C CD2 . TRP A 24  ? 0.133 0.236 0.244 -0.006 -0.001 0.006  353 TRP EEE CD2 
176  N NE1 . TRP A 24  ? 0.113 0.223 0.262 0.000  0.000  0.006  353 TRP EEE NE1 
177  C CE2 . TRP A 24  ? 0.135 0.225 0.239 0.002  -0.008 0.008  353 TRP EEE CE2 
178  C CE3 . TRP A 24  ? 0.164 0.245 0.272 -0.016 0.011  0.017  353 TRP EEE CE3 
179  C CZ2 . TRP A 24  ? 0.169 0.244 0.275 0.001  -0.016 0.021  353 TRP EEE CZ2 
180  C CZ3 . TRP A 24  ? 0.161 0.239 0.279 -0.023 -0.016 0.013  353 TRP EEE CZ3 
181  C CH2 . TRP A 24  ? 0.177 0.250 0.296 -0.000 -0.036 0.028  353 TRP EEE CH2 
182  N N   . ASN A 25  ? 0.158 0.250 0.227 -0.007 -0.024 -0.003 354 ASN EEE N   
183  C CA  . ASN A 25  ? 0.140 0.249 0.252 -0.005 -0.028 0.010  354 ASN EEE CA  
184  C C   . ASN A 25  ? 0.139 0.249 0.242 -0.019 -0.026 0.017  354 ASN EEE C   
185  O O   . ASN A 25  ? 0.208 0.236 0.263 0.004  -0.019 -0.002 354 ASN EEE O   
186  C CB  . ASN A 25  ? 0.120 0.275 0.276 -0.010 -0.006 0.012  354 ASN EEE CB  
187  C CG  . ASN A 25  ? 0.245 0.321 0.301 -0.051 0.043  0.001  354 ASN EEE CG  
188  O OD1 . ASN A 25  ? 0.346 0.461 0.331 -0.032 0.077  -0.033 354 ASN EEE OD1 
189  N ND2 . ASN A 25  ? 0.224 0.311 0.382 -0.030 0.034  -0.024 354 ASN EEE ND2 
190  N N   . ARG A 26  ? 0.170 0.278 0.275 -0.020 -0.004 0.043  355 ARG EEE N   
191  C CA  . ARG A 26  ? 0.176 0.264 0.274 -0.030 -0.022 0.030  355 ARG EEE CA  
192  C C   . ARG A 26  ? 0.173 0.256 0.286 -0.012 -0.001 0.018  355 ARG EEE C   
193  O O   . ARG A 26  ? 0.236 0.289 0.311 -0.023 0.025  0.005  355 ARG EEE O   
194  C CB  . ARG A 26  ? 0.182 0.252 0.267 -0.008 -0.026 0.011  355 ARG EEE CB  
195  C CG  . ARG A 26  ? 0.210 0.266 0.295 -0.007 -0.030 0.044  355 ARG EEE CG  
196  C CD  . ARG A 26  ? 0.226 0.296 0.316 0.008  -0.051 0.026  355 ARG EEE CD  
197  N NE  . ARG A 26  ? 0.206 0.282 0.317 0.010  -0.057 0.038  355 ARG EEE NE  
198  C CZ  . ARG A 26  ? 0.225 0.289 0.338 0.033  -0.061 0.039  355 ARG EEE CZ  
199  N NH1 . ARG A 26  ? 0.265 0.359 0.326 0.033  -0.073 0.048  355 ARG EEE NH1 
200  N NH2 . ARG A 26  ? 0.223 0.309 0.355 0.049  -0.060 0.068  355 ARG EEE NH2 
201  N N   . LYS A 27  ? 0.197 0.259 0.301 -0.015 -0.011 0.022  356 LYS EEE N   
202  C CA  . LYS A 27  ? 0.223 0.273 0.336 -0.033 -0.022 0.037  356 LYS EEE CA  
203  C C   . LYS A 27  ? 0.249 0.263 0.363 -0.039 -0.008 0.021  356 LYS EEE C   
204  O O   . LYS A 27  ? 0.242 0.283 0.377 -0.016 0.009  0.033  356 LYS EEE O   
205  C CB  . LYS A 27  ? 0.231 0.306 0.365 -0.029 -0.043 0.028  356 LYS EEE CB  
206  C CG  . LYS A 27  ? 0.323 0.319 0.439 -0.083 -0.030 0.025  356 LYS EEE CG  
207  C CD  . LYS A 27  ? 0.350 0.418 0.510 -0.062 -0.045 0.001  356 LYS EEE CD  
208  C CE  . LYS A 27  ? 0.398 0.467 0.539 -0.113 -0.010 -0.033 356 LYS EEE CE  
209  N NZ  . LYS A 27  ? 0.427 0.549 0.572 -0.117 -0.002 -0.042 356 LYS EEE NZ  
210  N N   . ARG A 28  ? 0.252 0.281 0.370 0.010  -0.021 0.033  357 ARG EEE N   
211  C CA  . ARG A 28  ? 0.275 0.261 0.397 -0.006 -0.000 0.039  357 ARG EEE CA  
212  C C   . ARG A 28  ? 0.253 0.268 0.415 0.001  0.022  0.013  357 ARG EEE C   
213  O O   . ARG A 28  ? 0.272 0.313 0.489 -0.023 0.066  0.035  357 ARG EEE O   
214  C CB  . ARG A 28  ? 0.257 0.307 0.383 -0.029 -0.030 0.026  357 ARG EEE CB  
215  C CG  . ARG A 28  ? 0.337 0.319 0.410 -0.003 -0.026 0.028  357 ARG EEE CG  
216  C CD  . ARG A 28  ? 0.447 0.353 0.409 0.002  -0.058 0.034  357 ARG EEE CD  
217  N NE  . ARG A 28  ? 0.432 0.439 0.461 0.017  -0.051 0.094  357 ARG EEE NE  
218  C CZ  . ARG A 28  ? 0.552 0.466 0.466 -0.029 -0.062 0.112  357 ARG EEE CZ  
219  N NH1 . ARG A 28  ? 0.618 0.487 0.565 -0.055 -0.045 0.095  357 ARG EEE NH1 
220  N NH2 . ARG A 28  ? 0.591 0.546 0.554 -0.014 -0.013 0.121  357 ARG EEE NH2 
221  N N   . ILE A 29  ? 0.254 0.254 0.425 -0.001 -0.011 0.004  358 ILE EEE N   
222  C CA  . ILE A 29  ? 0.239 0.286 0.444 -0.037 0.029  0.005  358 ILE EEE CA  
223  C C   . ILE A 29  ? 0.246 0.299 0.441 -0.048 0.012  0.019  358 ILE EEE C   
224  O O   . ILE A 29  ? 0.254 0.279 0.435 -0.044 0.015  -0.004 358 ILE EEE O   
225  C CB  . ILE A 29  ? 0.316 0.303 0.471 -0.034 -0.018 -0.010 358 ILE EEE CB  
226  C CG1 . ILE A 29  ? 0.376 0.320 0.520 -0.052 -0.025 -0.002 358 ILE EEE CG1 
227  C CG2 . ILE A 29  ? 0.354 0.306 0.480 -0.052 -0.035 0.016  358 ILE EEE CG2 
228  C CD1 . ILE A 29  ? 0.425 0.359 0.517 0.012  -0.020 -0.034 358 ILE EEE CD1 
229  N N   . SER A 30  ? 0.256 0.304 0.474 -0.071 0.003  0.041  359 SER EEE N   
230  C CA  . SER A 30  ? 0.298 0.288 0.491 -0.094 0.010  0.047  359 SER EEE CA  
231  C C   . SER A 30  ? 0.245 0.293 0.473 -0.071 -0.010 0.033  359 SER EEE C   
232  O O   . SER A 30  ? 0.257 0.297 0.497 -0.043 0.033  0.013  359 SER EEE O   
233  C CB  . SER A 30  ? 0.382 0.437 0.497 -0.070 -0.010 0.025  359 SER EEE CB  
234  O OG  . SER A 30  ? 0.532 0.537 0.563 -0.014 0.034  -0.024 359 SER EEE OG  
235  N N   . ASN A 31  ? 0.346 0.314 0.445 -0.057 0.016  0.038  360 ASN EEE N   
236  C CA  . ASN A 31  ? 0.375 0.308 0.487 -0.093 0.016  0.013  360 ASN EEE CA  
237  C C   . ASN A 31  ? 0.366 0.299 0.448 -0.076 0.035  0.034  360 ASN EEE C   
238  O O   . ASN A 31  ? 0.332 0.386 0.552 -0.073 0.014  0.024  360 ASN EEE O   
239  C CB  . ASN A 31  ? 0.439 0.351 0.490 -0.121 0.034  0.018  360 ASN EEE CB  
240  C CG  . ASN A 31  ? 0.495 0.384 0.535 -0.140 0.015  0.060  360 ASN EEE CG  
241  O OD1 . ASN A 31  ? 0.700 0.509 0.670 0.008  -0.009 0.016  360 ASN EEE OD1 
242  N ND2 . ASN A 31  ? 0.637 0.448 0.583 -0.135 -0.006 -0.000 360 ASN EEE ND2 
243  N N   . CYS A 32  ? 0.306 0.305 0.447 -0.088 0.031  0.032  361 CYS EEE N   
244  C CA  . CYS A 32  ? 0.327 0.334 0.476 -0.083 0.003  0.002  361 CYS EEE CA  
245  C C   . CYS A 32  ? 0.300 0.338 0.465 -0.048 -0.011 0.007  361 CYS EEE C   
246  O O   . CYS A 32  ? 0.311 0.339 0.448 -0.033 -0.015 0.006  361 CYS EEE O   
247  C CB  . CYS A 32  ? 0.300 0.344 0.492 -0.099 -0.007 0.012  361 CYS EEE CB  
248  S SG  . CYS A 32  ? 0.271 0.315 0.510 -0.060 0.005  0.018  361 CYS EEE SG  
249  N N   . VAL A 33  ? 0.315 0.351 0.517 -0.058 -0.040 -0.030 362 VAL EEE N   
250  C CA  A VAL A 33  ? 0.333 0.361 0.514 -0.042 -0.033 -0.014 362 VAL EEE CA  
251  C CA  B VAL A 33  ? 0.324 0.338 0.522 -0.044 -0.031 -0.018 362 VAL EEE CA  
252  C C   . VAL A 33  ? 0.340 0.328 0.520 -0.040 -0.015 -0.027 362 VAL EEE C   
253  O O   . VAL A 33  ? 0.348 0.346 0.510 -0.012 -0.010 -0.004 362 VAL EEE O   
254  C CB  A VAL A 33  ? 0.385 0.402 0.553 -0.075 -0.049 -0.029 362 VAL EEE CB  
255  C CB  B VAL A 33  ? 0.371 0.330 0.568 -0.057 -0.043 -0.011 362 VAL EEE CB  
256  C CG1 A VAL A 33  ? 0.395 0.437 0.573 -0.057 -0.039 -0.025 362 VAL EEE CG1 
257  C CG1 B VAL A 33  ? 0.356 0.276 0.575 -0.081 -0.046 -0.029 362 VAL EEE CG1 
258  C CG2 A VAL A 33  ? 0.392 0.406 0.549 -0.085 -0.066 -0.039 362 VAL EEE CG2 
259  C CG2 B VAL A 33  ? 0.376 0.368 0.586 -0.043 -0.034 -0.017 362 VAL EEE CG2 
260  N N   . ALA A 34  ? 0.334 0.375 0.499 -0.045 -0.021 -0.032 363 ALA EEE N   
261  C CA  . ALA A 34  ? 0.446 0.381 0.521 -0.046 -0.025 -0.035 363 ALA EEE CA  
262  C C   . ALA A 34  ? 0.366 0.436 0.499 -0.007 -0.030 -0.029 363 ALA EEE C   
263  O O   . ALA A 34  ? 0.468 0.462 0.507 0.069  -0.031 -0.023 363 ALA EEE O   
264  C CB  . ALA A 34  ? 0.492 0.415 0.557 -0.085 -0.022 -0.041 363 ALA EEE CB  
265  N N   . ASP A 35  ? 0.449 0.411 0.543 0.033  -0.017 0.030  364 ASP EEE N   
266  C CA  . ASP A 35  ? 0.355 0.444 0.550 0.038  -0.050 0.020  364 ASP EEE CA  
267  C C   . ASP A 35  ? 0.300 0.455 0.565 0.040  -0.045 0.020  364 ASP EEE C   
268  O O   . ASP A 35  ? 0.317 0.475 0.505 0.036  -0.058 0.061  364 ASP EEE O   
269  C CB  . ASP A 35  ? 0.359 0.447 0.593 0.033  -0.071 0.039  364 ASP EEE CB  
270  C CG  . ASP A 35  ? 0.377 0.517 0.612 0.035  -0.110 0.023  364 ASP EEE CG  
271  O OD1 . ASP A 35  ? 0.310 0.505 0.626 0.088  -0.142 0.034  364 ASP EEE OD1 
272  O OD2 . ASP A 35  ? 0.401 0.594 0.748 0.024  -0.157 -0.004 364 ASP EEE OD2 
273  N N   . TYR A 36  ? 0.295 0.408 0.493 0.062  -0.042 0.012  365 TYR EEE N   
274  C CA  . TYR A 36  ? 0.333 0.415 0.491 0.010  -0.081 -0.004 365 TYR EEE CA  
275  C C   . TYR A 36  ? 0.320 0.401 0.515 0.027  -0.101 -0.014 365 TYR EEE C   
276  O O   . TYR A 36  ? 0.346 0.391 0.546 -0.019 -0.141 -0.010 365 TYR EEE O   
277  C CB  . TYR A 36  ? 0.321 0.421 0.479 0.010  -0.059 0.012  365 TYR EEE CB  
278  C CG  . TYR A 36  ? 0.313 0.391 0.474 -0.025 -0.080 -0.004 365 TYR EEE CG  
279  C CD1 . TYR A 36  ? 0.376 0.375 0.504 -0.022 -0.058 -0.012 365 TYR EEE CD1 
280  C CD2 . TYR A 36  ? 0.352 0.369 0.496 -0.041 -0.066 -0.005 365 TYR EEE CD2 
281  C CE1 . TYR A 36  ? 0.381 0.387 0.495 -0.106 -0.072 -0.025 365 TYR EEE CE1 
282  C CE2 . TYR A 36  ? 0.360 0.401 0.508 -0.089 -0.084 0.004  365 TYR EEE CE2 
283  C CZ  . TYR A 36  ? 0.398 0.425 0.470 -0.075 -0.112 -0.005 365 TYR EEE CZ  
284  O OH  . TYR A 36  ? 0.462 0.636 0.446 -0.167 -0.067 -0.018 365 TYR EEE OH  
285  N N   . SER A 37  ? 0.441 0.379 0.549 -0.012 -0.093 -0.003 366 SER EEE N   
286  C CA  . SER A 37  ? 0.490 0.407 0.533 -0.019 -0.081 -0.030 366 SER EEE CA  
287  C C   . SER A 37  ? 0.454 0.380 0.499 -0.044 -0.090 -0.028 366 SER EEE C   
288  O O   . SER A 37  ? 0.491 0.411 0.464 -0.100 -0.136 -0.020 366 SER EEE O   
289  C CB  . SER A 37  ? 0.600 0.381 0.572 -0.011 -0.041 -0.044 366 SER EEE CB  
290  O OG  . SER A 37  ? 0.644 0.588 0.629 0.005  -0.061 -0.048 366 SER EEE OG  
291  N N   . VAL A 38  ? 0.435 0.411 0.498 -0.031 -0.111 -0.035 367 VAL EEE N   
292  C CA  . VAL A 38  ? 0.422 0.470 0.519 -0.000 -0.148 -0.031 367 VAL EEE CA  
293  C C   . VAL A 38  ? 0.357 0.480 0.498 0.011  -0.165 -0.026 367 VAL EEE C   
294  O O   . VAL A 38  ? 0.376 0.477 0.605 0.063  -0.160 0.002  367 VAL EEE O   
295  C CB  . VAL A 38  ? 0.464 0.549 0.575 0.019  -0.110 0.008  367 VAL EEE CB  
296  C CG1 . VAL A 38  ? 0.575 0.603 0.595 -0.005 -0.084 -0.014 367 VAL EEE CG1 
297  C CG2 . VAL A 38  ? 0.480 0.558 0.579 0.057  -0.069 0.019  367 VAL EEE CG2 
298  N N   . LEU A 39  ? 0.328 0.428 0.472 0.055  -0.160 -0.045 368 LEU EEE N   
299  C CA  . LEU A 39  ? 0.377 0.387 0.476 0.064  -0.144 -0.076 368 LEU EEE CA  
300  C C   . LEU A 39  ? 0.394 0.336 0.437 0.050  -0.163 -0.076 368 LEU EEE C   
301  O O   . LEU A 39  ? 0.420 0.353 0.457 0.016  -0.197 -0.061 368 LEU EEE O   
302  C CB  . LEU A 39  ? 0.392 0.425 0.489 0.087  -0.161 -0.068 368 LEU EEE CB  
303  C CG  . LEU A 39  ? 0.466 0.451 0.533 0.072  -0.130 -0.056 368 LEU EEE CG  
304  C CD1 . LEU A 39  ? 0.540 0.415 0.547 0.101  -0.146 -0.062 368 LEU EEE CD1 
305  C CD2 . LEU A 39  ? 0.447 0.491 0.537 0.086  -0.112 -0.036 368 LEU EEE CD2 
306  N N   . TYR A 40  ? 0.324 0.343 0.450 0.023  -0.111 -0.042 369 TYR EEE N   
307  C CA  . TYR A 40  ? 0.391 0.369 0.412 -0.004 -0.096 -0.053 369 TYR EEE CA  
308  C C   . TYR A 40  ? 0.431 0.397 0.416 0.007  -0.084 -0.016 369 TYR EEE C   
309  O O   . TYR A 40  ? 0.414 0.402 0.432 0.005  -0.067 -0.022 369 TYR EEE O   
310  C CB  . TYR A 40  ? 0.423 0.369 0.417 0.006  -0.079 -0.021 369 TYR EEE CB  
311  C CG  . TYR A 40  ? 0.430 0.408 0.447 0.005  -0.057 0.004  369 TYR EEE CG  
312  C CD1 . TYR A 40  ? 0.461 0.420 0.486 0.003  -0.041 0.020  369 TYR EEE CD1 
313  C CD2 . TYR A 40  ? 0.484 0.408 0.433 0.028  -0.015 0.027  369 TYR EEE CD2 
314  C CE1 . TYR A 40  ? 0.424 0.493 0.509 0.025  -0.036 0.014  369 TYR EEE CE1 
315  C CE2 . TYR A 40  ? 0.485 0.481 0.462 0.019  -0.017 0.038  369 TYR EEE CE2 
316  C CZ  . TYR A 40  ? 0.435 0.496 0.438 0.020  -0.041 0.039  369 TYR EEE CZ  
317  O OH  . TYR A 40  ? 0.548 0.616 0.505 -0.006 0.049  0.099  369 TYR EEE OH  
318  N N   . ASN A 41  ? 0.457 0.424 0.435 -0.024 -0.091 -0.031 370 ASN EEE N   
319  C CA  . ASN A 41  ? 0.499 0.447 0.448 -0.033 -0.099 -0.064 370 ASN EEE CA  
320  C C   . ASN A 41  ? 0.475 0.446 0.472 -0.033 -0.148 -0.061 370 ASN EEE C   
321  O O   . ASN A 41  ? 0.482 0.621 0.505 -0.049 -0.171 -0.037 370 ASN EEE O   
322  C CB  . ASN A 41  ? 0.494 0.500 0.427 -0.077 -0.098 -0.087 370 ASN EEE CB  
323  C CG  . ASN A 41  ? 0.596 0.474 0.457 -0.057 -0.043 -0.061 370 ASN EEE CG  
324  O OD1 . ASN A 41  ? 0.617 0.491 0.462 -0.057 -0.021 -0.044 370 ASN EEE OD1 
325  N ND2 . ASN A 41  ? 0.636 0.522 0.552 -0.108 -0.009 -0.038 370 ASN EEE ND2 
326  N N   . SER A 42  ? 0.523 0.447 0.492 0.005  -0.139 -0.054 371 SER EEE N   
327  C CA  . SER A 42  ? 0.437 0.489 0.528 0.013  -0.151 0.007  371 SER EEE CA  
328  C C   . SER A 42  ? 0.446 0.505 0.457 0.025  -0.180 0.035  371 SER EEE C   
329  O O   . SER A 42  ? 0.435 0.555 0.529 0.023  -0.110 0.047  371 SER EEE O   
330  C CB  . SER A 42  ? 0.420 0.463 0.519 0.039  -0.150 0.016  371 SER EEE CB  
331  O OG  . SER A 42  ? 0.389 0.438 0.557 0.001  -0.144 0.011  371 SER EEE OG  
332  N N   . ALA A 43  ? 0.451 0.444 0.432 -0.012 -0.227 -0.052 372 ALA EEE N   
333  C CA  . ALA A 43  ? 0.456 0.463 0.420 -0.006 -0.186 -0.028 372 ALA EEE CA  
334  C C   . ALA A 43  ? 0.472 0.458 0.457 -0.038 -0.192 -0.026 372 ALA EEE C   
335  O O   . ALA A 43  ? 0.602 0.447 0.475 -0.032 -0.141 -0.037 372 ALA EEE O   
336  C CB  . ALA A 43  ? 0.499 0.475 0.455 0.003  -0.214 -0.003 372 ALA EEE CB  
337  N N   . SER A 44  ? 0.404 0.487 0.478 -0.054 -0.150 -0.071 373 SER EEE N   
338  C CA  . SER A 44  ? 0.396 0.492 0.515 -0.015 -0.178 -0.072 373 SER EEE CA  
339  C C   . SER A 44  ? 0.348 0.440 0.504 0.036  -0.169 -0.082 373 SER EEE C   
340  O O   . SER A 44  ? 0.388 0.466 0.539 0.076  -0.271 -0.105 373 SER EEE O   
341  C CB  . SER A 44  ? 0.408 0.533 0.548 -0.039 -0.128 -0.089 373 SER EEE CB  
342  O OG  . SER A 44  ? 0.418 0.602 0.665 0.006  -0.145 -0.057 373 SER EEE OG  
343  N N   . PHE A 45  ? 0.344 0.356 0.342 0.013  -0.181 -0.066 374 PHE EEE N   
344  C CA  . PHE A 45  ? 0.311 0.339 0.355 0.010  -0.121 -0.047 374 PHE EEE CA  
345  C C   . PHE A 45  ? 0.401 0.359 0.349 0.007  -0.088 -0.045 374 PHE EEE C   
346  O O   . PHE A 45  ? 0.568 0.420 0.400 0.011  -0.093 -0.089 374 PHE EEE O   
347  C CB  . PHE A 45  ? 0.229 0.328 0.333 0.015  -0.128 -0.058 374 PHE EEE CB  
348  C CG  . PHE A 45  ? 0.239 0.310 0.335 0.029  -0.126 -0.027 374 PHE EEE CG  
349  C CD1 . PHE A 45  ? 0.253 0.299 0.355 0.032  -0.092 -0.020 374 PHE EEE CD1 
350  C CD2 . PHE A 45  ? 0.232 0.306 0.331 0.027  -0.089 -0.042 374 PHE EEE CD2 
351  C CE1 . PHE A 45  ? 0.255 0.321 0.372 0.022  -0.091 -0.020 374 PHE EEE CE1 
352  C CE2 . PHE A 45  ? 0.238 0.317 0.352 -0.009 -0.102 -0.030 374 PHE EEE CE2 
353  C CZ  . PHE A 45  ? 0.266 0.328 0.369 0.019  -0.086 -0.018 374 PHE EEE CZ  
354  N N   . SER A 46  ? 0.343 0.354 0.339 0.034  -0.103 -0.035 375 SER EEE N   
355  C CA  . SER A 46  ? 0.359 0.385 0.354 0.057  -0.083 -0.018 375 SER EEE CA  
356  C C   . SER A 46  ? 0.338 0.374 0.301 0.058  -0.044 -0.036 375 SER EEE C   
357  O O   . SER A 46  ? 0.365 0.435 0.327 0.057  -0.020 -0.023 375 SER EEE O   
358  C CB  . SER A 46  ? 0.389 0.388 0.468 0.048  -0.057 0.020  375 SER EEE CB  
359  O OG  . SER A 46  ? 0.416 0.336 0.542 0.048  -0.039 -0.039 375 SER EEE OG  
360  N N   . THR A 47  ? 0.324 0.352 0.286 0.074  -0.042 -0.063 376 THR EEE N   
361  C CA  . THR A 47  ? 0.308 0.352 0.312 0.069  -0.041 -0.055 376 THR EEE CA  
362  C C   . THR A 47  ? 0.255 0.310 0.314 0.049  -0.064 -0.077 376 THR EEE C   
363  O O   . THR A 47  ? 0.267 0.322 0.282 0.065  -0.072 -0.057 376 THR EEE O   
364  C CB  . THR A 47  ? 0.316 0.328 0.371 0.041  -0.034 -0.055 376 THR EEE CB  
365  O OG1 . THR A 47  ? 0.377 0.361 0.373 0.050  -0.021 -0.015 376 THR EEE OG1 
366  C CG2 . THR A 47  ? 0.326 0.375 0.370 0.058  -0.039 -0.064 376 THR EEE CG2 
367  N N   . PHE A 48  ? 0.270 0.315 0.343 0.050  -0.030 -0.078 377 PHE EEE N   
368  C CA  . PHE A 48  ? 0.258 0.323 0.330 0.056  -0.054 -0.080 377 PHE EEE CA  
369  C C   . PHE A 48  ? 0.269 0.336 0.337 0.072  -0.061 -0.091 377 PHE EEE C   
370  O O   . PHE A 48  ? 0.324 0.388 0.379 0.097  -0.048 -0.129 377 PHE EEE O   
371  C CB  . PHE A 48  ? 0.264 0.333 0.361 0.046  -0.076 -0.066 377 PHE EEE CB  
372  C CG  . PHE A 48  ? 0.298 0.340 0.395 0.025  -0.077 -0.057 377 PHE EEE CG  
373  C CD1 . PHE A 48  ? 0.356 0.356 0.443 0.032  -0.086 -0.010 377 PHE EEE CD1 
374  C CD2 . PHE A 48  ? 0.277 0.349 0.394 0.004  -0.102 -0.044 377 PHE EEE CD2 
375  C CE1 . PHE A 48  ? 0.334 0.401 0.470 0.024  -0.094 0.012  377 PHE EEE CE1 
376  C CE2 . PHE A 48  ? 0.211 0.364 0.429 -0.036 -0.140 -0.033 377 PHE EEE CE2 
377  C CZ  . PHE A 48  ? 0.353 0.351 0.457 0.020  -0.077 0.019  377 PHE EEE CZ  
378  N N   . LYS A 49  ? 0.241 0.335 0.325 0.084  -0.042 -0.113 378 LYS EEE N   
379  C CA  . LYS A 49  ? 0.250 0.341 0.330 0.092  -0.014 -0.099 378 LYS EEE CA  
380  C C   . LYS A 49  ? 0.252 0.343 0.352 0.072  -0.045 -0.098 378 LYS EEE C   
381  O O   . LYS A 49  ? 0.288 0.359 0.338 0.092  -0.032 -0.091 378 LYS EEE O   
382  C CB  . LYS A 49  ? 0.322 0.350 0.360 0.065  -0.029 -0.082 378 LYS EEE CB  
383  C CG  . LYS A 49  ? 0.407 0.448 0.392 0.062  -0.053 -0.044 378 LYS EEE CG  
384  C CD  . LYS A 49  ? 0.484 0.477 0.450 0.036  -0.023 -0.048 378 LYS EEE CD  
385  C CE  . LYS A 49  ? 0.555 0.554 0.482 0.019  -0.038 -0.004 378 LYS EEE CE  
386  N NZ  . LYS A 49  ? 0.634 0.605 0.548 -0.029 -0.032 -0.004 378 LYS EEE NZ  
387  N N   . CYS A 50  ? 0.329 0.330 0.361 0.054  -0.048 -0.117 379 CYS EEE N   
388  C CA  . CYS A 50  ? 0.277 0.362 0.375 0.070  -0.047 -0.087 379 CYS EEE CA  
389  C C   . CYS A 50  ? 0.275 0.355 0.359 0.072  -0.028 -0.076 379 CYS EEE C   
390  O O   . CYS A 50  ? 0.291 0.409 0.371 0.078  -0.023 -0.055 379 CYS EEE O   
391  C CB  . CYS A 50  ? 0.273 0.398 0.427 0.047  -0.063 -0.091 379 CYS EEE CB  
392  S SG  . CYS A 50  ? 0.270 0.430 0.484 0.038  -0.094 -0.067 379 CYS EEE SG  
393  N N   . TYR A 51  ? 0.245 0.384 0.359 0.083  -0.035 -0.090 380 TYR EEE N   
394  C CA  . TYR A 51  ? 0.224 0.370 0.402 0.066  -0.015 -0.092 380 TYR EEE CA  
395  C C   . TYR A 51  ? 0.201 0.386 0.394 0.078  -0.044 -0.088 380 TYR EEE C   
396  O O   . TYR A 51  ? 0.254 0.400 0.397 0.087  -0.035 -0.058 380 TYR EEE O   
397  C CB  . TYR A 51  ? 0.243 0.390 0.371 0.050  -0.021 -0.091 380 TYR EEE CB  
398  C CG  . TYR A 51  ? 0.246 0.371 0.356 0.047  -0.003 -0.092 380 TYR EEE CG  
399  C CD1 . TYR A 51  ? 0.213 0.383 0.390 0.034  0.016  -0.076 380 TYR EEE CD1 
400  C CD2 . TYR A 51  ? 0.185 0.383 0.402 0.032  -0.006 -0.089 380 TYR EEE CD2 
401  C CE1 . TYR A 51  ? 0.240 0.364 0.358 0.008  0.015  -0.104 380 TYR EEE CE1 
402  C CE2 . TYR A 51  ? 0.246 0.354 0.420 0.025  0.019  -0.105 380 TYR EEE CE2 
403  C CZ  . TYR A 51  ? 0.247 0.349 0.373 0.024  0.023  -0.090 380 TYR EEE CZ  
404  O OH  . TYR A 51  ? 0.294 0.350 0.406 0.015  0.023  -0.087 380 TYR EEE OH  
405  N N   . GLY A 52  ? 0.253 0.404 0.415 0.116  -0.025 -0.085 381 GLY EEE N   
406  C CA  . GLY A 52  ? 0.293 0.379 0.469 0.111  -0.030 -0.061 381 GLY EEE CA  
407  C C   . GLY A 52  ? 0.276 0.380 0.496 0.118  -0.009 -0.056 381 GLY EEE C   
408  O O   . GLY A 52  ? 0.334 0.407 0.554 0.063  -0.053 0.019  381 GLY EEE O   
409  N N   . VAL A 53  ? 0.360 0.366 0.459 0.084  -0.090 -0.060 382 VAL EEE N   
410  C CA  . VAL A 53  ? 0.383 0.439 0.450 0.051  -0.082 -0.055 382 VAL EEE CA  
411  C C   . VAL A 53  ? 0.352 0.384 0.453 0.039  -0.084 -0.059 382 VAL EEE C   
412  O O   . VAL A 53  ? 0.332 0.381 0.457 0.011  -0.089 -0.053 382 VAL EEE O   
413  C CB  . VAL A 53  ? 0.415 0.557 0.445 0.046  -0.089 -0.047 382 VAL EEE CB  
414  C CG1 . VAL A 53  ? 0.460 0.595 0.477 0.027  -0.077 -0.028 382 VAL EEE CG1 
415  C CG2 . VAL A 53  ? 0.369 0.580 0.454 0.053  -0.096 -0.077 382 VAL EEE CG2 
416  N N   . SER A 54  ? 0.410 0.405 0.411 0.023  -0.085 -0.070 383 SER EEE N   
417  C CA  . SER A 54  ? 0.361 0.449 0.394 0.003  -0.070 -0.058 383 SER EEE CA  
418  C C   . SER A 54  ? 0.378 0.400 0.413 0.018  -0.052 -0.055 383 SER EEE C   
419  O O   . SER A 54  ? 0.339 0.421 0.388 0.040  -0.072 -0.016 383 SER EEE O   
420  C CB  . SER A 54  ? 0.477 0.468 0.484 -0.029 -0.063 -0.098 383 SER EEE CB  
421  O OG  . SER A 54  ? 0.608 0.599 0.522 -0.034 -0.117 -0.083 383 SER EEE OG  
422  N N   . PRO A 55  ? 0.415 0.428 0.412 -0.024 -0.082 -0.004 384 PRO EEE N   
423  C CA  . PRO A 55  ? 0.399 0.380 0.407 0.012  -0.083 -0.022 384 PRO EEE CA  
424  C C   . PRO A 55  ? 0.421 0.375 0.387 -0.004 -0.066 -0.030 384 PRO EEE C   
425  O O   . PRO A 55  ? 0.421 0.406 0.403 -0.007 -0.080 -0.010 384 PRO EEE O   
426  C CB  . PRO A 55  ? 0.441 0.405 0.409 0.017  -0.073 0.008  384 PRO EEE CB  
427  C CG  . PRO A 55  ? 0.454 0.424 0.433 -0.009 -0.056 0.025  384 PRO EEE CG  
428  C CD  . PRO A 55  ? 0.435 0.466 0.434 -0.034 -0.075 0.015  384 PRO EEE CD  
429  N N   . THR A 56  ? 0.404 0.388 0.353 -0.021 -0.077 -0.016 385 THR EEE N   
430  C CA  . THR A 56  ? 0.425 0.390 0.322 -0.031 -0.080 -0.016 385 THR EEE CA  
431  C C   . THR A 56  ? 0.396 0.384 0.347 -0.036 -0.093 -0.017 385 THR EEE C   
432  O O   . THR A 56  ? 0.463 0.422 0.422 -0.092 -0.118 0.013  385 THR EEE O   
433  C CB  . THR A 56  ? 0.513 0.441 0.343 -0.004 -0.060 -0.021 385 THR EEE CB  
434  O OG1 . THR A 56  ? 0.499 0.511 0.389 -0.015 -0.020 -0.060 385 THR EEE OG1 
435  C CG2 . THR A 56  ? 0.590 0.464 0.351 -0.023 -0.074 0.001  385 THR EEE CG2 
436  N N   . LYS A 57  ? 0.402 0.325 0.369 -0.004 -0.114 -0.019 386 LYS EEE N   
437  C CA  . LYS A 57  ? 0.450 0.338 0.391 -0.018 -0.085 -0.009 386 LYS EEE CA  
438  C C   . LYS A 57  ? 0.360 0.302 0.395 -0.011 -0.082 0.010  386 LYS EEE C   
439  O O   . LYS A 57  ? 0.291 0.305 0.398 0.023  -0.055 0.017  386 LYS EEE O   
440  C CB  . LYS A 57  ? 0.470 0.392 0.459 0.004  -0.091 -0.001 386 LYS EEE CB  
441  C CG  . LYS A 57  ? 0.613 0.488 0.456 0.010  -0.079 -0.050 386 LYS EEE CG  
442  C CD  . LYS A 57  ? 0.714 0.536 0.596 -0.028 -0.107 -0.083 386 LYS EEE CD  
443  C CE  . LYS A 57  ? 0.804 0.646 0.645 -0.013 -0.072 -0.139 386 LYS EEE CE  
444  N NZ  . LYS A 57  ? 0.885 0.739 0.693 -0.023 -0.137 -0.137 386 LYS EEE NZ  
445  N N   . LEU A 58  ? 0.372 0.333 0.392 0.016  -0.076 -0.016 387 LEU EEE N   
446  C CA  . LEU A 58  ? 0.322 0.322 0.401 0.024  -0.073 -0.021 387 LEU EEE CA  
447  C C   . LEU A 58  ? 0.331 0.324 0.338 0.020  -0.066 -0.041 387 LEU EEE C   
448  O O   . LEU A 58  ? 0.320 0.360 0.354 0.011  -0.059 -0.024 387 LEU EEE O   
449  C CB  . LEU A 58  ? 0.406 0.307 0.394 0.033  -0.041 -0.031 387 LEU EEE CB  
450  C CG  . LEU A 58  ? 0.441 0.336 0.506 -0.009 0.001  -0.017 387 LEU EEE CG  
451  C CD1 . LEU A 58  ? 0.472 0.432 0.535 -0.016 0.022  0.009  387 LEU EEE CD1 
452  C CD2 . LEU A 58  ? 0.333 0.328 0.477 -0.002 -0.003 -0.024 387 LEU EEE CD2 
453  N N   . ASN A 59  ? 0.293 0.334 0.362 0.027  -0.087 0.008  388 ASN EEE N   
454  C CA  . ASN A 59  ? 0.344 0.346 0.418 0.004  -0.087 0.004  388 ASN EEE CA  
455  C C   . ASN A 59  ? 0.343 0.327 0.363 -0.006 -0.062 0.004  388 ASN EEE C   
456  O O   . ASN A 59  ? 0.337 0.329 0.444 -0.017 -0.056 0.037  388 ASN EEE O   
457  C CB  . ASN A 59  ? 0.349 0.347 0.439 0.000  -0.100 0.003  388 ASN EEE CB  
458  C CG  . ASN A 59  ? 0.365 0.367 0.489 0.014  -0.096 -0.008 388 ASN EEE CG  
459  O OD1 . ASN A 59  ? 0.405 0.360 0.532 0.067  -0.079 -0.036 388 ASN EEE OD1 
460  N ND2 . ASN A 59  ? 0.346 0.401 0.488 -0.016 -0.088 0.014  388 ASN EEE ND2 
461  N N   . ASP A 60  ? 0.341 0.307 0.402 0.012  -0.086 -0.018 389 ASP EEE N   
462  C CA  . ASP A 60  ? 0.387 0.298 0.420 0.009  -0.097 -0.005 389 ASP EEE CA  
463  C C   . ASP A 60  ? 0.412 0.267 0.404 0.017  -0.095 -0.004 389 ASP EEE C   
464  O O   . ASP A 60  ? 0.397 0.263 0.436 0.009  -0.105 -0.016 389 ASP EEE O   
465  C CB  . ASP A 60  ? 0.404 0.370 0.402 0.012  -0.108 -0.008 389 ASP EEE CB  
466  C CG  . ASP A 60  ? 0.438 0.511 0.445 -0.011 -0.152 0.012  389 ASP EEE CG  
467  O OD1 . ASP A 60  ? 0.469 0.553 0.544 -0.028 -0.107 -0.034 389 ASP EEE OD1 
468  O OD2 . ASP A 60  ? 0.566 0.614 0.438 -0.011 -0.123 -0.025 389 ASP EEE OD2 
469  N N   . LEU A 61  ? 0.312 0.273 0.399 0.031  -0.115 -0.008 390 LEU EEE N   
470  C CA  . LEU A 61  ? 0.294 0.286 0.396 0.019  -0.088 -0.001 390 LEU EEE CA  
471  C C   . LEU A 61  ? 0.306 0.273 0.400 0.027  -0.073 0.004  390 LEU EEE C   
472  O O   . LEU A 61  ? 0.271 0.317 0.447 0.023  -0.091 -0.007 390 LEU EEE O   
473  C CB  . LEU A 61  ? 0.289 0.264 0.411 0.022  -0.085 0.009  390 LEU EEE CB  
474  C CG  . LEU A 61  ? 0.340 0.283 0.409 0.020  -0.074 -0.019 390 LEU EEE CG  
475  C CD1 . LEU A 61  ? 0.352 0.302 0.395 0.008  -0.066 -0.007 390 LEU EEE CD1 
476  C CD2 . LEU A 61  ? 0.343 0.286 0.446 0.017  -0.067 0.003  390 LEU EEE CD2 
477  N N   . CYS A 62  ? 0.286 0.249 0.375 0.022  -0.051 0.006  391 CYS EEE N   
478  C CA  . CYS A 62  ? 0.313 0.317 0.387 -0.006 -0.053 -0.018 391 CYS EEE CA  
479  C C   . CYS A 62  ? 0.295 0.270 0.380 0.011  -0.043 -0.010 391 CYS EEE C   
480  O O   . CYS A 62  ? 0.295 0.287 0.417 0.032  -0.041 -0.032 391 CYS EEE O   
481  C CB  . CYS A 62  ? 0.389 0.356 0.397 -0.036 -0.089 0.011  391 CYS EEE CB  
482  S SG  . CYS A 62  ? 0.429 0.350 0.523 -0.081 -0.062 -0.026 391 CYS EEE SG  
483  N N   . PHE A 63  ? 0.281 0.245 0.403 -0.003 -0.053 -0.013 392 PHE EEE N   
484  C CA  . PHE A 63  ? 0.274 0.239 0.379 -0.003 -0.049 -0.004 392 PHE EEE CA  
485  C C   . PHE A 63  ? 0.274 0.271 0.374 -0.020 -0.064 0.011  392 PHE EEE C   
486  O O   . PHE A 63  ? 0.284 0.297 0.379 -0.022 -0.048 0.019  392 PHE EEE O   
487  C CB  . PHE A 63  ? 0.243 0.251 0.364 -0.010 -0.071 0.025  392 PHE EEE CB  
488  C CG  . PHE A 63  ? 0.351 0.276 0.386 -0.046 -0.060 0.015  392 PHE EEE CG  
489  C CD1 . PHE A 63  ? 0.394 0.277 0.372 0.005  -0.035 -0.007 392 PHE EEE CD1 
490  C CD2 . PHE A 63  ? 0.404 0.350 0.382 -0.058 -0.080 0.021  392 PHE EEE CD2 
491  C CE1 . PHE A 63  ? 0.478 0.257 0.398 0.029  -0.031 0.016  392 PHE EEE CE1 
492  C CE2 . PHE A 63  ? 0.445 0.360 0.408 -0.056 -0.033 0.034  392 PHE EEE CE2 
493  C CZ  . PHE A 63  ? 0.452 0.293 0.394 -0.038 -0.023 -0.002 392 PHE EEE CZ  
494  N N   . THR A 64  ? 0.292 0.264 0.361 -0.010 -0.088 0.021  393 THR EEE N   
495  C CA  . THR A 64  ? 0.305 0.290 0.373 -0.029 -0.045 0.006  393 THR EEE CA  
496  C C   . THR A 64  ? 0.331 0.316 0.383 -0.011 -0.024 0.018  393 THR EEE C   
497  O O   . THR A 64  ? 0.410 0.404 0.416 -0.030 0.033  0.009  393 THR EEE O   
498  C CB  . THR A 64  ? 0.336 0.331 0.375 -0.031 -0.074 0.029  393 THR EEE CB  
499  O OG1 . THR A 64  ? 0.365 0.299 0.371 -0.028 -0.096 0.033  393 THR EEE OG1 
500  C CG2 . THR A 64  ? 0.361 0.348 0.412 -0.028 -0.081 0.018  393 THR EEE CG2 
501  N N   . ASN A 65  ? 0.315 0.292 0.373 -0.020 -0.023 -0.001 394 ASN EEE N   
502  C CA  . ASN A 65  ? 0.301 0.317 0.381 -0.001 -0.031 0.011  394 ASN EEE CA  
503  C C   . ASN A 65  ? 0.290 0.269 0.390 -0.021 -0.034 0.004  394 ASN EEE C   
504  O O   . ASN A 65  ? 0.272 0.266 0.391 -0.002 -0.051 0.023  394 ASN EEE O   
505  C CB  . ASN A 65  ? 0.323 0.312 0.397 0.016  -0.031 -0.008 394 ASN EEE CB  
506  C CG  . ASN A 65  ? 0.337 0.373 0.396 0.015  -0.055 0.026  394 ASN EEE CG  
507  O OD1 . ASN A 65  ? 0.339 0.455 0.460 -0.010 -0.030 0.027  394 ASN EEE OD1 
508  N ND2 . ASN A 65  ? 0.440 0.454 0.375 0.004  -0.113 0.013  394 ASN EEE ND2 
509  N N   . VAL A 66  ? 0.267 0.262 0.417 -0.032 -0.010 -0.000 395 VAL EEE N   
510  C CA  . VAL A 66  ? 0.241 0.252 0.394 -0.021 -0.027 -0.008 395 VAL EEE CA  
511  C C   . VAL A 66  ? 0.232 0.244 0.389 -0.038 -0.011 -0.013 395 VAL EEE C   
512  O O   . VAL A 66  ? 0.284 0.293 0.400 -0.051 0.029  -0.011 395 VAL EEE O   
513  C CB  . VAL A 66  ? 0.211 0.295 0.426 -0.054 -0.031 -0.000 395 VAL EEE CB  
514  C CG1 . VAL A 66  ? 0.209 0.298 0.424 -0.028 -0.057 0.011  395 VAL EEE CG1 
515  C CG2 . VAL A 66  ? 0.235 0.312 0.438 -0.033 -0.025 -0.013 395 VAL EEE CG2 
516  N N   . TYR A 67  ? 0.155 0.267 0.348 -0.022 -0.020 -0.003 396 TYR EEE N   
517  C CA  . TYR A 67  ? 0.190 0.265 0.347 -0.001 -0.017 -0.003 396 TYR EEE CA  
518  C C   . TYR A 67  ? 0.191 0.254 0.324 0.009  -0.011 -0.021 396 TYR EEE C   
519  O O   . TYR A 67  ? 0.245 0.283 0.336 0.052  0.001  0.000  396 TYR EEE O   
520  C CB  . TYR A 67  ? 0.222 0.279 0.372 -0.024 -0.039 -0.007 396 TYR EEE CB  
521  C CG  . TYR A 67  ? 0.313 0.324 0.367 -0.038 -0.038 0.019  396 TYR EEE CG  
522  C CD1 . TYR A 67  ? 0.277 0.390 0.348 -0.074 -0.082 0.004  396 TYR EEE CD1 
523  C CD2 . TYR A 67  ? 0.337 0.363 0.401 0.001  -0.067 0.040  396 TYR EEE CD2 
524  C CE1 . TYR A 67  ? 0.356 0.461 0.363 -0.018 -0.077 0.041  396 TYR EEE CE1 
525  C CE2 . TYR A 67  ? 0.356 0.389 0.389 -0.008 -0.093 0.034  396 TYR EEE CE2 
526  C CZ  . TYR A 67  ? 0.406 0.429 0.365 -0.004 -0.100 0.045  396 TYR EEE CZ  
527  O OH  . TYR A 67  ? 0.525 0.517 0.430 0.017  -0.125 0.103  396 TYR EEE OH  
528  N N   . ALA A 68  ? 0.150 0.256 0.337 -0.011 -0.005 -0.003 397 ALA EEE N   
529  C CA  . ALA A 68  ? 0.138 0.257 0.318 -0.011 -0.025 -0.007 397 ALA EEE CA  
530  C C   . ALA A 68  ? 0.159 0.260 0.283 -0.017 -0.040 -0.004 397 ALA EEE C   
531  O O   . ALA A 68  ? 0.155 0.250 0.286 -0.020 -0.031 -0.004 397 ALA EEE O   
532  C CB  . ALA A 68  ? 0.134 0.262 0.314 -0.018 -0.029 -0.001 397 ALA EEE CB  
533  N N   . ASP A 69  ? 0.160 0.248 0.283 0.016  -0.024 0.000  398 ASP EEE N   
534  C CA  . ASP A 69  ? 0.134 0.232 0.267 0.014  -0.019 0.005  398 ASP EEE CA  
535  C C   . ASP A 69  ? 0.134 0.218 0.242 -0.005 -0.010 -0.003 398 ASP EEE C   
536  O O   . ASP A 69  ? 0.237 0.255 0.264 0.048  -0.029 -0.019 398 ASP EEE O   
537  C CB  . ASP A 69  ? 0.138 0.257 0.259 -0.008 -0.002 -0.009 398 ASP EEE CB  
538  C CG  . ASP A 69  ? 0.177 0.250 0.276 0.009  -0.000 -0.002 398 ASP EEE CG  
539  O OD1 . ASP A 69  ? 0.162 0.268 0.271 -0.001 -0.037 0.003  398 ASP EEE OD1 
540  O OD2 . ASP A 69  ? 0.153 0.276 0.293 0.015  -0.030 -0.002 398 ASP EEE OD2 
541  N N   . SER A 70  ? 0.186 0.198 0.246 -0.009 -0.020 -0.005 399 SER EEE N   
542  C CA  . SER A 70  ? 0.131 0.220 0.248 -0.005 -0.014 0.000  399 SER EEE CA  
543  C C   . SER A 70  ? 0.096 0.221 0.224 -0.007 -0.001 0.009  399 SER EEE C   
544  O O   . SER A 70  ? 0.117 0.235 0.220 -0.001 -0.004 0.008  399 SER EEE O   
545  C CB  . SER A 70  ? 0.144 0.239 0.267 -0.018 -0.035 -0.017 399 SER EEE CB  
546  O OG  . SER A 70  ? 0.153 0.252 0.278 -0.005 -0.006 -0.000 399 SER EEE OG  
547  N N   . PHE A 71  ? 0.108 0.233 0.215 0.001  -0.006 0.005  400 PHE EEE N   
548  C CA  . PHE A 71  ? 0.084 0.224 0.208 -0.001 0.000  0.001  400 PHE EEE CA  
549  C C   . PHE A 71  ? 0.066 0.230 0.220 0.006  0.000  -0.005 400 PHE EEE C   
550  O O   . PHE A 71  ? 0.126 0.231 0.227 0.004  -0.032 -0.014 400 PHE EEE O   
551  C CB  . PHE A 71  ? 0.099 0.235 0.197 0.004  -0.027 -0.001 400 PHE EEE CB  
552  C CG  . PHE A 71  ? 0.126 0.245 0.220 0.009  -0.014 -0.008 400 PHE EEE CG  
553  C CD1 . PHE A 71  ? 0.109 0.257 0.227 0.003  -0.020 0.005  400 PHE EEE CD1 
554  C CD2 . PHE A 71  ? 0.125 0.251 0.221 0.007  -0.007 0.003  400 PHE EEE CD2 
555  C CE1 . PHE A 71  ? 0.145 0.254 0.224 -0.008 -0.002 -0.002 400 PHE EEE CE1 
556  C CE2 . PHE A 71  ? 0.113 0.252 0.220 0.012  -0.025 -0.001 400 PHE EEE CE2 
557  C CZ  . PHE A 71  ? 0.113 0.268 0.249 0.004  0.009  -0.003 400 PHE EEE CZ  
558  N N   . VAL A 72  ? 0.091 0.224 0.222 -0.011 -0.002 -0.009 401 VAL EEE N   
559  C CA  . VAL A 72  ? 0.116 0.228 0.209 -0.004 0.003  -0.010 401 VAL EEE CA  
560  C C   . VAL A 72  ? 0.112 0.230 0.188 -0.001 0.012  -0.012 401 VAL EEE C   
561  O O   . VAL A 72  ? 0.107 0.251 0.180 0.011  0.014  -0.007 401 VAL EEE O   
562  C CB  . VAL A 72  ? 0.124 0.235 0.231 0.003  0.002  -0.009 401 VAL EEE CB  
563  C CG1 . VAL A 72  ? 0.126 0.259 0.233 0.030  -0.012 0.005  401 VAL EEE CG1 
564  C CG2 . VAL A 72  ? 0.136 0.238 0.248 -0.011 -0.019 -0.004 401 VAL EEE CG2 
565  N N   . ILE A 73  ? 0.133 0.222 0.189 0.003  -0.005 -0.011 402 ILE EEE N   
566  C CA  . ILE A 73  ? 0.116 0.236 0.188 0.012  0.011  -0.013 402 ILE EEE CA  
567  C C   . ILE A 73  ? 0.131 0.248 0.189 -0.011 -0.003 -0.003 402 ILE EEE C   
568  O O   . ILE A 73  ? 0.132 0.279 0.215 -0.011 -0.027 0.007  402 ILE EEE O   
569  C CB  . ILE A 73  ? 0.124 0.238 0.201 0.025  -0.001 -0.002 402 ILE EEE CB  
570  C CG1 . ILE A 73  ? 0.135 0.255 0.214 0.021  -0.004 -0.011 402 ILE EEE CG1 
571  C CG2 . ILE A 73  ? 0.109 0.250 0.200 0.006  0.013  -0.008 402 ILE EEE CG2 
572  C CD1 . ILE A 73  ? 0.155 0.259 0.242 0.028  0.028  -0.032 402 ILE EEE CD1 
573  N N   . ARG A 74  ? 0.107 0.258 0.171 -0.008 -0.011 -0.000 403 ARG EEE N   
574  C CA  . ARG A 74  ? 0.142 0.264 0.183 0.012  -0.021 0.011  403 ARG EEE CA  
575  C C   . ARG A 74  ? 0.152 0.271 0.187 0.022  -0.010 0.006  403 ARG EEE C   
576  O O   . ARG A 74  ? 0.159 0.286 0.191 0.043  -0.010 -0.007 403 ARG EEE O   
577  C CB  . ARG A 74  ? 0.175 0.277 0.201 -0.019 -0.031 0.007  403 ARG EEE CB  
578  C CG  . ARG A 74  ? 0.201 0.283 0.233 -0.024 -0.007 0.003  403 ARG EEE CG  
579  C CD  . ARG A 74  ? 0.224 0.309 0.251 -0.048 0.014  0.014  403 ARG EEE CD  
580  N NE  . ARG A 74  ? 0.292 0.291 0.256 -0.007 0.045  -0.006 403 ARG EEE NE  
581  C CZ  . ARG A 74  ? 0.252 0.333 0.295 -0.017 0.074  0.007  403 ARG EEE CZ  
582  N NH1 . ARG A 74  ? 0.267 0.323 0.270 -0.060 0.069  0.026  403 ARG EEE NH1 
583  N NH2 . ARG A 74  ? 0.316 0.383 0.269 0.017  0.041  0.003  403 ARG EEE NH2 
584  N N   . GLY A 75  ? 0.158 0.300 0.202 0.036  -0.028 0.009  404 GLY EEE N   
585  C CA  . GLY A 75  ? 0.156 0.311 0.196 0.029  -0.008 -0.001 404 GLY EEE CA  
586  C C   . GLY A 75  ? 0.169 0.292 0.180 0.021  0.006  0.008  404 GLY EEE C   
587  O O   . GLY A 75  ? 0.146 0.311 0.233 0.033  0.027  -0.009 404 GLY EEE O   
588  N N   . ASP A 76  ? 0.135 0.311 0.205 0.023  -0.000 -0.005 405 ASP EEE N   
589  C CA  . ASP A 76  ? 0.136 0.317 0.200 0.020  0.009  -0.012 405 ASP EEE CA  
590  C C   . ASP A 76  ? 0.169 0.311 0.168 0.015  0.016  -0.023 405 ASP EEE C   
591  O O   . ASP A 76  ? 0.159 0.353 0.222 0.013  0.020  -0.005 405 ASP EEE O   
592  C CB  . ASP A 76  ? 0.144 0.332 0.238 0.023  0.008  0.008  405 ASP EEE CB  
593  C CG  . ASP A 76  ? 0.224 0.336 0.236 -0.012 0.017  0.006  405 ASP EEE CG  
594  O OD1 . ASP A 76  ? 0.260 0.314 0.233 -0.009 0.020  0.026  405 ASP EEE OD1 
595  O OD2 . ASP A 76  ? 0.268 0.372 0.278 -0.001 0.034  0.035  405 ASP EEE OD2 
596  N N   . GLU A 77  ? 0.175 0.289 0.168 0.022  0.015  -0.018 406 GLU EEE N   
597  C CA  . GLU A 77  ? 0.148 0.264 0.182 0.027  0.021  -0.018 406 GLU EEE CA  
598  C C   . GLU A 77  ? 0.132 0.263 0.187 0.007  0.015  -0.025 406 GLU EEE C   
599  O O   . GLU A 77  ? 0.139 0.273 0.209 0.023  0.022  -0.006 406 GLU EEE O   
600  C CB  . GLU A 77  ? 0.134 0.272 0.179 0.016  0.002  -0.029 406 GLU EEE CB  
601  C CG  . GLU A 77  ? 0.127 0.260 0.211 0.010  -0.006 -0.025 406 GLU EEE CG  
602  C CD  . GLU A 77  ? 0.158 0.278 0.209 -0.006 0.015  -0.023 406 GLU EEE CD  
603  O OE1 . GLU A 77  ? 0.153 0.276 0.212 -0.008 0.013  -0.013 406 GLU EEE OE1 
604  O OE2 . GLU A 77  ? 0.190 0.306 0.285 -0.024 0.026  -0.043 406 GLU EEE OE2 
605  N N   . VAL A 78  ? 0.140 0.279 0.208 0.013  -0.011 -0.021 407 VAL EEE N   
606  C CA  . VAL A 78  ? 0.163 0.270 0.209 0.030  -0.022 -0.035 407 VAL EEE CA  
607  C C   . VAL A 78  ? 0.176 0.262 0.230 0.024  -0.009 -0.044 407 VAL EEE C   
608  O O   . VAL A 78  ? 0.133 0.302 0.250 0.024  -0.025 -0.015 407 VAL EEE O   
609  C CB  . VAL A 78  ? 0.162 0.303 0.231 0.008  -0.013 -0.053 407 VAL EEE CB  
610  C CG1 . VAL A 78  ? 0.165 0.313 0.294 -0.012 -0.035 -0.054 407 VAL EEE CG1 
611  C CG2 . VAL A 78  ? 0.164 0.306 0.235 0.002  0.008  -0.036 407 VAL EEE CG2 
612  N N   . ARG A 79  ? 0.173 0.303 0.236 0.034  -0.022 -0.025 408 ARG EEE N   
613  C CA  . ARG A 79  ? 0.189 0.273 0.249 0.034  -0.017 -0.036 408 ARG EEE CA  
614  C C   . ARG A 79  ? 0.192 0.263 0.243 0.015  -0.009 -0.026 408 ARG EEE C   
615  O O   . ARG A 79  ? 0.168 0.315 0.272 0.030  -0.008 -0.058 408 ARG EEE O   
616  C CB  . ARG A 79  ? 0.217 0.338 0.262 0.048  -0.029 0.006  408 ARG EEE CB  
617  C CG  . ARG A 79  ? 0.256 0.357 0.324 0.042  -0.032 0.002  408 ARG EEE CG  
618  C CD  . ARG A 79  ? 0.354 0.428 0.331 0.042  0.007  0.010  408 ARG EEE CD  
619  N NE  . ARG A 79  ? 0.366 0.524 0.409 0.065  0.046  -0.008 408 ARG EEE NE  
620  C CZ  . ARG A 79  ? 0.400 0.586 0.437 0.056  0.022  -0.012 408 ARG EEE CZ  
621  N NH1 . ARG A 79  ? 0.333 0.661 0.388 0.047  0.159  0.010  408 ARG EEE NH1 
622  N NH2 . ARG A 79  ? 0.412 0.625 0.547 0.072  0.048  -0.013 408 ARG EEE NH2 
623  N N   . GLN A 80  ? 0.121 0.288 0.244 0.029  0.005  -0.030 409 GLN EEE N   
624  C CA  . GLN A 80  ? 0.153 0.284 0.239 0.029  0.004  -0.030 409 GLN EEE CA  
625  C C   . GLN A 80  ? 0.154 0.271 0.261 0.018  -0.026 -0.026 409 GLN EEE C   
626  O O   . GLN A 80  ? 0.112 0.284 0.275 0.026  -0.020 -0.018 409 GLN EEE O   
627  C CB  . GLN A 80  ? 0.160 0.269 0.252 0.021  -0.012 -0.021 409 GLN EEE CB  
628  C CG  . GLN A 80  ? 0.129 0.273 0.261 0.017  0.011  -0.023 409 GLN EEE CG  
629  C CD  . GLN A 80  ? 0.132 0.284 0.224 -0.020 0.018  -0.017 409 GLN EEE CD  
630  O OE1 . GLN A 80  ? 0.121 0.296 0.217 -0.019 0.016  -0.025 409 GLN EEE OE1 
631  N NE2 . GLN A 80  ? 0.138 0.319 0.241 -0.014 0.016  0.009  409 GLN EEE NE2 
632  N N   . ILE A 81  ? 0.120 0.268 0.262 0.042  -0.016 -0.029 410 ILE EEE N   
633  C CA  . ILE A 81  ? 0.105 0.264 0.270 0.031  -0.033 -0.037 410 ILE EEE CA  
634  C C   . ILE A 81  ? 0.120 0.266 0.291 0.030  -0.008 -0.041 410 ILE EEE C   
635  O O   . ILE A 81  ? 0.164 0.283 0.285 0.010  -0.013 -0.051 410 ILE EEE O   
636  C CB  . ILE A 81  ? 0.105 0.270 0.256 0.016  -0.022 -0.022 410 ILE EEE CB  
637  C CG1 . ILE A 81  ? 0.131 0.273 0.243 0.026  -0.012 -0.015 410 ILE EEE CG1 
638  C CG2 . ILE A 81  ? 0.184 0.273 0.235 0.031  -0.017 -0.019 410 ILE EEE CG2 
639  C CD1 . ILE A 81  ? 0.151 0.272 0.241 0.026  0.003  -0.026 410 ILE EEE CD1 
640  N N   . ALA A 82  ? 0.123 0.297 0.309 0.046  -0.015 -0.034 411 ALA EEE N   
641  C CA  . ALA A 82  ? 0.184 0.269 0.313 0.032  -0.018 -0.030 411 ALA EEE CA  
642  C C   . ALA A 82  ? 0.181 0.287 0.335 0.052  -0.018 -0.045 411 ALA EEE C   
643  O O   . ALA A 82  ? 0.168 0.322 0.345 0.048  -0.029 -0.065 411 ALA EEE O   
644  C CB  . ALA A 82  ? 0.175 0.309 0.322 0.040  -0.002 -0.051 411 ALA EEE CB  
645  N N   . PRO A 83  ? 0.167 0.279 0.376 0.053  -0.031 -0.044 412 PRO EEE N   
646  C CA  . PRO A 83  ? 0.176 0.316 0.381 0.060  -0.035 -0.024 412 PRO EEE CA  
647  C C   . PRO A 83  ? 0.190 0.334 0.362 0.049  -0.033 -0.030 412 PRO EEE C   
648  O O   . PRO A 83  ? 0.234 0.367 0.369 0.071  -0.000 -0.047 412 PRO EEE O   
649  C CB  . PRO A 83  ? 0.199 0.313 0.412 0.058  -0.031 -0.030 412 PRO EEE CB  
650  C CG  . PRO A 83  ? 0.223 0.317 0.433 0.050  -0.031 -0.007 412 PRO EEE CG  
651  C CD  . PRO A 83  ? 0.175 0.288 0.377 0.041  -0.002 -0.020 412 PRO EEE CD  
652  N N   . GLY A 84  ? 0.171 0.335 0.363 0.034  -0.013 -0.028 413 GLY EEE N   
653  C CA  . GLY A 84  ? 0.158 0.367 0.388 0.038  0.025  -0.036 413 GLY EEE CA  
654  C C   . GLY A 84  ? 0.124 0.378 0.395 0.046  0.047  -0.026 413 GLY EEE C   
655  O O   . GLY A 84  ? 0.176 0.490 0.496 0.059  0.119  0.031  413 GLY EEE O   
656  N N   . GLN A 85  ? 0.108 0.359 0.393 0.035  0.030  -0.029 414 GLN EEE N   
657  C CA  . GLN A 85  ? 0.105 0.357 0.385 0.010  0.034  -0.035 414 GLN EEE CA  
658  C C   . GLN A 85  ? 0.146 0.360 0.356 0.042  0.035  -0.038 414 GLN EEE C   
659  O O   . GLN A 85  ? 0.243 0.394 0.366 0.051  0.021  -0.030 414 GLN EEE O   
660  C CB  . GLN A 85  ? 0.098 0.380 0.422 0.013  0.040  -0.041 414 GLN EEE CB  
661  C CG  . GLN A 85  ? 0.190 0.426 0.483 -0.013 -0.013 -0.062 414 GLN EEE CG  
662  C CD  . GLN A 85  ? 0.279 0.465 0.469 -0.021 -0.005 -0.055 414 GLN EEE CD  
663  O OE1 . GLN A 85  ? 0.454 0.524 0.559 0.034  -0.004 -0.085 414 GLN EEE OE1 
664  N NE2 . GLN A 85  ? 0.292 0.459 0.437 -0.013 -0.027 -0.047 414 GLN EEE NE2 
665  N N   . THR A 86  ? 0.176 0.360 0.359 0.039  0.030  -0.038 415 THR EEE N   
666  C CA  . THR A 86  ? 0.204 0.365 0.364 0.023  0.068  -0.057 415 THR EEE CA  
667  C C   . THR A 86  ? 0.224 0.349 0.301 -0.016 0.030  -0.024 415 THR EEE C   
668  O O   . THR A 86  ? 0.221 0.366 0.346 0.023  0.002  -0.054 415 THR EEE O   
669  C CB  . THR A 86  ? 0.213 0.403 0.456 -0.021 0.045  -0.051 415 THR EEE CB  
670  O OG1 . THR A 86  ? 0.344 0.527 0.515 0.007  -0.013 -0.086 415 THR EEE OG1 
671  C CG2 . THR A 86  ? 0.214 0.419 0.447 -0.051 0.064  -0.072 415 THR EEE CG2 
672  N N   . GLY A 87  ? 0.201 0.332 0.303 -0.025 0.028  -0.025 416 GLY EEE N   
673  C CA  . GLY A 87  ? 0.185 0.305 0.284 -0.045 0.024  -0.008 416 GLY EEE CA  
674  C C   . GLY A 87  ? 0.162 0.282 0.277 -0.020 0.022  0.007  416 GLY EEE C   
675  O O   . GLY A 87  ? 0.121 0.295 0.279 0.022  0.029  0.008  416 GLY EEE O   
676  N N   . LYS A 88  ? 0.163 0.285 0.237 -0.010 0.006  0.003  417 LYS EEE N   
677  C CA  . LYS A 88  ? 0.152 0.277 0.233 -0.010 0.000  -0.016 417 LYS EEE CA  
678  C C   . LYS A 88  ? 0.142 0.265 0.221 0.001  -0.004 -0.014 417 LYS EEE C   
679  O O   . LYS A 88  ? 0.099 0.272 0.231 0.013  0.005  -0.007 417 LYS EEE O   
680  C CB  . LYS A 88  ? 0.188 0.300 0.269 0.027  0.029  0.002  417 LYS EEE CB  
681  C CG  . LYS A 88  ? 0.215 0.349 0.326 -0.009 0.018  0.008  417 LYS EEE CG  
682  C CD  . LYS A 88  ? 0.235 0.420 0.362 -0.026 0.026  -0.022 417 LYS EEE CD  
683  C CE  . LYS A 88  ? 0.291 0.438 0.372 -0.016 0.083  -0.026 417 LYS EEE CE  
684  N NZ  . LYS A 88  ? 0.312 0.526 0.418 0.001  0.055  -0.026 417 LYS EEE NZ  
685  N N   . ILE A 89  ? 0.162 0.242 0.204 0.018  0.002  -0.017 418 ILE EEE N   
686  C CA  . ILE A 89  ? 0.145 0.250 0.207 0.001  -0.005 -0.014 418 ILE EEE CA  
687  C C   . ILE A 89  ? 0.150 0.247 0.211 0.008  0.014  -0.019 418 ILE EEE C   
688  O O   . ILE A 89  ? 0.101 0.262 0.218 0.005  0.015  -0.004 418 ILE EEE O   
689  C CB  . ILE A 89  ? 0.170 0.264 0.182 -0.002 -0.005 -0.025 418 ILE EEE CB  
690  C CG1 . ILE A 89  ? 0.142 0.279 0.220 0.008  0.000  -0.022 418 ILE EEE CG1 
691  C CG2 . ILE A 89  ? 0.180 0.277 0.220 0.001  -0.018 0.003  418 ILE EEE CG2 
692  C CD1 . ILE A 89  ? 0.130 0.304 0.227 0.024  -0.010 -0.020 418 ILE EEE CD1 
693  N N   . ALA A 90  ? 0.128 0.255 0.219 0.009  0.029  -0.004 419 ALA EEE N   
694  C CA  . ALA A 90  ? 0.155 0.237 0.229 0.005  0.011  -0.016 419 ALA EEE CA  
695  C C   . ALA A 90  ? 0.103 0.262 0.250 0.023  0.014  -0.005 419 ALA EEE C   
696  O O   . ALA A 90  ? 0.118 0.309 0.271 0.004  0.006  0.012  419 ALA EEE O   
697  C CB  . ALA A 90  ? 0.132 0.284 0.245 0.046  0.017  -0.009 419 ALA EEE CB  
698  N N   . ASP A 91  ? 0.130 0.253 0.253 0.019  -0.017 -0.015 420 ASP EEE N   
699  C CA  . ASP A 91  ? 0.152 0.277 0.246 0.005  -0.023 -0.015 420 ASP EEE CA  
700  C C   . ASP A 91  ? 0.131 0.265 0.261 0.007  -0.005 0.000  420 ASP EEE C   
701  O O   . ASP A 91  ? 0.101 0.283 0.281 0.030  -0.014 -0.007 420 ASP EEE O   
702  C CB  . ASP A 91  ? 0.122 0.328 0.281 -0.017 -0.022 -0.004 420 ASP EEE CB  
703  C CG  . ASP A 91  ? 0.193 0.374 0.318 0.024  -0.002 -0.016 420 ASP EEE CG  
704  O OD1 . ASP A 91  ? 0.185 0.399 0.340 0.004  0.009  -0.062 420 ASP EEE OD1 
705  O OD2 . ASP A 91  ? 0.218 0.432 0.387 0.006  0.046  0.013  420 ASP EEE OD2 
706  N N   . TYR A 92  ? 0.109 0.253 0.203 0.001  -0.022 -0.016 421 TYR EEE N   
707  C CA  . TYR A 92  ? 0.103 0.258 0.215 -0.014 -0.014 -0.026 421 TYR EEE CA  
708  C C   . TYR A 92  ? 0.110 0.248 0.227 -0.015 -0.014 -0.019 421 TYR EEE C   
709  O O   . TYR A 92  ? 0.086 0.282 0.239 -0.019 -0.019 -0.025 421 TYR EEE O   
710  C CB  . TYR A 92  ? 0.122 0.261 0.210 -0.016 -0.005 -0.004 421 TYR EEE CB  
711  C CG  . TYR A 92  ? 0.126 0.257 0.213 -0.010 0.012  0.004  421 TYR EEE CG  
712  C CD1 . TYR A 92  ? 0.122 0.272 0.239 -0.024 -0.002 0.014  421 TYR EEE CD1 
713  C CD2 . TYR A 92  ? 0.128 0.255 0.245 -0.019 -0.010 0.004  421 TYR EEE CD2 
714  C CE1 . TYR A 92  ? 0.113 0.284 0.249 -0.018 0.026  -0.009 421 TYR EEE CE1 
715  C CE2 . TYR A 92  ? 0.161 0.260 0.261 -0.027 0.039  0.013  421 TYR EEE CE2 
716  C CZ  . TYR A 92  ? 0.145 0.290 0.273 -0.027 0.036  0.004  421 TYR EEE CZ  
717  O OH  . TYR A 92  ? 0.157 0.322 0.371 -0.053 0.042  -0.013 421 TYR EEE OH  
718  N N   . ASN A 93  ? 0.102 0.254 0.207 -0.013 0.006  -0.030 422 ASN EEE N   
719  C CA  . ASN A 93  ? 0.101 0.231 0.216 0.000  0.017  -0.001 422 ASN EEE CA  
720  C C   . ASN A 93  ? 0.110 0.232 0.216 0.010  -0.011 -0.014 422 ASN EEE C   
721  O O   . ASN A 93  ? 0.124 0.249 0.214 0.015  -0.010 -0.001 422 ASN EEE O   
722  C CB  . ASN A 93  ? 0.116 0.230 0.208 0.003  0.013  -0.006 422 ASN EEE CB  
723  C CG  . ASN A 93  ? 0.136 0.225 0.177 0.000  0.012  -0.016 422 ASN EEE CG  
724  O OD1 . ASN A 93  ? 0.094 0.231 0.203 -0.006 0.012  -0.026 422 ASN EEE OD1 
725  N ND2 . ASN A 93  ? 0.121 0.231 0.198 -0.023 -0.009 -0.004 422 ASN EEE ND2 
726  N N   . TYR A 94  ? 0.097 0.234 0.208 0.002  -0.006 -0.012 423 TYR EEE N   
727  C CA  . TYR A 94  ? 0.094 0.232 0.228 0.014  -0.022 -0.017 423 TYR EEE CA  
728  C C   . TYR A 94  ? 0.127 0.228 0.224 0.013  -0.010 -0.021 423 TYR EEE C   
729  O O   . TYR A 94  ? 0.122 0.271 0.235 0.022  -0.006 -0.015 423 TYR EEE O   
730  C CB  . TYR A 94  ? 0.092 0.229 0.224 0.016  -0.023 -0.005 423 TYR EEE CB  
731  C CG  . TYR A 94  ? 0.108 0.225 0.227 0.012  -0.032 0.002  423 TYR EEE CG  
732  C CD1 . TYR A 94  ? 0.135 0.239 0.228 0.000  -0.015 -0.010 423 TYR EEE CD1 
733  C CD2 . TYR A 94  ? 0.122 0.240 0.228 0.015  -0.012 0.000  423 TYR EEE CD2 
734  C CE1 . TYR A 94  ? 0.120 0.235 0.259 -0.001 -0.016 -0.006 423 TYR EEE CE1 
735  C CE2 . TYR A 94  ? 0.137 0.240 0.261 0.012  -0.016 -0.016 423 TYR EEE CE2 
736  C CZ  . TYR A 94  ? 0.122 0.229 0.268 0.007  -0.028 -0.006 423 TYR EEE CZ  
737  O OH  . TYR A 94  ? 0.146 0.236 0.293 -0.004 -0.013 -0.006 423 TYR EEE OH  
738  N N   . LYS A 95  ? 0.134 0.243 0.241 0.017  -0.014 -0.009 424 LYS EEE N   
739  C CA  . LYS A 95  ? 0.123 0.250 0.258 0.014  -0.023 -0.019 424 LYS EEE CA  
740  C C   . LYS A 95  ? 0.089 0.252 0.277 0.021  -0.024 -0.019 424 LYS EEE C   
741  O O   . LYS A 95  ? 0.170 0.228 0.311 0.021  -0.029 0.001  424 LYS EEE O   
742  C CB  . LYS A 95  ? 0.119 0.255 0.278 0.009  -0.028 -0.025 424 LYS EEE CB  
743  C CG  . LYS A 95  ? 0.144 0.265 0.324 0.027  -0.002 -0.023 424 LYS EEE CG  
744  C CD  . LYS A 95  ? 0.175 0.306 0.347 0.018  0.010  -0.016 424 LYS EEE CD  
745  C CE  . LYS A 95  ? 0.199 0.350 0.404 0.026  0.028  -0.039 424 LYS EEE CE  
746  N NZ  . LYS A 95  ? 0.245 0.365 0.425 0.011  0.064  -0.029 424 LYS EEE NZ  
747  N N   . LEU A 96  ? 0.149 0.278 0.288 0.000  -0.028 -0.027 425 LEU EEE N   
748  C CA  . LEU A 96  ? 0.159 0.270 0.323 0.036  -0.037 -0.040 425 LEU EEE CA  
749  C C   . LEU A 96  ? 0.166 0.290 0.358 0.042  -0.019 -0.040 425 LEU EEE C   
750  O O   . LEU A 96  ? 0.204 0.273 0.448 0.006  -0.025 -0.027 425 LEU EEE O   
751  C CB  . LEU A 96  ? 0.181 0.269 0.329 0.026  -0.023 -0.056 425 LEU EEE CB  
752  C CG  . LEU A 96  ? 0.176 0.252 0.350 0.031  -0.025 -0.028 425 LEU EEE CG  
753  C CD1 . LEU A 96  ? 0.196 0.279 0.377 0.005  -0.046 -0.042 425 LEU EEE CD1 
754  C CD2 . LEU A 96  ? 0.189 0.277 0.364 0.037  -0.026 -0.018 425 LEU EEE CD2 
755  N N   . PRO A 97  ? 0.160 0.289 0.367 0.044  -0.042 -0.042 426 PRO EEE N   
756  C CA  . PRO A 97  ? 0.159 0.313 0.430 0.055  -0.022 -0.040 426 PRO EEE CA  
757  C C   . PRO A 97  ? 0.177 0.338 0.407 0.058  -0.041 -0.030 426 PRO EEE C   
758  O O   . PRO A 97  ? 0.196 0.327 0.395 0.055  -0.030 -0.052 426 PRO EEE O   
759  C CB  . PRO A 97  ? 0.213 0.305 0.409 0.054  -0.031 -0.045 426 PRO EEE CB  
760  C CG  . PRO A 97  ? 0.205 0.288 0.406 0.040  0.010  -0.011 426 PRO EEE CG  
761  C CD  . PRO A 97  ? 0.219 0.293 0.387 0.047  0.003  -0.020 426 PRO EEE CD  
762  N N   . ASP A 98  ? 0.166 0.378 0.422 0.056  -0.049 -0.040 427 ASP EEE N   
763  C CA  . ASP A 98  ? 0.185 0.390 0.461 0.055  -0.021 -0.043 427 ASP EEE CA  
764  C C   . ASP A 98  ? 0.144 0.363 0.434 0.081  -0.042 -0.059 427 ASP EEE C   
765  O O   . ASP A 98  ? 0.307 0.463 0.436 0.074  -0.064 -0.093 427 ASP EEE O   
766  C CB  . ASP A 98  ? 0.184 0.429 0.510 0.075  -0.041 -0.033 427 ASP EEE CB  
767  C CG  . ASP A 98  ? 0.178 0.480 0.580 0.042  -0.032 -0.019 427 ASP EEE CG  
768  O OD1 . ASP A 98  ? 0.282 0.479 0.589 0.053  -0.057 -0.023 427 ASP EEE OD1 
769  O OD2 . ASP A 98  ? 0.183 0.616 0.655 0.047  -0.038 -0.013 427 ASP EEE OD2 
770  N N   . ASP A 99  ? 0.180 0.366 0.463 0.071  -0.074 -0.038 428 ASP EEE N   
771  C CA  . ASP A 99  ? 0.283 0.371 0.485 0.032  -0.048 -0.056 428 ASP EEE CA  
772  C C   . ASP A 99  ? 0.266 0.340 0.456 0.047  -0.070 -0.052 428 ASP EEE C   
773  O O   . ASP A 99  ? 0.216 0.386 0.481 0.074  -0.052 -0.022 428 ASP EEE O   
774  C CB  . ASP A 99  ? 0.306 0.408 0.541 0.042  -0.092 -0.039 428 ASP EEE CB  
775  C CG  . ASP A 99  ? 0.394 0.420 0.535 0.074  -0.088 -0.033 428 ASP EEE CG  
776  O OD1 . ASP A 99  ? 0.431 0.395 0.508 0.075  -0.139 -0.012 428 ASP EEE OD1 
777  O OD2 . ASP A 99  ? 0.455 0.512 0.558 0.044  -0.135 0.007  428 ASP EEE OD2 
778  N N   . PHE A 100 ? 0.239 0.324 0.435 0.026  -0.027 -0.055 429 PHE EEE N   
779  C CA  . PHE A 100 ? 0.223 0.298 0.401 0.019  -0.034 -0.066 429 PHE EEE CA  
780  C C   . PHE A 100 ? 0.224 0.265 0.373 0.031  -0.039 -0.040 429 PHE EEE C   
781  O O   . PHE A 100 ? 0.222 0.331 0.395 0.070  -0.039 -0.052 429 PHE EEE O   
782  C CB  . PHE A 100 ? 0.198 0.305 0.397 0.011  -0.024 -0.046 429 PHE EEE CB  
783  C CG  . PHE A 100 ? 0.197 0.288 0.370 -0.005 -0.038 -0.052 429 PHE EEE CG  
784  C CD1 . PHE A 100 ? 0.199 0.294 0.368 -0.005 -0.056 -0.031 429 PHE EEE CD1 
785  C CD2 . PHE A 100 ? 0.181 0.288 0.379 0.010  -0.039 -0.057 429 PHE EEE CD2 
786  C CE1 . PHE A 100 ? 0.203 0.273 0.382 0.001  -0.029 -0.043 429 PHE EEE CE1 
787  C CE2 . PHE A 100 ? 0.173 0.314 0.395 -0.008 -0.051 -0.045 429 PHE EEE CE2 
788  C CZ  . PHE A 100 ? 0.199 0.263 0.378 -0.003 -0.036 -0.052 429 PHE EEE CZ  
789  N N   . THR A 101 ? 0.229 0.294 0.360 0.033  -0.044 -0.035 430 THR EEE N   
790  C CA  . THR A 101 ? 0.187 0.284 0.389 0.031  -0.033 -0.020 430 THR EEE CA  
791  C C   . THR A 101 ? 0.179 0.263 0.347 0.016  -0.047 -0.028 430 THR EEE C   
792  O O   . THR A 101 ? 0.189 0.274 0.360 0.027  -0.060 -0.040 430 THR EEE O   
793  C CB  . THR A 101 ? 0.188 0.287 0.442 0.041  -0.046 -0.002 430 THR EEE CB  
794  O OG1 . THR A 101 ? 0.192 0.370 0.445 0.053  -0.021 -0.010 430 THR EEE OG1 
795  C CG2 . THR A 101 ? 0.236 0.327 0.427 0.009  -0.045 0.009  430 THR EEE CG2 
796  N N   . GLY A 102 ? 0.200 0.286 0.352 0.047  -0.041 -0.048 431 GLY EEE N   
797  C CA  . GLY A 102 ? 0.183 0.278 0.369 0.033  -0.047 -0.034 431 GLY EEE CA  
798  C C   . GLY A 102 ? 0.190 0.300 0.368 0.045  -0.034 -0.033 431 GLY EEE C   
799  O O   . GLY A 102 ? 0.228 0.346 0.359 0.061  -0.034 -0.042 431 GLY EEE O   
800  N N   . CYS A 103 ? 0.184 0.282 0.372 0.045  -0.015 -0.045 432 CYS EEE N   
801  C CA  . CYS A 103 ? 0.233 0.269 0.349 0.024  -0.036 -0.048 432 CYS EEE CA  
802  C C   . CYS A 103 ? 0.177 0.268 0.323 0.022  -0.037 -0.035 432 CYS EEE C   
803  O O   . CYS A 103 ? 0.273 0.284 0.345 0.041  0.001  -0.044 432 CYS EEE O   
804  C CB  . CYS A 103 ? 0.271 0.291 0.419 -0.018 -0.064 -0.021 432 CYS EEE CB  
805  S SG  . CYS A 103 ? 0.354 0.324 0.464 0.013  -0.092 -0.053 432 CYS EEE SG  
806  N N   . VAL A 104 ? 0.175 0.269 0.306 0.034  -0.063 -0.030 433 VAL EEE N   
807  C CA  . VAL A 104 ? 0.190 0.263 0.285 0.031  -0.043 -0.023 433 VAL EEE CA  
808  C C   . VAL A 104 ? 0.192 0.280 0.270 0.043  -0.034 -0.034 433 VAL EEE C   
809  O O   . VAL A 104 ? 0.174 0.325 0.277 0.030  -0.045 -0.043 433 VAL EEE O   
810  C CB  . VAL A 104 ? 0.190 0.280 0.288 0.022  -0.056 -0.022 433 VAL EEE CB  
811  C CG1 . VAL A 104 ? 0.225 0.284 0.301 0.033  -0.060 -0.029 433 VAL EEE CG1 
812  C CG2 . VAL A 104 ? 0.197 0.290 0.296 0.052  -0.059 -0.028 433 VAL EEE CG2 
813  N N   . ILE A 105 ? 0.173 0.267 0.249 0.029  -0.032 -0.033 434 ILE EEE N   
814  C CA  . ILE A 105 ? 0.175 0.266 0.255 0.016  -0.042 -0.043 434 ILE EEE CA  
815  C C   . ILE A 105 ? 0.186 0.258 0.264 0.001  -0.035 -0.015 434 ILE EEE C   
816  O O   . ILE A 105 ? 0.227 0.256 0.275 0.034  -0.030 -0.029 434 ILE EEE O   
817  C CB  . ILE A 105 ? 0.204 0.266 0.288 0.004  -0.045 -0.033 434 ILE EEE CB  
818  C CG1 . ILE A 105 ? 0.232 0.273 0.347 -0.001 -0.062 -0.020 434 ILE EEE CG1 
819  C CG2 . ILE A 105 ? 0.215 0.281 0.284 0.016  -0.050 -0.035 434 ILE EEE CG2 
820  C CD1 . ILE A 105 ? 0.215 0.329 0.389 -0.006 -0.045 0.000  434 ILE EEE CD1 
821  N N   . ALA A 106 ? 0.174 0.258 0.260 -0.000 -0.044 -0.033 435 ALA EEE N   
822  C CA  . ALA A 106 ? 0.206 0.259 0.242 0.022  -0.052 -0.027 435 ALA EEE CA  
823  C C   . ALA A 106 ? 0.187 0.284 0.270 0.032  -0.057 -0.043 435 ALA EEE C   
824  O O   . ALA A 106 ? 0.235 0.298 0.277 0.016  -0.074 -0.048 435 ALA EEE O   
825  C CB  . ALA A 106 ? 0.227 0.273 0.257 0.008  -0.032 -0.046 435 ALA EEE CB  
826  N N   . TRP A 107 ? 0.192 0.261 0.280 0.029  -0.063 -0.041 436 TRP EEE N   
827  C CA  . TRP A 107 ? 0.206 0.273 0.271 0.028  -0.060 -0.024 436 TRP EEE CA  
828  C C   . TRP A 107 ? 0.185 0.276 0.250 0.031  -0.046 -0.031 436 TRP EEE C   
829  O O   . TRP A 107 ? 0.163 0.299 0.235 0.033  -0.048 -0.024 436 TRP EEE O   
830  C CB  . TRP A 107 ? 0.217 0.288 0.328 0.006  -0.071 -0.029 436 TRP EEE CB  
831  C CG  . TRP A 107 ? 0.166 0.291 0.331 -0.014 -0.081 -0.028 436 TRP EEE CG  
832  C CD1 . TRP A 107 ? 0.199 0.326 0.353 0.013  -0.071 -0.025 436 TRP EEE CD1 
833  C CD2 . TRP A 107 ? 0.186 0.267 0.333 -0.007 -0.070 -0.024 436 TRP EEE CD2 
834  N NE1 . TRP A 107 ? 0.143 0.320 0.372 -0.012 -0.064 -0.014 436 TRP EEE NE1 
835  C CE2 . TRP A 107 ? 0.192 0.267 0.348 -0.030 -0.069 -0.032 436 TRP EEE CE2 
836  C CE3 . TRP A 107 ? 0.209 0.263 0.314 0.002  -0.070 -0.016 436 TRP EEE CE3 
837  C CZ2 . TRP A 107 ? 0.165 0.265 0.329 -0.034 -0.055 -0.037 436 TRP EEE CZ2 
838  C CZ3 . TRP A 107 ? 0.193 0.270 0.308 0.010  -0.065 -0.029 436 TRP EEE CZ3 
839  C CH2 . TRP A 107 ? 0.201 0.283 0.317 -0.010 -0.046 -0.020 436 TRP EEE CH2 
840  N N   . ASN A 108 ? 0.231 0.275 0.256 0.034  -0.051 -0.016 437 ASN EEE N   
841  C CA  . ASN A 108 ? 0.217 0.269 0.231 0.017  -0.038 -0.008 437 ASN EEE CA  
842  C C   . ASN A 108 ? 0.187 0.258 0.227 -0.014 -0.039 -0.003 437 ASN EEE C   
843  O O   . ASN A 108 ? 0.179 0.292 0.302 -0.012 -0.070 -0.032 437 ASN EEE O   
844  C CB  . ASN A 108 ? 0.220 0.305 0.225 0.009  -0.063 -0.016 437 ASN EEE CB  
845  C CG  . ASN A 108 ? 0.249 0.297 0.229 0.018  -0.040 -0.009 437 ASN EEE CG  
846  O OD1 . ASN A 108 ? 0.250 0.309 0.260 0.042  -0.051 -0.013 437 ASN EEE OD1 
847  N ND2 . ASN A 108 ? 0.189 0.294 0.251 0.029  -0.056 -0.006 437 ASN EEE ND2 
848  N N   . SER A 109 ? 0.155 0.255 0.234 -0.011 -0.030 -0.008 438 SER EEE N   
849  C CA  . SER A 109 ? 0.127 0.259 0.253 -0.018 -0.026 -0.012 438 SER EEE CA  
850  C C   . SER A 109 ? 0.126 0.269 0.223 -0.012 -0.036 -0.003 438 SER EEE C   
851  O O   . SER A 109 ? 0.110 0.300 0.249 0.017  -0.016 -0.014 438 SER EEE O   
852  C CB  . SER A 109 ? 0.165 0.257 0.283 -0.033 -0.048 0.012  438 SER EEE CB  
853  O OG  . SER A 109 ? 0.130 0.271 0.263 -0.024 -0.024 0.004  438 SER EEE OG  
854  N N   . ASN A 110 ? 0.107 0.281 0.224 -0.003 -0.027 -0.002 439 ASN EEE N   
855  C CA  . ASN A 110 ? 0.098 0.277 0.241 -0.005 -0.022 0.004  439 ASN EEE CA  
856  C C   . ASN A 110 ? 0.112 0.316 0.244 0.011  -0.014 0.005  439 ASN EEE C   
857  O O   . ASN A 110 ? 0.096 0.312 0.287 0.003  -0.011 -0.001 439 ASN EEE O   
858  C CB  . ASN A 110 ? 0.158 0.289 0.238 0.018  -0.033 0.013  439 ASN EEE CB  
859  C CG  . ASN A 110 ? 0.148 0.283 0.235 0.034  0.008  0.011  439 ASN EEE CG  
860  O OD1 . ASN A 110 ? 0.216 0.301 0.263 0.013  -0.006 -0.003 439 ASN EEE OD1 
861  N ND2 . ASN A 110 ? 0.158 0.340 0.237 0.064  0.001  0.024  439 ASN EEE ND2 
862  N N   . ASN A 111 ? 0.152 0.300 0.278 0.006  0.013  -0.001 440 ASN EEE N   
863  C CA  . ASN A 111 ? 0.137 0.326 0.304 -0.001 -0.016 -0.025 440 ASN EEE CA  
864  C C   . ASN A 111 ? 0.138 0.294 0.292 0.005  -0.035 -0.021 440 ASN EEE C   
865  O O   . ASN A 111 ? 0.159 0.333 0.367 0.039  -0.004 -0.007 440 ASN EEE O   
866  C CB  . ASN A 111 ? 0.089 0.391 0.312 -0.013 -0.051 -0.045 440 ASN EEE CB  
867  C CG  . ASN A 111 ? 0.224 0.389 0.413 -0.041 -0.056 -0.033 440 ASN EEE CG  
868  O OD1 . ASN A 111 ? 0.269 0.423 0.433 -0.026 -0.067 -0.022 440 ASN EEE OD1 
869  N ND2 . ASN A 111 ? 0.313 0.479 0.585 -0.123 -0.048 -0.065 440 ASN EEE ND2 
870  N N   . LEU A 112 ? 0.098 0.329 0.301 0.013  -0.019 -0.003 441 LEU EEE N   
871  C CA  . LEU A 112 ? 0.089 0.335 0.307 0.002  -0.010 -0.010 441 LEU EEE CA  
872  C C   . LEU A 112 ? 0.110 0.326 0.288 -0.001 0.011  -0.016 441 LEU EEE C   
873  O O   . LEU A 112 ? 0.131 0.403 0.292 0.007  -0.002 -0.043 441 LEU EEE O   
874  C CB  . LEU A 112 ? 0.165 0.336 0.340 -0.002 0.020  -0.011 441 LEU EEE CB  
875  C CG  . LEU A 112 ? 0.190 0.343 0.390 -0.021 -0.018 0.005  441 LEU EEE CG  
876  C CD1 . LEU A 112 ? 0.266 0.381 0.415 -0.021 -0.021 0.038  441 LEU EEE CD1 
877  C CD2 . LEU A 112 ? 0.190 0.382 0.412 -0.029 -0.020 0.006  441 LEU EEE CD2 
878  N N   . ASP A 113 ? 0.112 0.281 0.233 0.008  0.015  -0.007 442 ASP EEE N   
879  C CA  . ASP A 113 ? 0.181 0.272 0.249 0.002  -0.025 -0.003 442 ASP EEE CA  
880  C C   . ASP A 113 ? 0.176 0.274 0.235 -0.000 -0.038 0.002  442 ASP EEE C   
881  O O   . ASP A 113 ? 0.177 0.263 0.248 -0.018 -0.025 -0.012 442 ASP EEE O   
882  C CB  . ASP A 113 ? 0.133 0.272 0.252 -0.009 0.006  -0.009 442 ASP EEE CB  
883  C CG  . ASP A 113 ? 0.161 0.288 0.207 -0.016 0.003  -0.010 442 ASP EEE CG  
884  O OD1 . ASP A 113 ? 0.109 0.314 0.246 -0.032 0.020  0.000  442 ASP EEE OD1 
885  O OD2 . ASP A 113 ? 0.158 0.291 0.262 -0.016 0.015  -0.005 442 ASP EEE OD2 
886  N N   . SER A 114 ? 0.140 0.280 0.262 0.007  -0.037 0.008  443 SER EEE N   
887  C CA  A SER A 114 ? 0.135 0.282 0.310 0.013  -0.038 0.009  443 SER EEE CA  
888  C CA  B SER A 114 ? 0.147 0.284 0.295 0.022  -0.042 0.008  443 SER EEE CA  
889  C C   . SER A 114 ? 0.156 0.288 0.341 0.026  -0.075 0.014  443 SER EEE C   
890  O O   . SER A 114 ? 0.188 0.338 0.453 -0.008 -0.057 -0.005 443 SER EEE O   
891  C CB  A SER A 114 ? 0.152 0.292 0.317 -0.001 -0.030 0.012  443 SER EEE CB  
892  C CB  B SER A 114 ? 0.202 0.314 0.287 0.009  -0.037 0.005  443 SER EEE CB  
893  O OG  A SER A 114 ? 0.108 0.301 0.351 0.003  -0.033 0.044  443 SER EEE OG  
894  O OG  B SER A 114 ? 0.235 0.359 0.274 0.020  -0.052 0.033  443 SER EEE OG  
895  N N   . LYS A 115 ? 0.126 0.282 0.377 0.035  -0.057 0.023  444 LYS EEE N   
896  C CA  . LYS A 115 ? 0.122 0.312 0.368 0.029  -0.065 0.055  444 LYS EEE CA  
897  C C   . LYS A 115 ? 0.110 0.276 0.362 0.021  -0.060 0.027  444 LYS EEE C   
898  O O   . LYS A 115 ? 0.108 0.311 0.406 0.001  -0.045 0.032  444 LYS EEE O   
899  C CB  . LYS A 115 ? 0.185 0.344 0.401 0.018  -0.011 0.070  444 LYS EEE CB  
900  C CG  . LYS A 115 ? 0.272 0.371 0.414 0.041  -0.028 0.065  444 LYS EEE CG  
901  C CD  . LYS A 115 ? 0.289 0.475 0.443 0.040  -0.018 0.072  444 LYS EEE CD  
902  C CE  . LYS A 115 ? 0.441 0.522 0.465 -0.003 -0.045 0.029  444 LYS EEE CE  
903  N NZ  . LYS A 115 ? 0.469 0.529 0.591 0.031  -0.023 0.065  444 LYS EEE NZ  
904  N N   . VAL A 116 ? 0.142 0.328 0.368 0.031  -0.070 0.067  445 VAL EEE N   
905  C CA  . VAL A 116 ? 0.118 0.326 0.401 0.026  -0.070 0.042  445 VAL EEE CA  
906  C C   . VAL A 116 ? 0.160 0.304 0.358 0.070  -0.064 0.060  445 VAL EEE C   
907  O O   . VAL A 116 ? 0.171 0.384 0.396 0.043  -0.033 0.051  445 VAL EEE O   
908  C CB  . VAL A 116 ? 0.135 0.379 0.377 0.053  -0.075 0.019  445 VAL EEE CB  
909  C CG1 . VAL A 116 ? 0.170 0.370 0.393 0.077  -0.065 0.019  445 VAL EEE CG1 
910  C CG2 . VAL A 116 ? 0.129 0.400 0.361 0.044  -0.073 0.037  445 VAL EEE CG2 
911  N N   . GLY A 117 ? 0.150 0.346 0.365 0.040  -0.048 0.043  446 GLY EEE N   
912  C CA  . GLY A 117 ? 0.188 0.338 0.386 0.078  -0.048 0.015  446 GLY EEE CA  
913  C C   . GLY A 117 ? 0.141 0.340 0.413 0.059  -0.040 -0.005 446 GLY EEE C   
914  O O   . GLY A 117 ? 0.258 0.356 0.471 0.085  -0.092 -0.034 446 GLY EEE O   
915  N N   . GLY A 118 ? 0.094 0.319 0.327 0.042  -0.045 0.027  447 GLY EEE N   
916  C CA  . GLY A 118 ? 0.111 0.290 0.307 0.039  -0.054 0.023  447 GLY EEE CA  
917  C C   . GLY A 118 ? 0.151 0.296 0.281 0.034  -0.031 0.005  447 GLY EEE C   
918  O O   . GLY A 118 ? 0.184 0.365 0.335 0.084  0.002  0.032  447 GLY EEE O   
919  N N   . ASN A 119 ? 0.124 0.256 0.258 -0.005 -0.027 0.019  448 ASN EEE N   
920  C CA  . ASN A 119 ? 0.090 0.265 0.232 -0.005 -0.040 0.011  448 ASN EEE CA  
921  C C   . ASN A 119 ? 0.102 0.265 0.229 -0.004 -0.046 -0.008 448 ASN EEE C   
922  O O   . ASN A 119 ? 0.145 0.261 0.237 0.003  -0.020 -0.013 448 ASN EEE O   
923  C CB  . ASN A 119 ? 0.078 0.264 0.292 0.006  -0.003 0.016  448 ASN EEE CB  
924  C CG  . ASN A 119 ? 0.080 0.281 0.272 -0.021 -0.012 -0.001 448 ASN EEE CG  
925  O OD1 . ASN A 119 ? 0.199 0.303 0.285 -0.062 -0.024 -0.011 448 ASN EEE OD1 
926  N ND2 . ASN A 119 ? 0.169 0.280 0.325 -0.010 -0.026 -0.008 448 ASN EEE ND2 
927  N N   . TYR A 120 ? 0.102 0.267 0.226 0.010  -0.020 -0.010 449 TYR EEE N   
928  C CA  . TYR A 120 ? 0.096 0.253 0.237 -0.003 -0.019 -0.006 449 TYR EEE CA  
929  C C   . TYR A 120 ? 0.119 0.244 0.217 0.006  -0.006 -0.014 449 TYR EEE C   
930  O O   . TYR A 120 ? 0.121 0.282 0.241 0.008  -0.024 -0.021 449 TYR EEE O   
931  C CB  . TYR A 120 ? 0.086 0.247 0.250 0.014  -0.022 -0.010 449 TYR EEE CB  
932  C CG  . TYR A 120 ? 0.116 0.241 0.240 -0.011 -0.030 -0.009 449 TYR EEE CG  
933  C CD1 . TYR A 120 ? 0.129 0.255 0.274 0.003  -0.047 -0.003 449 TYR EEE CD1 
934  C CD2 . TYR A 120 ? 0.109 0.248 0.240 -0.006 -0.029 -0.009 449 TYR EEE CD2 
935  C CE1 . TYR A 120 ? 0.118 0.256 0.295 0.006  -0.045 -0.002 449 TYR EEE CE1 
936  C CE2 . TYR A 120 ? 0.113 0.249 0.250 0.019  -0.048 0.000  449 TYR EEE CE2 
937  C CZ  . TYR A 120 ? 0.120 0.247 0.255 0.013  -0.048 0.007  449 TYR EEE CZ  
938  O OH  . TYR A 120 ? 0.172 0.267 0.302 -0.005 -0.043 0.028  449 TYR EEE OH  
939  N N   . ASN A 121 ? 0.110 0.256 0.236 0.006  -0.013 -0.013 450 ASN EEE N   
940  C CA  . ASN A 121 ? 0.123 0.277 0.249 0.013  0.007  -0.010 450 ASN EEE CA  
941  C C   . ASN A 121 ? 0.130 0.260 0.197 0.010  0.017  -0.007 450 ASN EEE C   
942  O O   . ASN A 121 ? 0.175 0.311 0.200 0.030  0.021  0.004  450 ASN EEE O   
943  C CB  . ASN A 121 ? 0.124 0.328 0.276 -0.001 0.056  -0.004 450 ASN EEE CB  
944  C CG  . ASN A 121 ? 0.190 0.381 0.325 0.052  0.040  -0.043 450 ASN EEE CG  
945  O OD1 . ASN A 121 ? 0.251 0.377 0.493 0.023  0.071  -0.076 450 ASN EEE OD1 
946  N ND2 . ASN A 121 ? 0.215 0.521 0.390 -0.021 0.007  -0.031 450 ASN EEE ND2 
947  N N   . TYR A 122 ? 0.126 0.242 0.188 0.009  0.006  0.000  451 TYR EEE N   
948  C CA  . TYR A 122 ? 0.118 0.227 0.218 -0.002 0.009  -0.007 451 TYR EEE CA  
949  C C   . TYR A 122 ? 0.123 0.239 0.187 -0.003 0.001  0.002  451 TYR EEE C   
950  O O   . TYR A 122 ? 0.108 0.246 0.202 0.017  -0.001 0.007  451 TYR EEE O   
951  C CB  . TYR A 122 ? 0.105 0.226 0.210 -0.016 0.001  0.001  451 TYR EEE CB  
952  C CG  . TYR A 122 ? 0.107 0.225 0.225 -0.018 -0.008 0.004  451 TYR EEE CG  
953  C CD1 . TYR A 122 ? 0.124 0.255 0.231 -0.012 -0.020 0.025  451 TYR EEE CD1 
954  C CD2 . TYR A 122 ? 0.137 0.251 0.217 -0.014 -0.017 0.019  451 TYR EEE CD2 
955  C CE1 . TYR A 122 ? 0.171 0.237 0.264 -0.025 -0.024 0.029  451 TYR EEE CE1 
956  C CE2 . TYR A 122 ? 0.116 0.259 0.237 -0.015 0.004  0.007  451 TYR EEE CE2 
957  C CZ  . TYR A 122 ? 0.125 0.265 0.234 -0.033 0.004  0.008  451 TYR EEE CZ  
958  O OH  . TYR A 122 ? 0.142 0.283 0.271 -0.054 -0.011 0.010  451 TYR EEE OH  
959  N N   . LEU A 123 ? 0.097 0.251 0.201 -0.003 0.002  0.002  452 LEU EEE N   
960  C CA  . LEU A 123 ? 0.107 0.205 0.191 -0.008 0.003  -0.003 452 LEU EEE CA  
961  C C   . LEU A 123 ? 0.118 0.209 0.184 -0.007 -0.002 -0.004 452 LEU EEE C   
962  O O   . LEU A 123 ? 0.096 0.224 0.206 -0.000 0.011  -0.004 452 LEU EEE O   
963  C CB  . LEU A 123 ? 0.123 0.238 0.200 0.004  -0.012 -0.017 452 LEU EEE CB  
964  C CG  . LEU A 123 ? 0.124 0.233 0.210 -0.001 0.001  -0.014 452 LEU EEE CG  
965  C CD1 . LEU A 123 ? 0.155 0.257 0.223 0.003  -0.005 -0.013 452 LEU EEE CD1 
966  C CD2 . LEU A 123 ? 0.133 0.250 0.223 0.022  0.009  -0.012 452 LEU EEE CD2 
967  N N   . TYR A 124 ? 0.128 0.201 0.217 -0.016 0.025  -0.005 453 TYR EEE N   
968  C CA  . TYR A 124 ? 0.125 0.208 0.199 -0.001 -0.014 -0.009 453 TYR EEE CA  
969  C C   . TYR A 124 ? 0.103 0.207 0.190 -0.001 0.009  -0.013 453 TYR EEE C   
970  O O   . TYR A 124 ? 0.086 0.218 0.227 0.013  -0.006 -0.006 453 TYR EEE O   
971  C CB  . TYR A 124 ? 0.079 0.231 0.190 0.004  -0.019 -0.009 453 TYR EEE CB  
972  C CG  . TYR A 124 ? 0.121 0.252 0.196 -0.022 -0.002 0.001  453 TYR EEE CG  
973  C CD1 . TYR A 124 ? 0.126 0.254 0.207 -0.010 0.008  0.005  453 TYR EEE CD1 
974  C CD2 . TYR A 124 ? 0.134 0.290 0.238 -0.047 -0.013 0.008  453 TYR EEE CD2 
975  C CE1 . TYR A 124 ? 0.139 0.263 0.214 -0.028 -0.002 -0.007 453 TYR EEE CE1 
976  C CE2 . TYR A 124 ? 0.151 0.312 0.238 -0.042 0.004  0.021  453 TYR EEE CE2 
977  C CZ  . TYR A 124 ? 0.159 0.288 0.221 -0.050 -0.007 0.019  453 TYR EEE CZ  
978  O OH  . TYR A 124 ? 0.199 0.319 0.237 -0.072 -0.010 0.037  453 TYR EEE OH  
979  N N   . ARG A 125 ? 0.115 0.222 0.200 0.008  -0.014 -0.015 454 ARG EEE N   
980  C CA  . ARG A 125 ? 0.102 0.229 0.187 -0.012 0.005  -0.007 454 ARG EEE CA  
981  C C   . ARG A 125 ? 0.083 0.233 0.178 0.002  -0.014 -0.006 454 ARG EEE C   
982  O O   . ARG A 125 ? 0.122 0.231 0.195 -0.022 -0.004 -0.015 454 ARG EEE O   
983  C CB  . ARG A 125 ? 0.109 0.238 0.187 -0.014 0.002  -0.004 454 ARG EEE CB  
984  C CG  . ARG A 125 ? 0.096 0.227 0.202 -0.016 0.002  -0.011 454 ARG EEE CG  
985  C CD  . ARG A 125 ? 0.123 0.243 0.189 -0.014 -0.003 -0.003 454 ARG EEE CD  
986  N NE  . ARG A 125 ? 0.114 0.238 0.195 -0.011 -0.011 -0.003 454 ARG EEE NE  
987  C CZ  . ARG A 125 ? 0.161 0.230 0.187 -0.010 0.003  0.006  454 ARG EEE CZ  
988  N NH1 . ARG A 125 ? 0.169 0.243 0.206 -0.011 0.019  -0.022 454 ARG EEE NH1 
989  N NH2 . ARG A 125 ? 0.152 0.253 0.206 -0.028 0.003  -0.006 454 ARG EEE NH2 
990  N N   . LEU A 126 ? 0.100 0.229 0.187 -0.009 0.010  -0.004 455 LEU EEE N   
991  C CA  . LEU A 126 ? 0.114 0.233 0.175 -0.029 0.001  -0.000 455 LEU EEE CA  
992  C C   . LEU A 126 ? 0.122 0.256 0.183 0.001  0.000  -0.016 455 LEU EEE C   
993  O O   . LEU A 126 ? 0.118 0.277 0.205 0.006  0.013  -0.013 455 LEU EEE O   
994  C CB  . LEU A 126 ? 0.113 0.241 0.199 -0.030 -0.010 0.008  455 LEU EEE CB  
995  C CG  . LEU A 126 ? 0.123 0.287 0.230 -0.020 0.018  0.019  455 LEU EEE CG  
996  C CD1 . LEU A 126 ? 0.121 0.312 0.234 0.004  0.035  0.027  455 LEU EEE CD1 
997  C CD2 . LEU A 126 ? 0.138 0.304 0.266 -0.016 0.032  0.039  455 LEU EEE CD2 
998  N N   . PHE A 127 ? 0.094 0.277 0.188 -0.015 0.002  -0.004 456 PHE EEE N   
999  C CA  . PHE A 127 ? 0.091 0.266 0.211 -0.002 -0.004 0.001  456 PHE EEE CA  
1000 C C   . PHE A 127 ? 0.120 0.274 0.210 -0.009 -0.011 0.007  456 PHE EEE C   
1001 O O   . PHE A 127 ? 0.120 0.286 0.201 -0.021 -0.016 0.007  456 PHE EEE O   
1002 C CB  . PHE A 127 ? 0.099 0.279 0.239 -0.035 -0.003 -0.003 456 PHE EEE CB  
1003 C CG  . PHE A 127 ? 0.145 0.265 0.238 -0.036 0.009  -0.001 456 PHE EEE CG  
1004 C CD1 . PHE A 127 ? 0.166 0.302 0.233 -0.038 0.014  0.008  456 PHE EEE CD1 
1005 C CD2 . PHE A 127 ? 0.166 0.271 0.236 -0.025 -0.010 0.006  456 PHE EEE CD2 
1006 C CE1 . PHE A 127 ? 0.192 0.282 0.266 -0.043 0.045  0.015  456 PHE EEE CE1 
1007 C CE2 . PHE A 127 ? 0.173 0.289 0.244 -0.011 0.012  0.010  456 PHE EEE CE2 
1008 C CZ  . PHE A 127 ? 0.216 0.301 0.253 -0.020 0.023  0.022  456 PHE EEE CZ  
1009 N N   . ARG A 128 ? 0.108 0.295 0.241 -0.007 0.013  0.006  457 ARG EEE N   
1010 C CA  . ARG A 128 ? 0.113 0.278 0.240 -0.009 0.003  -0.001 457 ARG EEE CA  
1011 C C   . ARG A 128 ? 0.118 0.278 0.264 0.003  -0.018 -0.009 457 ARG EEE C   
1012 O O   . ARG A 128 ? 0.122 0.319 0.287 -0.016 -0.018 -0.004 457 ARG EEE O   
1013 C CB  . ARG A 128 ? 0.132 0.276 0.266 -0.009 0.009  0.009  457 ARG EEE CB  
1014 C CG  . ARG A 128 ? 0.088 0.280 0.268 0.006  0.004  0.008  457 ARG EEE CG  
1015 C CD  . ARG A 128 ? 0.104 0.283 0.287 0.016  0.011  -0.006 457 ARG EEE CD  
1016 N NE  . ARG A 128 ? 0.095 0.293 0.310 -0.006 -0.012 0.015  457 ARG EEE NE  
1017 C CZ  . ARG A 128 ? 0.140 0.302 0.312 0.021  -0.009 0.007  457 ARG EEE CZ  
1018 N NH1 . ARG A 128 ? 0.137 0.342 0.347 0.047  -0.006 0.023  457 ARG EEE NH1 
1019 N NH2 . ARG A 128 ? 0.160 0.325 0.321 0.010  -0.037 0.020  457 ARG EEE NH2 
1020 N N   . LYS A 129 ? 0.097 0.289 0.289 0.011  -0.019 -0.014 458 LYS EEE N   
1021 C CA  . LYS A 129 ? 0.093 0.300 0.316 -0.008 -0.024 -0.035 458 LYS EEE CA  
1022 C C   . LYS A 129 ? 0.119 0.292 0.343 -0.016 -0.022 -0.041 458 LYS EEE C   
1023 O O   . LYS A 129 ? 0.114 0.378 0.437 -0.002 -0.018 -0.030 458 LYS EEE O   
1024 C CB  . LYS A 129 ? 0.152 0.340 0.313 0.023  -0.051 -0.028 458 LYS EEE CB  
1025 C CG  . LYS A 129 ? 0.269 0.360 0.331 0.026  -0.075 -0.037 458 LYS EEE CG  
1026 C CD  . LYS A 129 ? 0.401 0.460 0.343 0.020  -0.099 -0.085 458 LYS EEE CD  
1027 C CE  . LYS A 129 ? 0.452 0.554 0.469 0.043  -0.116 -0.027 458 LYS EEE CE  
1028 N NZ  . LYS A 129 ? 0.569 0.596 0.463 0.084  -0.135 -0.042 458 LYS EEE NZ  
1029 N N   . SER A 130 ? 0.128 0.297 0.338 -0.012 -0.037 -0.026 459 SER EEE N   
1030 C CA  . SER A 130 ? 0.170 0.293 0.325 -0.018 -0.052 -0.037 459 SER EEE CA  
1031 C C   . SER A 130 ? 0.117 0.273 0.336 0.004  -0.028 -0.043 459 SER EEE C   
1032 O O   . SER A 130 ? 0.121 0.288 0.306 0.012  -0.007 -0.029 459 SER EEE O   
1033 C CB  . SER A 130 ? 0.210 0.347 0.345 -0.006 -0.065 -0.023 459 SER EEE CB  
1034 O OG  . SER A 130 ? 0.294 0.364 0.342 0.008  -0.029 0.006  459 SER EEE OG  
1035 N N   . ASN A 131 ? 0.115 0.282 0.320 0.012  -0.035 -0.034 460 ASN EEE N   
1036 C CA  . ASN A 131 ? 0.103 0.294 0.326 -0.006 -0.027 -0.017 460 ASN EEE CA  
1037 C C   . ASN A 131 ? 0.125 0.292 0.309 0.015  -0.027 0.007  460 ASN EEE C   
1038 O O   . ASN A 131 ? 0.133 0.342 0.308 -0.007 -0.029 0.001  460 ASN EEE O   
1039 C CB  . ASN A 131 ? 0.143 0.311 0.314 0.004  -0.009 -0.022 460 ASN EEE CB  
1040 C CG  . ASN A 131 ? 0.177 0.323 0.321 0.011  -0.012 -0.017 460 ASN EEE CG  
1041 O OD1 . ASN A 131 ? 0.115 0.332 0.335 -0.006 0.011  -0.007 460 ASN EEE OD1 
1042 N ND2 . ASN A 131 ? 0.266 0.435 0.337 0.054  0.005  -0.040 460 ASN EEE ND2 
1043 N N   . LEU A 132 ? 0.121 0.277 0.282 0.032  -0.030 0.001  461 LEU EEE N   
1044 C CA  . LEU A 132 ? 0.140 0.263 0.281 0.014  -0.055 0.006  461 LEU EEE CA  
1045 C C   . LEU A 132 ? 0.142 0.250 0.289 -0.012 -0.037 -0.018 461 LEU EEE C   
1046 O O   . LEU A 132 ? 0.159 0.298 0.322 0.011  -0.009 -0.014 461 LEU EEE O   
1047 C CB  . LEU A 132 ? 0.134 0.277 0.277 -0.009 -0.049 -0.010 461 LEU EEE CB  
1048 C CG  . LEU A 132 ? 0.182 0.262 0.291 -0.004 -0.045 0.012  461 LEU EEE CG  
1049 C CD1 . LEU A 132 ? 0.160 0.286 0.296 -0.029 -0.023 0.014  461 LEU EEE CD1 
1050 C CD2 . LEU A 132 ? 0.175 0.292 0.294 0.011  -0.035 0.016  461 LEU EEE CD2 
1051 N N   . LYS A 133 ? 0.147 0.282 0.303 0.007  -0.018 -0.010 462 LYS EEE N   
1052 C CA  . LYS A 133 ? 0.160 0.290 0.335 0.020  -0.020 -0.013 462 LYS EEE CA  
1053 C C   . LYS A 133 ? 0.181 0.269 0.324 0.032  -0.039 -0.015 462 LYS EEE C   
1054 O O   . LYS A 133 ? 0.173 0.265 0.305 0.032  -0.018 -0.002 462 LYS EEE O   
1055 C CB  . LYS A 133 ? 0.175 0.315 0.337 0.030  -0.017 0.006  462 LYS EEE CB  
1056 C CG  . LYS A 133 ? 0.178 0.369 0.369 0.035  -0.031 0.003  462 LYS EEE CG  
1057 C CD  . LYS A 133 ? 0.315 0.472 0.384 0.051  -0.049 0.030  462 LYS EEE CD  
1058 C CE  . LYS A 133 ? 0.370 0.580 0.497 -0.010 -0.073 0.007  462 LYS EEE CE  
1059 N NZ  . LYS A 133 ? 0.560 0.675 0.537 0.003  -0.055 0.017  462 LYS EEE NZ  
1060 N N   . PRO A 134 ? 0.157 0.273 0.341 0.049  -0.051 -0.027 463 PRO EEE N   
1061 C CA  . PRO A 134 ? 0.179 0.272 0.325 0.034  -0.062 -0.026 463 PRO EEE CA  
1062 C C   . PRO A 134 ? 0.203 0.273 0.318 0.032  -0.050 -0.021 463 PRO EEE C   
1063 O O   . PRO A 134 ? 0.194 0.308 0.351 0.031  -0.052 0.005  463 PRO EEE O   
1064 C CB  . PRO A 134 ? 0.215 0.290 0.359 0.051  -0.047 -0.040 463 PRO EEE CB  
1065 C CG  . PRO A 134 ? 0.219 0.337 0.397 0.052  -0.029 -0.050 463 PRO EEE CG  
1066 C CD  . PRO A 134 ? 0.178 0.327 0.361 0.070  -0.035 -0.034 463 PRO EEE CD  
1067 N N   . PHE A 135 ? 0.185 0.257 0.295 0.014  -0.043 0.012  464 PHE EEE N   
1068 C CA  . PHE A 135 ? 0.187 0.251 0.292 0.020  -0.025 -0.003 464 PHE EEE CA  
1069 C C   . PHE A 135 ? 0.185 0.242 0.266 0.007  -0.037 0.019  464 PHE EEE C   
1070 O O   . PHE A 135 ? 0.194 0.305 0.296 0.010  -0.015 0.016  464 PHE EEE O   
1071 C CB  . PHE A 135 ? 0.205 0.251 0.309 0.030  -0.013 -0.004 464 PHE EEE CB  
1072 C CG  . PHE A 135 ? 0.209 0.263 0.328 0.004  -0.042 -0.014 464 PHE EEE CG  
1073 C CD1 . PHE A 135 ? 0.208 0.295 0.319 0.016  -0.026 -0.015 464 PHE EEE CD1 
1074 C CD2 . PHE A 135 ? 0.212 0.291 0.352 0.017  -0.077 -0.030 464 PHE EEE CD2 
1075 C CE1 . PHE A 135 ? 0.213 0.299 0.346 -0.017 -0.031 -0.030 464 PHE EEE CE1 
1076 C CE2 . PHE A 135 ? 0.231 0.304 0.366 0.049  -0.025 -0.046 464 PHE EEE CE2 
1077 C CZ  . PHE A 135 ? 0.244 0.315 0.344 -0.003 -0.060 -0.061 464 PHE EEE CZ  
1078 N N   . GLU A 136 ? 0.173 0.260 0.294 -0.007 -0.014 0.001  465 GLU EEE N   
1079 C CA  . GLU A 136 ? 0.190 0.269 0.291 0.004  -0.016 0.010  465 GLU EEE CA  
1080 C C   . GLU A 136 ? 0.167 0.247 0.254 -0.010 -0.001 0.005  465 GLU EEE C   
1081 O O   . GLU A 136 ? 0.184 0.242 0.256 0.008  0.003  -0.008 465 GLU EEE O   
1082 C CB  . GLU A 136 ? 0.195 0.301 0.307 -0.015 -0.021 -0.005 465 GLU EEE CB  
1083 C CG  . GLU A 136 ? 0.202 0.337 0.290 -0.007 -0.017 -0.012 465 GLU EEE CG  
1084 C CD  . GLU A 136 ? 0.226 0.351 0.323 -0.020 -0.042 -0.019 465 GLU EEE CD  
1085 O OE1 . GLU A 136 ? 0.245 0.346 0.286 0.003  -0.056 0.001  465 GLU EEE OE1 
1086 O OE2 . GLU A 136 ? 0.283 0.439 0.355 -0.025 -0.051 -0.048 465 GLU EEE OE2 
1087 N N   . ARG A 137 ? 0.208 0.255 0.237 0.007  -0.020 -0.003 466 ARG EEE N   
1088 C CA  . ARG A 137 ? 0.202 0.244 0.250 0.004  -0.008 -0.006 466 ARG EEE CA  
1089 C C   . ARG A 137 ? 0.191 0.243 0.244 0.012  -0.019 0.004  466 ARG EEE C   
1090 O O   . ARG A 137 ? 0.365 0.266 0.243 -0.001 -0.035 0.021  466 ARG EEE O   
1091 C CB  . ARG A 137 ? 0.251 0.258 0.230 -0.031 0.017  0.010  466 ARG EEE CB  
1092 C CG  . ARG A 137 ? 0.254 0.299 0.252 -0.023 -0.016 0.005  466 ARG EEE CG  
1093 C CD  . ARG A 137 ? 0.312 0.361 0.270 -0.021 0.027  0.029  466 ARG EEE CD  
1094 N NE  . ARG A 137 ? 0.326 0.380 0.254 -0.034 0.000  0.026  466 ARG EEE NE  
1095 C CZ  . ARG A 137 ? 0.392 0.364 0.315 -0.040 -0.040 0.033  466 ARG EEE CZ  
1096 N NH1 . ARG A 137 ? 0.417 0.398 0.335 -0.041 -0.072 -0.007 466 ARG EEE NH1 
1097 N NH2 . ARG A 137 ? 0.449 0.317 0.356 -0.045 -0.051 0.047  466 ARG EEE NH2 
1098 N N   . ASP A 138 ? 0.148 0.240 0.227 0.008  -0.029 0.004  467 ASP EEE N   
1099 C CA  . ASP A 138 ? 0.170 0.241 0.234 0.000  -0.019 -0.006 467 ASP EEE CA  
1100 C C   . ASP A 138 ? 0.170 0.245 0.215 -0.003 0.004  0.010  467 ASP EEE C   
1101 O O   . ASP A 138 ? 0.138 0.260 0.208 -0.003 0.001  0.002  467 ASP EEE O   
1102 C CB  . ASP A 138 ? 0.186 0.258 0.265 -0.011 0.006  -0.012 467 ASP EEE CB  
1103 C CG  . ASP A 138 ? 0.209 0.276 0.247 -0.015 -0.002 -0.012 467 ASP EEE CG  
1104 O OD1 . ASP A 138 ? 0.177 0.299 0.273 0.000  -0.009 -0.045 467 ASP EEE OD1 
1105 O OD2 . ASP A 138 ? 0.170 0.302 0.305 -0.017 -0.024 -0.007 467 ASP EEE OD2 
1106 N N   . ILE A 139 ? 0.191 0.235 0.195 -0.003 -0.009 -0.001 468 ILE EEE N   
1107 C CA  . ILE A 139 ? 0.145 0.237 0.185 -0.013 -0.003 0.015  468 ILE EEE CA  
1108 C C   . ILE A 139 ? 0.185 0.238 0.210 -0.003 0.003  -0.005 468 ILE EEE C   
1109 O O   . ILE A 139 ? 0.160 0.251 0.219 -0.016 0.021  0.001  468 ILE EEE O   
1110 C CB  . ILE A 139 ? 0.160 0.256 0.200 -0.025 0.017  0.010  468 ILE EEE CB  
1111 C CG1 . ILE A 139 ? 0.209 0.289 0.207 -0.031 0.011  0.019  468 ILE EEE CG1 
1112 C CG2 . ILE A 139 ? 0.216 0.282 0.198 -0.031 0.028  0.001  468 ILE EEE CG2 
1113 C CD1 . ILE A 139 ? 0.236 0.289 0.218 -0.068 0.002  0.028  468 ILE EEE CD1 
1114 N N   . SER A 140 ? 0.190 0.245 0.226 -0.020 -0.007 0.001  469 SER EEE N   
1115 C CA  . SER A 140 ? 0.185 0.244 0.226 -0.017 -0.011 -0.003 469 SER EEE CA  
1116 C C   . SER A 140 ? 0.138 0.250 0.201 -0.030 -0.003 -0.005 469 SER EEE C   
1117 O O   . SER A 140 ? 0.179 0.257 0.199 -0.025 -0.002 -0.002 469 SER EEE O   
1118 C CB  . SER A 140 ? 0.217 0.277 0.233 -0.016 -0.059 -0.003 469 SER EEE CB  
1119 O OG  . SER A 140 ? 0.212 0.283 0.261 -0.007 -0.042 -0.016 469 SER EEE OG  
1120 N N   . THR A 141 ? 0.133 0.253 0.201 -0.010 0.013  -0.016 470 THR EEE N   
1121 C CA  . THR A 141 ? 0.192 0.253 0.216 -0.023 0.013  -0.013 470 THR EEE CA  
1122 C C   . THR A 141 ? 0.198 0.257 0.206 -0.033 0.008  0.004  470 THR EEE C   
1123 O O   . THR A 141 ? 0.187 0.280 0.290 -0.039 0.004  -0.015 470 THR EEE O   
1124 C CB  . THR A 141 ? 0.195 0.275 0.268 -0.008 -0.016 0.006  470 THR EEE CB  
1125 O OG1 . THR A 141 ? 0.209 0.321 0.304 -0.013 0.018  -0.020 470 THR EEE OG1 
1126 C CG2 . THR A 141 ? 0.225 0.292 0.280 -0.010 -0.038 0.009  470 THR EEE CG2 
1127 N N   . GLU A 142 ? 0.208 0.254 0.225 -0.039 0.010  0.005  471 GLU EEE N   
1128 C CA  . GLU A 142 ? 0.217 0.268 0.240 -0.041 -0.019 0.001  471 GLU EEE CA  
1129 C C   . GLU A 142 ? 0.133 0.250 0.221 0.002  -0.027 -0.007 471 GLU EEE C   
1130 O O   . GLU A 142 ? 0.171 0.258 0.215 -0.020 -0.023 -0.014 471 GLU EEE O   
1131 C CB  . GLU A 142 ? 0.251 0.315 0.304 -0.011 -0.040 0.033  471 GLU EEE CB  
1132 C CG  . GLU A 142 ? 0.338 0.410 0.377 -0.076 -0.041 0.044  471 GLU EEE CG  
1133 C CD  . GLU A 142 ? 0.423 0.475 0.413 0.018  -0.005 0.060  471 GLU EEE CD  
1134 O OE1 . GLU A 142 ? 0.597 0.567 0.433 0.085  -0.002 0.092  471 GLU EEE OE1 
1135 O OE2 . GLU A 142 ? 0.417 0.521 0.376 0.055  -0.011 0.093  471 GLU EEE OE2 
1136 N N   . ILE A 143 ? 0.177 0.259 0.196 -0.019 -0.007 -0.009 472 ILE EEE N   
1137 C CA  . ILE A 143 ? 0.161 0.253 0.209 -0.015 -0.003 0.000  472 ILE EEE CA  
1138 C C   . ILE A 143 ? 0.162 0.246 0.193 -0.008 -0.005 0.014  472 ILE EEE C   
1139 O O   . ILE A 143 ? 0.184 0.351 0.238 -0.011 -0.041 0.017  472 ILE EEE O   
1140 C CB  . ILE A 143 ? 0.165 0.259 0.211 -0.008 0.011  -0.013 472 ILE EEE CB  
1141 C CG1 . ILE A 143 ? 0.169 0.273 0.206 -0.019 0.021  -0.038 472 ILE EEE CG1 
1142 C CG2 . ILE A 143 ? 0.215 0.272 0.240 -0.030 -0.001 0.003  472 ILE EEE CG2 
1143 C CD1 . ILE A 143 ? 0.133 0.305 0.221 0.015  0.033  -0.034 472 ILE EEE CD1 
1144 N N   . TYR A 144 ? 0.120 0.274 0.197 0.001  0.003  -0.005 473 TYR EEE N   
1145 C CA  . TYR A 144 ? 0.129 0.257 0.208 0.014  0.007  0.009  473 TYR EEE CA  
1146 C C   . TYR A 144 ? 0.137 0.260 0.221 0.006  -0.012 0.007  473 TYR EEE C   
1147 O O   . TYR A 144 ? 0.130 0.263 0.255 -0.013 0.014  0.019  473 TYR EEE O   
1148 C CB  . TYR A 144 ? 0.135 0.267 0.231 0.002  0.010  -0.011 473 TYR EEE CB  
1149 C CG  . TYR A 144 ? 0.131 0.267 0.220 0.008  -0.002 -0.020 473 TYR EEE CG  
1150 C CD1 . TYR A 144 ? 0.160 0.254 0.238 -0.007 0.023  -0.035 473 TYR EEE CD1 
1151 C CD2 . TYR A 144 ? 0.133 0.278 0.237 0.011  0.002  -0.018 473 TYR EEE CD2 
1152 C CE1 . TYR A 144 ? 0.130 0.263 0.260 0.017  -0.002 -0.035 473 TYR EEE CE1 
1153 C CE2 . TYR A 144 ? 0.128 0.284 0.248 0.009  0.004  -0.030 473 TYR EEE CE2 
1154 C CZ  . TYR A 144 ? 0.139 0.287 0.248 0.015  0.009  -0.038 473 TYR EEE CZ  
1155 O OH  . TYR A 144 ? 0.145 0.362 0.322 0.021  0.047  -0.049 473 TYR EEE OH  
1156 N N   . GLN A 145 ? 0.120 0.269 0.265 0.003  0.002  0.002  474 GLN EEE N   
1157 C CA  . GLN A 145 ? 0.159 0.272 0.290 -0.013 0.011  0.026  474 GLN EEE CA  
1158 C C   . GLN A 145 ? 0.175 0.280 0.292 -0.006 0.021  0.029  474 GLN EEE C   
1159 O O   . GLN A 145 ? 0.163 0.296 0.321 0.004  0.042  0.052  474 GLN EEE O   
1160 C CB  . GLN A 145 ? 0.166 0.296 0.297 -0.017 -0.005 0.024  474 GLN EEE CB  
1161 C CG  . GLN A 145 ? 0.166 0.314 0.383 -0.031 -0.032 0.039  474 GLN EEE CG  
1162 C CD  . GLN A 145 ? 0.194 0.350 0.412 0.004  -0.043 0.051  474 GLN EEE CD  
1163 O OE1 . GLN A 145 ? 0.240 0.402 0.402 -0.047 -0.021 0.028  474 GLN EEE OE1 
1164 N NE2 . GLN A 145 ? 0.207 0.409 0.472 -0.064 -0.033 -0.015 474 GLN EEE NE2 
1165 N N   . ALA A 146 ? 0.136 0.310 0.302 0.019  0.028  0.037  475 ALA EEE N   
1166 C CA  . ALA A 146 ? 0.143 0.291 0.289 0.000  0.029  0.024  475 ALA EEE CA  
1167 C C   . ALA A 146 ? 0.150 0.308 0.309 -0.003 0.052  -0.006 475 ALA EEE C   
1168 O O   . ALA A 146 ? 0.108 0.325 0.299 0.004  0.030  0.007  475 ALA EEE O   
1169 C CB  . ALA A 146 ? 0.126 0.327 0.294 0.015  0.037  0.031  475 ALA EEE CB  
1170 N N   . GLY A 147 ? 0.168 0.345 0.334 -0.032 0.099  -0.021 476 GLY EEE N   
1171 C CA  . GLY A 147 ? 0.226 0.331 0.398 -0.051 0.072  -0.010 476 GLY EEE CA  
1172 C C   . GLY A 147 ? 0.149 0.332 0.474 -0.032 0.058  0.030  476 GLY EEE C   
1173 O O   . GLY A 147 ? 0.147 0.328 0.642 -0.017 0.062  0.059  476 GLY EEE O   
1174 N N   . SER A 148 ? 0.230 0.315 0.447 -0.061 0.079  0.039  477 SER EEE N   
1175 C CA  . SER A 148 ? 0.164 0.347 0.515 -0.050 0.046  0.070  477 SER EEE CA  
1176 C C   . SER A 148 ? 0.230 0.385 0.450 -0.091 0.008  0.104  477 SER EEE C   
1177 O O   . SER A 148 ? 0.371 0.586 0.555 -0.126 -0.125 0.153  477 SER EEE O   
1178 C CB  . SER A 148 ? 0.167 0.401 0.562 -0.088 0.042  0.084  477 SER EEE CB  
1179 O OG  . SER A 148 ? 0.252 0.407 0.499 -0.066 -0.038 0.104  477 SER EEE OG  
1180 N N   . THR A 149 ? 0.217 0.484 0.438 -0.087 0.019  0.019  478 THR EEE N   
1181 C CA  . THR A 149 ? 0.316 0.513 0.438 -0.120 0.021  -0.017 478 THR EEE CA  
1182 C C   . THR A 149 ? 0.243 0.529 0.335 -0.094 -0.017 -0.011 478 THR EEE C   
1183 O O   . THR A 149 ? 0.206 0.500 0.292 -0.077 -0.020 -0.001 478 THR EEE O   
1184 C CB  . THR A 149 ? 0.337 0.567 0.493 -0.067 0.058  -0.015 478 THR EEE CB  
1185 O OG1 . THR A 149 ? 0.481 0.617 0.562 -0.110 0.070  0.001  478 THR EEE OG1 
1186 C CG2 . THR A 149 ? 0.392 0.601 0.514 -0.090 0.052  -0.062 478 THR EEE CG2 
1187 N N   . PRO A 150 ? 0.269 0.603 0.343 -0.095 -0.088 -0.009 479 PRO EEE N   
1188 C CA  . PRO A 150 ? 0.238 0.561 0.367 -0.050 -0.037 -0.019 479 PRO EEE CA  
1189 C C   . PRO A 150 ? 0.234 0.483 0.328 -0.067 -0.028 -0.004 479 PRO EEE C   
1190 O O   . PRO A 150 ? 0.284 0.506 0.362 -0.066 -0.022 -0.018 479 PRO EEE O   
1191 C CB  . PRO A 150 ? 0.281 0.643 0.381 -0.042 -0.061 0.008  479 PRO EEE CB  
1192 C CG  . PRO A 150 ? 0.290 0.687 0.419 -0.074 -0.082 -0.002 479 PRO EEE CG  
1193 C CD  . PRO A 150 ? 0.227 0.671 0.433 -0.088 -0.091 0.002  479 PRO EEE CD  
1194 N N   . CYS A 151 ? 0.203 0.437 0.328 -0.031 -0.011 0.005  480 CYS EEE N   
1195 C CA  . CYS A 151 ? 0.223 0.424 0.268 0.007  -0.036 0.022  480 CYS EEE CA  
1196 C C   . CYS A 151 ? 0.234 0.382 0.264 -0.025 -0.034 0.000  480 CYS EEE C   
1197 O O   . CYS A 151 ? 0.262 0.355 0.272 -0.012 -0.067 0.013  480 CYS EEE O   
1198 C CB  . CYS A 151 ? 0.267 0.411 0.262 -0.003 -0.045 0.012  480 CYS EEE CB  
1199 S SG  . CYS A 151 ? 0.236 0.450 0.313 0.031  -0.022 -0.028 480 CYS EEE SG  
1200 N N   . ASN A 152 ? 0.257 0.433 0.297 0.039  -0.027 0.011  481 ASN EEE N   
1201 C CA  . ASN A 152 ? 0.290 0.475 0.292 0.010  -0.039 0.004  481 ASN EEE CA  
1202 C C   . ASN A 152 ? 0.299 0.400 0.279 -0.011 -0.042 0.004  481 ASN EEE C   
1203 O O   . ASN A 152 ? 0.309 0.446 0.252 0.021  -0.064 0.001  481 ASN EEE O   
1204 C CB  . ASN A 152 ? 0.336 0.515 0.298 -0.002 -0.034 -0.037 481 ASN EEE CB  
1205 C CG  . ASN A 152 ? 0.341 0.559 0.374 0.001  -0.044 -0.034 481 ASN EEE CG  
1206 O OD1 . ASN A 152 ? 0.343 0.609 0.440 -0.002 -0.066 -0.023 481 ASN EEE OD1 
1207 N ND2 . ASN A 152 ? 0.329 0.604 0.468 -0.058 -0.031 -0.047 481 ASN EEE ND2 
1208 N N   . GLY A 153 ? 0.263 0.356 0.260 -0.020 -0.018 0.016  482 GLY EEE N   
1209 C CA  . GLY A 153 ? 0.262 0.358 0.267 -0.031 0.001  0.037  482 GLY EEE CA  
1210 C C   . GLY A 153 ? 0.252 0.318 0.229 -0.042 0.009  0.022  482 GLY EEE C   
1211 O O   . GLY A 153 ? 0.259 0.366 0.278 -0.056 0.042  0.017  482 GLY EEE O   
1212 N N   . VAL A 154 ? 0.201 0.302 0.220 -0.026 0.008  0.006  483 VAL EEE N   
1213 C CA  . VAL A 154 ? 0.183 0.300 0.207 -0.012 0.012  -0.007 483 VAL EEE CA  
1214 C C   . VAL A 154 ? 0.140 0.279 0.209 -0.035 0.002  -0.017 483 VAL EEE C   
1215 O O   . VAL A 154 ? 0.153 0.306 0.210 -0.022 0.023  -0.009 483 VAL EEE O   
1216 C CB  . VAL A 154 ? 0.202 0.296 0.229 -0.015 0.002  -0.013 483 VAL EEE CB  
1217 C CG1 . VAL A 154 ? 0.189 0.313 0.237 -0.001 -0.008 -0.023 483 VAL EEE CG1 
1218 C CG2 . VAL A 154 ? 0.216 0.325 0.234 -0.022 -0.029 -0.023 483 VAL EEE CG2 
1219 N N   . GLU A 155 ? 0.112 0.278 0.203 -0.014 0.008  0.006  484 GLU EEE N   
1220 C CA  . GLU A 155 ? 0.130 0.254 0.218 -0.007 -0.000 -0.002 484 GLU EEE CA  
1221 C C   . GLU A 155 ? 0.151 0.248 0.186 -0.015 -0.012 -0.001 484 GLU EEE C   
1222 O O   . GLU A 155 ? 0.176 0.258 0.223 0.010  -0.014 0.005  484 GLU EEE O   
1223 C CB  . GLU A 155 ? 0.127 0.268 0.264 -0.006 -0.012 -0.008 484 GLU EEE CB  
1224 C CG  . GLU A 155 ? 0.150 0.280 0.271 -0.004 0.006  -0.023 484 GLU EEE CG  
1225 C CD  . GLU A 155 ? 0.151 0.284 0.257 0.010  -0.023 -0.022 484 GLU EEE CD  
1226 O OE1 . GLU A 155 ? 0.204 0.307 0.276 -0.004 -0.011 -0.018 484 GLU EEE OE1 
1227 O OE2 . GLU A 155 ? 0.135 0.285 0.258 -0.008 -0.016 -0.017 484 GLU EEE OE2 
1228 N N   . GLY A 156 ? 0.132 0.260 0.217 0.012  -0.006 -0.014 485 GLY EEE N   
1229 C CA  . GLY A 156 ? 0.119 0.263 0.216 0.006  -0.009 -0.012 485 GLY EEE CA  
1230 C C   . GLY A 156 ? 0.134 0.256 0.203 -0.022 -0.002 -0.007 485 GLY EEE C   
1231 O O   . GLY A 156 ? 0.115 0.243 0.260 -0.021 0.016  -0.004 485 GLY EEE O   
1232 N N   . PHE A 157 ? 0.160 0.261 0.231 -0.021 0.018  0.001  486 PHE EEE N   
1233 C CA  . PHE A 157 ? 0.174 0.260 0.231 -0.009 0.032  0.014  486 PHE EEE CA  
1234 C C   . PHE A 157 ? 0.154 0.244 0.248 -0.031 0.013  0.012  486 PHE EEE C   
1235 O O   . PHE A 157 ? 0.148 0.291 0.261 -0.032 0.007  0.013  486 PHE EEE O   
1236 C CB  . PHE A 157 ? 0.178 0.273 0.232 -0.019 0.008  0.009  486 PHE EEE CB  
1237 C CG  . PHE A 157 ? 0.168 0.280 0.260 -0.013 0.026  0.008  486 PHE EEE CG  
1238 C CD1 . PHE A 157 ? 0.199 0.344 0.274 -0.040 0.027  0.039  486 PHE EEE CD1 
1239 C CD2 . PHE A 157 ? 0.196 0.347 0.303 -0.033 -0.012 0.014  486 PHE EEE CD2 
1240 C CE1 . PHE A 157 ? 0.188 0.363 0.278 -0.020 0.025  0.038  486 PHE EEE CE1 
1241 C CE2 . PHE A 157 ? 0.169 0.361 0.323 -0.018 0.002  0.025  486 PHE EEE CE2 
1242 C CZ  . PHE A 157 ? 0.169 0.384 0.305 -0.020 0.045  0.041  486 PHE EEE CZ  
1243 N N   . ASN A 158 ? 0.151 0.269 0.251 -0.028 0.022  0.014  487 ASN EEE N   
1244 C CA  . ASN A 158 ? 0.141 0.269 0.275 -0.023 0.015  0.027  487 ASN EEE CA  
1245 C C   . ASN A 158 ? 0.153 0.251 0.264 0.003  0.046  0.011  487 ASN EEE C   
1246 O O   . ASN A 158 ? 0.129 0.284 0.281 0.005  0.031  0.032  487 ASN EEE O   
1247 C CB  . ASN A 158 ? 0.151 0.324 0.314 -0.050 0.014  0.035  487 ASN EEE CB  
1248 C CG  . ASN A 158 ? 0.228 0.360 0.315 -0.042 0.038  0.033  487 ASN EEE CG  
1249 O OD1 . ASN A 158 ? 0.301 0.418 0.300 -0.020 0.035  0.036  487 ASN EEE OD1 
1250 N ND2 . ASN A 158 ? 0.201 0.428 0.417 -0.031 0.024  0.033  487 ASN EEE ND2 
1251 N N   . CYS A 159 ? 0.124 0.252 0.239 -0.030 0.022  0.006  488 CYS EEE N   
1252 C CA  . CYS A 159 ? 0.148 0.263 0.237 -0.037 0.001  0.009  488 CYS EEE CA  
1253 C C   . CYS A 159 ? 0.140 0.242 0.219 -0.021 0.012  -0.011 488 CYS EEE C   
1254 O O   . CYS A 159 ? 0.161 0.225 0.230 -0.004 -0.003 -0.005 488 CYS EEE O   
1255 C CB  . CYS A 159 ? 0.115 0.268 0.235 -0.057 -0.001 0.003  488 CYS EEE CB  
1256 S SG  . CYS A 159 ? 0.130 0.343 0.268 -0.037 -0.028 0.004  488 CYS EEE SG  
1257 N N   . TYR A 160 ? 0.126 0.241 0.193 -0.003 -0.005 -0.017 489 TYR EEE N   
1258 C CA  . TYR A 160 ? 0.133 0.253 0.203 -0.006 -0.013 -0.013 489 TYR EEE CA  
1259 C C   . TYR A 160 ? 0.149 0.242 0.206 0.001  -0.005 -0.006 489 TYR EEE C   
1260 O O   . TYR A 160 ? 0.146 0.241 0.220 -0.018 -0.002 -0.002 489 TYR EEE O   
1261 C CB  . TYR A 160 ? 0.198 0.287 0.183 -0.017 -0.013 -0.012 489 TYR EEE CB  
1262 C CG  . TYR A 160 ? 0.260 0.315 0.194 -0.027 -0.008 0.007  489 TYR EEE CG  
1263 C CD1 . TYR A 160 ? 0.368 0.345 0.280 -0.032 0.065  0.042  489 TYR EEE CD1 
1264 C CD2 . TYR A 160 ? 0.179 0.394 0.228 -0.026 -0.022 0.045  489 TYR EEE CD2 
1265 C CE1 . TYR A 160 ? 0.415 0.377 0.326 -0.062 0.062  0.065  489 TYR EEE CE1 
1266 C CE2 . TYR A 160 ? 0.243 0.427 0.253 -0.067 0.016  0.051  489 TYR EEE CE2 
1267 C CZ  . TYR A 160 ? 0.322 0.411 0.282 -0.104 0.044  0.054  489 TYR EEE CZ  
1268 O OH  . TYR A 160 ? 0.583 0.547 0.325 -0.205 0.091  0.112  489 TYR EEE OH  
1269 N N   . PHE A 161 ? 0.151 0.233 0.208 0.006  -0.026 -0.004 490 PHE EEE N   
1270 C CA  . PHE A 161 ? 0.145 0.237 0.195 0.004  -0.009 -0.015 490 PHE EEE CA  
1271 C C   . PHE A 161 ? 0.100 0.222 0.186 0.003  -0.007 -0.005 490 PHE EEE C   
1272 O O   . PHE A 161 ? 0.156 0.243 0.198 -0.026 -0.016 0.017  490 PHE EEE O   
1273 C CB  . PHE A 161 ? 0.129 0.260 0.200 0.004  -0.017 -0.023 490 PHE EEE CB  
1274 C CG  . PHE A 161 ? 0.166 0.246 0.209 0.005  -0.001 -0.003 490 PHE EEE CG  
1275 C CD1 . PHE A 161 ? 0.145 0.261 0.221 -0.011 -0.005 -0.016 490 PHE EEE CD1 
1276 C CD2 . PHE A 161 ? 0.168 0.249 0.213 -0.009 0.025  -0.010 490 PHE EEE CD2 
1277 C CE1 . PHE A 161 ? 0.204 0.280 0.235 -0.014 0.039  -0.012 490 PHE EEE CE1 
1278 C CE2 . PHE A 161 ? 0.164 0.258 0.241 -0.025 0.009  -0.012 490 PHE EEE CE2 
1279 C CZ  . PHE A 161 ? 0.185 0.256 0.252 -0.024 0.042  0.003  490 PHE EEE CZ  
1280 N N   . PRO A 162 ? 0.128 0.227 0.194 -0.002 -0.000 -0.007 491 PRO EEE N   
1281 C CA  . PRO A 162 ? 0.153 0.223 0.185 -0.019 0.004  -0.015 491 PRO EEE CA  
1282 C C   . PRO A 162 ? 0.120 0.235 0.195 -0.003 0.003  -0.015 491 PRO EEE C   
1283 O O   . PRO A 162 ? 0.105 0.258 0.202 -0.003 -0.010 -0.022 491 PRO EEE O   
1284 C CB  . PRO A 162 ? 0.116 0.243 0.189 -0.001 -0.012 -0.021 491 PRO EEE CB  
1285 C CG  . PRO A 162 ? 0.109 0.255 0.183 -0.018 -0.010 -0.011 491 PRO EEE CG  
1286 C CD  . PRO A 162 ? 0.123 0.260 0.187 -0.007 0.003  -0.017 491 PRO EEE CD  
1287 N N   . LEU A 163 ? 0.121 0.238 0.178 -0.000 -0.003 0.003  492 LEU EEE N   
1288 C CA  . LEU A 163 ? 0.145 0.225 0.182 -0.025 -0.006 0.008  492 LEU EEE CA  
1289 C C   . LEU A 163 ? 0.099 0.223 0.193 -0.022 -0.002 0.001  492 LEU EEE C   
1290 O O   . LEU A 163 ? 0.143 0.243 0.196 -0.003 0.006  -0.014 492 LEU EEE O   
1291 C CB  . LEU A 163 ? 0.143 0.229 0.200 -0.025 0.006  0.015  492 LEU EEE CB  
1292 C CG  . LEU A 163 ? 0.154 0.234 0.194 -0.023 0.013  0.018  492 LEU EEE CG  
1293 C CD1 . LEU A 163 ? 0.151 0.268 0.201 0.007  0.030  0.017  492 LEU EEE CD1 
1294 C CD2 . LEU A 163 ? 0.165 0.248 0.227 -0.000 -0.003 0.017  492 LEU EEE CD2 
1295 N N   . GLN A 164 ? 0.121 0.226 0.180 -0.016 0.008  -0.005 493 GLN EEE N   
1296 C CA  . GLN A 164 ? 0.112 0.232 0.196 -0.008 -0.004 0.005  493 GLN EEE CA  
1297 C C   . GLN A 164 ? 0.113 0.202 0.211 -0.001 -0.003 -0.001 493 GLN EEE C   
1298 O O   . GLN A 164 ? 0.102 0.208 0.219 0.012  -0.014 0.000  493 GLN EEE O   
1299 C CB  . GLN A 164 ? 0.110 0.262 0.207 -0.016 -0.019 0.025  493 GLN EEE CB  
1300 C CG  . GLN A 164 ? 0.114 0.277 0.227 -0.021 -0.032 0.024  493 GLN EEE CG  
1301 C CD  . GLN A 164 ? 0.139 0.274 0.222 -0.030 -0.027 0.026  493 GLN EEE CD  
1302 O OE1 . GLN A 164 ? 0.170 0.327 0.242 0.001  -0.016 0.051  493 GLN EEE OE1 
1303 N NE2 . GLN A 164 ? 0.151 0.258 0.211 -0.009 -0.019 0.007  493 GLN EEE NE2 
1304 N N   . SER A 165 ? 0.120 0.208 0.201 0.001  -0.014 -0.008 494 SER EEE N   
1305 C CA  . SER A 165 ? 0.135 0.210 0.195 -0.014 -0.011 -0.017 494 SER EEE CA  
1306 C C   . SER A 165 ? 0.113 0.210 0.191 0.009  -0.022 -0.005 494 SER EEE C   
1307 O O   . SER A 165 ? 0.168 0.221 0.191 -0.014 -0.017 0.002  494 SER EEE O   
1308 C CB  . SER A 165 ? 0.136 0.218 0.217 -0.000 -0.012 -0.021 494 SER EEE CB  
1309 O OG  . SER A 165 ? 0.132 0.254 0.201 -0.005 -0.010 -0.011 494 SER EEE OG  
1310 N N   . TYR A 166 ? 0.098 0.219 0.192 0.005  0.001  -0.007 495 TYR EEE N   
1311 C CA  . TYR A 166 ? 0.134 0.233 0.190 -0.003 0.011  -0.012 495 TYR EEE CA  
1312 C C   . TYR A 166 ? 0.158 0.242 0.214 -0.000 0.010  -0.001 495 TYR EEE C   
1313 O O   . TYR A 166 ? 0.150 0.265 0.208 -0.003 -0.008 0.010  495 TYR EEE O   
1314 C CB  . TYR A 166 ? 0.125 0.233 0.194 -0.000 -0.002 -0.001 495 TYR EEE CB  
1315 C CG  . TYR A 166 ? 0.122 0.232 0.184 0.007  -0.005 -0.003 495 TYR EEE CG  
1316 C CD1 . TYR A 166 ? 0.152 0.240 0.177 0.005  0.014  0.035  495 TYR EEE CD1 
1317 C CD2 . TYR A 166 ? 0.100 0.253 0.218 -0.008 -0.009 0.012  495 TYR EEE CD2 
1318 C CE1 . TYR A 166 ? 0.137 0.250 0.192 0.012  0.002  0.021  495 TYR EEE CE1 
1319 C CE2 . TYR A 166 ? 0.115 0.248 0.216 -0.005 -0.001 0.027  495 TYR EEE CE2 
1320 C CZ  . TYR A 166 ? 0.119 0.235 0.189 0.003  -0.015 0.018  495 TYR EEE CZ  
1321 O OH  . TYR A 166 ? 0.122 0.237 0.248 0.006  -0.012 0.007  495 TYR EEE OH  
1322 N N   . GLY A 167 ? 0.151 0.251 0.210 -0.004 0.004  -0.004 496 GLY EEE N   
1323 C CA  . GLY A 167 ? 0.200 0.232 0.208 -0.002 -0.002 0.006  496 GLY EEE CA  
1324 C C   . GLY A 167 ? 0.194 0.217 0.226 -0.015 -0.006 -0.003 496 GLY EEE C   
1325 O O   . GLY A 167 ? 0.182 0.237 0.235 -0.006 -0.042 0.018  496 GLY EEE O   
1326 N N   . PHE A 168 ? 0.187 0.212 0.227 -0.006 -0.000 -0.013 497 PHE EEE N   
1327 C CA  . PHE A 168 ? 0.178 0.235 0.204 0.012  -0.006 0.000  497 PHE EEE CA  
1328 C C   . PHE A 168 ? 0.200 0.239 0.215 0.022  -0.017 -0.008 497 PHE EEE C   
1329 O O   . PHE A 168 ? 0.213 0.301 0.237 0.032  0.005  0.010  497 PHE EEE O   
1330 C CB  . PHE A 168 ? 0.144 0.242 0.217 0.008  -0.006 0.003  497 PHE EEE CB  
1331 C CG  . PHE A 168 ? 0.125 0.237 0.198 -0.002 -0.012 -0.004 497 PHE EEE CG  
1332 C CD1 . PHE A 168 ? 0.138 0.245 0.175 0.004  0.002  0.024  497 PHE EEE CD1 
1333 C CD2 . PHE A 168 ? 0.077 0.252 0.215 -0.017 -0.001 0.004  497 PHE EEE CD2 
1334 C CE1 . PHE A 168 ? 0.098 0.251 0.192 0.010  0.003  -0.001 497 PHE EEE CE1 
1335 C CE2 . PHE A 168 ? 0.131 0.252 0.175 -0.004 -0.010 0.024  497 PHE EEE CE2 
1336 C CZ  . PHE A 168 ? 0.102 0.269 0.194 -0.006 -0.015 0.009  497 PHE EEE CZ  
1337 N N   . GLN A 169 ? 0.178 0.270 0.219 0.002  -0.026 0.004  498 GLN EEE N   
1338 C CA  . GLN A 169 ? 0.250 0.267 0.237 0.011  -0.047 0.013  498 GLN EEE CA  
1339 C C   . GLN A 169 ? 0.215 0.280 0.276 0.005  -0.086 0.002  498 GLN EEE C   
1340 O O   . GLN A 169 ? 0.247 0.315 0.239 0.009  -0.063 0.010  498 GLN EEE O   
1341 C CB  . GLN A 169 ? 0.210 0.270 0.262 0.008  -0.053 0.027  498 GLN EEE CB  
1342 C CG  . GLN A 169 ? 0.187 0.290 0.268 -0.015 -0.028 0.006  498 GLN EEE CG  
1343 C CD  . GLN A 169 ? 0.199 0.278 0.316 -0.010 -0.027 -0.008 498 GLN EEE CD  
1344 O OE1 . GLN A 169 ? 0.228 0.284 0.353 -0.020 -0.076 -0.020 498 GLN EEE OE1 
1345 N NE2 . GLN A 169 ? 0.144 0.347 0.326 -0.006 -0.032 -0.034 498 GLN EEE NE2 
1346 N N   . PRO A 170 ? 0.215 0.331 0.294 -0.008 -0.098 -0.011 499 PRO EEE N   
1347 C CA  . PRO A 170 ? 0.302 0.344 0.303 -0.008 -0.094 -0.027 499 PRO EEE CA  
1348 C C   . PRO A 170 ? 0.317 0.361 0.309 0.002  -0.105 -0.003 499 PRO EEE C   
1349 O O   . PRO A 170 ? 0.451 0.334 0.318 -0.011 -0.082 0.011  499 PRO EEE O   
1350 C CB  . PRO A 170 ? 0.292 0.400 0.336 -0.042 -0.089 -0.019 499 PRO EEE CB  
1351 C CG  . PRO A 170 ? 0.228 0.397 0.332 -0.013 -0.112 -0.019 499 PRO EEE CG  
1352 C CD  . PRO A 170 ? 0.243 0.325 0.295 -0.025 -0.103 -0.026 499 PRO EEE CD  
1353 N N   . THR A 171 ? 0.319 0.344 0.322 0.044  -0.089 0.016  500 THR EEE N   
1354 C CA  . THR A 171 ? 0.342 0.377 0.324 0.059  -0.065 0.026  500 THR EEE CA  
1355 C C   . THR A 171 ? 0.345 0.362 0.260 0.034  -0.066 0.013  500 THR EEE C   
1356 O O   . THR A 171 ? 0.334 0.421 0.263 0.033  -0.062 0.020  500 THR EEE O   
1357 C CB  . THR A 171 ? 0.449 0.388 0.325 0.030  -0.026 0.065  500 THR EEE CB  
1358 O OG1 . THR A 171 ? 0.479 0.371 0.373 0.041  -0.036 0.028  500 THR EEE OG1 
1359 C CG2 . THR A 171 ? 0.444 0.431 0.337 0.032  -0.035 0.047  500 THR EEE CG2 
1360 N N   . ASN A 172 ? 0.287 0.330 0.270 0.033  -0.052 0.008  501 ASN EEE N   
1361 C CA  . ASN A 172 ? 0.290 0.331 0.264 0.029  -0.071 -0.003 501 ASN EEE CA  
1362 C C   . ASN A 172 ? 0.229 0.309 0.262 0.023  -0.040 0.019  501 ASN EEE C   
1363 O O   . ASN A 172 ? 0.256 0.339 0.275 0.005  -0.039 0.005  501 ASN EEE O   
1364 C CB  . ASN A 172 ? 0.293 0.296 0.250 0.019  -0.076 -0.005 501 ASN EEE CB  
1365 C CG  . ASN A 172 ? 0.312 0.304 0.251 -0.018 -0.094 -0.001 501 ASN EEE CG  
1366 O OD1 . ASN A 172 ? 0.406 0.351 0.271 -0.041 -0.076 0.028  501 ASN EEE OD1 
1367 N ND2 . ASN A 172 ? 0.258 0.356 0.251 0.000  -0.089 -0.003 501 ASN EEE ND2 
1368 N N   . GLY A 173 ? 0.215 0.316 0.240 -0.002 -0.029 0.019  502 GLY EEE N   
1369 C CA  . GLY A 173 ? 0.197 0.329 0.269 -0.001 -0.017 0.018  502 GLY EEE CA  
1370 C C   . GLY A 173 ? 0.154 0.311 0.240 0.006  0.004  0.003  502 GLY EEE C   
1371 O O   . GLY A 173 ? 0.183 0.308 0.229 0.013  -0.002 0.020  502 GLY EEE O   
1372 N N   . VAL A 174 ? 0.163 0.331 0.234 0.003  0.032  -0.013 503 VAL EEE N   
1373 C CA  . VAL A 174 ? 0.168 0.325 0.248 0.001  0.040  -0.007 503 VAL EEE CA  
1374 C C   . VAL A 174 ? 0.189 0.299 0.232 -0.001 0.035  -0.009 503 VAL EEE C   
1375 O O   . VAL A 174 ? 0.200 0.316 0.230 0.002  0.020  -0.003 503 VAL EEE O   
1376 C CB  . VAL A 174 ? 0.234 0.358 0.274 0.005  0.019  -0.032 503 VAL EEE CB  
1377 C CG1 . VAL A 174 ? 0.240 0.362 0.243 0.019  0.021  -0.047 503 VAL EEE CG1 
1378 C CG2 . VAL A 174 ? 0.331 0.392 0.357 -0.016 0.027  -0.013 503 VAL EEE CG2 
1379 N N   . GLY A 175 ? 0.174 0.291 0.197 0.004  0.011  -0.004 504 GLY EEE N   
1380 C CA  . GLY A 175 ? 0.179 0.296 0.208 0.008  0.009  0.006  504 GLY EEE CA  
1381 C C   . GLY A 175 ? 0.171 0.274 0.210 0.010  0.035  0.018  504 GLY EEE C   
1382 O O   . GLY A 175 ? 0.155 0.337 0.237 0.053  0.018  0.003  504 GLY EEE O   
1383 N N   . TYR A 176 ? 0.164 0.268 0.209 0.005  0.009  0.007  505 TYR EEE N   
1384 C CA  . TYR A 176 ? 0.162 0.293 0.215 0.015  0.014  -0.002 505 TYR EEE CA  
1385 C C   . TYR A 176 ? 0.177 0.289 0.209 -0.002 0.006  -0.010 505 TYR EEE C   
1386 O O   . TYR A 176 ? 0.115 0.377 0.205 -0.025 -0.003 -0.033 505 TYR EEE O   
1387 C CB  . TYR A 176 ? 0.227 0.310 0.239 0.022  -0.008 0.006  505 TYR EEE CB  
1388 C CG  . TYR A 176 ? 0.268 0.353 0.247 -0.010 0.009  -0.009 505 TYR EEE CG  
1389 C CD1 . TYR A 176 ? 0.218 0.367 0.216 -0.021 0.048  -0.031 505 TYR EEE CD1 
1390 C CD2 . TYR A 176 ? 0.254 0.399 0.255 -0.003 -0.001 0.024  505 TYR EEE CD2 
1391 C CE1 . TYR A 176 ? 0.306 0.337 0.264 -0.034 0.075  -0.009 505 TYR EEE CE1 
1392 C CE2 . TYR A 176 ? 0.281 0.379 0.278 0.001  0.032  0.011  505 TYR EEE CE2 
1393 C CZ  . TYR A 176 ? 0.284 0.378 0.300 -0.026 0.052  0.016  505 TYR EEE CZ  
1394 O OH  . TYR A 176 ? 0.380 0.375 0.371 -0.035 0.119  0.040  505 TYR EEE OH  
1395 N N   . GLN A 177 ? 0.143 0.295 0.191 -0.001 0.008  0.005  506 GLN EEE N   
1396 C CA  . GLN A 177 ? 0.128 0.271 0.195 0.005  0.002  0.011  506 GLN EEE CA  
1397 C C   . GLN A 177 ? 0.144 0.277 0.192 -0.005 -0.012 0.009  506 GLN EEE C   
1398 O O   . GLN A 177 ? 0.168 0.287 0.199 0.014  -0.018 0.014  506 GLN EEE O   
1399 C CB  . GLN A 177 ? 0.145 0.277 0.203 0.001  0.005  -0.000 506 GLN EEE CB  
1400 C CG  . GLN A 177 ? 0.154 0.302 0.214 0.007  -0.008 0.012  506 GLN EEE CG  
1401 C CD  . GLN A 177 ? 0.139 0.277 0.206 0.034  0.005  -0.002 506 GLN EEE CD  
1402 O OE1 . GLN A 177 ? 0.143 0.304 0.241 0.028  -0.015 0.000  506 GLN EEE OE1 
1403 N NE2 . GLN A 177 ? 0.126 0.320 0.221 0.020  0.014  0.022  506 GLN EEE NE2 
1404 N N   . PRO A 178 ? 0.115 0.257 0.190 0.017  -0.026 0.003  507 PRO EEE N   
1405 C CA  . PRO A 178 ? 0.074 0.254 0.191 0.001  -0.034 -0.005 507 PRO EEE CA  
1406 C C   . PRO A 178 ? 0.090 0.244 0.205 -0.006 -0.020 0.007  507 PRO EEE C   
1407 O O   . PRO A 178 ? 0.114 0.268 0.246 -0.006 -0.056 -0.012 507 PRO EEE O   
1408 C CB  . PRO A 178 ? 0.113 0.265 0.189 0.011  -0.019 -0.006 507 PRO EEE CB  
1409 C CG  . PRO A 178 ? 0.136 0.271 0.189 0.007  -0.024 0.014  507 PRO EEE CG  
1410 C CD  . PRO A 178 ? 0.117 0.256 0.181 0.020  -0.024 0.009  507 PRO EEE CD  
1411 N N   . TYR A 179 ? 0.094 0.253 0.226 -0.000 -0.034 0.005  508 TYR EEE N   
1412 C CA  . TYR A 179 ? 0.101 0.263 0.243 0.013  -0.016 0.002  508 TYR EEE CA  
1413 C C   . TYR A 179 ? 0.126 0.253 0.218 -0.001 0.013  -0.022 508 TYR EEE C   
1414 O O   . TYR A 179 ? 0.149 0.257 0.236 -0.000 -0.019 -0.007 508 TYR EEE O   
1415 C CB  . TYR A 179 ? 0.135 0.278 0.247 0.025  0.003  -0.013 508 TYR EEE CB  
1416 C CG  . TYR A 179 ? 0.155 0.296 0.252 0.036  -0.016 -0.011 508 TYR EEE CG  
1417 C CD1 . TYR A 179 ? 0.119 0.300 0.229 0.022  0.005  -0.006 508 TYR EEE CD1 
1418 C CD2 . TYR A 179 ? 0.195 0.293 0.230 0.038  -0.015 -0.002 508 TYR EEE CD2 
1419 C CE1 . TYR A 179 ? 0.196 0.325 0.235 0.042  -0.006 -0.003 508 TYR EEE CE1 
1420 C CE2 . TYR A 179 ? 0.194 0.331 0.216 0.051  -0.007 -0.029 508 TYR EEE CE2 
1421 C CZ  . TYR A 179 ? 0.210 0.328 0.228 0.041  -0.005 -0.018 508 TYR EEE CZ  
1422 O OH  . TYR A 179 ? 0.275 0.388 0.235 0.071  -0.010 -0.021 508 TYR EEE OH  
1423 N N   . ARG A 180 ? 0.115 0.234 0.257 0.004  -0.034 -0.008 509 ARG EEE N   
1424 C CA  . ARG A 180 ? 0.120 0.236 0.231 -0.010 -0.030 -0.021 509 ARG EEE CA  
1425 C C   . ARG A 180 ? 0.153 0.237 0.238 0.006  -0.040 -0.020 509 ARG EEE C   
1426 O O   . ARG A 180 ? 0.171 0.252 0.246 0.034  -0.049 -0.019 509 ARG EEE O   
1427 C CB  . ARG A 180 ? 0.122 0.257 0.265 -0.022 -0.039 -0.009 509 ARG EEE CB  
1428 C CG  . ARG A 180 ? 0.119 0.256 0.271 -0.021 -0.038 -0.009 509 ARG EEE CG  
1429 C CD  . ARG A 180 ? 0.136 0.254 0.304 -0.044 -0.018 -0.007 509 ARG EEE CD  
1430 N NE  . ARG A 180 ? 0.124 0.259 0.289 -0.022 -0.018 -0.003 509 ARG EEE NE  
1431 C CZ  . ARG A 180 ? 0.146 0.299 0.326 -0.040 0.007  -0.007 509 ARG EEE CZ  
1432 N NH1 . ARG A 180 ? 0.187 0.307 0.436 -0.040 0.069  -0.011 509 ARG EEE NH1 
1433 N NH2 . ARG A 180 ? 0.131 0.308 0.365 -0.027 -0.005 0.002  509 ARG EEE NH2 
1434 N N   . VAL A 181 ? 0.172 0.243 0.227 0.002  -0.038 -0.027 510 VAL EEE N   
1435 C CA  . VAL A 181 ? 0.141 0.248 0.240 -0.013 -0.044 -0.025 510 VAL EEE CA  
1436 C C   . VAL A 181 ? 0.101 0.250 0.243 -0.003 -0.047 -0.022 510 VAL EEE C   
1437 O O   . VAL A 181 ? 0.109 0.252 0.242 0.006  -0.030 -0.012 510 VAL EEE O   
1438 C CB  . VAL A 181 ? 0.133 0.244 0.252 -0.012 -0.037 -0.029 510 VAL EEE CB  
1439 C CG1 . VAL A 181 ? 0.162 0.259 0.288 0.006  -0.051 -0.024 510 VAL EEE CG1 
1440 C CG2 . VAL A 181 ? 0.149 0.256 0.279 0.006  -0.030 -0.011 510 VAL EEE CG2 
1441 N N   . VAL A 182 ? 0.134 0.243 0.270 0.006  -0.031 -0.025 511 VAL EEE N   
1442 C CA  . VAL A 182 ? 0.136 0.252 0.275 -0.002 -0.020 -0.016 511 VAL EEE CA  
1443 C C   . VAL A 182 ? 0.150 0.255 0.285 0.009  -0.031 -0.020 511 VAL EEE C   
1444 O O   . VAL A 182 ? 0.154 0.279 0.287 0.018  -0.042 -0.020 511 VAL EEE O   
1445 C CB  . VAL A 182 ? 0.148 0.264 0.313 -0.021 -0.010 -0.010 511 VAL EEE CB  
1446 C CG1 . VAL A 182 ? 0.146 0.275 0.337 -0.051 -0.022 -0.003 511 VAL EEE CG1 
1447 C CG2 . VAL A 182 ? 0.174 0.268 0.308 -0.001 -0.008 -0.013 511 VAL EEE CG2 
1448 N N   . VAL A 183 ? 0.158 0.231 0.268 0.012  -0.017 0.001  512 VAL EEE N   
1449 C CA  . VAL A 183 ? 0.149 0.242 0.291 0.017  -0.042 -0.015 512 VAL EEE CA  
1450 C C   . VAL A 183 ? 0.127 0.259 0.284 0.013  -0.043 -0.010 512 VAL EEE C   
1451 O O   . VAL A 183 ? 0.195 0.245 0.299 0.012  -0.022 -0.009 512 VAL EEE O   
1452 C CB  . VAL A 183 ? 0.152 0.245 0.283 0.012  -0.029 -0.020 512 VAL EEE CB  
1453 C CG1 . VAL A 183 ? 0.158 0.241 0.316 0.014  -0.034 0.002  512 VAL EEE CG1 
1454 C CG2 . VAL A 183 ? 0.149 0.245 0.290 0.011  -0.050 -0.010 512 VAL EEE CG2 
1455 N N   . LEU A 184 ? 0.142 0.272 0.297 0.002  -0.053 -0.027 513 LEU EEE N   
1456 C CA  . LEU A 184 ? 0.171 0.256 0.314 0.018  -0.043 -0.021 513 LEU EEE CA  
1457 C C   . LEU A 184 ? 0.190 0.236 0.333 0.027  -0.045 -0.013 513 LEU EEE C   
1458 O O   . LEU A 184 ? 0.210 0.329 0.338 0.023  -0.053 -0.028 513 LEU EEE O   
1459 C CB  . LEU A 184 ? 0.216 0.250 0.322 0.010  -0.041 -0.028 513 LEU EEE CB  
1460 C CG  . LEU A 184 ? 0.221 0.259 0.350 0.011  -0.045 -0.019 513 LEU EEE CG  
1461 C CD1 . LEU A 184 ? 0.244 0.276 0.361 0.012  -0.050 -0.046 513 LEU EEE CD1 
1462 C CD2 . LEU A 184 ? 0.218 0.265 0.351 0.009  -0.040 0.002  513 LEU EEE CD2 
1463 N N   . SER A 185 ? 0.197 0.244 0.325 0.028  -0.053 -0.028 514 SER EEE N   
1464 C CA  . SER A 185 ? 0.230 0.258 0.360 0.046  -0.055 0.002  514 SER EEE CA  
1465 C C   . SER A 185 ? 0.238 0.280 0.314 0.023  -0.053 0.013  514 SER EEE C   
1466 O O   . SER A 185 ? 0.234 0.268 0.359 0.053  -0.017 0.006  514 SER EEE O   
1467 C CB  . SER A 185 ? 0.259 0.299 0.386 0.045  -0.085 -0.009 514 SER EEE CB  
1468 O OG  . SER A 185 ? 0.345 0.349 0.475 0.010  -0.042 -0.017 514 SER EEE OG  
1469 N N   . PHE A 186 ? 0.230 0.270 0.376 0.011  -0.041 0.008  515 PHE EEE N   
1470 C CA  . PHE A 186 ? 0.244 0.279 0.393 -0.002 -0.013 0.007  515 PHE EEE CA  
1471 C C   . PHE A 186 ? 0.256 0.253 0.393 -0.017 -0.009 0.023  515 PHE EEE C   
1472 O O   . PHE A 186 ? 0.229 0.304 0.483 0.041  0.002  0.013  515 PHE EEE O   
1473 C CB  . PHE A 186 ? 0.286 0.297 0.380 0.016  -0.010 0.004  515 PHE EEE CB  
1474 C CG  . PHE A 186 ? 0.259 0.301 0.393 -0.009 -0.021 0.004  515 PHE EEE CG  
1475 C CD1 . PHE A 186 ? 0.286 0.419 0.407 0.035  -0.007 0.032  515 PHE EEE CD1 
1476 C CD2 . PHE A 186 ? 0.305 0.354 0.404 0.004  -0.043 0.017  515 PHE EEE CD2 
1477 C CE1 . PHE A 186 ? 0.323 0.439 0.425 0.046  -0.039 0.006  515 PHE EEE CE1 
1478 C CE2 . PHE A 186 ? 0.290 0.399 0.404 0.002  -0.060 -0.004 515 PHE EEE CE2 
1479 C CZ  . PHE A 186 ? 0.314 0.376 0.404 0.033  -0.027 -0.031 515 PHE EEE CZ  
1480 N N   . GLU A 187 ? 0.259 0.265 0.391 0.008  -0.019 0.021  516 GLU EEE N   
1481 C CA  . GLU A 187 ? 0.310 0.266 0.384 -0.014 -0.046 0.036  516 GLU EEE CA  
1482 C C   . GLU A 187 ? 0.305 0.265 0.378 -0.013 -0.069 0.032  516 GLU EEE C   
1483 O O   . GLU A 187 ? 0.301 0.277 0.386 -0.012 -0.085 0.014  516 GLU EEE O   
1484 C CB  . GLU A 187 ? 0.341 0.297 0.392 -0.013 -0.062 0.017  516 GLU EEE CB  
1485 C CG  . GLU A 187 ? 0.340 0.330 0.415 -0.006 -0.076 0.019  516 GLU EEE CG  
1486 C CD  . GLU A 187 ? 0.375 0.356 0.403 0.013  -0.070 -0.003 516 GLU EEE CD  
1487 O OE1 . GLU A 187 ? 0.346 0.378 0.415 -0.001 -0.077 -0.038 516 GLU EEE OE1 
1488 O OE2 . GLU A 187 ? 0.432 0.355 0.441 -0.015 -0.067 -0.014 516 GLU EEE OE2 
1489 N N   . LEU A 188 ? 0.314 0.298 0.389 0.038  -0.051 0.040  517 LEU EEE N   
1490 C CA  . LEU A 188 ? 0.416 0.331 0.422 0.074  -0.068 0.010  517 LEU EEE CA  
1491 C C   . LEU A 188 ? 0.368 0.324 0.408 0.029  -0.070 0.004  517 LEU EEE C   
1492 O O   . LEU A 188 ? 0.368 0.359 0.530 0.034  -0.064 0.001  517 LEU EEE O   
1493 C CB  . LEU A 188 ? 0.418 0.382 0.486 0.088  -0.037 0.029  517 LEU EEE CB  
1494 C CG  . LEU A 188 ? 0.462 0.441 0.483 0.062  -0.077 0.018  517 LEU EEE CG  
1495 C CD1 . LEU A 188 ? 0.483 0.455 0.490 0.056  -0.076 0.024  517 LEU EEE CD1 
1496 C CD2 . LEU A 188 ? 0.500 0.463 0.478 0.041  -0.094 0.011  517 LEU EEE CD2 
1497 N N   . LEU A 189 ? 0.399 0.304 0.368 -0.009 -0.095 0.002  518 LEU EEE N   
1498 C CA  . LEU A 189 ? 0.382 0.277 0.417 0.011  -0.111 0.020  518 LEU EEE CA  
1499 C C   . LEU A 189 ? 0.355 0.273 0.418 0.013  -0.127 0.018  518 LEU EEE C   
1500 O O   . LEU A 189 ? 0.420 0.307 0.440 0.003  -0.177 0.010  518 LEU EEE O   
1501 C CB  . LEU A 189 ? 0.442 0.316 0.383 -0.008 -0.109 0.003  518 LEU EEE CB  
1502 C CG  . LEU A 189 ? 0.483 0.327 0.412 0.018  -0.133 -0.012 518 LEU EEE CG  
1503 C CD1 . LEU A 189 ? 0.522 0.350 0.410 0.014  -0.141 -0.052 518 LEU EEE CD1 
1504 C CD2 . LEU A 189 ? 0.546 0.297 0.497 -0.036 -0.110 0.004  518 LEU EEE CD2 
1505 N N   . HIS A 190 ? 0.368 0.288 0.463 0.031  -0.145 0.006  519 HIS EEE N   
1506 C CA  . HIS A 190 ? 0.431 0.274 0.465 0.022  -0.126 -0.021 519 HIS EEE CA  
1507 C C   . HIS A 190 ? 0.422 0.300 0.438 0.002  -0.147 -0.012 519 HIS EEE C   
1508 O O   . HIS A 190 ? 0.535 0.320 0.434 -0.002 -0.150 -0.013 519 HIS EEE O   
1509 C CB  . HIS A 190 ? 0.441 0.325 0.526 0.028  -0.133 0.002  519 HIS EEE CB  
1510 C CG  . HIS A 190 ? 0.499 0.326 0.554 0.039  -0.092 0.005  519 HIS EEE CG  
1511 N ND1 . HIS A 190 ? 0.549 0.348 0.556 0.027  -0.082 0.021  519 HIS EEE ND1 
1512 C CD2 . HIS A 190 ? 0.504 0.350 0.580 0.044  -0.081 0.016  519 HIS EEE CD2 
1513 C CE1 . HIS A 190 ? 0.514 0.351 0.540 0.052  -0.069 -0.017 519 HIS EEE CE1 
1514 N NE2 . HIS A 190 ? 0.490 0.382 0.577 0.059  -0.082 -0.006 519 HIS EEE NE2 
1515 N N   . ALA A 191 ? 0.412 0.281 0.370 -0.008 -0.113 -0.033 520 ALA EEE N   
1516 C CA  . ALA A 191 ? 0.423 0.291 0.347 0.001  -0.116 -0.021 520 ALA EEE CA  
1517 C C   . ALA A 191 ? 0.416 0.269 0.352 -0.020 -0.083 -0.040 520 ALA EEE C   
1518 O O   . ALA A 191 ? 0.479 0.251 0.352 0.026  -0.091 -0.037 520 ALA EEE O   
1519 C CB  . ALA A 191 ? 0.432 0.339 0.314 -0.005 -0.084 -0.057 520 ALA EEE CB  
1520 N N   . PRO A 192 ? 0.448 0.300 0.364 -0.024 -0.073 0.013  521 PRO EEE N   
1521 C CA  . PRO A 192 ? 0.438 0.295 0.384 -0.011 -0.062 -0.017 521 PRO EEE CA  
1522 C C   . PRO A 192 ? 0.466 0.284 0.350 -0.028 -0.061 -0.029 521 PRO EEE C   
1523 O O   . PRO A 192 ? 0.494 0.273 0.384 0.005  -0.081 -0.039 521 PRO EEE O   
1524 C CB  . PRO A 192 ? 0.456 0.318 0.387 -0.018 -0.052 -0.009 521 PRO EEE CB  
1525 C CG  . PRO A 192 ? 0.497 0.328 0.372 -0.039 -0.047 0.027  521 PRO EEE CG  
1526 C CD  . PRO A 192 ? 0.484 0.322 0.365 -0.029 -0.057 0.011  521 PRO EEE CD  
1527 N N   . ALA A 193 ? 0.454 0.262 0.363 -0.048 -0.070 -0.037 522 ALA EEE N   
1528 C CA  . ALA A 193 ? 0.443 0.274 0.419 -0.001 -0.068 0.005  522 ALA EEE CA  
1529 C C   . ALA A 193 ? 0.439 0.295 0.449 -0.050 -0.020 0.051  522 ALA EEE C   
1530 O O   . ALA A 193 ? 0.462 0.313 0.607 -0.033 -0.088 0.039  522 ALA EEE O   
1531 C CB  . ALA A 193 ? 0.495 0.297 0.427 0.050  -0.048 0.026  522 ALA EEE CB  
1532 N N   . THR A 194 ? 0.337 0.365 0.448 -0.021 -0.024 0.030  523 THR EEE N   
1533 C CA  . THR A 194 ? 0.367 0.480 0.425 0.000  -0.000 0.056  523 THR EEE CA  
1534 C C   . THR A 194 ? 0.237 0.413 0.436 -0.031 0.018  0.040  523 THR EEE C   
1535 O O   . THR A 194 ? 0.244 0.466 0.512 -0.029 0.029  0.073  523 THR EEE O   
1536 C CB  . THR A 194 ? 0.472 0.582 0.466 -0.010 0.016  -0.009 523 THR EEE CB  
1537 O OG1 . THR A 194 ? 0.525 0.733 0.656 -0.034 0.028  0.037  523 THR EEE OG1 
1538 C CG2 . THR A 194 ? 0.461 0.605 0.462 0.014  -0.008 -0.018 523 THR EEE CG2 
1539 N N   . VAL A 195 ? 0.288 0.297 0.356 -0.031 -0.028 0.005  524 VAL EEE N   
1540 C CA  . VAL A 195 ? 0.249 0.315 0.400 -0.028 -0.017 0.020  524 VAL EEE CA  
1541 C C   . VAL A 195 ? 0.304 0.322 0.396 -0.030 -0.025 0.010  524 VAL EEE C   
1542 O O   . VAL A 195 ? 0.259 0.364 0.433 -0.026 -0.052 -0.026 524 VAL EEE O   
1543 C CB  . VAL A 195 ? 0.312 0.312 0.451 -0.033 -0.017 0.034  524 VAL EEE CB  
1544 C CG1 . VAL A 195 ? 0.260 0.301 0.469 -0.038 0.002  0.049  524 VAL EEE CG1 
1545 C CG2 . VAL A 195 ? 0.348 0.350 0.468 -0.018 -0.023 0.022  524 VAL EEE CG2 
1546 N N   . CYS A 196 ? 0.266 0.386 0.443 -0.036 -0.014 -0.001 525 CYS EEE N   
1547 C CA  . CYS A 196 ? 0.316 0.366 0.444 0.024  -0.061 -0.010 525 CYS EEE CA  
1548 C C   . CYS A 196 ? 0.358 0.403 0.448 0.039  -0.078 -0.008 525 CYS EEE C   
1549 O O   . CYS A 196 ? 0.239 0.469 0.442 -0.016 -0.033 -0.040 525 CYS EEE O   
1550 C CB  . CYS A 196 ? 0.396 0.384 0.491 -0.017 -0.049 0.017  525 CYS EEE CB  
1551 S SG  . CYS A 196 ? 0.422 0.414 0.547 -0.033 -0.053 0.064  525 CYS EEE SG  
1552 N N   . GLY A 197 ? 0.345 0.422 0.441 0.020  -0.054 -0.006 526 GLY EEE N   
1553 C CA  . GLY A 197 ? 0.387 0.441 0.472 -0.017 -0.085 0.001  526 GLY EEE CA  
1554 C C   . GLY A 197 ? 0.435 0.428 0.503 -0.050 -0.080 0.037  526 GLY EEE C   
1555 O O   . GLY A 197 ? 0.531 0.565 0.479 -0.078 -0.150 0.058  526 GLY EEE O   
1556 N N   . PRO A 198 ? 0.358 0.475 0.563 -0.098 -0.072 0.004  527 PRO EEE N   
1557 C CA  . PRO A 198 ? 0.407 0.509 0.599 -0.141 -0.095 -0.031 527 PRO EEE CA  
1558 C C   . PRO A 198 ? 0.478 0.480 0.583 -0.150 -0.110 -0.043 527 PRO EEE C   
1559 O O   . PRO A 198 ? 0.680 0.601 0.577 -0.064 -0.116 0.041  527 PRO EEE O   
1560 C CB  . PRO A 198 ? 0.397 0.514 0.604 -0.083 -0.063 -0.004 527 PRO EEE CB  
1561 C CG  . PRO A 198 ? 0.342 0.524 0.590 -0.080 -0.089 -0.000 527 PRO EEE CG  
1562 C CD  . PRO A 198 ? 0.338 0.462 0.574 -0.114 -0.098 0.008  527 PRO EEE CD  
1563 N N   . GLN B 1   ? 0.481 0.787 0.606 -0.054 -0.120 -0.034 1   GLN FFF N   
1564 C CA  . GLN B 1   ? 0.317 0.747 0.510 -0.134 -0.091 -0.046 1   GLN FFF CA  
1565 C C   . GLN B 1   ? 0.340 0.629 0.375 -0.068 -0.070 -0.047 1   GLN FFF C   
1566 O O   . GLN B 1   ? 0.333 0.625 0.389 -0.150 0.028  -0.063 1   GLN FFF O   
1567 C CB  . GLN B 1   ? 0.374 0.795 0.612 -0.168 -0.111 -0.033 1   GLN FFF CB  
1568 C CG  . GLN B 1   ? 0.410 0.902 0.625 -0.181 -0.108 -0.015 1   GLN FFF CG  
1569 C CD  . GLN B 1   ? 0.578 0.902 0.741 -0.197 -0.127 -0.015 1   GLN FFF CD  
1570 O OE1 . GLN B 1   ? 0.573 1.119 0.747 -0.150 -0.141 -0.051 1   GLN FFF OE1 
1571 N NE2 . GLN B 1   ? 0.745 1.042 0.823 -0.156 -0.086 0.078  1   GLN FFF NE2 
1572 N N   . VAL B 2   ? 0.343 0.504 0.360 -0.100 -0.083 -0.044 2   VAL FFF N   
1573 C CA  . VAL B 2   ? 0.347 0.463 0.300 -0.121 -0.089 -0.047 2   VAL FFF CA  
1574 C C   . VAL B 2   ? 0.369 0.441 0.281 -0.113 -0.079 -0.068 2   VAL FFF C   
1575 O O   . VAL B 2   ? 0.374 0.436 0.375 -0.113 -0.032 -0.051 2   VAL FFF O   
1576 C CB  . VAL B 2   ? 0.410 0.471 0.299 -0.138 -0.056 -0.045 2   VAL FFF CB  
1577 C CG1 . VAL B 2   ? 0.409 0.472 0.307 -0.149 -0.062 -0.055 2   VAL FFF CG1 
1578 C CG2 . VAL B 2   ? 0.428 0.485 0.336 -0.136 -0.106 -0.031 2   VAL FFF CG2 
1579 N N   . GLN B 3   ? 0.359 0.449 0.285 -0.149 -0.082 -0.026 3   GLN FFF N   
1580 C CA  . GLN B 3   ? 0.438 0.449 0.341 -0.140 -0.081 -0.011 3   GLN FFF CA  
1581 C C   . GLN B 3   ? 0.439 0.366 0.306 -0.120 -0.050 -0.007 3   GLN FFF C   
1582 O O   . GLN B 3   ? 0.456 0.387 0.330 -0.153 -0.011 0.021  3   GLN FFF O   
1583 C CB  . GLN B 3   ? 0.476 0.516 0.376 -0.172 -0.047 -0.016 3   GLN FFF CB  
1584 C CG  . GLN B 3   ? 0.502 0.642 0.486 -0.166 -0.083 -0.002 3   GLN FFF CG  
1585 C CD  . GLN B 3   ? 0.629 0.645 0.593 -0.165 -0.045 0.001  3   GLN FFF CD  
1586 O OE1 . GLN B 3   ? 0.529 0.789 0.742 -0.226 -0.067 0.026  3   GLN FFF OE1 
1587 N NE2 . GLN B 3   ? 0.642 0.758 0.692 -0.088 -0.022 0.034  3   GLN FFF NE2 
1588 N N   . LEU B 4   ? 0.419 0.336 0.305 -0.133 -0.053 0.016  4   LEU FFF N   
1589 C CA  . LEU B 4   ? 0.451 0.344 0.285 -0.134 -0.089 0.032  4   LEU FFF CA  
1590 C C   . LEU B 4   ? 0.479 0.357 0.315 -0.121 -0.100 0.071  4   LEU FFF C   
1591 O O   . LEU B 4   ? 0.514 0.433 0.336 -0.190 -0.150 0.136  4   LEU FFF O   
1592 C CB  . LEU B 4   ? 0.402 0.298 0.323 -0.135 -0.080 0.035  4   LEU FFF CB  
1593 C CG  . LEU B 4   ? 0.414 0.333 0.310 -0.110 -0.069 0.029  4   LEU FFF CG  
1594 C CD1 . LEU B 4   ? 0.400 0.301 0.345 -0.082 -0.079 0.041  4   LEU FFF CD1 
1595 C CD2 . LEU B 4   ? 0.466 0.342 0.338 -0.113 -0.068 0.036  4   LEU FFF CD2 
1596 N N   . VAL B 5   ? 0.442 0.361 0.328 -0.069 -0.067 0.042  5   VAL FFF N   
1597 C CA  . VAL B 5   ? 0.329 0.441 0.313 -0.035 -0.074 0.012  5   VAL FFF CA  
1598 C C   . VAL B 5   ? 0.314 0.350 0.285 -0.024 -0.035 0.036  5   VAL FFF C   
1599 O O   . VAL B 5   ? 0.386 0.378 0.318 -0.088 0.001  0.013  5   VAL FFF O   
1600 C CB  . VAL B 5   ? 0.329 0.501 0.345 -0.032 -0.075 -0.010 5   VAL FFF CB  
1601 C CG1 . VAL B 5   ? 0.375 0.544 0.370 -0.075 -0.080 0.029  5   VAL FFF CG1 
1602 C CG2 . VAL B 5   ? 0.370 0.524 0.357 -0.001 -0.103 0.029  5   VAL FFF CG2 
1603 N N   . GLU B 6   ? 0.300 0.342 0.407 -0.028 -0.026 0.015  6   GLU FFF N   
1604 C CA  . GLU B 6   ? 0.297 0.379 0.357 -0.017 -0.064 0.027  6   GLU FFF CA  
1605 C C   . GLU B 6   ? 0.312 0.442 0.347 -0.026 -0.040 -0.009 6   GLU FFF C   
1606 O O   . GLU B 6   ? 0.308 0.386 0.340 0.030  -0.028 0.005  6   GLU FFF O   
1607 C CB  . GLU B 6   ? 0.382 0.422 0.345 -0.002 -0.057 -0.014 6   GLU FFF CB  
1608 C CG  . GLU B 6   ? 0.388 0.397 0.342 0.008  -0.030 0.009  6   GLU FFF CG  
1609 C CD  . GLU B 6   ? 0.468 0.360 0.367 -0.023 -0.077 0.014  6   GLU FFF CD  
1610 O OE1 . GLU B 6   ? 0.584 0.428 0.457 -0.066 0.051  -0.019 6   GLU FFF OE1 
1611 O OE2 . GLU B 6   ? 0.401 0.266 0.418 -0.006 -0.041 0.041  6   GLU FFF OE2 
1612 N N   . SER B 7   ? 0.316 0.425 0.348 -0.005 -0.051 0.017  7   SER FFF N   
1613 C CA  . SER B 7   ? 0.284 0.400 0.334 0.021  -0.050 -0.005 7   SER FFF CA  
1614 C C   . SER B 7   ? 0.292 0.381 0.286 0.032  -0.081 0.047  7   SER FFF C   
1615 O O   . SER B 7   ? 0.455 0.327 0.342 -0.011 -0.010 0.012  7   SER FFF O   
1616 C CB  . SER B 7   ? 0.310 0.458 0.341 0.023  -0.027 -0.040 7   SER FFF CB  
1617 O OG  . SER B 7   ? 0.359 0.544 0.371 0.004  -0.050 -0.022 7   SER FFF OG  
1618 N N   . GLY B 8   ? 0.313 0.421 0.244 0.019  -0.051 0.048  8   GLY FFF N   
1619 C CA  . GLY B 8   ? 0.312 0.365 0.356 0.038  -0.094 -0.009 8   GLY FFF CA  
1620 C C   . GLY B 8   ? 0.425 0.388 0.381 0.043  -0.060 -0.018 8   GLY FFF C   
1621 O O   . GLY B 8   ? 0.461 0.410 0.379 -0.011 -0.050 -0.040 8   GLY FFF O   
1622 N N   . GLY B 9   ? 0.475 0.350 0.422 0.115  -0.131 0.037  9   GLY FFF N   
1623 C CA  . GLY B 9   ? 0.592 0.367 0.430 0.104  -0.137 0.000  9   GLY FFF CA  
1624 C C   . GLY B 9   ? 0.627 0.350 0.423 0.113  -0.153 0.007  9   GLY FFF C   
1625 O O   . GLY B 9   ? 0.738 0.400 0.410 0.081  -0.139 0.019  9   GLY FFF O   
1626 N N   . GLY B 10  ? 0.636 0.388 0.399 0.090  -0.191 -0.013 10  GLY FFF N   
1627 C CA  . GLY B 10  ? 0.679 0.354 0.376 0.068  -0.141 -0.040 10  GLY FFF CA  
1628 C C   . GLY B 10  ? 0.675 0.424 0.385 0.090  -0.157 -0.025 10  GLY FFF C   
1629 O O   . GLY B 10  ? 0.747 0.328 0.367 0.062  -0.149 0.004  10  GLY FFF O   
1630 N N   . SER B 11  ? 0.723 0.421 0.390 0.081  -0.157 -0.023 11  SER FFF N   
1631 C CA  . SER B 11  ? 0.703 0.474 0.479 0.076  -0.179 -0.042 11  SER FFF CA  
1632 C C   . SER B 11  ? 0.738 0.507 0.517 0.060  -0.215 -0.063 11  SER FFF C   
1633 O O   . SER B 11  ? 0.886 0.575 0.526 0.056  -0.254 -0.108 11  SER FFF O   
1634 C CB  . SER B 11  ? 0.756 0.530 0.469 0.074  -0.175 -0.007 11  SER FFF CB  
1635 O OG  . SER B 11  ? 0.809 0.610 0.571 -0.022 -0.113 0.050  11  SER FFF OG  
1636 N N   . VAL B 12  ? 0.682 0.453 0.481 0.128  -0.296 -0.043 12  VAL FFF N   
1637 C CA  . VAL B 12  ? 0.765 0.462 0.566 0.059  -0.354 -0.038 12  VAL FFF CA  
1638 C C   . VAL B 12  ? 0.777 0.525 0.623 0.097  -0.387 -0.044 12  VAL FFF C   
1639 O O   . VAL B 12  ? 0.729 0.536 0.591 0.115  -0.426 -0.031 12  VAL FFF O   
1640 C CB  . VAL B 12  ? 0.825 0.463 0.600 0.104  -0.398 0.003  12  VAL FFF CB  
1641 C CG1 . VAL B 12  ? 0.905 0.404 0.586 0.084  -0.326 0.048  12  VAL FFF CG1 
1642 C CG2 . VAL B 12  ? 0.825 0.471 0.669 0.065  -0.330 -0.002 12  VAL FFF CG2 
1643 N N   . GLN B 13  ? 0.798 0.564 0.671 0.065  -0.410 -0.043 13  GLN FFF N   
1644 C CA  . GLN B 13  ? 0.785 0.604 0.629 0.068  -0.402 -0.026 13  GLN FFF CA  
1645 C C   . GLN B 13  ? 0.726 0.478 0.631 0.015  -0.414 -0.012 13  GLN FFF C   
1646 O O   . GLN B 13  ? 0.688 0.462 0.661 0.037  -0.378 -0.056 13  GLN FFF O   
1647 C CB  . GLN B 13  ? 0.895 0.742 0.612 0.092  -0.436 -0.024 13  GLN FFF CB  
1648 C CG  . GLN B 13  ? 0.942 0.835 0.641 0.096  -0.432 0.029  13  GLN FFF CG  
1649 C CD  . GLN B 13  ? 1.041 0.938 0.612 0.098  -0.444 0.039  13  GLN FFF CD  
1650 O OE1 . GLN B 13  ? 1.066 0.993 0.785 0.050  -0.341 0.018  13  GLN FFF OE1 
1651 N NE2 . GLN B 13  ? 1.136 0.981 0.784 0.062  -0.338 0.102  13  GLN FFF NE2 
1652 N N   . ALA B 14  ? 0.769 0.413 0.619 0.021  -0.378 0.028  14  ALA FFF N   
1653 C CA  . ALA B 14  ? 0.723 0.385 0.573 0.004  -0.442 0.039  14  ALA FFF CA  
1654 C C   . ALA B 14  ? 0.680 0.449 0.659 0.014  -0.445 0.023  14  ALA FFF C   
1655 O O   . ALA B 14  ? 0.840 0.403 0.682 0.055  -0.521 0.017  14  ALA FFF O   
1656 C CB  . ALA B 14  ? 0.677 0.451 0.640 0.006  -0.385 -0.003 14  ALA FFF CB  
1657 N N   . GLY B 15  ? 0.734 0.434 0.692 -0.005 -0.426 0.012  15  GLY FFF N   
1658 C CA  . GLY B 15  ? 0.685 0.481 0.733 -0.007 -0.347 -0.035 15  GLY FFF CA  
1659 C C   . GLY B 15  ? 0.588 0.465 0.778 0.012  -0.314 0.008  15  GLY FFF C   
1660 O O   . GLY B 15  ? 0.678 0.451 0.756 0.002  -0.263 0.058  15  GLY FFF O   
1661 N N   . GLY B 16  ? 0.586 0.484 0.795 0.089  -0.289 -0.043 16  GLY FFF N   
1662 C CA  . GLY B 16  ? 0.438 0.511 0.721 0.091  -0.328 -0.023 16  GLY FFF CA  
1663 C C   . GLY B 16  ? 0.525 0.507 0.680 0.130  -0.306 -0.041 16  GLY FFF C   
1664 O O   . GLY B 16  ? 0.592 0.552 0.665 0.135  -0.376 0.024  16  GLY FFF O   
1665 N N   . SER B 17  ? 0.577 0.462 0.587 0.121  -0.271 0.014  17  SER FFF N   
1666 C CA  . SER B 17  ? 0.400 0.397 0.543 0.104  -0.262 -0.038 17  SER FFF CA  
1667 C C   . SER B 17  ? 0.488 0.401 0.460 0.055  -0.198 -0.007 17  SER FFF C   
1668 O O   . SER B 17  ? 0.521 0.451 0.460 0.100  -0.223 -0.002 17  SER FFF O   
1669 C CB  . SER B 17  ? 0.550 0.466 0.637 0.046  -0.181 -0.024 17  SER FFF CB  
1670 O OG  . SER B 17  ? 0.564 0.561 0.680 0.063  -0.169 0.034  17  SER FFF OG  
1671 N N   . LEU B 18  ? 0.420 0.374 0.517 0.071  -0.206 -0.021 18  LEU FFF N   
1672 C CA  A LEU B 18  ? 0.439 0.418 0.488 0.062  -0.157 0.001  18  LEU FFF CA  
1673 C CA  B LEU B 18  ? 0.436 0.422 0.498 0.059  -0.164 0.001  18  LEU FFF CA  
1674 C C   . LEU B 18  ? 0.340 0.455 0.461 0.094  -0.141 0.014  18  LEU FFF C   
1675 O O   . LEU B 18  ? 0.445 0.449 0.398 0.032  -0.158 0.117  18  LEU FFF O   
1676 C CB  A LEU B 18  ? 0.492 0.400 0.500 0.051  -0.161 -0.002 18  LEU FFF CB  
1677 C CB  B LEU B 18  ? 0.496 0.431 0.537 0.040  -0.181 -0.018 18  LEU FFF CB  
1678 C CG  A LEU B 18  ? 0.548 0.422 0.507 0.063  -0.154 0.015  18  LEU FFF CG  
1679 C CG  B LEU B 18  ? 0.535 0.480 0.574 0.028  -0.163 -0.015 18  LEU FFF CG  
1680 C CD1 A LEU B 18  ? 0.550 0.446 0.513 0.060  -0.161 0.001  18  LEU FFF CD1 
1681 C CD1 B LEU B 18  ? 0.606 0.497 0.581 0.041  -0.166 -0.002 18  LEU FFF CD1 
1682 C CD2 A LEU B 18  ? 0.596 0.443 0.540 0.057  -0.119 0.016  18  LEU FFF CD2 
1683 C CD2 B LEU B 18  ? 0.554 0.472 0.597 0.027  -0.174 -0.001 18  LEU FFF CD2 
1684 N N   . THR B 19  ? 0.396 0.374 0.423 0.063  -0.057 -0.003 19  THR FFF N   
1685 C CA  . THR B 19  ? 0.317 0.332 0.422 0.038  -0.051 -0.015 19  THR FFF CA  
1686 C C   . THR B 19  ? 0.334 0.370 0.289 0.020  -0.022 -0.060 19  THR FFF C   
1687 O O   . THR B 19  ? 0.371 0.528 0.315 -0.034 -0.019 -0.052 19  THR FFF O   
1688 C CB  . THR B 19  ? 0.211 0.344 0.459 0.048  -0.020 -0.036 19  THR FFF CB  
1689 O OG1 . THR B 19  ? 0.204 0.369 0.624 0.034  -0.050 -0.035 19  THR FFF OG1 
1690 C CG2 . THR B 19  ? 0.272 0.367 0.493 0.046  -0.058 -0.003 19  THR FFF CG2 
1691 N N   . LEU B 20  ? 0.345 0.336 0.345 0.028  -0.117 -0.025 20  LEU FFF N   
1692 C CA  . LEU B 20  ? 0.386 0.333 0.357 0.036  -0.141 -0.005 20  LEU FFF CA  
1693 C C   . LEU B 20  ? 0.332 0.299 0.319 0.042  -0.109 -0.042 20  LEU FFF C   
1694 O O   . LEU B 20  ? 0.512 0.339 0.312 -0.008 -0.150 0.015  20  LEU FFF O   
1695 C CB  . LEU B 20  ? 0.505 0.305 0.386 -0.024 -0.160 -0.021 20  LEU FFF CB  
1696 C CG  . LEU B 20  ? 0.586 0.320 0.435 -0.008 -0.204 -0.024 20  LEU FFF CG  
1697 C CD1 . LEU B 20  ? 0.580 0.318 0.457 -0.040 -0.273 -0.024 20  LEU FFF CD1 
1698 C CD2 . LEU B 20  ? 0.638 0.340 0.416 -0.003 -0.199 -0.029 20  LEU FFF CD2 
1699 N N   . SER B 21  ? 0.352 0.356 0.394 0.041  -0.101 0.001  21  SER FFF N   
1700 C CA  . SER B 21  ? 0.425 0.328 0.376 -0.013 -0.134 0.028  21  SER FFF CA  
1701 C C   . SER B 21  ? 0.467 0.360 0.306 -0.061 -0.125 0.041  21  SER FFF C   
1702 O O   . SER B 21  ? 0.436 0.344 0.301 -0.045 -0.091 0.038  21  SER FFF O   
1703 C CB  . SER B 21  ? 0.447 0.402 0.370 -0.029 -0.148 -0.019 21  SER FFF CB  
1704 O OG  . SER B 21  ? 0.467 0.468 0.402 -0.037 -0.129 -0.037 21  SER FFF OG  
1705 N N   . CYS B 22  ? 0.405 0.313 0.312 -0.068 -0.119 0.029  22  CYS FFF N   
1706 C CA  . CYS B 22  ? 0.359 0.352 0.300 -0.074 -0.085 0.036  22  CYS FFF CA  
1707 C C   . CYS B 22  ? 0.330 0.327 0.264 -0.103 -0.043 0.006  22  CYS FFF C   
1708 O O   . CYS B 22  ? 0.304 0.313 0.295 -0.097 -0.042 0.019  22  CYS FFF O   
1709 C CB  . CYS B 22  ? 0.343 0.307 0.328 -0.038 -0.088 0.020  22  CYS FFF CB  
1710 S SG  . CYS B 22  ? 0.411 0.304 0.320 -0.050 -0.122 0.006  22  CYS FFF SG  
1711 N N   . VAL B 23  ? 0.345 0.354 0.244 -0.136 -0.005 0.012  23  VAL FFF N   
1712 C CA  . VAL B 23  ? 0.313 0.387 0.258 -0.124 0.006  -0.010 23  VAL FFF CA  
1713 C C   . VAL B 23  ? 0.342 0.354 0.267 -0.118 -0.008 -0.003 23  VAL FFF C   
1714 O O   . VAL B 23  ? 0.355 0.410 0.313 -0.163 0.002  0.011  23  VAL FFF O   
1715 C CB  . VAL B 23  ? 0.285 0.411 0.266 -0.135 0.025  -0.014 23  VAL FFF CB  
1716 C CG1 . VAL B 23  ? 0.244 0.463 0.316 -0.106 0.023  -0.043 23  VAL FFF CG1 
1717 C CG2 . VAL B 23  ? 0.365 0.479 0.281 -0.140 -0.015 0.005  23  VAL FFF CG2 
1718 N N   . ALA B 24  ? 0.324 0.361 0.271 -0.121 -0.011 0.002  24  ALA FFF N   
1719 C CA  . ALA B 24  ? 0.357 0.360 0.264 -0.122 -0.027 0.003  24  ALA FFF CA  
1720 C C   . ALA B 24  ? 0.295 0.387 0.269 -0.124 -0.029 -0.005 24  ALA FFF C   
1721 O O   . ALA B 24  ? 0.306 0.379 0.290 -0.095 -0.002 -0.024 24  ALA FFF O   
1722 C CB  . ALA B 24  ? 0.357 0.384 0.253 -0.147 -0.034 0.005  24  ALA FFF CB  
1723 N N   . SER B 25  ? 0.308 0.359 0.233 -0.168 -0.018 0.004  25  SER FFF N   
1724 C CA  . SER B 25  ? 0.346 0.431 0.228 -0.126 -0.023 -0.014 25  SER FFF CA  
1725 C C   . SER B 25  ? 0.244 0.391 0.220 -0.102 0.006  -0.009 25  SER FFF C   
1726 O O   . SER B 25  ? 0.354 0.419 0.276 -0.108 -0.002 -0.024 25  SER FFF O   
1727 C CB  . SER B 25  ? 0.449 0.474 0.224 -0.134 0.003  -0.009 25  SER FFF CB  
1728 O OG  . SER B 25  ? 0.479 0.547 0.332 -0.219 0.048  0.042  25  SER FFF OG  
1729 N N   . GLY B 26  ? 0.265 0.370 0.262 -0.112 0.022  0.004  26  GLY FFF N   
1730 C CA  . GLY B 26  ? 0.275 0.403 0.266 -0.091 0.007  -0.010 26  GLY FFF CA  
1731 C C   . GLY B 26  ? 0.260 0.427 0.265 -0.093 -0.000 0.002  26  GLY FFF C   
1732 O O   . GLY B 26  ? 0.258 0.485 0.299 -0.087 -0.021 -0.018 26  GLY FFF O   
1733 N N   . VAL B 27  ? 0.243 0.400 0.260 -0.077 0.022  0.041  27  VAL FFF N   
1734 C CA  . VAL B 27  ? 0.241 0.378 0.230 -0.075 0.004  0.033  27  VAL FFF CA  
1735 C C   . VAL B 27  ? 0.215 0.375 0.248 -0.072 0.010  0.033  27  VAL FFF C   
1736 O O   . VAL B 27  ? 0.271 0.377 0.273 -0.122 -0.005 0.069  27  VAL FFF O   
1737 C CB  . VAL B 27  ? 0.337 0.390 0.271 -0.057 -0.002 0.016  27  VAL FFF CB  
1738 C CG1 . VAL B 27  ? 0.386 0.415 0.296 -0.001 0.023  0.025  27  VAL FFF CG1 
1739 C CG2 . VAL B 27  ? 0.361 0.388 0.272 -0.090 0.002  0.007  27  VAL FFF CG2 
1740 N N   . THR B 28  ? 0.198 0.304 0.234 -0.028 -0.003 0.017  28  THR FFF N   
1741 C CA  . THR B 28  ? 0.187 0.292 0.224 -0.037 0.041  0.005  28  THR FFF CA  
1742 C C   . THR B 28  ? 0.170 0.272 0.203 -0.011 0.002  0.011  28  THR FFF C   
1743 O O   . THR B 28  ? 0.203 0.277 0.201 -0.008 0.023  0.016  28  THR FFF O   
1744 C CB  . THR B 28  ? 0.197 0.292 0.265 -0.007 0.047  -0.023 28  THR FFF CB  
1745 O OG1 . THR B 28  ? 0.210 0.344 0.316 0.020  0.066  -0.012 28  THR FFF OG1 
1746 C CG2 . THR B 28  ? 0.215 0.322 0.268 -0.008 0.023  -0.034 28  THR FFF CG2 
1747 N N   . LEU B 29  ? 0.152 0.264 0.195 -0.032 0.011  0.031  29  LEU FFF N   
1748 C CA  . LEU B 29  ? 0.184 0.258 0.210 -0.021 0.022  0.018  29  LEU FFF CA  
1749 C C   . LEU B 29  ? 0.193 0.241 0.197 -0.014 0.006  0.012  29  LEU FFF C   
1750 O O   . LEU B 29  ? 0.177 0.252 0.227 -0.024 0.042  0.006  29  LEU FFF O   
1751 C CB  . LEU B 29  ? 0.192 0.264 0.225 -0.023 -0.005 0.026  29  LEU FFF CB  
1752 C CG  . LEU B 29  ? 0.263 0.285 0.249 -0.030 -0.001 0.048  29  LEU FFF CG  
1753 C CD1 . LEU B 29  ? 0.281 0.309 0.266 -0.012 -0.018 0.060  29  LEU FFF CD1 
1754 C CD2 . LEU B 29  ? 0.268 0.269 0.283 -0.062 -0.017 0.058  29  LEU FFF CD2 
1755 N N   . GLY B 30  ? 0.142 0.232 0.195 -0.004 -0.014 -0.001 30  GLY FFF N   
1756 C CA  . GLY B 30  ? 0.122 0.229 0.203 -0.007 -0.027 -0.000 30  GLY FFF CA  
1757 C C   . GLY B 30  ? 0.136 0.209 0.200 -0.002 -0.019 0.003  30  GLY FFF C   
1758 O O   . GLY B 30  ? 0.147 0.219 0.178 -0.008 -0.018 -0.002 30  GLY FFF O   
1759 N N   . ARG B 31  ? 0.141 0.222 0.200 -0.020 -0.020 0.006  31  ARG FFF N   
1760 C CA  . ARG B 31  ? 0.126 0.217 0.207 -0.002 -0.024 -0.000 31  ARG FFF CA  
1761 C C   . ARG B 31  ? 0.144 0.222 0.203 0.018  -0.023 0.016  31  ARG FFF C   
1762 O O   . ARG B 31  ? 0.162 0.241 0.206 -0.014 -0.015 -0.022 31  ARG FFF O   
1763 C CB  . ARG B 31  ? 0.120 0.229 0.206 -0.003 -0.027 0.000  31  ARG FFF CB  
1764 C CG  . ARG B 31  ? 0.115 0.250 0.210 0.000  -0.014 -0.006 31  ARG FFF CG  
1765 C CD  . ARG B 31  ? 0.146 0.237 0.193 0.005  -0.003 0.004  31  ARG FFF CD  
1766 N NE  . ARG B 31  ? 0.146 0.260 0.213 -0.008 -0.004 -0.023 31  ARG FFF NE  
1767 C CZ  . ARG B 31  ? 0.144 0.288 0.199 -0.012 -0.018 -0.010 31  ARG FFF CZ  
1768 N NH1 . ARG B 31  ? 0.142 0.304 0.223 -0.025 0.003  -0.008 31  ARG FFF NH1 
1769 N NH2 . ARG B 31  ? 0.148 0.313 0.209 0.004  -0.011 -0.016 31  ARG FFF NH2 
1770 N N   . HIS B 32  ? 0.164 0.219 0.198 -0.005 -0.010 0.001  32  HIS FFF N   
1771 C CA  . HIS B 32  ? 0.160 0.223 0.224 -0.006 0.000  -0.003 32  HIS FFF CA  
1772 C C   . HIS B 32  ? 0.179 0.221 0.223 -0.001 -0.015 -0.007 32  HIS FFF C   
1773 O O   . HIS B 32  ? 0.145 0.232 0.223 -0.010 -0.013 -0.007 32  HIS FFF O   
1774 C CB  . HIS B 32  ? 0.114 0.252 0.266 -0.006 -0.032 -0.008 32  HIS FFF CB  
1775 C CG  . HIS B 32  ? 0.164 0.270 0.257 0.020  -0.040 0.009  32  HIS FFF CG  
1776 N ND1 . HIS B 32  ? 0.161 0.288 0.269 -0.006 -0.017 0.000  32  HIS FFF ND1 
1777 C CD2 . HIS B 32  ? 0.150 0.319 0.247 0.033  -0.005 0.005  32  HIS FFF CD2 
1778 C CE1 . HIS B 32  ? 0.200 0.336 0.296 0.045  -0.026 0.005  32  HIS FFF CE1 
1779 N NE2 . HIS B 32  ? 0.192 0.342 0.305 0.067  -0.014 0.004  32  HIS FFF NE2 
1780 N N   . ALA B 33  ? 0.190 0.223 0.237 -0.012 -0.023 -0.018 33  ALA FFF N   
1781 C CA  . ALA B 33  ? 0.172 0.248 0.255 -0.007 -0.033 -0.012 33  ALA FFF CA  
1782 C C   . ALA B 33  ? 0.170 0.258 0.269 -0.005 -0.034 0.002  33  ALA FFF C   
1783 O O   . ALA B 33  ? 0.169 0.259 0.264 -0.021 -0.056 0.000  33  ALA FFF O   
1784 C CB  . ALA B 33  ? 0.193 0.262 0.268 0.017  -0.032 -0.030 33  ALA FFF CB  
1785 N N   . ILE B 34  ? 0.174 0.239 0.272 -0.010 -0.044 -0.010 34  ILE FFF N   
1786 C CA  . ILE B 34  ? 0.176 0.233 0.286 -0.010 -0.053 0.001  34  ILE FFF CA  
1787 C C   . ILE B 34  ? 0.197 0.224 0.319 -0.002 -0.055 0.014  34  ILE FFF C   
1788 O O   . ILE B 34  ? 0.198 0.235 0.344 -0.003 -0.064 0.039  34  ILE FFF O   
1789 C CB  . ILE B 34  ? 0.196 0.256 0.276 0.003  -0.059 0.003  34  ILE FFF CB  
1790 C CG1 . ILE B 34  ? 0.199 0.243 0.277 -0.001 -0.066 0.015  34  ILE FFF CG1 
1791 C CG2 . ILE B 34  ? 0.219 0.247 0.285 -0.020 -0.026 -0.024 34  ILE FFF CG2 
1792 C CD1 . ILE B 34  ? 0.225 0.264 0.293 -0.001 -0.039 0.026  34  ILE FFF CD1 
1793 N N   . GLY B 35  ? 0.195 0.224 0.377 0.018  -0.078 0.034  35  GLY FFF N   
1794 C CA  . GLY B 35  ? 0.199 0.231 0.396 0.013  -0.100 0.034  35  GLY FFF CA  
1795 C C   . GLY B 35  ? 0.248 0.234 0.345 -0.016 -0.105 0.024  35  GLY FFF C   
1796 O O   . GLY B 35  ? 0.261 0.245 0.351 -0.004 -0.101 0.049  35  GLY FFF O   
1797 N N   . TRP B 36  ? 0.236 0.266 0.415 -0.015 -0.143 0.015  36  TRP FFF N   
1798 C CA  . TRP B 36  ? 0.309 0.276 0.348 0.002  -0.143 0.015  36  TRP FFF CA  
1799 C C   . TRP B 36  ? 0.288 0.293 0.314 -0.016 -0.101 0.008  36  TRP FFF C   
1800 O O   . TRP B 36  ? 0.284 0.237 0.340 -0.001 -0.085 0.037  36  TRP FFF O   
1801 C CB  . TRP B 36  ? 0.378 0.339 0.372 0.044  -0.194 0.030  36  TRP FFF CB  
1802 C CG  . TRP B 36  ? 0.445 0.387 0.421 0.025  -0.139 0.025  36  TRP FFF CG  
1803 C CD1 . TRP B 36  ? 0.427 0.419 0.435 0.001  -0.184 0.043  36  TRP FFF CD1 
1804 C CD2 . TRP B 36  ? 0.368 0.453 0.397 0.025  -0.145 0.129  36  TRP FFF CD2 
1805 N NE1 . TRP B 36  ? 0.353 0.467 0.363 0.018  -0.151 0.096  36  TRP FFF NE1 
1806 C CE2 . TRP B 36  ? 0.363 0.473 0.461 0.062  -0.112 0.109  36  TRP FFF CE2 
1807 C CE3 . TRP B 36  ? 0.309 0.361 0.481 0.025  -0.164 0.084  36  TRP FFF CE3 
1808 C CZ2 . TRP B 36  ? 0.328 0.555 0.356 0.045  -0.155 0.126  36  TRP FFF CZ2 
1809 C CZ3 . TRP B 36  ? 0.356 0.450 0.445 0.024  -0.143 0.106  36  TRP FFF CZ3 
1810 C CH2 . TRP B 36  ? 0.430 0.479 0.536 0.028  -0.116 0.095  36  TRP FFF CH2 
1811 N N   . PHE B 37  ? 0.284 0.276 0.336 -0.009 -0.069 0.000  37  PHE FFF N   
1812 C CA  . PHE B 37  ? 0.296 0.260 0.330 -0.018 -0.075 0.011  37  PHE FFF CA  
1813 C C   . PHE B 37  ? 0.284 0.262 0.321 -0.013 -0.083 0.007  37  PHE FFF C   
1814 O O   . PHE B 37  ? 0.346 0.254 0.329 -0.011 -0.089 0.007  37  PHE FFF O   
1815 C CB  . PHE B 37  ? 0.256 0.258 0.333 -0.006 -0.061 0.010  37  PHE FFF CB  
1816 C CG  . PHE B 37  ? 0.265 0.282 0.314 -0.005 -0.084 0.003  37  PHE FFF CG  
1817 C CD1 . PHE B 37  ? 0.222 0.283 0.312 0.016  -0.072 0.014  37  PHE FFF CD1 
1818 C CD2 . PHE B 37  ? 0.300 0.272 0.312 0.002  -0.060 0.018  37  PHE FFF CD2 
1819 C CE1 . PHE B 37  ? 0.256 0.309 0.318 -0.017 -0.085 0.022  37  PHE FFF CE1 
1820 C CE2 . PHE B 37  ? 0.327 0.341 0.309 -0.003 -0.078 0.012  37  PHE FFF CE2 
1821 C CZ  . PHE B 37  ? 0.290 0.327 0.289 -0.017 -0.067 0.052  37  PHE FFF CZ  
1822 N N   . ARG B 38  ? 0.314 0.250 0.330 -0.023 -0.072 0.013  38  ARG FFF N   
1823 C CA  . ARG B 38  ? 0.319 0.244 0.328 -0.036 -0.085 0.008  38  ARG FFF CA  
1824 C C   . ARG B 38  ? 0.288 0.258 0.315 -0.031 -0.079 -0.005 38  ARG FFF C   
1825 O O   . ARG B 38  ? 0.337 0.259 0.319 -0.014 -0.058 -0.010 38  ARG FFF O   
1826 C CB  . ARG B 38  ? 0.307 0.270 0.387 -0.047 -0.094 0.015  38  ARG FFF CB  
1827 C CG  . ARG B 38  ? 0.318 0.267 0.391 -0.034 -0.099 0.017  38  ARG FFF CG  
1828 C CD  . ARG B 38  ? 0.343 0.360 0.407 -0.016 -0.121 -0.002 38  ARG FFF CD  
1829 N NE  . ARG B 38  ? 0.309 0.407 0.404 0.062  -0.147 0.012  38  ARG FFF NE  
1830 C CZ  . ARG B 38  ? 0.308 0.452 0.501 0.022  -0.147 -0.002 38  ARG FFF CZ  
1831 N NH1 . ARG B 38  ? 0.391 0.368 0.490 -0.018 -0.118 0.016  38  ARG FFF NH1 
1832 N NH2 . ARG B 38  ? 0.388 0.500 0.511 0.051  -0.098 -0.018 38  ARG FFF NH2 
1833 N N   . GLN B 39  ? 0.285 0.271 0.296 -0.013 -0.072 -0.003 39  GLN FFF N   
1834 C CA  . GLN B 39  ? 0.287 0.257 0.321 -0.016 -0.079 0.008  39  GLN FFF CA  
1835 C C   . GLN B 39  ? 0.318 0.245 0.304 -0.033 -0.070 0.015  39  GLN FFF C   
1836 O O   . GLN B 39  ? 0.292 0.279 0.294 -0.017 -0.093 0.013  39  GLN FFF O   
1837 C CB  . GLN B 39  ? 0.281 0.291 0.334 0.013  -0.094 -0.020 39  GLN FFF CB  
1838 C CG  . GLN B 39  ? 0.305 0.287 0.375 -0.017 -0.106 -0.022 39  GLN FFF CG  
1839 C CD  . GLN B 39  ? 0.289 0.338 0.461 0.001  -0.113 -0.011 39  GLN FFF CD  
1840 O OE1 . GLN B 39  ? 0.301 0.413 0.675 0.036  -0.137 -0.065 39  GLN FFF OE1 
1841 N NE2 . GLN B 39  ? 0.388 0.310 0.478 0.011  -0.119 0.001  39  GLN FFF NE2 
1842 N N   . ALA B 40  ? 0.307 0.270 0.344 -0.037 -0.091 0.029  40  ALA FFF N   
1843 C CA  . ALA B 40  ? 0.345 0.265 0.321 -0.030 -0.071 0.031  40  ALA FFF CA  
1844 C C   . ALA B 40  ? 0.363 0.259 0.310 -0.014 -0.058 0.016  40  ALA FFF C   
1845 O O   . ALA B 40  ? 0.330 0.246 0.323 -0.008 -0.062 0.004  40  ALA FFF O   
1846 C CB  . ALA B 40  ? 0.340 0.269 0.349 -0.050 -0.058 -0.011 40  ALA FFF CB  
1847 N N   . PRO B 41  ? 0.351 0.251 0.315 0.003  -0.066 0.018  41  PRO FFF N   
1848 C CA  . PRO B 41  ? 0.288 0.260 0.325 0.008  -0.072 0.010  41  PRO FFF CA  
1849 C C   . PRO B 41  ? 0.287 0.272 0.344 0.023  -0.053 0.013  41  PRO FFF C   
1850 O O   . PRO B 41  ? 0.264 0.274 0.426 0.015  -0.063 0.029  41  PRO FFF O   
1851 C CB  . PRO B 41  ? 0.375 0.309 0.331 0.030  -0.080 0.021  41  PRO FFF CB  
1852 C CG  . PRO B 41  ? 0.398 0.285 0.341 -0.005 -0.097 0.016  41  PRO FFF CG  
1853 C CD  . PRO B 41  ? 0.375 0.295 0.343 -0.000 -0.098 0.020  41  PRO FFF CD  
1854 N N   . GLY B 42  ? 0.271 0.272 0.393 0.004  -0.059 0.011  42  GLY FFF N   
1855 C CA  . GLY B 42  ? 0.292 0.270 0.398 -0.001 -0.048 0.000  42  GLY FFF CA  
1856 C C   . GLY B 42  ? 0.287 0.289 0.399 -0.022 -0.055 -0.010 42  GLY FFF C   
1857 O O   . GLY B 42  ? 0.353 0.300 0.405 -0.010 -0.051 -0.026 42  GLY FFF O   
1858 N N   . LYS B 43  ? 0.303 0.289 0.360 -0.016 -0.032 -0.012 43  LYS FFF N   
1859 C CA  . LYS B 43  ? 0.335 0.336 0.375 -0.013 -0.035 0.015  43  LYS FFF CA  
1860 C C   . LYS B 43  ? 0.316 0.270 0.343 -0.035 -0.039 0.001  43  LYS FFF C   
1861 O O   . LYS B 43  ? 0.312 0.301 0.330 0.009  -0.044 0.019  43  LYS FFF O   
1862 C CB  . LYS B 43  ? 0.352 0.376 0.405 -0.040 -0.041 0.025  43  LYS FFF CB  
1863 C CG  . LYS B 43  ? 0.410 0.472 0.501 0.015  -0.053 0.046  43  LYS FFF CG  
1864 C CD  . LYS B 43  ? 0.469 0.560 0.582 -0.021 -0.082 0.010  43  LYS FFF CD  
1865 C CE  . LYS B 43  ? 0.566 0.641 0.683 0.050  -0.029 0.005  43  LYS FFF CE  
1866 N NZ  . LYS B 43  ? 0.721 0.669 0.763 0.022  -0.033 0.045  43  LYS FFF NZ  
1867 N N   . GLU B 44  ? 0.395 0.312 0.353 -0.025 -0.039 0.001  44  GLU FFF N   
1868 C CA  . GLU B 44  ? 0.403 0.303 0.374 -0.021 -0.054 -0.005 44  GLU FFF CA  
1869 C C   . GLU B 44  ? 0.366 0.316 0.343 -0.028 -0.046 -0.009 44  GLU FFF C   
1870 O O   . GLU B 44  ? 0.332 0.300 0.326 -0.030 -0.021 0.000  44  GLU FFF O   
1871 C CB  . GLU B 44  ? 0.504 0.355 0.378 -0.026 -0.048 -0.014 44  GLU FFF CB  
1872 C CG  . GLU B 44  ? 0.583 0.378 0.427 -0.023 -0.029 -0.047 44  GLU FFF CG  
1873 C CD  . GLU B 44  ? 0.666 0.449 0.433 -0.012 -0.052 -0.043 44  GLU FFF CD  
1874 O OE1 . GLU B 44  ? 0.740 0.565 0.526 0.018  -0.111 -0.032 44  GLU FFF OE1 
1875 O OE2 . GLU B 44  ? 0.786 0.609 0.533 0.018  0.055  -0.068 44  GLU FFF OE2 
1876 N N   . ARG B 45  ? 0.324 0.302 0.366 -0.042 -0.057 -0.011 45  ARG FFF N   
1877 C CA  . ARG B 45  ? 0.309 0.297 0.356 -0.031 -0.049 -0.023 45  ARG FFF CA  
1878 C C   . ARG B 45  ? 0.354 0.307 0.312 -0.039 -0.063 -0.014 45  ARG FFF C   
1879 O O   . ARG B 45  ? 0.413 0.328 0.314 -0.053 -0.072 -0.010 45  ARG FFF O   
1880 C CB  . ARG B 45  ? 0.358 0.320 0.430 0.003  -0.050 -0.014 45  ARG FFF CB  
1881 C CG  . ARG B 45  ? 0.387 0.317 0.472 -0.023 -0.021 -0.025 45  ARG FFF CG  
1882 C CD  . ARG B 45  ? 0.417 0.358 0.577 0.010  -0.001 -0.025 45  ARG FFF CD  
1883 N NE  . ARG B 45  ? 0.413 0.480 0.569 -0.025 -0.016 -0.020 45  ARG FFF NE  
1884 C CZ  . ARG B 45  ? 0.417 0.527 0.614 -0.035 -0.017 -0.026 45  ARG FFF CZ  
1885 N NH1 . ARG B 45  ? 0.412 0.489 0.593 -0.047 -0.107 0.040  45  ARG FFF NH1 
1886 N NH2 . ARG B 45  ? 0.458 0.600 0.633 -0.158 -0.052 -0.064 45  ARG FFF NH2 
1887 N N   . GLU B 46  ? 0.326 0.286 0.322 -0.022 -0.076 -0.007 46  GLU FFF N   
1888 C CA  . GLU B 46  ? 0.350 0.271 0.352 -0.019 -0.059 0.011  46  GLU FFF CA  
1889 C C   . GLU B 46  ? 0.330 0.260 0.358 0.011  -0.048 -0.006 46  GLU FFF C   
1890 O O   . GLU B 46  ? 0.260 0.260 0.355 -0.025 -0.065 0.013  46  GLU FFF O   
1891 C CB  . GLU B 46  ? 0.376 0.280 0.451 0.001  -0.018 -0.002 46  GLU FFF CB  
1892 C CG  . GLU B 46  ? 0.379 0.344 0.499 -0.006 -0.055 -0.008 46  GLU FFF CG  
1893 C CD  . GLU B 46  ? 0.427 0.433 0.624 0.044  -0.067 -0.025 46  GLU FFF CD  
1894 O OE1 . GLU B 46  ? 0.544 0.477 0.688 0.071  -0.058 -0.057 46  GLU FFF OE1 
1895 O OE2 . GLU B 46  ? 0.416 0.382 0.877 -0.028 -0.135 -0.047 46  GLU FFF OE2 
1896 N N   . ARG B 47  ? 0.369 0.284 0.390 -0.008 -0.052 0.010  47  ARG FFF N   
1897 C CA  . ARG B 47  ? 0.364 0.297 0.441 -0.041 -0.086 0.023  47  ARG FFF CA  
1898 C C   . ARG B 47  ? 0.360 0.232 0.442 -0.013 -0.081 0.012  47  ARG FFF C   
1899 O O   . ARG B 47  ? 0.335 0.301 0.481 0.001  -0.050 -0.019 47  ARG FFF O   
1900 C CB  . ARG B 47  ? 0.381 0.270 0.461 -0.040 -0.081 0.029  47  ARG FFF CB  
1901 C CG  . ARG B 47  ? 0.382 0.304 0.479 -0.005 -0.073 0.009  47  ARG FFF CG  
1902 C CD  . ARG B 47  ? 0.372 0.376 0.461 0.020  -0.069 0.017  47  ARG FFF CD  
1903 N NE  . ARG B 47  ? 0.414 0.415 0.437 0.042  -0.077 0.020  47  ARG FFF NE  
1904 C CZ  . ARG B 47  ? 0.463 0.380 0.466 0.001  -0.088 -0.015 47  ARG FFF CZ  
1905 N NH1 . ARG B 47  ? 0.429 0.410 0.458 0.031  -0.130 -0.025 47  ARG FFF NH1 
1906 N NH2 . ARG B 47  ? 0.501 0.381 0.540 -0.020 -0.160 -0.018 47  ARG FFF NH2 
1907 N N   . VAL B 48  ? 0.331 0.233 0.472 0.026  -0.127 0.009  48  VAL FFF N   
1908 C CA  . VAL B 48  ? 0.314 0.215 0.475 0.034  -0.132 0.009  48  VAL FFF CA  
1909 C C   . VAL B 48  ? 0.288 0.224 0.487 0.051  -0.080 0.003  48  VAL FFF C   
1910 O O   . VAL B 48  ? 0.277 0.267 0.573 0.022  -0.091 0.049  48  VAL FFF O   
1911 C CB  . VAL B 48  ? 0.292 0.271 0.481 0.023  -0.145 0.006  48  VAL FFF CB  
1912 C CG1 . VAL B 48  ? 0.311 0.325 0.468 0.030  -0.151 -0.012 48  VAL FFF CG1 
1913 C CG2 . VAL B 48  ? 0.342 0.291 0.482 0.005  -0.150 0.025  48  VAL FFF CG2 
1914 N N   . SER B 49  ? 0.269 0.218 0.514 0.040  -0.111 0.050  49  SER FFF N   
1915 C CA  . SER B 49  ? 0.303 0.221 0.532 0.038  -0.130 0.045  49  SER FFF CA  
1916 C C   . SER B 49  ? 0.268 0.221 0.479 0.034  -0.096 0.034  49  SER FFF C   
1917 O O   . SER B 49  ? 0.288 0.243 0.447 0.031  -0.063 0.008  49  SER FFF O   
1918 C CB  . SER B 49  ? 0.333 0.240 0.566 0.048  -0.183 0.028  49  SER FFF CB  
1919 O OG  . SER B 49  ? 0.354 0.294 0.675 0.007  -0.220 0.007  49  SER FFF OG  
1920 N N   . CYS B 50  ? 0.240 0.246 0.445 0.021  -0.072 0.023  50  CYS FFF N   
1921 C CA  . CYS B 50  ? 0.218 0.236 0.398 0.024  -0.056 0.007  50  CYS FFF CA  
1922 C C   . CYS B 50  ? 0.195 0.235 0.391 0.033  -0.037 -0.015 50  CYS FFF C   
1923 O O   . CYS B 50  ? 0.188 0.231 0.445 0.006  -0.043 -0.008 50  CYS FFF O   
1924 C CB  . CYS B 50  ? 0.154 0.267 0.410 -0.012 -0.037 -0.033 50  CYS FFF CB  
1925 S SG  . CYS B 50  ? 0.235 0.316 0.387 0.007  -0.069 -0.011 50  CYS FFF SG  
1926 N N   . ILE B 51  ? 0.097 0.259 0.385 0.021  -0.041 -0.011 51  ILE FFF N   
1927 C CA  . ILE B 51  ? 0.184 0.243 0.370 0.032  -0.045 0.001  51  ILE FFF CA  
1928 C C   . ILE B 51  ? 0.177 0.241 0.318 0.012  -0.015 0.021  51  ILE FFF C   
1929 O O   . ILE B 51  ? 0.160 0.232 0.321 -0.003 -0.025 0.002  51  ILE FFF O   
1930 C CB  . ILE B 51  ? 0.203 0.268 0.354 0.020  -0.046 0.016  51  ILE FFF CB  
1931 C CG1 . ILE B 51  ? 0.222 0.267 0.354 0.012  -0.056 0.017  51  ILE FFF CG1 
1932 C CG2 . ILE B 51  ? 0.216 0.255 0.352 0.028  -0.039 0.014  51  ILE FFF CG2 
1933 C CD1 . ILE B 51  ? 0.228 0.309 0.367 0.009  -0.085 0.030  51  ILE FFF CD1 
1934 N N   . ARG B 52  ? 0.153 0.234 0.291 -0.009 -0.011 -0.007 52  ARG FFF N   
1935 C CA  . ARG B 52  ? 0.170 0.229 0.271 -0.009 -0.026 -0.020 52  ARG FFF CA  
1936 C C   . ARG B 52  ? 0.157 0.224 0.265 0.003  -0.006 -0.018 52  ARG FFF C   
1937 O O   . ARG B 52  ? 0.144 0.239 0.296 0.013  -0.030 -0.035 52  ARG FFF O   
1938 C CB  . ARG B 52  ? 0.150 0.271 0.274 0.001  -0.012 -0.027 52  ARG FFF CB  
1939 C CG  . ARG B 52  ? 0.185 0.288 0.283 -0.003 -0.015 -0.036 52  ARG FFF CG  
1940 C CD  . ARG B 52  ? 0.227 0.316 0.318 0.004  0.031  -0.062 52  ARG FFF CD  
1941 N NE  . ARG B 52  ? 0.270 0.323 0.314 -0.032 0.025  -0.040 52  ARG FFF NE  
1942 C CZ  . ARG B 52  ? 0.379 0.371 0.328 -0.026 0.015  -0.017 52  ARG FFF CZ  
1943 N NH1 . ARG B 52  ? 0.369 0.416 0.358 -0.066 0.004  -0.003 52  ARG FFF NH1 
1944 N NH2 . ARG B 52  ? 0.455 0.358 0.395 -0.025 0.003  -0.010 52  ARG FFF NH2 
1945 N N   . THR B 53  ? 0.128 0.245 0.227 -0.011 -0.031 -0.008 53  THR FFF N   
1946 C CA  . THR B 53  ? 0.118 0.231 0.222 -0.009 -0.031 0.003  53  THR FFF CA  
1947 C C   . THR B 53  ? 0.095 0.232 0.208 0.002  -0.024 -0.001 53  THR FFF C   
1948 O O   . THR B 53  ? 0.095 0.249 0.209 0.008  -0.020 -0.006 53  THR FFF O   
1949 C CB  . THR B 53  ? 0.129 0.260 0.213 -0.011 -0.026 0.001  53  THR FFF CB  
1950 O OG1 . THR B 53  ? 0.134 0.237 0.212 0.000  -0.031 0.003  53  THR FFF OG1 
1951 C CG2 . THR B 53  ? 0.146 0.251 0.242 -0.006 -0.025 -0.004 53  THR FFF CG2 
1952 N N   . PHE B 54  ? 0.102 0.224 0.211 0.013  -0.007 0.005  54  PHE FFF N   
1953 C CA  . PHE B 54  ? 0.119 0.230 0.219 0.008  0.008  0.004  54  PHE FFF CA  
1954 C C   . PHE B 54  ? 0.131 0.234 0.233 0.002  0.004  0.007  54  PHE FFF C   
1955 O O   . PHE B 54  ? 0.126 0.236 0.246 0.011  -0.001 -0.007 54  PHE FFF O   
1956 C CB  . PHE B 54  ? 0.098 0.252 0.215 0.004  0.022  -0.001 54  PHE FFF CB  
1957 C CG  . PHE B 54  ? 0.140 0.244 0.208 -0.012 -0.007 -0.006 54  PHE FFF CG  
1958 C CD1 . PHE B 54  ? 0.140 0.231 0.205 -0.016 -0.002 -0.004 54  PHE FFF CD1 
1959 C CD2 . PHE B 54  ? 0.132 0.265 0.233 -0.001 0.004  -0.001 54  PHE FFF CD2 
1960 C CE1 . PHE B 54  ? 0.152 0.236 0.233 -0.003 0.013  0.005  54  PHE FFF CE1 
1961 C CE2 . PHE B 54  ? 0.192 0.267 0.248 -0.011 0.003  0.009  54  PHE FFF CE2 
1962 C CZ  . PHE B 54  ? 0.201 0.259 0.220 -0.004 0.011  0.032  54  PHE FFF CZ  
1963 N N   . ASP B 55  ? 0.140 0.237 0.268 0.008  -0.001 -0.027 55  ASP FFF N   
1964 C CA  . ASP B 55  ? 0.141 0.269 0.274 -0.005 0.003  -0.022 55  ASP FFF CA  
1965 C C   . ASP B 55  ? 0.123 0.254 0.290 0.006  0.012  -0.022 55  ASP FFF C   
1966 O O   . ASP B 55  ? 0.124 0.285 0.361 -0.014 0.041  -0.035 55  ASP FFF O   
1967 C CB  . ASP B 55  ? 0.140 0.302 0.291 0.005  0.010  -0.028 55  ASP FFF CB  
1968 C CG  . ASP B 55  ? 0.209 0.317 0.306 0.012  0.032  -0.046 55  ASP FFF CG  
1969 O OD1 . ASP B 55  ? 0.167 0.317 0.342 0.008  0.018  -0.041 55  ASP FFF OD1 
1970 O OD2 . ASP B 55  ? 0.426 0.359 0.321 0.014  0.027  -0.063 55  ASP FFF OD2 
1971 N N   . GLY B 56  ? 0.133 0.272 0.291 0.009  0.007  -0.016 56  GLY FFF N   
1972 C CA  . GLY B 56  ? 0.173 0.266 0.314 -0.003 -0.002 -0.004 56  GLY FFF CA  
1973 C C   . GLY B 56  ? 0.157 0.289 0.332 0.007  0.003  -0.011 56  GLY FFF C   
1974 O O   . GLY B 56  ? 0.206 0.308 0.374 0.032  -0.030 -0.009 56  GLY FFF O   
1975 N N   . ILE B 57  ? 0.121 0.257 0.353 0.031  -0.002 -0.021 57  ILE FFF N   
1976 C CA  . ILE B 57  ? 0.139 0.262 0.393 0.046  0.006  -0.027 57  ILE FFF CA  
1977 C C   . ILE B 57  ? 0.166 0.275 0.456 0.020  -0.019 -0.027 57  ILE FFF C   
1978 O O   . ILE B 57  ? 0.159 0.270 0.408 0.024  -0.036 -0.025 57  ILE FFF O   
1979 C CB  . ILE B 57  ? 0.242 0.314 0.393 0.064  0.014  -0.027 57  ILE FFF CB  
1980 C CG1 . ILE B 57  ? 0.210 0.339 0.425 0.057  0.045  -0.033 57  ILE FFF CG1 
1981 C CG2 . ILE B 57  ? 0.272 0.325 0.358 0.070  0.004  -0.032 57  ILE FFF CG2 
1982 C CD1 . ILE B 57  ? 0.317 0.419 0.445 0.042  0.063  -0.024 57  ILE FFF CD1 
1983 N N   . THR B 58  ? 0.152 0.296 0.511 0.005  -0.029 -0.002 58  THR FFF N   
1984 C CA  . THR B 58  ? 0.181 0.292 0.501 0.013  -0.025 -0.007 58  THR FFF CA  
1985 C C   . THR B 58  ? 0.198 0.308 0.544 0.018  -0.036 -0.016 58  THR FFF C   
1986 O O   . THR B 58  ? 0.241 0.319 0.569 0.050  0.009  -0.046 58  THR FFF O   
1987 C CB  . THR B 58  ? 0.164 0.309 0.510 0.008  -0.048 -0.028 58  THR FFF CB  
1988 O OG1 . THR B 58  ? 0.159 0.317 0.607 -0.001 -0.076 -0.019 58  THR FFF OG1 
1989 C CG2 . THR B 58  ? 0.256 0.283 0.523 0.020  -0.059 -0.027 58  THR FFF CG2 
1990 N N   . SER B 59  ? 0.170 0.297 0.583 0.030  -0.029 -0.048 59  SER FFF N   
1991 C CA  . SER B 59  ? 0.231 0.325 0.562 0.030  -0.030 -0.068 59  SER FFF CA  
1992 C C   . SER B 59  ? 0.247 0.358 0.539 0.047  -0.056 -0.046 59  SER FFF C   
1993 O O   . SER B 59  ? 0.225 0.269 0.487 0.021  -0.093 -0.016 59  SER FFF O   
1994 C CB  . SER B 59  ? 0.186 0.338 0.569 0.031  -0.012 -0.115 59  SER FFF CB  
1995 O OG  . SER B 59  ? 0.179 0.436 0.639 0.029  -0.035 -0.059 59  SER FFF OG  
1996 N N   . TYR B 60  ? 0.233 0.372 0.612 0.054  -0.083 -0.048 60  TYR FFF N   
1997 C CA  . TYR B 60  ? 0.285 0.381 0.669 0.056  -0.144 -0.040 60  TYR FFF CA  
1998 C C   . TYR B 60  ? 0.311 0.394 0.654 0.042  -0.106 -0.055 60  TYR FFF C   
1999 O O   . TYR B 60  ? 0.433 0.330 0.677 0.059  -0.056 -0.054 60  TYR FFF O   
2000 C CB  . TYR B 60  ? 0.227 0.369 0.744 0.067  -0.150 -0.035 60  TYR FFF CB  
2001 C CG  . TYR B 60  ? 0.246 0.321 0.748 0.060  -0.207 -0.017 60  TYR FFF CG  
2002 C CD1 . TYR B 60  ? 0.253 0.324 0.733 0.034  -0.242 -0.044 60  TYR FFF CD1 
2003 C CD2 . TYR B 60  ? 0.236 0.318 0.772 0.042  -0.234 -0.033 60  TYR FFF CD2 
2004 C CE1 . TYR B 60  ? 0.358 0.352 0.732 0.026  -0.263 -0.037 60  TYR FFF CE1 
2005 C CE2 . TYR B 60  ? 0.296 0.327 0.745 0.021  -0.234 -0.040 60  TYR FFF CE2 
2006 C CZ  . TYR B 60  ? 0.272 0.355 0.752 0.020  -0.236 -0.028 60  TYR FFF CZ  
2007 O OH  . TYR B 60  ? 0.288 0.352 0.764 0.042  -0.250 -0.030 60  TYR FFF OH  
2008 N N   . VAL B 61  ? 0.446 0.393 0.716 0.093  -0.128 -0.034 61  VAL FFF N   
2009 C CA  . VAL B 61  ? 0.450 0.383 0.795 0.092  -0.111 -0.041 61  VAL FFF CA  
2010 C C   . VAL B 61  ? 0.488 0.402 0.830 0.121  -0.142 -0.019 61  VAL FFF C   
2011 O O   . VAL B 61  ? 0.471 0.370 0.965 0.127  -0.257 -0.042 61  VAL FFF O   
2012 C CB  . VAL B 61  ? 0.391 0.385 0.794 0.125  -0.057 -0.019 61  VAL FFF CB  
2013 C CG1 . VAL B 61  ? 0.364 0.362 0.798 0.081  -0.054 -0.008 61  VAL FFF CG1 
2014 C CG2 . VAL B 61  ? 0.405 0.430 0.779 0.133  -0.102 -0.004 61  VAL FFF CG2 
2015 N N   . GLU B 62  ? 0.548 0.362 0.969 0.117  -0.115 -0.027 62  GLU FFF N   
2016 C CA  . GLU B 62  ? 0.520 0.489 0.989 0.115  -0.112 -0.010 62  GLU FFF CA  
2017 C C   . GLU B 62  ? 0.492 0.476 1.003 0.093  -0.093 -0.029 62  GLU FFF C   
2018 O O   . GLU B 62  ? 0.497 0.545 1.041 0.189  -0.169 -0.004 62  GLU FFF O   
2019 C CB  . GLU B 62  ? 0.639 0.564 1.036 0.165  -0.050 -0.012 62  GLU FFF CB  
2020 C CG  . GLU B 62  ? 0.735 0.654 1.056 0.166  -0.069 0.022  62  GLU FFF CG  
2021 C CD  . GLU B 62  ? 0.770 0.747 1.124 0.143  -0.020 0.039  62  GLU FFF CD  
2022 O OE1 . GLU B 62  ? 0.795 0.882 1.109 0.146  0.040  0.048  62  GLU FFF OE1 
2023 O OE2 . GLU B 62  ? 0.869 0.789 1.263 0.219  -0.052 0.079  62  GLU FFF OE2 
2024 N N   . SER B 63  ? 0.385 0.384 0.952 0.159  -0.123 -0.071 63  SER FFF N   
2025 C CA  . SER B 63  ? 0.397 0.358 0.961 0.114  -0.053 -0.063 63  SER FFF CA  
2026 C C   . SER B 63  ? 0.373 0.426 0.950 0.092  -0.065 -0.073 63  SER FFF C   
2027 O O   . SER B 63  ? 0.409 0.533 0.927 0.119  -0.053 -0.158 63  SER FFF O   
2028 C CB  . SER B 63  ? 0.469 0.335 0.949 0.078  -0.062 -0.105 63  SER FFF CB  
2029 O OG  . SER B 63  ? 0.455 0.339 0.981 0.056  -0.035 -0.047 63  SER FFF OG  
2030 N N   . THR B 64  ? 0.319 0.408 0.972 0.078  -0.082 -0.096 64  THR FFF N   
2031 C CA  . THR B 64  ? 0.238 0.464 0.946 0.051  -0.045 -0.095 64  THR FFF CA  
2032 C C   . THR B 64  ? 0.309 0.498 0.940 0.013  -0.047 -0.110 64  THR FFF C   
2033 O O   . THR B 64  ? 0.321 0.489 0.916 0.025  -0.043 -0.124 64  THR FFF O   
2034 C CB  . THR B 64  ? 0.252 0.466 0.905 0.065  -0.061 -0.077 64  THR FFF CB  
2035 O OG1 . THR B 64  ? 0.389 0.405 0.946 0.056  -0.053 -0.111 64  THR FFF OG1 
2036 C CG2 . THR B 64  ? 0.381 0.468 0.925 0.025  -0.053 -0.083 64  THR FFF CG2 
2037 N N   . LYS B 65  ? 0.235 0.525 0.954 0.116  -0.058 -0.016 65  LYS FFF N   
2038 C CA  . LYS B 65  ? 0.312 0.532 1.047 0.078  -0.050 -0.022 65  LYS FFF CA  
2039 C C   . LYS B 65  ? 0.371 0.506 0.992 0.040  -0.039 -0.024 65  LYS FFF C   
2040 O O   . LYS B 65  ? 0.304 0.535 1.147 0.034  -0.071 0.018  65  LYS FFF O   
2041 C CB  . LYS B 65  ? 0.456 0.610 1.014 0.081  -0.019 0.008  65  LYS FFF CB  
2042 C CG  . LYS B 65  ? 0.242 0.657 1.132 0.232  -0.115 0.023  65  LYS FFF CG  
2043 C CD  . LYS B 65  ? 0.437 0.819 1.097 0.120  -0.048 0.013  65  LYS FFF CD  
2044 C CE  . LYS B 65  ? 0.491 0.932 1.129 0.080  -0.034 0.045  65  LYS FFF CE  
2045 N NZ  . LYS B 65  ? 0.372 0.956 1.187 -0.003 0.079  -0.013 65  LYS FFF NZ  
2046 N N   . GLY B 66  ? 0.250 0.577 0.801 -0.069 -0.023 -0.027 66  GLY FFF N   
2047 C CA  . GLY B 66  ? 0.158 0.566 0.822 0.028  -0.079 0.056  66  GLY FFF CA  
2048 C C   . GLY B 66  ? 0.282 0.538 0.792 -0.107 -0.143 0.051  66  GLY FFF C   
2049 O O   . GLY B 66  ? 0.376 0.613 0.869 -0.106 -0.092 -0.004 66  GLY FFF O   
2050 N N   . ARG B 67  ? 0.321 0.511 0.651 -0.159 -0.231 0.006  67  ARG FFF N   
2051 C CA  . ARG B 67  ? 0.286 0.557 0.697 -0.089 -0.134 -0.046 67  ARG FFF CA  
2052 C C   . ARG B 67  ? 0.421 0.454 0.567 0.028  -0.214 -0.027 67  ARG FFF C   
2053 O O   . ARG B 67  ? 0.255 0.526 0.630 -0.054 -0.101 -0.082 67  ARG FFF O   
2054 C CB  . ARG B 67  ? 0.341 0.535 0.780 -0.056 -0.063 -0.034 67  ARG FFF CB  
2055 C CG  . ARG B 67  ? 0.407 0.561 0.845 0.013  -0.073 -0.015 67  ARG FFF CG  
2056 C CD  . ARG B 67  ? 0.394 0.548 0.895 -0.013 -0.081 -0.023 67  ARG FFF CD  
2057 N NE  . ARG B 67  ? 0.284 0.488 0.895 0.061  -0.060 -0.008 67  ARG FFF NE  
2058 C CZ  . ARG B 67  ? 0.358 0.401 0.835 0.010  -0.109 0.021  67  ARG FFF CZ  
2059 N NH1 . ARG B 67  ? 0.271 0.414 0.850 -0.007 -0.135 0.055  67  ARG FFF NH1 
2060 N NH2 . ARG B 67  ? 0.359 0.365 0.821 0.010  -0.102 0.033  67  ARG FFF NH2 
2061 N N   . PHE B 68  ? 0.336 0.454 0.645 -0.023 -0.275 -0.094 68  PHE FFF N   
2062 C CA  . PHE B 68  ? 0.412 0.418 0.679 0.037  -0.230 0.015  68  PHE FFF CA  
2063 C C   . PHE B 68  ? 0.432 0.391 0.624 0.077  -0.251 -0.010 68  PHE FFF C   
2064 O O   . PHE B 68  ? 0.423 0.384 0.619 0.056  -0.250 0.016  68  PHE FFF O   
2065 C CB  . PHE B 68  ? 0.443 0.364 0.676 0.049  -0.241 -0.001 68  PHE FFF CB  
2066 C CG  . PHE B 68  ? 0.445 0.360 0.665 0.096  -0.285 0.033  68  PHE FFF CG  
2067 C CD1 . PHE B 68  ? 0.529 0.333 0.617 0.048  -0.294 0.018  68  PHE FFF CD1 
2068 C CD2 . PHE B 68  ? 0.560 0.399 0.634 0.070  -0.348 0.052  68  PHE FFF CD2 
2069 C CE1 . PHE B 68  ? 0.548 0.370 0.640 0.025  -0.279 0.056  68  PHE FFF CE1 
2070 C CE2 . PHE B 68  ? 0.609 0.410 0.643 0.018  -0.328 0.045  68  PHE FFF CE2 
2071 C CZ  . PHE B 68  ? 0.620 0.364 0.643 0.019  -0.324 0.068  68  PHE FFF CZ  
2072 N N   . THR B 69  ? 0.397 0.328 0.625 0.023  -0.303 -0.008 69  THR FFF N   
2073 C CA  . THR B 69  ? 0.424 0.314 0.631 0.008  -0.294 -0.011 69  THR FFF CA  
2074 C C   . THR B 69  ? 0.430 0.325 0.555 0.024  -0.265 -0.017 69  THR FFF C   
2075 O O   . THR B 69  ? 0.309 0.363 0.599 0.050  -0.266 0.006  69  THR FFF O   
2076 C CB  . THR B 69  ? 0.412 0.439 0.627 -0.010 -0.327 -0.030 69  THR FFF CB  
2077 O OG1 . THR B 69  ? 0.701 0.582 0.698 -0.085 -0.207 -0.014 69  THR FFF OG1 
2078 C CG2 . THR B 69  ? 0.393 0.350 0.658 0.035  -0.369 -0.024 69  THR FFF CG2 
2079 N N   . ILE B 70  ? 0.367 0.292 0.574 -0.002 -0.254 -0.015 70  ILE FFF N   
2080 C CA  A ILE B 70  ? 0.387 0.265 0.569 0.028  -0.198 0.011  70  ILE FFF CA  
2081 C CA  B ILE B 70  ? 0.364 0.267 0.542 0.000  -0.228 0.000  70  ILE FFF CA  
2082 C C   . ILE B 70  ? 0.343 0.271 0.528 0.003  -0.179 -0.012 70  ILE FFF C   
2083 O O   . ILE B 70  ? 0.293 0.290 0.540 0.027  -0.186 0.018  70  ILE FFF O   
2084 C CB  A ILE B 70  ? 0.368 0.272 0.571 0.034  -0.196 0.004  70  ILE FFF CB  
2085 C CB  B ILE B 70  ? 0.311 0.213 0.571 -0.017 -0.232 -0.008 70  ILE FFF CB  
2086 C CG1 A ILE B 70  ? 0.385 0.312 0.595 0.079  -0.160 0.032  70  ILE FFF CG1 
2087 C CG1 B ILE B 70  ? 0.298 0.202 0.542 -0.031 -0.246 -0.006 70  ILE FFF CG1 
2088 C CG2 A ILE B 70  ? 0.368 0.305 0.567 0.021  -0.195 -0.001 70  ILE FFF CG2 
2089 C CG2 B ILE B 70  ? 0.311 0.253 0.568 -0.027 -0.239 -0.013 70  ILE FFF CG2 
2090 C CD1 A ILE B 70  ? 0.356 0.329 0.578 0.127  -0.165 0.026  70  ILE FFF CD1 
2091 C CD1 B ILE B 70  ? 0.250 0.165 0.537 0.002  -0.259 0.008  70  ILE FFF CD1 
2092 N N   . SER B 71  ? 0.308 0.265 0.463 -0.011 -0.184 -0.003 71  SER FFF N   
2093 C CA  A SER B 71  ? 0.247 0.253 0.455 -0.019 -0.167 0.006  71  SER FFF CA  
2094 C CA  B SER B 71  ? 0.275 0.262 0.503 0.007  -0.151 0.003  71  SER FFF CA  
2095 C C   . SER B 71  ? 0.255 0.269 0.452 -0.021 -0.139 0.037  71  SER FFF C   
2096 O O   . SER B 71  ? 0.258 0.286 0.461 -0.046 -0.163 0.052  71  SER FFF O   
2097 C CB  A SER B 71  ? 0.194 0.246 0.458 -0.068 -0.135 -0.005 71  SER FFF CB  
2098 C CB  B SER B 71  ? 0.309 0.330 0.527 -0.030 -0.150 -0.032 71  SER FFF CB  
2099 O OG  A SER B 71  ? 0.193 0.229 0.402 -0.041 -0.170 0.002  71  SER FFF OG  
2100 O OG  B SER B 71  ? 0.369 0.439 0.583 -0.030 -0.081 -0.028 71  SER FFF OG  
2101 N N   . SER B 72  ? 0.281 0.251 0.396 -0.016 -0.077 0.025  72  SER FFF N   
2102 C CA  . SER B 72  ? 0.253 0.252 0.321 -0.030 -0.069 0.023  72  SER FFF CA  
2103 C C   . SER B 72  ? 0.238 0.266 0.312 -0.042 -0.040 0.019  72  SER FFF C   
2104 O O   . SER B 72  ? 0.219 0.259 0.349 -0.047 -0.043 0.007  72  SER FFF O   
2105 C CB  . SER B 72  ? 0.268 0.263 0.291 -0.015 -0.056 -0.006 72  SER FFF CB  
2106 O OG  . SER B 72  ? 0.267 0.314 0.329 0.002  -0.047 0.009  72  SER FFF OG  
2107 N N   . ASN B 73  ? 0.240 0.268 0.259 -0.037 -0.047 0.017  73  ASN FFF N   
2108 C CA  . ASN B 73  ? 0.228 0.283 0.246 -0.037 -0.047 0.010  73  ASN FFF CA  
2109 C C   . ASN B 73  ? 0.235 0.277 0.204 -0.029 -0.034 0.033  73  ASN FFF C   
2110 O O   . ASN B 73  ? 0.251 0.298 0.213 -0.055 -0.016 0.024  73  ASN FFF O   
2111 C CB  . ASN B 73  ? 0.249 0.302 0.237 -0.028 -0.074 0.019  73  ASN FFF CB  
2112 C CG  . ASN B 73  ? 0.263 0.307 0.225 -0.025 -0.045 0.015  73  ASN FFF CG  
2113 O OD1 . ASN B 73  ? 0.310 0.319 0.240 -0.011 -0.068 0.016  73  ASN FFF OD1 
2114 N ND2 . ASN B 73  ? 0.318 0.388 0.276 0.009  -0.114 -0.005 73  ASN FFF ND2 
2115 N N   . ASN B 74  ? 0.186 0.277 0.197 -0.025 -0.014 0.024  74  ASN FFF N   
2116 C CA  . ASN B 74  ? 0.169 0.282 0.216 -0.039 -0.023 0.010  74  ASN FFF CA  
2117 C C   . ASN B 74  ? 0.192 0.280 0.220 -0.043 0.001  0.018  74  ASN FFF C   
2118 O O   . ASN B 74  ? 0.193 0.301 0.231 -0.066 -0.005 0.020  74  ASN FFF O   
2119 C CB  . ASN B 74  ? 0.143 0.269 0.207 -0.021 -0.020 0.013  74  ASN FFF CB  
2120 C CG  . ASN B 74  ? 0.133 0.252 0.209 -0.015 -0.016 0.023  74  ASN FFF CG  
2121 O OD1 . ASN B 74  ? 0.200 0.257 0.223 -0.026 -0.018 0.015  74  ASN FFF OD1 
2122 N ND2 . ASN B 74  ? 0.118 0.258 0.194 -0.020 -0.013 0.017  74  ASN FFF ND2 
2123 N N   . ALA B 75  ? 0.200 0.287 0.215 -0.024 -0.004 0.012  75  ALA FFF N   
2124 C CA  . ALA B 75  ? 0.236 0.285 0.225 -0.062 0.036  0.003  75  ALA FFF CA  
2125 C C   . ALA B 75  ? 0.255 0.290 0.209 -0.069 0.025  0.003  75  ALA FFF C   
2126 O O   . ALA B 75  ? 0.266 0.343 0.254 -0.049 0.029  -0.011 75  ALA FFF O   
2127 C CB  . ALA B 75  ? 0.247 0.342 0.246 -0.070 0.008  -0.018 75  ALA FFF CB  
2128 N N   . MET B 76  ? 0.245 0.323 0.226 -0.072 0.005  0.024  76  MET FFF N   
2129 C CA  A MET B 76  ? 0.274 0.324 0.222 -0.068 0.016  0.022  76  MET FFF CA  
2130 C CA  B MET B 76  ? 0.304 0.343 0.234 -0.095 0.013  0.028  76  MET FFF CA  
2131 C C   . MET B 76  ? 0.293 0.339 0.197 -0.063 0.010  0.016  76  MET FFF C   
2132 O O   . MET B 76  ? 0.292 0.365 0.208 -0.107 -0.008 0.013  76  MET FFF O   
2133 C CB  A MET B 76  ? 0.292 0.337 0.237 -0.042 0.009  0.005  76  MET FFF CB  
2134 C CB  B MET B 76  ? 0.365 0.398 0.262 -0.086 -0.020 0.039  76  MET FFF CB  
2135 C CG  A MET B 76  ? 0.257 0.344 0.250 -0.029 0.018  -0.009 76  MET FFF CG  
2136 C CG  B MET B 76  ? 0.415 0.443 0.317 -0.124 -0.012 0.014  76  MET FFF CG  
2137 S SD  A MET B 76  ? 0.259 0.334 0.300 -0.019 -0.007 -0.042 76  MET FFF SD  
2138 S SD  B MET B 76  ? 0.474 0.584 0.372 -0.129 -0.053 0.040  76  MET FFF SD  
2139 C CE  A MET B 76  ? 0.275 0.371 0.201 -0.025 0.002  -0.073 76  MET FFF CE  
2140 C CE  B MET B 76  ? 0.493 0.584 0.359 -0.117 -0.024 0.039  76  MET FFF CE  
2141 N N   . ASN B 77  ? 0.219 0.326 0.198 -0.050 0.015  0.026  77  ASN FFF N   
2142 C CA  . ASN B 77  ? 0.199 0.330 0.213 -0.054 0.010  0.017  77  ASN FFF CA  
2143 C C   . ASN B 77  ? 0.219 0.317 0.211 -0.068 -0.019 0.016  77  ASN FFF C   
2144 O O   . ASN B 77  ? 0.276 0.310 0.245 -0.079 -0.030 0.025  77  ASN FFF O   
2145 C CB  . ASN B 77  ? 0.200 0.336 0.243 -0.035 0.002  0.027  77  ASN FFF CB  
2146 C CG  . ASN B 77  ? 0.240 0.365 0.247 -0.065 -0.024 0.027  77  ASN FFF CG  
2147 O OD1 . ASN B 77  ? 0.235 0.369 0.235 -0.025 0.021  0.035  77  ASN FFF OD1 
2148 N ND2 . ASN B 77  ? 0.224 0.403 0.286 -0.091 0.023  0.016  77  ASN FFF ND2 
2149 N N   . THR B 78  ? 0.227 0.311 0.236 -0.069 -0.047 0.027  78  THR FFF N   
2150 C CA  . THR B 78  ? 0.253 0.291 0.296 -0.105 -0.052 0.045  78  THR FFF CA  
2151 C C   . THR B 78  ? 0.277 0.290 0.292 -0.061 -0.075 0.051  78  THR FFF C   
2152 O O   . THR B 78  ? 0.248 0.317 0.343 -0.060 -0.068 0.065  78  THR FFF O   
2153 C CB  . THR B 78  ? 0.313 0.321 0.298 -0.097 -0.069 0.050  78  THR FFF CB  
2154 O OG1 . THR B 78  ? 0.339 0.394 0.270 -0.103 -0.045 0.067  78  THR FFF OG1 
2155 C CG2 . THR B 78  ? 0.323 0.375 0.330 -0.100 -0.087 0.099  78  THR FFF CG2 
2156 N N   . VAL B 79  ? 0.307 0.296 0.320 -0.057 -0.092 0.052  79  VAL FFF N   
2157 C CA  . VAL B 79  ? 0.269 0.310 0.346 -0.067 -0.097 0.062  79  VAL FFF CA  
2158 C C   . VAL B 79  ? 0.321 0.330 0.358 -0.058 -0.127 0.054  79  VAL FFF C   
2159 O O   . VAL B 79  ? 0.284 0.322 0.381 -0.034 -0.124 0.065  79  VAL FFF O   
2160 C CB  . VAL B 79  ? 0.327 0.341 0.356 -0.034 -0.099 0.056  79  VAL FFF CB  
2161 C CG1 . VAL B 79  ? 0.328 0.346 0.340 -0.022 -0.084 0.052  79  VAL FFF CG1 
2162 C CG2 . VAL B 79  ? 0.306 0.357 0.357 -0.027 -0.129 0.044  79  VAL FFF CG2 
2163 N N   . TYR B 80  ? 0.332 0.295 0.426 -0.028 -0.164 0.043  80  TYR FFF N   
2164 C CA  . TYR B 80  ? 0.417 0.311 0.415 -0.056 -0.211 0.049  80  TYR FFF CA  
2165 C C   . TYR B 80  ? 0.390 0.320 0.442 -0.059 -0.228 0.014  80  TYR FFF C   
2166 O O   . TYR B 80  ? 0.357 0.296 0.492 -0.009 -0.233 0.062  80  TYR FFF O   
2167 C CB  . TYR B 80  ? 0.389 0.373 0.415 -0.082 -0.212 0.054  80  TYR FFF CB  
2168 C CG  . TYR B 80  ? 0.420 0.423 0.392 -0.087 -0.159 0.034  80  TYR FFF CG  
2169 C CD1 . TYR B 80  ? 0.371 0.473 0.388 -0.131 -0.156 0.076  80  TYR FFF CD1 
2170 C CD2 . TYR B 80  ? 0.433 0.401 0.446 -0.122 -0.126 0.048  80  TYR FFF CD2 
2171 C CE1 . TYR B 80  ? 0.449 0.470 0.394 -0.128 -0.150 0.049  80  TYR FFF CE1 
2172 C CE2 . TYR B 80  ? 0.474 0.457 0.445 -0.141 -0.099 -0.002 80  TYR FFF CE2 
2173 C CZ  . TYR B 80  ? 0.468 0.436 0.444 -0.161 -0.108 0.002  80  TYR FFF CZ  
2174 O OH  . TYR B 80  ? 0.555 0.573 0.481 -0.155 -0.063 -0.107 80  TYR FFF OH  
2175 N N   . LEU B 81  ? 0.429 0.315 0.530 -0.034 -0.245 0.027  81  LEU FFF N   
2176 C CA  . LEU B 81  ? 0.351 0.398 0.494 -0.009 -0.245 -0.010 81  LEU FFF CA  
2177 C C   . LEU B 81  ? 0.405 0.432 0.463 -0.068 -0.256 -0.012 81  LEU FFF C   
2178 O O   . LEU B 81  ? 0.276 0.379 0.456 0.069  -0.159 -0.079 81  LEU FFF O   
2179 C CB  . LEU B 81  ? 0.365 0.358 0.470 -0.022 -0.228 0.021  81  LEU FFF CB  
2180 C CG  . LEU B 81  ? 0.349 0.388 0.471 -0.026 -0.211 0.010  81  LEU FFF CG  
2181 C CD1 . LEU B 81  ? 0.443 0.310 0.481 -0.074 -0.204 -0.007 81  LEU FFF CD1 
2182 C CD2 . LEU B 81  ? 0.345 0.392 0.434 -0.025 -0.208 -0.005 81  LEU FFF CD2 
2183 N N   . GLN B 82  ? 0.305 0.435 0.557 0.050  -0.228 0.031  82  GLN FFF N   
2184 C CA  A GLN B 82  ? 0.369 0.417 0.516 0.049  -0.242 0.014  82  GLN FFF CA  
2185 C CA  B GLN B 82  ? 0.394 0.409 0.518 0.045  -0.253 0.016  82  GLN FFF CA  
2186 C C   . GLN B 82  ? 0.377 0.442 0.562 0.038  -0.213 -0.024 82  GLN FFF C   
2187 O O   . GLN B 82  ? 0.400 0.392 0.483 0.031  -0.216 0.013  82  GLN FFF O   
2188 C CB  A GLN B 82  ? 0.409 0.401 0.538 0.033  -0.201 0.010  82  GLN FFF CB  
2189 C CB  B GLN B 82  ? 0.488 0.401 0.562 -0.001 -0.214 0.015  82  GLN FFF CB  
2190 C CG  A GLN B 82  ? 0.414 0.409 0.522 0.062  -0.176 0.019  82  GLN FFF CG  
2191 C CG  B GLN B 82  ? 0.556 0.429 0.554 0.019  -0.217 0.042  82  GLN FFF CG  
2192 C CD  A GLN B 82  ? 0.371 0.426 0.535 0.102  -0.143 0.002  82  GLN FFF CD  
2193 C CD  B GLN B 82  ? 0.614 0.449 0.588 -0.015 -0.188 0.026  82  GLN FFF CD  
2194 O OE1 A GLN B 82  ? 0.339 0.384 0.451 0.089  -0.140 0.003  82  GLN FFF OE1 
2195 O OE1 B GLN B 82  ? 0.778 0.470 0.617 -0.061 -0.114 0.041  82  GLN FFF OE1 
2196 N NE2 A GLN B 82  ? 0.337 0.414 0.545 0.068  -0.183 -0.017 82  GLN FFF NE2 
2197 N NE2 B GLN B 82  ? 0.574 0.476 0.647 0.014  -0.144 0.009  82  GLN FFF NE2 
2198 N N   . MET B 83  ? 0.269 0.438 0.614 0.059  -0.222 -0.022 83  MET FFF N   
2199 C CA  A MET B 83  ? 0.323 0.455 0.629 0.084  -0.219 -0.027 83  MET FFF CA  
2200 C CA  B MET B 83  ? 0.342 0.421 0.614 0.055  -0.225 -0.003 83  MET FFF CA  
2201 C C   . MET B 83  ? 0.312 0.450 0.596 0.074  -0.197 -0.014 83  MET FFF C   
2202 O O   . MET B 83  ? 0.297 0.437 0.662 0.126  -0.136 -0.002 83  MET FFF O   
2203 C CB  A MET B 83  ? 0.332 0.450 0.639 0.089  -0.212 -0.037 83  MET FFF CB  
2204 C CB  B MET B 83  ? 0.400 0.380 0.584 0.040  -0.242 0.015  83  MET FFF CB  
2205 C CG  A MET B 83  ? 0.320 0.486 0.647 0.104  -0.208 -0.083 83  MET FFF CG  
2206 C CG  B MET B 83  ? 0.395 0.364 0.585 0.029  -0.235 0.014  83  MET FFF CG  
2207 S SD  A MET B 83  ? 0.368 0.480 0.681 0.108  -0.146 -0.088 83  MET FFF SD  
2208 S SD  B MET B 83  ? 0.489 0.389 0.611 -0.030 -0.243 0.034  83  MET FFF SD  
2209 C CE  A MET B 83  ? 0.207 0.432 0.681 0.124  -0.188 -0.121 83  MET FFF CE  
2210 C CE  B MET B 83  ? 0.416 0.164 0.493 -0.084 -0.301 0.003  83  MET FFF CE  
2211 N N   . ASN B 84  ? 0.253 0.414 0.650 0.086  -0.184 -0.012 84  ASN FFF N   
2212 C CA  . ASN B 84  ? 0.402 0.488 0.676 0.041  -0.349 -0.012 84  ASN FFF CA  
2213 C C   . ASN B 84  ? 0.402 0.461 0.792 0.079  -0.361 0.007  84  ASN FFF C   
2214 O O   . ASN B 84  ? 0.589 0.448 0.804 0.087  -0.373 0.017  84  ASN FFF O   
2215 C CB  . ASN B 84  ? 0.444 0.522 0.724 0.025  -0.318 0.006  84  ASN FFF CB  
2216 C CG  . ASN B 84  ? 0.532 0.439 0.702 -0.008 -0.365 0.046  84  ASN FFF CG  
2217 O OD1 . ASN B 84  ? 0.642 0.509 0.767 -0.008 -0.310 -0.014 84  ASN FFF OD1 
2218 N ND2 . ASN B 84  ? 0.575 0.634 0.820 -0.085 -0.232 0.099  84  ASN FFF ND2 
2219 N N   . SER B 85  ? 0.427 0.506 0.826 0.017  -0.474 0.005  85  SER FFF N   
2220 C CA  . SER B 85  ? 0.441 0.454 0.884 -0.059 -0.362 0.027  85  SER FFF CA  
2221 C C   . SER B 85  ? 0.389 0.441 0.834 -0.046 -0.329 0.063  85  SER FFF C   
2222 O O   . SER B 85  ? 0.392 0.399 0.816 -0.042 -0.343 0.083  85  SER FFF O   
2223 C CB  . SER B 85  ? 0.457 0.448 0.940 -0.141 -0.331 0.112  85  SER FFF CB  
2224 O OG  . SER B 85  ? 0.524 0.499 1.062 -0.172 -0.436 0.111  85  SER FFF OG  
2225 N N   . LEU B 86  ? 0.481 0.401 0.792 -0.046 -0.317 0.023  86  LEU FFF N   
2226 C CA  . LEU B 86  ? 0.421 0.318 0.708 0.003  -0.320 0.039  86  LEU FFF CA  
2227 C C   . LEU B 86  ? 0.431 0.324 0.716 -0.002 -0.361 0.014  86  LEU FFF C   
2228 O O   . LEU B 86  ? 0.496 0.435 0.757 -0.006 -0.409 0.040  86  LEU FFF O   
2229 C CB  . LEU B 86  ? 0.497 0.396 0.691 0.035  -0.308 0.050  86  LEU FFF CB  
2230 C CG  . LEU B 86  ? 0.522 0.380 0.654 0.051  -0.273 0.042  86  LEU FFF CG  
2231 C CD1 . LEU B 86  ? 0.537 0.432 0.646 0.029  -0.291 0.029  86  LEU FFF CD1 
2232 C CD2 . LEU B 86  ? 0.526 0.389 0.663 0.043  -0.282 0.076  86  LEU FFF CD2 
2233 N N   . LYS B 87  ? 0.500 0.332 0.693 -0.077 -0.336 0.024  87  LYS FFF N   
2234 C CA  . LYS B 87  ? 0.465 0.353 0.653 -0.048 -0.309 0.030  87  LYS FFF CA  
2235 C C   . LYS B 87  ? 0.487 0.315 0.665 -0.043 -0.269 0.039  87  LYS FFF C   
2236 O O   . LYS B 87  ? 0.553 0.308 0.621 -0.016 -0.289 0.058  87  LYS FFF O   
2237 C CB  . LYS B 87  ? 0.494 0.408 0.706 -0.068 -0.242 0.006  87  LYS FFF CB  
2238 C CG  . LYS B 87  ? 0.559 0.504 0.699 -0.121 -0.195 -0.009 87  LYS FFF CG  
2239 C CD  . LYS B 87  ? 0.682 0.564 0.762 -0.079 -0.123 -0.048 87  LYS FFF CD  
2240 C CE  . LYS B 87  ? 0.721 0.638 0.795 -0.076 -0.069 -0.020 87  LYS FFF CE  
2241 N NZ  . LYS B 87  ? 0.767 0.662 0.803 0.029  -0.035 0.028  87  LYS FFF NZ  
2242 N N   . PRO B 88  ? 0.482 0.335 0.574 -0.021 -0.306 0.056  88  PRO FFF N   
2243 C CA  . PRO B 88  ? 0.495 0.298 0.615 -0.011 -0.253 0.060  88  PRO FFF CA  
2244 C C   . PRO B 88  ? 0.493 0.293 0.583 -0.010 -0.236 0.075  88  PRO FFF C   
2245 O O   . PRO B 88  ? 0.509 0.267 0.575 -0.074 -0.241 0.053  88  PRO FFF O   
2246 C CB  . PRO B 88  ? 0.479 0.331 0.615 0.011  -0.295 0.087  88  PRO FFF CB  
2247 C CG  . PRO B 88  ? 0.498 0.333 0.596 0.013  -0.295 0.073  88  PRO FFF CG  
2248 C CD  . PRO B 88  ? 0.445 0.366 0.603 -0.017 -0.288 0.036  88  PRO FFF CD  
2249 N N   . GLU B 89  ? 0.520 0.304 0.601 -0.044 -0.213 0.060  89  GLU FFF N   
2250 C CA  . GLU B 89  ? 0.505 0.346 0.611 -0.020 -0.232 0.071  89  GLU FFF CA  
2251 C C   . GLU B 89  ? 0.477 0.330 0.516 -0.015 -0.217 0.033  89  GLU FFF C   
2252 O O   . GLU B 89  ? 0.475 0.377 0.522 -0.060 -0.217 0.010  89  GLU FFF O   
2253 C CB  . GLU B 89  ? 0.563 0.473 0.623 0.001  -0.222 0.045  89  GLU FFF CB  
2254 C CG  . GLU B 89  ? 0.499 0.587 0.755 -0.028 -0.256 0.020  89  GLU FFF CG  
2255 C CD  . GLU B 89  ? 0.546 0.624 0.798 -0.108 -0.242 -0.018 89  GLU FFF CD  
2256 O OE1 . GLU B 89  ? 0.526 0.609 0.855 -0.071 -0.230 0.043  89  GLU FFF OE1 
2257 O OE2 . GLU B 89  ? 0.685 0.744 0.875 -0.081 -0.113 0.021  89  GLU FFF OE2 
2258 N N   . ASP B 90  ? 0.473 0.298 0.551 -0.042 -0.207 0.041  90  ASP FFF N   
2259 C CA  . ASP B 90  ? 0.432 0.320 0.500 -0.049 -0.190 0.034  90  ASP FFF CA  
2260 C C   . ASP B 90  ? 0.422 0.255 0.475 -0.017 -0.182 0.020  90  ASP FFF C   
2261 O O   . ASP B 90  ? 0.420 0.261 0.459 -0.001 -0.153 0.016  90  ASP FFF O   
2262 C CB  . ASP B 90  ? 0.422 0.314 0.550 -0.023 -0.228 0.034  90  ASP FFF CB  
2263 C CG  . ASP B 90  ? 0.420 0.350 0.587 -0.038 -0.222 0.037  90  ASP FFF CG  
2264 O OD1 . ASP B 90  ? 0.382 0.429 0.620 -0.010 -0.268 0.043  90  ASP FFF OD1 
2265 O OD2 . ASP B 90  ? 0.431 0.475 0.718 -0.080 -0.266 0.063  90  ASP FFF OD2 
2266 N N   . THR B 91  ? 0.408 0.253 0.422 0.010  -0.157 0.030  91  THR FFF N   
2267 C CA  . THR B 91  ? 0.439 0.272 0.386 -0.011 -0.164 0.010  91  THR FFF CA  
2268 C C   . THR B 91  ? 0.384 0.307 0.374 0.015  -0.133 0.004  91  THR FFF C   
2269 O O   . THR B 91  ? 0.408 0.272 0.381 0.003  -0.115 0.015  91  THR FFF O   
2270 C CB  . THR B 91  ? 0.417 0.274 0.378 0.022  -0.191 0.017  91  THR FFF CB  
2271 O OG1 . THR B 91  ? 0.454 0.303 0.400 0.012  -0.223 0.009  91  THR FFF OG1 
2272 C CG2 . THR B 91  ? 0.478 0.331 0.379 -0.003 -0.154 0.013  91  THR FFF CG2 
2273 N N   . ALA B 92  ? 0.396 0.273 0.354 0.013  -0.152 -0.009 92  ALA FFF N   
2274 C CA  . ALA B 92  ? 0.395 0.269 0.314 0.005  -0.133 -0.007 92  ALA FFF CA  
2275 C C   . ALA B 92  ? 0.431 0.237 0.317 0.014  -0.127 -0.005 92  ALA FFF C   
2276 O O   . ALA B 92  ? 0.466 0.283 0.316 0.037  -0.154 -0.009 92  ALA FFF O   
2277 C CB  . ALA B 92  ? 0.380 0.256 0.335 -0.030 -0.141 -0.009 92  ALA FFF CB  
2278 N N   . VAL B 93  ? 0.389 0.248 0.282 0.013  -0.090 0.016  93  VAL FFF N   
2279 C CA  . VAL B 93  ? 0.373 0.279 0.276 0.012  -0.060 -0.000 93  VAL FFF CA  
2280 C C   . VAL B 93  ? 0.357 0.267 0.294 -0.020 -0.067 -0.021 93  VAL FFF C   
2281 O O   . VAL B 93  ? 0.451 0.215 0.289 -0.004 -0.046 0.004  93  VAL FFF O   
2282 C CB  . VAL B 93  ? 0.357 0.286 0.302 0.005  -0.038 -0.014 93  VAL FFF CB  
2283 C CG1 . VAL B 93  ? 0.399 0.288 0.306 0.022  -0.038 -0.005 93  VAL FFF CG1 
2284 C CG2 . VAL B 93  ? 0.327 0.310 0.346 -0.007 -0.024 0.006  93  VAL FFF CG2 
2285 N N   . TYR B 94  ? 0.377 0.260 0.275 -0.022 -0.070 -0.008 94  TYR FFF N   
2286 C CA  . TYR B 94  ? 0.386 0.237 0.306 -0.004 -0.077 -0.006 94  TYR FFF CA  
2287 C C   . TYR B 94  ? 0.377 0.245 0.258 0.000  -0.052 0.006  94  TYR FFF C   
2288 O O   . TYR B 94  ? 0.379 0.344 0.252 0.022  -0.051 0.014  94  TYR FFF O   
2289 C CB  . TYR B 94  ? 0.399 0.224 0.335 0.002  -0.113 0.011  94  TYR FFF CB  
2290 C CG  . TYR B 94  ? 0.363 0.273 0.335 -0.006 -0.131 0.021  94  TYR FFF CG  
2291 C CD1 . TYR B 94  ? 0.361 0.271 0.369 -0.009 -0.117 0.030  94  TYR FFF CD1 
2292 C CD2 . TYR B 94  ? 0.415 0.305 0.382 -0.030 -0.125 0.050  94  TYR FFF CD2 
2293 C CE1 . TYR B 94  ? 0.333 0.270 0.346 -0.001 -0.147 0.024  94  TYR FFF CE1 
2294 C CE2 . TYR B 94  ? 0.426 0.270 0.398 -0.035 -0.154 0.030  94  TYR FFF CE2 
2295 C CZ  . TYR B 94  ? 0.393 0.280 0.327 -0.026 -0.155 0.022  94  TYR FFF CZ  
2296 O OH  . TYR B 94  ? 0.381 0.273 0.445 -0.039 -0.175 0.013  94  TYR FFF OH  
2297 N N   . PHE B 95  ? 0.372 0.255 0.261 -0.006 -0.058 0.007  95  PHE FFF N   
2298 C CA  . PHE B 95  ? 0.397 0.243 0.294 -0.003 -0.072 0.014  95  PHE FFF CA  
2299 C C   . PHE B 95  ? 0.336 0.268 0.298 -0.041 -0.091 0.010  95  PHE FFF C   
2300 O O   . PHE B 95  ? 0.414 0.255 0.312 -0.010 -0.051 0.026  95  PHE FFF O   
2301 C CB  . PHE B 95  ? 0.397 0.281 0.278 -0.018 -0.086 0.027  95  PHE FFF CB  
2302 C CG  . PHE B 95  ? 0.386 0.286 0.258 -0.032 -0.087 0.023  95  PHE FFF CG  
2303 C CD1 . PHE B 95  ? 0.414 0.301 0.353 -0.028 -0.082 0.035  95  PHE FFF CD1 
2304 C CD2 . PHE B 95  ? 0.399 0.290 0.317 -0.024 -0.080 0.034  95  PHE FFF CD2 
2305 C CE1 . PHE B 95  ? 0.369 0.301 0.327 -0.035 -0.082 0.028  95  PHE FFF CE1 
2306 C CE2 . PHE B 95  ? 0.378 0.323 0.311 -0.056 -0.074 0.051  95  PHE FFF CE2 
2307 C CZ  . PHE B 95  ? 0.396 0.306 0.339 -0.074 -0.058 0.022  95  PHE FFF CZ  
2308 N N   . CYS B 96  ? 0.328 0.261 0.291 -0.035 -0.113 0.016  96  CYS FFF N   
2309 C CA  . CYS B 96  ? 0.343 0.290 0.274 -0.018 -0.118 0.050  96  CYS FFF CA  
2310 C C   . CYS B 96  ? 0.292 0.253 0.251 -0.032 -0.082 0.042  96  CYS FFF C   
2311 O O   . CYS B 96  ? 0.278 0.268 0.294 -0.022 -0.069 0.006  96  CYS FFF O   
2312 C CB  . CYS B 96  ? 0.399 0.313 0.280 -0.032 -0.161 0.036  96  CYS FFF CB  
2313 S SG  . CYS B 96  ? 0.448 0.332 0.361 -0.060 -0.098 0.033  96  CYS FFF SG  
2314 N N   . ALA B 97  ? 0.243 0.243 0.258 -0.015 -0.077 0.039  97  ALA FFF N   
2315 C CA  . ALA B 97  ? 0.237 0.257 0.266 -0.019 -0.075 0.035  97  ALA FFF CA  
2316 C C   . ALA B 97  ? 0.221 0.229 0.288 -0.018 -0.059 0.015  97  ALA FFF C   
2317 O O   . ALA B 97  ? 0.224 0.245 0.337 -0.029 -0.047 0.053  97  ALA FFF O   
2318 C CB  . ALA B 97  ? 0.309 0.254 0.301 -0.029 -0.062 0.014  97  ALA FFF CB  
2319 N N   . LEU B 98  ? 0.188 0.244 0.264 -0.027 -0.052 0.014  98  LEU FFF N   
2320 C CA  . LEU B 98  ? 0.184 0.253 0.272 -0.027 -0.057 0.020  98  LEU FFF CA  
2321 C C   . LEU B 98  ? 0.223 0.233 0.268 -0.039 -0.052 0.012  98  LEU FFF C   
2322 O O   . LEU B 98  ? 0.219 0.251 0.275 -0.049 -0.074 0.019  98  LEU FFF O   
2323 C CB  . LEU B 98  ? 0.233 0.249 0.288 -0.008 -0.039 0.018  98  LEU FFF CB  
2324 C CG  . LEU B 98  ? 0.234 0.251 0.274 -0.026 -0.029 0.022  98  LEU FFF CG  
2325 C CD1 . LEU B 98  ? 0.235 0.257 0.282 -0.030 -0.039 0.036  98  LEU FFF CD1 
2326 C CD2 . LEU B 98  ? 0.247 0.263 0.311 0.006  -0.021 0.017  98  LEU FFF CD2 
2327 N N   . GLY B 99  ? 0.167 0.270 0.268 -0.036 -0.064 0.023  99  GLY FFF N   
2328 C CA  . GLY B 99  ? 0.219 0.247 0.262 -0.020 -0.047 0.037  99  GLY FFF CA  
2329 C C   . GLY B 99  ? 0.196 0.283 0.269 -0.004 -0.033 0.016  99  GLY FFF C   
2330 O O   . GLY B 99  ? 0.233 0.302 0.273 0.008  -0.046 0.021  99  GLY FFF O   
2331 N N   . VAL B 100 ? 0.220 0.266 0.277 -0.024 -0.057 0.014  100 VAL FFF N   
2332 C CA  . VAL B 100 ? 0.193 0.289 0.293 -0.012 -0.063 0.033  100 VAL FFF CA  
2333 C C   . VAL B 100 ? 0.189 0.284 0.262 0.005  -0.029 0.003  100 VAL FFF C   
2334 O O   . VAL B 100 ? 0.213 0.283 0.262 -0.011 -0.057 0.017  100 VAL FFF O   
2335 C CB  . VAL B 100 ? 0.199 0.324 0.323 -0.027 -0.077 0.046  100 VAL FFF CB  
2336 C CG1 . VAL B 100 ? 0.190 0.308 0.340 -0.042 -0.082 0.040  100 VAL FFF CG1 
2337 C CG2 . VAL B 100 ? 0.195 0.326 0.351 -0.036 -0.079 0.024  100 VAL FFF CG2 
2338 N N   . THR B 101 ? 0.186 0.258 0.261 0.010  -0.026 -0.008 101 THR FFF N   
2339 C CA  . THR B 101 ? 0.210 0.271 0.257 -0.025 -0.042 -0.001 101 THR FFF CA  
2340 C C   . THR B 101 ? 0.195 0.252 0.221 -0.013 -0.025 -0.002 101 THR FFF C   
2341 O O   . THR B 101 ? 0.199 0.252 0.240 -0.014 -0.014 0.011  101 THR FFF O   
2342 C CB  . THR B 101 ? 0.263 0.285 0.241 -0.030 -0.059 -0.003 101 THR FFF CB  
2343 O OG1 . THR B 101 ? 0.284 0.294 0.291 -0.012 -0.049 -0.018 101 THR FFF OG1 
2344 C CG2 . THR B 101 ? 0.280 0.318 0.258 -0.058 -0.059 -0.002 101 THR FFF CG2 
2345 N N   . ALA B 102 ? 0.182 0.262 0.219 -0.012 -0.016 0.002  102 ALA FFF N   
2346 C CA  . ALA B 102 ? 0.175 0.254 0.239 0.002  -0.021 -0.025 102 ALA FFF CA  
2347 C C   . ALA B 102 ? 0.190 0.283 0.259 0.018  -0.021 -0.037 102 ALA FFF C   
2348 O O   . ALA B 102 ? 0.217 0.293 0.263 0.015  -0.053 -0.043 102 ALA FFF O   
2349 C CB  . ALA B 102 ? 0.180 0.265 0.254 -0.005 -0.009 -0.013 102 ALA FFF CB  
2350 N N   . ALA B 103 ? 0.202 0.307 0.264 0.031  -0.014 -0.043 103 ALA FFF N   
2351 C CA  . ALA B 103 ? 0.250 0.302 0.299 0.037  0.004  -0.056 103 ALA FFF CA  
2352 C C   . ALA B 103 ? 0.270 0.317 0.306 0.038  -0.031 -0.040 103 ALA FFF C   
2353 O O   . ALA B 103 ? 0.317 0.300 0.309 0.000  -0.038 -0.030 103 ALA FFF O   
2354 C CB  . ALA B 103 ? 0.321 0.320 0.278 0.037  0.004  -0.021 103 ALA FFF CB  
2355 N N   . CYS B 104 ? 0.250 0.308 0.317 0.029  -0.026 -0.050 104 CYS FFF N   
2356 C CA  . CYS B 104 ? 0.287 0.320 0.338 0.046  -0.010 -0.051 104 CYS FFF CA  
2357 C C   . CYS B 104 ? 0.342 0.334 0.347 0.032  -0.030 -0.058 104 CYS FFF C   
2358 O O   . CYS B 104 ? 0.424 0.327 0.379 0.057  -0.047 -0.041 104 CYS FFF O   
2359 C CB  . CYS B 104 ? 0.299 0.289 0.386 0.034  -0.044 -0.018 104 CYS FFF CB  
2360 S SG  . CYS B 104 ? 0.299 0.345 0.399 0.007  -0.034 -0.021 104 CYS FFF SG  
2361 N N   . SER B 105 ? 0.321 0.329 0.354 0.038  -0.018 -0.062 105 SER FFF N   
2362 C CA  . SER B 105 ? 0.309 0.344 0.363 0.039  -0.049 -0.072 105 SER FFF CA  
2363 C C   . SER B 105 ? 0.298 0.338 0.372 0.034  -0.029 -0.075 105 SER FFF C   
2364 O O   . SER B 105 ? 0.298 0.343 0.448 0.024  -0.038 -0.072 105 SER FFF O   
2365 C CB  . SER B 105 ? 0.271 0.372 0.376 0.039  -0.039 -0.065 105 SER FFF CB  
2366 O OG  . SER B 105 ? 0.364 0.399 0.393 0.045  0.008  -0.022 105 SER FFF OG  
2367 N N   . ASP B 106 ? 0.318 0.319 0.348 0.030  -0.025 -0.061 106 ASP FFF N   
2368 C CA  . ASP B 106 ? 0.345 0.324 0.360 0.007  -0.065 -0.094 106 ASP FFF CA  
2369 C C   . ASP B 106 ? 0.350 0.332 0.353 0.026  -0.065 -0.096 106 ASP FFF C   
2370 O O   . ASP B 106 ? 0.499 0.329 0.355 0.049  -0.093 -0.034 106 ASP FFF O   
2371 C CB  . ASP B 106 ? 0.353 0.358 0.379 0.035  -0.065 -0.101 106 ASP FFF CB  
2372 C CG  . ASP B 106 ? 0.406 0.384 0.367 0.021  -0.047 -0.108 106 ASP FFF CG  
2373 O OD1 . ASP B 106 ? 0.388 0.356 0.390 0.051  -0.054 -0.096 106 ASP FFF OD1 
2374 O OD2 . ASP B 106 ? 0.462 0.411 0.422 0.050  -0.036 -0.102 106 ASP FFF OD2 
2375 N N   . ASN B 107 ? 0.363 0.386 0.397 -0.002 -0.092 -0.078 107 ASN FFF N   
2376 C CA  . ASN B 107 ? 0.384 0.402 0.369 0.013  -0.070 -0.060 107 ASN FFF CA  
2377 C C   . ASN B 107 ? 0.336 0.351 0.353 0.026  -0.094 -0.027 107 ASN FFF C   
2378 O O   . ASN B 107 ? 0.409 0.343 0.326 0.056  -0.058 -0.022 107 ASN FFF O   
2379 C CB  . ASN B 107 ? 0.427 0.478 0.442 -0.014 -0.076 -0.114 107 ASN FFF CB  
2380 C CG  . ASN B 107 ? 0.448 0.566 0.501 0.009  -0.051 -0.159 107 ASN FFF CG  
2381 O OD1 . ASN B 107 ? 0.439 0.597 0.580 -0.037 -0.049 -0.222 107 ASN FFF OD1 
2382 N ND2 . ASN B 107 ? 0.562 0.625 0.568 -0.052 -0.093 -0.182 107 ASN FFF ND2 
2383 N N   . PRO B 108 ? 0.332 0.321 0.402 -0.023 -0.113 0.016  108 PRO FFF N   
2384 C CA  . PRO B 108 ? 0.314 0.328 0.396 -0.049 -0.084 0.051  108 PRO FFF CA  
2385 C C   . PRO B 108 ? 0.334 0.306 0.357 -0.026 -0.095 0.038  108 PRO FFF C   
2386 O O   . PRO B 108 ? 0.360 0.329 0.444 -0.039 -0.120 -0.002 108 PRO FFF O   
2387 C CB  . PRO B 108 ? 0.362 0.441 0.406 -0.048 -0.081 0.087  108 PRO FFF CB  
2388 C CG  . PRO B 108 ? 0.302 0.442 0.493 -0.017 -0.095 0.099  108 PRO FFF CG  
2389 C CD  . PRO B 108 ? 0.330 0.415 0.485 0.023  -0.102 0.070  108 PRO FFF CD  
2390 N N   . TYR B 109 ? 0.340 0.305 0.338 -0.073 -0.088 -0.003 109 TYR FFF N   
2391 C CA  . TYR B 109 ? 0.340 0.326 0.305 -0.052 -0.085 0.025  109 TYR FFF CA  
2392 C C   . TYR B 109 ? 0.316 0.289 0.310 -0.079 -0.076 0.001  109 TYR FFF C   
2393 O O   . TYR B 109 ? 0.339 0.321 0.372 -0.106 -0.105 0.015  109 TYR FFF O   
2394 C CB  . TYR B 109 ? 0.338 0.328 0.327 -0.076 -0.061 0.043  109 TYR FFF CB  
2395 C CG  . TYR B 109 ? 0.352 0.317 0.346 -0.051 -0.074 0.019  109 TYR FFF CG  
2396 C CD1 . TYR B 109 ? 0.342 0.338 0.376 -0.062 -0.074 0.024  109 TYR FFF CD1 
2397 C CD2 . TYR B 109 ? 0.324 0.318 0.346 -0.052 -0.093 0.009  109 TYR FFF CD2 
2398 C CE1 . TYR B 109 ? 0.351 0.353 0.426 -0.033 -0.093 0.003  109 TYR FFF CE1 
2399 C CE2 . TYR B 109 ? 0.302 0.335 0.393 -0.042 -0.080 0.021  109 TYR FFF CE2 
2400 C CZ  . TYR B 109 ? 0.343 0.337 0.411 -0.014 -0.078 0.028  109 TYR FFF CZ  
2401 O OH  . TYR B 109 ? 0.343 0.419 0.485 0.010  -0.124 -0.026 109 TYR FFF OH  
2402 N N   . PHE B 110 ? 0.247 0.273 0.269 -0.054 -0.087 0.031  110 PHE FFF N   
2403 C CA  . PHE B 110 ? 0.209 0.272 0.286 -0.042 -0.078 0.037  110 PHE FFF CA  
2404 C C   . PHE B 110 ? 0.241 0.301 0.271 -0.025 -0.071 0.053  110 PHE FFF C   
2405 O O   . PHE B 110 ? 0.246 0.282 0.301 -0.039 -0.062 0.024  110 PHE FFF O   
2406 C CB  . PHE B 110 ? 0.238 0.271 0.305 -0.034 -0.083 0.027  110 PHE FFF CB  
2407 C CG  . PHE B 110 ? 0.233 0.281 0.304 -0.019 -0.083 0.021  110 PHE FFF CG  
2408 C CD1 . PHE B 110 ? 0.237 0.318 0.330 -0.016 -0.049 0.037  110 PHE FFF CD1 
2409 C CD2 . PHE B 110 ? 0.257 0.292 0.286 -0.012 -0.088 0.032  110 PHE FFF CD2 
2410 C CE1 . PHE B 110 ? 0.268 0.343 0.313 -0.015 -0.071 0.038  110 PHE FFF CE1 
2411 C CE2 . PHE B 110 ? 0.273 0.291 0.307 -0.001 -0.069 0.046  110 PHE FFF CE2 
2412 C CZ  . PHE B 110 ? 0.272 0.325 0.298 0.010  -0.089 0.055  110 PHE FFF CZ  
2413 N N   . TRP B 111 ? 0.257 0.300 0.334 -0.047 -0.062 0.052  111 TRP FFF N   
2414 C CA  . TRP B 111 ? 0.255 0.295 0.322 -0.045 -0.066 0.042  111 TRP FFF CA  
2415 C C   . TRP B 111 ? 0.258 0.314 0.319 -0.030 -0.054 0.019  111 TRP FFF C   
2416 O O   . TRP B 111 ? 0.260 0.378 0.353 -0.029 -0.048 0.070  111 TRP FFF O   
2417 C CB  . TRP B 111 ? 0.309 0.290 0.350 -0.050 -0.050 0.023  111 TRP FFF CB  
2418 C CG  . TRP B 111 ? 0.319 0.297 0.335 -0.041 -0.073 -0.002 111 TRP FFF CG  
2419 C CD1 . TRP B 111 ? 0.332 0.383 0.339 -0.010 -0.073 0.008  111 TRP FFF CD1 
2420 C CD2 . TRP B 111 ? 0.310 0.309 0.328 -0.048 -0.070 -0.004 111 TRP FFF CD2 
2421 N NE1 . TRP B 111 ? 0.345 0.374 0.347 -0.021 -0.086 -0.004 111 TRP FFF NE1 
2422 C CE2 . TRP B 111 ? 0.320 0.350 0.332 -0.050 -0.084 -0.013 111 TRP FFF CE2 
2423 C CE3 . TRP B 111 ? 0.331 0.336 0.332 -0.020 -0.089 -0.019 111 TRP FFF CE3 
2424 C CZ2 . TRP B 111 ? 0.338 0.376 0.358 -0.034 -0.072 -0.018 111 TRP FFF CZ2 
2425 C CZ3 . TRP B 111 ? 0.329 0.385 0.359 -0.016 -0.079 -0.014 111 TRP FFF CZ3 
2426 C CH2 . TRP B 111 ? 0.352 0.371 0.362 -0.034 -0.067 0.008  111 TRP FFF CH2 
2427 N N   . GLY B 112 ? 0.233 0.323 0.372 -0.048 -0.065 0.048  112 GLY FFF N   
2428 C CA  . GLY B 112 ? 0.298 0.296 0.371 -0.027 -0.057 0.056  112 GLY FFF CA  
2429 C C   . GLY B 112 ? 0.255 0.317 0.377 -0.089 -0.060 0.018  112 GLY FFF C   
2430 O O   . GLY B 112 ? 0.366 0.325 0.342 -0.056 -0.064 0.037  112 GLY FFF O   
2431 N N   . GLN B 113 ? 0.411 0.336 0.370 -0.073 -0.054 0.055  113 GLN FFF N   
2432 C CA  . GLN B 113 ? 0.484 0.316 0.368 -0.083 -0.065 0.031  113 GLN FFF CA  
2433 C C   . GLN B 113 ? 0.516 0.325 0.350 -0.066 -0.054 0.024  113 GLN FFF C   
2434 O O   . GLN B 113 ? 0.690 0.340 0.418 -0.123 -0.090 0.037  113 GLN FFF O   
2435 C CB  . GLN B 113 ? 0.555 0.433 0.425 -0.058 -0.005 0.022  113 GLN FFF CB  
2436 C CG  . GLN B 113 ? 0.596 0.548 0.498 -0.042 0.028  0.006  113 GLN FFF CG  
2437 C CD  . GLN B 113 ? 0.660 0.629 0.612 -0.092 0.092  -0.051 113 GLN FFF CD  
2438 O OE1 . GLN B 113 ? 0.855 0.754 0.697 -0.017 0.075  -0.144 113 GLN FFF OE1 
2439 N NE2 . GLN B 113 ? 0.773 0.774 0.606 -0.084 0.178  0.001  113 GLN FFF NE2 
2440 N N   . GLY B 114 ? 0.462 0.336 0.311 -0.014 -0.089 0.076  114 GLY FFF N   
2441 C CA  . GLY B 114 ? 0.480 0.355 0.297 0.013  -0.070 0.004  114 GLY FFF CA  
2442 C C   . GLY B 114 ? 0.466 0.341 0.299 0.028  -0.052 0.020  114 GLY FFF C   
2443 O O   . GLY B 114 ? 0.482 0.436 0.305 0.039  -0.060 0.049  114 GLY FFF O   
2444 N N   . THR B 115 ? 0.453 0.315 0.274 0.038  -0.058 -0.006 115 THR FFF N   
2445 C CA  . THR B 115 ? 0.470 0.312 0.284 0.043  -0.059 0.016  115 THR FFF CA  
2446 C C   . THR B 115 ? 0.464 0.308 0.269 0.034  -0.103 0.005  115 THR FFF C   
2447 O O   . THR B 115 ? 0.442 0.272 0.286 0.029  -0.107 0.032  115 THR FFF O   
2448 C CB  . THR B 115 ? 0.492 0.330 0.354 0.017  -0.032 -0.020 115 THR FFF CB  
2449 O OG1 . THR B 115 ? 0.570 0.399 0.392 0.064  -0.070 -0.023 115 THR FFF OG1 
2450 C CG2 . THR B 115 ? 0.540 0.370 0.401 0.033  -0.002 0.011  115 THR FFF CG2 
2451 N N   . GLN B 116 ? 0.524 0.296 0.321 0.023  -0.085 0.016  116 GLN FFF N   
2452 C CA  . GLN B 116 ? 0.514 0.342 0.277 0.056  -0.129 0.008  116 GLN FFF CA  
2453 C C   . GLN B 116 ? 0.557 0.344 0.310 0.019  -0.125 0.005  116 GLN FFF C   
2454 O O   . GLN B 116 ? 0.602 0.339 0.350 0.067  -0.155 -0.012 116 GLN FFF O   
2455 C CB  . GLN B 116 ? 0.546 0.297 0.331 0.034  -0.106 -0.012 116 GLN FFF CB  
2456 C CG  . GLN B 116 ? 0.565 0.306 0.348 0.043  -0.112 0.019  116 GLN FFF CG  
2457 C CD  . GLN B 116 ? 0.570 0.333 0.336 0.030  -0.103 0.019  116 GLN FFF CD  
2458 O OE1 . GLN B 116 ? 0.619 0.306 0.368 0.042  -0.125 -0.003 116 GLN FFF OE1 
2459 N NE2 . GLN B 116 ? 0.553 0.257 0.333 0.023  -0.138 0.039  116 GLN FFF NE2 
2460 N N   . VAL B 117 ? 0.521 0.274 0.300 0.038  -0.144 0.024  117 VAL FFF N   
2461 C CA  . VAL B 117 ? 0.564 0.305 0.364 0.050  -0.189 0.013  117 VAL FFF CA  
2462 C C   . VAL B 117 ? 0.598 0.322 0.375 0.074  -0.207 0.000  117 VAL FFF C   
2463 O O   . VAL B 117 ? 0.603 0.286 0.388 0.059  -0.221 -0.012 117 VAL FFF O   
2464 C CB  . VAL B 117 ? 0.600 0.316 0.380 0.045  -0.162 -0.014 117 VAL FFF CB  
2465 C CG1 . VAL B 117 ? 0.622 0.347 0.457 0.036  -0.167 0.009  117 VAL FFF CG1 
2466 C CG2 . VAL B 117 ? 0.580 0.288 0.390 0.012  -0.162 -0.013 117 VAL FFF CG2 
2467 N N   . THR B 118 ? 0.605 0.337 0.388 0.052  -0.227 0.006  118 THR FFF N   
2468 C CA  . THR B 118 ? 0.636 0.352 0.395 0.076  -0.236 0.001  118 THR FFF CA  
2469 C C   . THR B 118 ? 0.649 0.348 0.401 0.085  -0.251 0.014  118 THR FFF C   
2470 O O   . THR B 118 ? 0.765 0.477 0.404 0.118  -0.270 -0.043 118 THR FFF O   
2471 C CB  . THR B 118 ? 0.624 0.343 0.459 0.057  -0.226 -0.002 118 THR FFF CB  
2472 O OG1 . THR B 118 ? 0.623 0.392 0.478 0.019  -0.210 0.010  118 THR FFF OG1 
2473 C CG2 . THR B 118 ? 0.664 0.342 0.487 0.058  -0.188 0.009  118 THR FFF CG2 
2474 N N   . VAL B 119 ? 0.644 0.314 0.436 0.078  -0.232 0.028  119 VAL FFF N   
2475 C CA  . VAL B 119 ? 0.666 0.380 0.498 0.042  -0.316 0.055  119 VAL FFF CA  
2476 C C   . VAL B 119 ? 0.673 0.348 0.628 0.047  -0.290 0.040  119 VAL FFF C   
2477 O O   . VAL B 119 ? 0.676 0.376 0.605 0.052  -0.369 0.042  119 VAL FFF O   
2478 C CB  . VAL B 119 ? 0.605 0.411 0.490 0.028  -0.330 0.050  119 VAL FFF CB  
2479 C CG1 . VAL B 119 ? 0.588 0.376 0.543 0.079  -0.327 0.062  119 VAL FFF CG1 
2480 C CG2 . VAL B 119 ? 0.526 0.366 0.540 -0.004 -0.281 0.049  119 VAL FFF CG2 
2481 N N   . SER B 120 ? 0.773 0.406 0.654 0.102  -0.320 0.080  120 SER FFF N   
2482 C CA  . SER B 120 ? 0.797 0.422 0.754 0.118  -0.267 0.136  120 SER FFF CA  
2483 C C   . SER B 120 ? 0.765 0.417 0.852 0.139  -0.307 0.147  120 SER FFF C   
2484 O O   . SER B 120 ? 0.796 0.428 0.960 0.122  -0.312 0.112  120 SER FFF O   
2485 C CB  . SER B 120 ? 0.829 0.517 0.771 0.143  -0.229 0.173  120 SER FFF CB  
2486 O OG  . SER B 120 ? 0.858 0.620 0.845 0.141  -0.128 0.156  120 SER FFF OG  
2487 N N   . SER B 121 ? 0.887 0.461 0.913 0.172  -0.252 0.144  121 SER FFF N   
2488 C CA  . SER B 121 ? 0.882 0.556 0.904 0.212  -0.276 0.176  121 SER FFF CA  
2489 C C   . SER B 121 ? 0.976 0.588 0.879 0.166  -0.281 0.098  121 SER FFF C   
2490 O O   . SER B 121 ? 1.045 0.587 0.753 0.118  -0.401 0.083  121 SER FFF O   
2491 C CB  . SER B 121 ? 0.861 0.674 1.017 0.224  -0.195 0.064  121 SER FFF CB  
2492 O OG  . SER B 121 ? 0.817 0.874 1.138 0.278  -0.204 0.058  121 SER FFF OG  
2493 C C1  . NAG C .   ? 0.415 0.695 0.675 0.060  -0.114 -0.062 601 NAG EEE C1  
2494 C C2  . NAG C .   ? 0.485 0.698 0.726 0.043  -0.128 -0.045 601 NAG EEE C2  
2495 C C3  . NAG C .   ? 0.561 0.723 0.750 0.021  -0.156 -0.064 601 NAG EEE C3  
2496 C C4  . NAG C .   ? 0.571 0.801 0.801 0.035  -0.172 -0.056 601 NAG EEE C4  
2497 C C5  . NAG C .   ? 0.498 0.804 0.779 0.066  -0.159 -0.051 601 NAG EEE C5  
2498 C C6  . NAG C .   ? 0.455 0.899 0.799 0.067  -0.117 -0.033 601 NAG EEE C6  
2499 C C7  . NAG C .   ? 0.458 0.577 0.568 0.000  -0.042 -0.010 601 NAG EEE C7  
2500 C C8  . NAG C .   ? 0.465 0.514 0.623 0.013  -0.016 -0.016 601 NAG EEE C8  
2501 N N2  . NAG C .   ? 0.463 0.605 0.631 0.035  -0.075 -0.003 601 NAG EEE N2  
2502 O O3  . NAG C .   ? 0.698 0.705 0.785 0.062  -0.102 -0.041 601 NAG EEE O3  
2503 O O4  . NAG C .   ? 0.719 0.948 0.767 0.085  -0.173 -0.047 601 NAG EEE O4  
2504 O O5  . NAG C .   ? 0.464 0.771 0.765 0.077  -0.171 -0.028 601 NAG EEE O5  
2505 O O6  . NAG C .   ? 0.395 0.901 0.836 0.074  -0.120 0.005  601 NAG EEE O6  
2506 O O7  . NAG C .   ? 0.501 0.574 0.585 -0.046 -0.026 -0.031 601 NAG EEE O7  
2507 C C   . ACT D .   ? 0.547 0.455 0.559 0.011  -0.019 0.022  602 ACT EEE C   
2508 O O   . ACT D .   ? 0.669 0.565 0.622 -0.041 -0.005 -0.008 602 ACT EEE O   
2509 O OXT . ACT D .   ? 0.612 0.579 0.746 0.077  0.021  -0.043 602 ACT EEE OXT 
2510 C CH3 . ACT D .   ? 0.512 0.364 0.452 -0.003 -0.035 0.105  602 ACT EEE CH3 
2511 O O   . HOH E .   ? 1.090 1.175 0.856 -0.071 -0.115 0.050  701 HOH EEE O   
2512 O O   . HOH E .   ? 0.973 0.478 1.182 -0.179 -0.212 0.011  702 HOH EEE O   
2513 O O   . HOH E .   ? 0.350 0.492 0.395 0.013  -0.093 0.020  703 HOH EEE O   
2514 O O   . HOH E .   ? 0.651 0.630 0.560 0.038  0.029  0.093  704 HOH EEE O   
2515 O O   . HOH E .   ? 0.293 0.688 0.465 -0.085 -0.101 0.107  705 HOH EEE O   
2516 O O   . HOH E .   ? 0.279 0.279 0.402 -0.007 -0.073 0.007  706 HOH EEE O   
2517 O O   . HOH E .   ? 0.276 0.494 0.601 -0.069 -0.052 0.033  707 HOH EEE O   
2518 O O   . HOH E .   ? 0.499 0.794 0.712 0.016  0.101  -0.319 708 HOH EEE O   
2519 O O   . HOH E .   ? 0.621 0.529 0.810 0.026  0.269  0.018  709 HOH EEE O   
2520 O O   . HOH E .   ? 0.487 0.832 0.657 0.083  0.199  0.103  710 HOH EEE O   
2521 O O   . HOH E .   ? 0.337 0.398 0.392 0.046  -0.046 -0.014 711 HOH EEE O   
2522 O O   . HOH E .   ? 0.357 0.535 0.387 -0.037 -0.131 -0.004 712 HOH EEE O   
2523 O O   . HOH E .   ? 0.175 0.398 0.323 -0.027 0.087  -0.015 713 HOH EEE O   
2524 O O   . HOH E .   ? 0.269 0.286 0.440 -0.008 0.097  0.017  714 HOH EEE O   
2525 O O   . HOH E .   ? 0.289 0.654 0.486 -0.091 0.076  -0.041 715 HOH EEE O   
2526 O O   . HOH E .   ? 0.507 0.527 0.858 0.154  0.126  0.064  716 HOH EEE O   
2527 O O   . HOH E .   ? 0.287 0.498 0.569 -0.026 -0.096 0.087  717 HOH EEE O   
2528 O O   . HOH E .   ? 0.541 0.446 0.472 -0.086 -0.163 -0.087 718 HOH EEE O   
2529 O O   . HOH E .   ? 0.451 0.812 0.904 -0.094 -0.150 -0.279 719 HOH EEE O   
2530 O O   . HOH E .   ? 0.303 0.504 0.462 -0.007 -0.193 -0.129 720 HOH EEE O   
2531 O O   . HOH E .   ? 0.498 0.367 1.127 0.026  -0.349 -0.034 721 HOH EEE O   
2532 O O   . HOH E .   ? 0.274 0.481 0.408 0.029  0.057  -0.019 722 HOH EEE O   
2533 O O   . HOH E .   ? 0.284 0.323 0.339 -0.069 -0.019 0.011  723 HOH EEE O   
2534 O O   . HOH E .   ? 0.258 0.447 0.348 -0.053 0.054  -0.097 724 HOH EEE O   
2535 O O   . HOH E .   ? 0.150 0.318 0.303 0.006  -0.043 -0.070 725 HOH EEE O   
2536 O O   . HOH E .   ? 0.170 0.298 0.254 -0.010 -0.020 0.054  726 HOH EEE O   
2537 O O   . HOH E .   ? 0.155 0.503 0.269 -0.035 -0.001 0.051  727 HOH EEE O   
2538 O O   . HOH E .   ? 0.183 0.406 0.772 -0.023 -0.023 -0.011 728 HOH EEE O   
2539 O O   . HOH E .   ? 0.190 0.362 0.457 -0.048 0.020  0.051  729 HOH EEE O   
2540 O O   . HOH E .   ? 0.149 0.349 0.361 -0.024 -0.007 0.020  730 HOH EEE O   
2541 O O   . HOH E .   ? 0.498 0.402 0.406 0.095  -0.010 -0.026 731 HOH EEE O   
2542 O O   . HOH E .   ? 0.197 0.462 0.442 -0.018 0.042  -0.033 732 HOH EEE O   
2543 O O   . HOH E .   ? 0.735 0.670 0.802 -0.044 -0.507 0.012  733 HOH EEE O   
2544 O O   . HOH E .   ? 0.142 0.255 0.223 -0.004 -0.031 0.003  734 HOH EEE O   
2545 O O   . HOH E .   ? 1.091 0.572 0.472 -0.135 -0.019 -0.005 735 HOH EEE O   
2546 O O   . HOH E .   ? 0.255 0.601 0.544 -0.021 0.053  0.013  736 HOH EEE O   
2547 O O   . HOH E .   ? 0.124 0.266 0.219 -0.002 -0.008 0.006  737 HOH EEE O   
2548 O O   . HOH E .   ? 0.988 0.705 0.415 -0.027 -0.092 -0.040 738 HOH EEE O   
2549 O O   . HOH E .   ? 0.604 0.432 0.544 0.049  -0.189 0.101  739 HOH EEE O   
2550 O O   . HOH E .   ? 0.617 0.500 0.477 -0.116 -0.207 -0.039 740 HOH EEE O   
2551 O O   . HOH E .   ? 0.623 0.997 0.819 -0.257 0.214  0.040  741 HOH EEE O   
2552 O O   . HOH E .   ? 0.301 0.358 0.245 0.028  -0.003 0.013  742 HOH EEE O   
2553 O O   . HOH E .   ? 0.135 0.273 0.216 -0.017 0.001  -0.019 743 HOH EEE O   
2554 O O   . HOH E .   ? 0.407 0.476 0.395 -0.065 0.157  -0.015 744 HOH EEE O   
2555 O O   . HOH E .   ? 0.227 0.460 0.345 0.002  -0.007 -0.051 745 HOH EEE O   
2556 O O   . HOH E .   ? 0.287 0.491 0.606 0.032  -0.134 -0.071 746 HOH EEE O   
2557 O O   . HOH E .   ? 0.214 0.325 0.284 -0.001 -0.007 0.018  747 HOH EEE O   
2558 O O   . HOH E .   ? 0.223 0.289 0.378 -0.001 -0.036 0.005  748 HOH EEE O   
2559 O O   . HOH E .   ? 0.360 0.404 0.529 -0.004 -0.065 -0.083 749 HOH EEE O   
2560 O O   . HOH E .   ? 0.593 0.464 0.339 -0.106 -0.056 0.012  750 HOH EEE O   
2561 O O   . HOH E .   ? 0.173 0.330 0.244 0.023  0.020  -0.004 751 HOH EEE O   
2562 O O   . HOH E .   ? 0.147 0.333 0.294 -0.016 -0.024 0.014  752 HOH EEE O   
2563 O O   . HOH E .   ? 0.174 0.257 0.297 -0.034 -0.037 0.010  753 HOH EEE O   
2564 O O   . HOH E .   ? 0.297 1.006 0.359 0.116  -0.022 -0.220 754 HOH EEE O   
2565 O O   . HOH E .   ? 0.283 0.397 0.266 0.008  0.080  -0.001 755 HOH EEE O   
2566 O O   . HOH E .   ? 0.112 0.360 0.354 0.025  0.029  0.037  756 HOH EEE O   
2567 O O   . HOH E .   ? 0.151 0.370 0.306 -0.016 0.059  -0.010 757 HOH EEE O   
2568 O O   . HOH E .   ? 0.134 0.309 0.365 -0.016 -0.001 0.022  758 HOH EEE O   
2569 O O   . HOH E .   ? 0.229 0.355 0.338 -0.019 0.031  -0.101 759 HOH EEE O   
2570 O O   . HOH E .   ? 0.366 0.368 0.296 -0.100 -0.023 0.057  760 HOH EEE O   
2571 O O   . HOH E .   ? 0.118 0.243 0.204 -0.005 0.004  -0.012 761 HOH EEE O   
2572 O O   . HOH E .   ? 0.438 0.468 0.317 0.182  -0.023 -0.112 762 HOH EEE O   
2573 O O   . HOH E .   ? 0.501 0.620 0.450 0.027  0.058  -0.158 763 HOH EEE O   
2574 O O   . HOH E .   ? 0.396 0.329 0.456 0.046  -0.134 0.005  764 HOH EEE O   
2575 O O   . HOH E .   ? 0.401 0.296 0.566 -0.038 0.146  -0.081 765 HOH EEE O   
2576 O O   . HOH E .   ? 0.297 0.420 0.370 -0.081 0.016  -0.053 766 HOH EEE O   
2577 O O   . HOH E .   ? 0.395 0.622 0.565 0.057  0.107  0.046  767 HOH EEE O   
2578 O O   . HOH E .   ? 0.652 0.451 0.408 -0.061 -0.031 -0.133 768 HOH EEE O   
2579 O O   . HOH E .   ? 0.369 0.646 0.759 -0.009 -0.123 0.070  769 HOH EEE O   
2580 O O   . HOH E .   ? 0.264 0.554 0.991 -0.014 0.074  -0.167 770 HOH EEE O   
2581 O O   . HOH E .   ? 0.384 0.468 0.810 -0.115 -0.120 0.119  771 HOH EEE O   
2582 O O   . HOH E .   ? 0.336 0.327 0.273 -0.000 0.032  0.005  772 HOH EEE O   
2583 O O   . HOH E .   ? 0.444 0.531 0.773 0.002  -0.277 -0.052 773 HOH EEE O   
2584 O O   . HOH E .   ? 0.233 0.343 0.249 0.018  0.025  -0.007 774 HOH EEE O   
2585 O O   . HOH E .   ? 0.259 0.276 0.286 0.010  0.007  -0.053 775 HOH EEE O   
2586 O O   . HOH E .   ? 0.256 0.362 0.421 -0.066 0.078  -0.028 776 HOH EEE O   
2587 O O   . HOH E .   ? 0.381 0.526 0.432 0.003  -0.036 -0.034 777 HOH EEE O   
2588 O O   . HOH E .   ? 0.362 0.684 0.594 -0.126 -0.091 0.060  778 HOH EEE O   
2589 O O   . HOH E .   ? 0.267 0.545 0.511 0.041  0.034  0.092  779 HOH EEE O   
2590 O O   . HOH E .   ? 0.264 0.367 0.466 -0.026 -0.097 0.064  780 HOH EEE O   
2591 O O   . HOH E .   ? 0.161 0.258 0.309 -0.009 -0.020 0.033  781 HOH EEE O   
2592 O O   . HOH E .   ? 0.358 0.455 0.525 0.010  -0.082 0.006  782 HOH EEE O   
2593 O O   . HOH E .   ? 0.607 0.478 0.486 0.210  -0.096 -0.027 783 HOH EEE O   
2594 O O   . HOH E .   ? 0.288 0.500 0.592 0.135  0.131  -0.004 784 HOH EEE O   
2595 O O   . HOH E .   ? 0.220 0.377 0.257 0.068  -0.002 -0.055 785 HOH EEE O   
2596 O O   . HOH E .   ? 0.191 0.321 0.275 -0.008 -0.038 -0.005 786 HOH EEE O   
2597 O O   . HOH E .   ? 0.263 0.322 0.252 -0.010 0.026  0.011  787 HOH EEE O   
2598 O O   . HOH E .   ? 0.395 0.490 0.512 0.037  0.076  -0.114 788 HOH EEE O   
2599 O O   . HOH E .   ? 0.277 0.651 0.616 -0.073 0.072  -0.159 789 HOH EEE O   
2600 O O   . HOH E .   ? 0.224 0.452 0.593 -0.059 0.022  0.022  790 HOH EEE O   
2601 O O   . HOH E .   ? 0.155 0.368 0.247 -0.042 0.030  -0.021 791 HOH EEE O   
2602 O O   . HOH E .   ? 0.419 0.437 0.411 0.007  0.003  -0.083 792 HOH EEE O   
2603 O O   . HOH E .   ? 0.293 0.723 0.618 0.145  -0.050 -0.165 793 HOH EEE O   
2604 O O   . HOH E .   ? 0.167 0.293 0.298 -0.010 -0.062 0.018  794 HOH EEE O   
2605 O O   . HOH E .   ? 0.588 0.781 0.552 0.056  -0.142 0.041  795 HOH EEE O   
2606 O O   . HOH E .   ? 0.130 0.335 0.306 -0.003 -0.025 -0.016 796 HOH EEE O   
2607 O O   . HOH E .   ? 0.220 0.449 0.328 -0.078 -0.001 0.010  797 HOH EEE O   
2608 O O   . HOH E .   ? 0.620 0.466 0.744 0.169  -0.257 -0.137 798 HOH EEE O   
2609 O O   . HOH E .   ? 0.651 0.560 0.567 0.141  -0.169 -0.022 799 HOH EEE O   
2610 O O   . HOH E .   ? 0.675 0.451 0.424 -0.005 -0.114 -0.137 800 HOH EEE O   
2611 O O   . HOH E .   ? 0.439 0.851 0.726 0.280  0.329  0.187  801 HOH EEE O   
2612 O O   . HOH E .   ? 0.296 0.449 0.364 0.048  0.013  -0.050 802 HOH EEE O   
2613 O O   . HOH E .   ? 0.212 0.375 0.403 -0.061 0.030  -0.024 803 HOH EEE O   
2614 O O   . HOH E .   ? 0.145 0.416 0.431 0.000  0.083  0.106  804 HOH EEE O   
2615 O O   . HOH E .   ? 0.087 0.394 0.333 0.025  0.014  -0.039 805 HOH EEE O   
2616 O O   . HOH E .   ? 0.138 0.276 0.325 -0.001 -0.012 0.008  806 HOH EEE O   
2617 O O   . HOH E .   ? 0.339 0.438 0.243 0.166  0.017  0.030  807 HOH EEE O   
2618 O O   . HOH E .   ? 0.352 0.505 0.402 0.043  -0.026 0.085  808 HOH EEE O   
2619 O O   . HOH E .   ? 0.214 0.325 0.233 -0.052 -0.017 -0.007 809 HOH EEE O   
2620 O O   . HOH E .   ? 0.429 0.255 0.368 0.046  -0.111 -0.025 810 HOH EEE O   
2621 O O   . HOH E .   ? 0.180 0.299 0.301 0.029  0.044  0.003  811 HOH EEE O   
2622 O O   . HOH E .   ? 0.270 0.370 0.556 -0.000 0.070  0.000  812 HOH EEE O   
2623 O O   . HOH E .   ? 0.238 0.345 0.351 -0.051 -0.035 0.041  813 HOH EEE O   
2624 O O   . HOH E .   ? 0.459 0.482 0.449 -0.003 0.015  -0.060 814 HOH EEE O   
2625 O O   . HOH E .   ? 0.647 0.879 0.458 0.120  -0.004 0.174  815 HOH EEE O   
2626 O O   . HOH E .   ? 0.936 0.609 0.375 0.038  -0.157 0.034  816 HOH EEE O   
2627 O O   . HOH E .   ? 0.781 0.507 0.371 0.068  -0.016 -0.047 817 HOH EEE O   
2628 O O   . HOH E .   ? 0.224 0.468 0.410 -0.026 -0.104 -0.059 818 HOH EEE O   
2629 O O   . HOH E .   ? 0.196 0.429 0.310 -0.003 -0.047 -0.016 819 HOH EEE O   
2630 O O   . HOH E .   ? 0.351 0.399 0.556 0.039  -0.167 -0.012 820 HOH EEE O   
2631 O O   . HOH E .   ? 0.144 0.312 0.274 -0.016 0.038  -0.023 821 HOH EEE O   
2632 O O   . HOH E .   ? 1.149 0.439 0.284 0.167  -0.100 -0.032 822 HOH EEE O   
2633 O O   . HOH E .   ? 0.432 0.392 0.684 -0.021 -0.238 0.021  823 HOH EEE O   
2634 O O   . HOH E .   ? 0.633 0.397 0.313 0.074  -0.104 -0.049 824 HOH EEE O   
2635 O O   . HOH E .   ? 0.353 0.480 0.616 0.040  -0.042 0.107  825 HOH EEE O   
2636 O O   . HOH E .   ? 0.460 0.503 0.388 0.041  -0.095 0.009  826 HOH EEE O   
2637 O O   . HOH E .   ? 0.619 0.382 0.228 -0.118 0.020  0.006  827 HOH EEE O   
2638 O O   . HOH E .   ? 0.529 0.426 0.332 -0.116 0.033  0.004  828 HOH EEE O   
2639 O O   . HOH E .   ? 0.201 0.650 0.569 0.051  -0.003 -0.055 829 HOH EEE O   
2640 O O   . HOH E .   ? 0.255 0.688 0.538 0.034  -0.143 -0.155 830 HOH EEE O   
2641 O O   . HOH E .   ? 0.342 0.416 0.592 -0.037 -0.110 -0.019 831 HOH EEE O   
2642 O O   . HOH E .   ? 0.349 0.389 0.301 0.047  -0.013 0.099  832 HOH EEE O   
2643 O O   . HOH E .   ? 0.212 0.401 0.222 -0.045 -0.001 -0.014 833 HOH EEE O   
2644 O O   . HOH E .   ? 0.656 0.495 0.890 -0.211 -0.097 0.096  834 HOH EEE O   
2645 O O   . HOH E .   ? 0.317 0.325 0.290 -0.014 0.027  -0.023 835 HOH EEE O   
2646 O O   . HOH E .   ? 0.502 0.473 0.417 0.097  0.048  -0.113 836 HOH EEE O   
2647 O O   . HOH E .   ? 0.465 0.559 0.563 0.063  -0.251 -0.115 837 HOH EEE O   
2648 O O   . HOH E .   ? 0.305 0.830 0.435 0.031  -0.116 0.114  838 HOH EEE O   
2649 O O   . HOH E .   ? 0.430 0.391 0.380 0.019  -0.038 -0.060 839 HOH EEE O   
2650 O O   . HOH E .   ? 0.322 0.539 0.419 0.062  -0.023 0.010  840 HOH EEE O   
2651 O O   . HOH E .   ? 0.625 0.418 0.397 0.047  -0.007 0.004  841 HOH EEE O   
2652 O O   . HOH E .   ? 0.390 0.500 0.310 -0.002 0.127  0.045  842 HOH EEE O   
2653 O O   . HOH E .   ? 0.499 0.416 0.334 0.012  0.052  0.031  843 HOH EEE O   
2654 O O   . HOH E .   ? 0.134 0.295 0.315 -0.016 -0.014 0.017  844 HOH EEE O   
2655 O O   . HOH E .   ? 0.689 0.960 0.632 0.044  0.317  0.039  845 HOH EEE O   
2656 O O   . HOH E .   ? 0.224 0.613 0.285 -0.033 0.065  -0.011 846 HOH EEE O   
2657 O O   . HOH E .   ? 0.789 0.384 0.458 0.134  -0.066 -0.022 847 HOH EEE O   
2658 O O   . HOH E .   ? 0.296 0.377 0.578 -0.051 -0.193 0.024  848 HOH EEE O   
2659 O O   . HOH E .   ? 0.276 0.339 0.342 -0.025 0.028  0.007  849 HOH EEE O   
2660 O O   . HOH E .   ? 0.367 1.291 0.913 0.068  -0.007 0.042  850 HOH EEE O   
2661 O O   . HOH E .   ? 0.585 1.224 0.762 -0.026 -0.357 0.235  851 HOH EEE O   
2662 O O   . HOH E .   ? 0.435 0.557 0.267 -0.074 -0.006 0.001  852 HOH EEE O   
2663 O O   . HOH E .   ? 0.788 0.758 0.433 -0.079 -0.306 0.068  853 HOH EEE O   
2664 O O   . HOH E .   ? 0.469 1.047 0.772 0.311  0.188  -0.070 854 HOH EEE O   
2665 O O   . HOH E .   ? 0.475 0.897 0.775 0.105  -0.122 -0.130 855 HOH EEE O   
2666 O O   . HOH E .   ? 0.594 0.573 0.331 0.018  -0.054 0.064  856 HOH EEE O   
2667 O O   . HOH E .   ? 0.593 0.646 0.619 -0.052 0.112  0.095  857 HOH EEE O   
2668 O O   . HOH E .   ? 0.283 0.644 0.604 0.034  -0.107 0.083  858 HOH EEE O   
2669 O O   . HOH E .   ? 0.358 0.488 0.555 -0.024 0.049  0.101  859 HOH EEE O   
2670 O O   . HOH E .   ? 0.749 0.478 0.762 -0.040 -0.342 -0.054 860 HOH EEE O   
2671 O O   . HOH E .   ? 0.413 0.553 0.815 0.061  -0.160 -0.061 861 HOH EEE O   
2672 O O   . HOH E .   ? 0.234 0.492 0.613 0.042  -0.033 -0.101 862 HOH EEE O   
2673 O O   . HOH E .   ? 0.241 0.627 0.848 0.020  0.002  0.225  863 HOH EEE O   
2674 O O   . HOH E .   ? 0.557 0.449 0.650 0.024  -0.201 0.025  864 HOH EEE O   
2675 O O   . HOH E .   ? 0.431 0.752 0.782 -0.085 0.162  -0.362 865 HOH EEE O   
2676 O O   . HOH E .   ? 0.477 0.711 0.436 0.083  0.015  -0.050 866 HOH EEE O   
2677 O O   . HOH E .   ? 0.360 0.725 0.654 0.171  0.058  -0.022 867 HOH EEE O   
2678 O O   . HOH E .   ? 0.208 1.101 0.634 -0.066 0.007  0.004  868 HOH EEE O   
2679 O O   . HOH E .   ? 0.531 0.578 0.887 0.101  0.096  0.058  869 HOH EEE O   
2680 O O   . HOH E .   ? 1.033 0.449 0.527 0.025  0.031  -0.132 870 HOH EEE O   
2681 O O   . HOH E .   ? 0.798 0.333 0.756 -0.006 -0.269 -0.002 871 HOH EEE O   
2682 O O   . HOH E .   ? 0.256 0.425 0.567 -0.009 -0.026 0.050  872 HOH EEE O   
2683 O O   . HOH E .   ? 0.869 0.687 0.713 -0.094 -0.019 0.028  873 HOH EEE O   
2684 O O   . HOH E .   ? 0.355 1.043 0.655 0.145  0.109  -0.098 874 HOH EEE O   
2685 O O   . HOH E .   ? 0.499 0.691 0.898 0.054  -0.225 -0.273 875 HOH EEE O   
2686 O O   . HOH E .   ? 0.255 0.584 0.314 -0.018 0.002  0.022  876 HOH EEE O   
2687 O O   . HOH E .   ? 0.704 0.663 0.856 0.135  -0.066 0.091  877 HOH EEE O   
2688 O O   . HOH E .   ? 0.924 0.660 0.764 -0.236 0.034  -0.115 878 HOH EEE O   
2689 O O   . HOH E .   ? 0.995 0.482 0.415 -0.137 0.066  -0.076 879 HOH EEE O   
2690 O O   . HOH E .   ? 0.397 0.560 0.590 0.097  -0.073 -0.132 880 HOH EEE O   
2691 O O   . HOH E .   ? 0.428 0.605 0.631 -0.022 -0.190 -0.090 881 HOH EEE O   
2692 O O   . HOH E .   ? 0.581 0.654 0.857 0.170  0.114  0.208  882 HOH EEE O   
2693 O O   . HOH E .   ? 0.316 0.397 0.498 -0.046 0.065  0.005  883 HOH EEE O   
2694 O O   . HOH E .   ? 0.278 0.416 0.338 -0.011 0.060  0.047  884 HOH EEE O   
2695 O O   . HOH E .   ? 1.235 0.806 0.547 -0.073 0.122  -0.172 885 HOH EEE O   
2696 O O   . HOH E .   ? 0.826 0.542 0.892 -0.234 -0.239 0.162  886 HOH EEE O   
2697 O O   . HOH E .   ? 0.805 0.715 0.468 -0.159 -0.109 -0.049 887 HOH EEE O   
2698 O O   . HOH E .   ? 0.345 0.382 0.332 0.038  -0.109 -0.010 888 HOH EEE O   
2699 O O   . HOH E .   ? 0.335 0.530 0.440 -0.007 -0.107 -0.014 889 HOH EEE O   
2700 O O   . HOH E .   ? 0.448 0.854 0.770 0.194  -0.205 -0.161 890 HOH EEE O   
2701 O O   . HOH E .   ? 0.456 0.798 0.530 0.073  -0.098 -0.122 891 HOH EEE O   
2702 O O   . HOH E .   ? 0.238 0.663 0.457 -0.023 -0.121 0.097  892 HOH EEE O   
2703 O O   . HOH E .   ? 0.316 0.527 0.387 -0.012 0.026  0.033  893 HOH EEE O   
2704 O O   . HOH E .   ? 1.566 0.899 0.713 -0.382 0.011  0.152  894 HOH EEE O   
2705 O O   . HOH E .   ? 0.488 0.400 0.371 0.074  0.123  -0.007 895 HOH EEE O   
2706 O O   . HOH E .   ? 0.516 0.762 0.696 0.067  0.046  -0.185 896 HOH EEE O   
2707 O O   . HOH E .   ? 0.896 0.598 0.755 0.159  0.166  -0.126 897 HOH EEE O   
2708 O O   . HOH E .   ? 0.606 0.684 0.406 0.019  0.042  -0.043 898 HOH EEE O   
2709 O O   . HOH E .   ? 0.396 0.536 0.351 -0.029 0.018  0.077  899 HOH EEE O   
2710 O O   . HOH E .   ? 0.829 0.888 0.730 0.117  0.002  -0.289 900 HOH EEE O   
2711 O O   . HOH E .   ? 0.296 0.684 0.374 0.062  0.061  0.125  901 HOH EEE O   
2712 O O   . HOH E .   ? 0.646 0.563 0.369 -0.004 0.011  -0.060 902 HOH EEE O   
2713 O O   . HOH F .   ? 0.912 0.542 0.519 -0.171 0.174  -0.009 201 HOH FFF O   
2714 O O   . HOH F .   ? 0.515 0.680 0.801 -0.115 -0.254 -0.041 202 HOH FFF O   
2715 O O   . HOH F .   ? 0.915 0.929 0.618 -0.147 0.043  -0.313 203 HOH FFF O   
2716 O O   . HOH F .   ? 0.339 0.666 0.905 0.117  -0.129 -0.231 204 HOH FFF O   
2717 O O   . HOH F .   ? 0.702 0.562 0.517 0.171  -0.138 -0.079 205 HOH FFF O   
2718 O O   . HOH F .   ? 0.808 0.481 0.997 -0.069 -0.244 0.041  206 HOH FFF O   
2719 O O   . HOH F .   ? 0.817 0.722 1.011 0.198  -0.260 -0.129 207 HOH FFF O   
2720 O O   . HOH F .   ? 0.128 0.621 0.591 -0.066 0.009  -0.187 208 HOH FFF O   
2721 O O   . HOH F .   ? 0.396 0.399 0.753 -0.049 -0.139 -0.081 209 HOH FFF O   
2722 O O   . HOH F .   ? 0.882 0.374 0.454 0.021  -0.118 0.044  210 HOH FFF O   
2723 O O   . HOH F .   ? 0.408 0.355 0.446 -0.015 -0.102 -0.029 211 HOH FFF O   
2724 O O   . HOH F .   ? 0.178 0.424 0.514 -0.037 0.013  0.003  212 HOH FFF O   
2725 O O   . HOH F .   ? 0.814 0.440 0.816 -0.047 0.317  0.096  213 HOH FFF O   
2726 O O   . HOH F .   ? 0.293 0.329 0.455 -0.055 0.097  0.051  214 HOH FFF O   
2727 O O   . HOH F .   ? 0.741 0.472 0.500 -0.144 -0.070 0.022  215 HOH FFF O   
2728 O O   . HOH F .   ? 0.392 0.573 1.038 -0.073 -0.132 -0.072 216 HOH FFF O   
2729 O O   . HOH F .   ? 0.331 0.710 0.476 -0.131 0.063  0.035  217 HOH FFF O   
2730 O O   . HOH F .   ? 0.327 0.581 0.721 -0.073 0.066  0.017  218 HOH FFF O   
2731 O O   . HOH F .   ? 0.407 0.500 0.495 -0.035 0.014  -0.036 219 HOH FFF O   
2732 O O   . HOH F .   ? 0.544 0.363 0.579 0.072  0.043  -0.043 220 HOH FFF O   
2733 O O   . HOH F .   ? 0.446 0.875 0.865 -0.129 0.042  -0.170 221 HOH FFF O   
2734 O O   . HOH F .   ? 0.282 0.281 0.391 -0.010 -0.076 -0.002 222 HOH FFF O   
2735 O O   . HOH F .   ? 0.438 0.344 0.403 0.105  -0.144 -0.052 223 HOH FFF O   
2736 O O   . HOH F .   ? 0.555 0.503 0.350 -0.210 0.182  -0.056 224 HOH FFF O   
2737 O O   . HOH F .   ? 0.170 0.289 0.219 -0.018 0.018  -0.006 225 HOH FFF O   
2738 O O   . HOH F .   ? 0.412 0.471 0.592 0.086  -0.011 -0.046 226 HOH FFF O   
2739 O O   . HOH F .   ? 0.456 0.419 0.430 0.036  -0.153 -0.053 227 HOH FFF O   
2740 O O   . HOH F .   ? 0.241 0.736 0.830 -0.085 -0.068 0.250  228 HOH FFF O   
2741 O O   . HOH F .   ? 0.492 0.564 0.474 -0.001 0.147  -0.040 229 HOH FFF O   
2742 O O   . HOH F .   ? 0.931 0.497 0.298 -0.191 -0.042 -0.017 230 HOH FFF O   
2743 O O   . HOH F .   ? 0.334 0.394 0.573 0.002  -0.117 -0.012 231 HOH FFF O   
2744 O O   . HOH F .   ? 0.197 0.464 0.419 0.040  -0.096 -0.007 232 HOH FFF O   
2745 O O   . HOH F .   ? 0.598 0.267 0.451 0.034  -0.174 -0.029 233 HOH FFF O   
2746 O O   . HOH F .   ? 0.285 0.312 0.306 -0.012 -0.004 0.019  234 HOH FFF O   
2747 O O   . HOH F .   ? 0.182 0.254 0.243 0.004  -0.010 -0.037 235 HOH FFF O   
2748 O O   . HOH F .   ? 0.413 0.285 0.396 -0.012 -0.104 0.046  236 HOH FFF O   
2749 O O   . HOH F .   ? 0.157 0.340 0.347 -0.015 0.005  0.003  237 HOH FFF O   
2750 O O   . HOH F .   ? 0.517 0.584 0.571 -0.138 -0.063 0.124  238 HOH FFF O   
2751 O O   . HOH F .   ? 0.903 0.381 0.554 -0.141 -0.316 0.032  239 HOH FFF O   
2752 O O   . HOH F .   ? 0.778 0.619 0.532 -0.305 -0.009 -0.138 240 HOH FFF O   
2753 O O   . HOH F .   ? 0.604 0.501 0.535 -0.099 -0.132 -0.020 241 HOH FFF O   
2754 O O   . HOH F .   ? 0.321 0.466 0.359 0.024  -0.062 -0.052 242 HOH FFF O   
2755 O O   . HOH F .   ? 0.409 0.496 0.342 -0.028 0.036  0.066  243 HOH FFF O   
2756 O O   . HOH F .   ? 0.568 0.335 0.538 0.065  -0.302 -0.006 244 HOH FFF O   
2757 O O   . HOH F .   ? 0.414 0.390 0.389 0.020  -0.065 -0.009 245 HOH FFF O   
2758 O O   . HOH F .   ? 0.283 0.508 0.631 -0.043 -0.106 0.014  246 HOH FFF O   
2759 O O   . HOH F .   ? 0.272 0.441 0.395 -0.040 -0.058 0.050  247 HOH FFF O   
2760 O O   . HOH F .   ? 0.377 0.278 0.305 0.002  -0.008 -0.021 248 HOH FFF O   
2761 O O   . HOH F .   ? 0.243 0.331 0.469 0.002  -0.029 -0.048 249 HOH FFF O   
2762 O O   . HOH F .   ? 0.945 0.428 0.377 -0.053 -0.005 0.095  250 HOH FFF O   
2763 O O   . HOH F .   ? 0.382 0.679 0.727 -0.084 0.241  0.064  251 HOH FFF O   
2764 O O   . HOH F .   ? 0.718 0.576 0.343 -0.130 -0.005 -0.031 252 HOH FFF O   
2765 O O   . HOH F .   ? 0.337 0.582 0.534 0.008  0.126  0.020  253 HOH FFF O   
2766 O O   . HOH F .   ? 0.416 0.369 0.279 -0.002 -0.021 0.026  254 HOH FFF O   
2767 O O   . HOH F .   ? 0.503 0.593 0.475 0.069  -0.044 -0.126 255 HOH FFF O   
2768 O O   . HOH F .   ? 0.276 0.679 0.571 -0.079 -0.168 0.245  256 HOH FFF O   
2769 O O   . HOH F .   ? 0.484 0.436 0.560 -0.086 -0.169 0.003  257 HOH FFF O   
2770 O O   . HOH F .   ? 0.307 0.745 0.327 -0.104 0.000  0.093  258 HOH FFF O   
2771 O O   . HOH F .   ? 0.335 0.304 0.388 -0.039 -0.081 0.006  259 HOH FFF O   
2772 O O   . HOH F .   ? 0.485 0.437 0.664 -0.235 -0.165 0.040  260 HOH FFF O   
2773 O O   . HOH F .   ? 0.466 0.591 0.497 -0.091 0.074  -0.107 261 HOH FFF O   
2774 O O   . HOH F .   ? 0.485 0.355 0.594 0.153  -0.251 -0.189 262 HOH FFF O   
2775 O O   . HOH F .   ? 0.442 0.719 0.448 -0.009 -0.023 0.061  263 HOH FFF O   
2776 O O   . HOH F .   ? 0.232 0.686 0.338 -0.094 -0.008 0.107  264 HOH FFF O   
2777 O O   . HOH F .   ? 0.304 0.341 0.437 0.004  -0.024 -0.055 265 HOH FFF O   
2778 O O   . HOH F .   ? 0.195 1.020 0.551 -0.005 -0.003 0.163  266 HOH FFF O   
2779 O O   . HOH F .   ? 0.591 0.657 0.552 0.027  0.125  -0.087 267 HOH FFF O   
2780 O O   . HOH F .   ? 0.319 0.617 0.724 -0.095 -0.173 0.132  268 HOH FFF O   
2781 O O   . HOH F .   ? 0.167 0.444 0.669 0.018  -0.047 0.033  269 HOH FFF O   
2782 O O   . HOH F .   ? 0.665 0.469 0.554 0.197  -0.123 -0.063 270 HOH FFF O   
2783 O O   . HOH F .   ? 0.482 0.536 0.750 -0.059 -0.097 0.147  271 HOH FFF O   
2784 O O   . HOH F .   ? 0.424 0.806 0.607 -0.037 -0.061 0.048  272 HOH FFF O   
2785 O O   . HOH F .   ? 0.426 0.535 0.519 -0.043 -0.157 -0.111 273 HOH FFF O   
2786 O O   . HOH F .   ? 0.638 0.673 0.782 -0.188 0.016  0.089  274 HOH FFF O   
2787 O O   . HOH F .   ? 0.458 1.092 0.759 0.014  -0.134 -0.134 275 HOH FFF O   
2788 O O   . HOH F .   ? 0.609 0.511 0.557 0.118  -0.224 -0.155 276 HOH FFF O   
2789 O O   . HOH F .   ? 0.572 0.434 0.756 0.050  0.149  -0.166 277 HOH FFF O   
2790 O O   . HOH F .   ? 0.415 1.062 0.828 -0.150 -0.078 0.355  278 HOH FFF O   
2791 O O   . HOH F .   ? 0.243 0.560 0.403 0.008  -0.084 0.023  279 HOH FFF O   
2792 O O   . HOH F .   ? 0.549 0.427 0.442 -0.032 -0.041 0.074  280 HOH FFF O   
2793 O O   . HOH F .   ? 0.287 0.708 0.380 -0.113 0.091  -0.064 281 HOH FFF O   
2794 O O   . HOH F .   ? 0.584 0.639 0.611 -0.038 -0.040 0.010  282 HOH FFF O   
2795 O O   . HOH F .   ? 0.296 0.705 0.547 0.119  -0.116 -0.012 283 HOH FFF O   
2796 O O   . HOH F .   ? 0.243 0.388 0.297 -0.009 -0.007 -0.022 284 HOH FFF O   
2797 O O   . HOH F .   ? 0.669 0.492 0.567 -0.148 0.331  -0.048 285 HOH FFF O   
2798 O O   . HOH F .   ? 0.170 0.372 0.223 -0.006 0.052  -0.000 286 HOH FFF O   
2799 O O   . HOH F .   ? 0.398 0.776 0.505 0.118  0.066  0.068  287 HOH FFF O   
2800 O O   . HOH F .   ? 0.346 1.028 0.419 -0.216 0.026  -0.152 288 HOH FFF O   
# 
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   PRO 1   330 ?   ?   ?   EEE . n 
A 1 2   ASN 2   331 ?   ?   ?   EEE . n 
A 1 3   ILE 3   332 332 ILE ILE EEE . n 
A 1 4   THR 4   333 333 THR THR EEE . n 
A 1 5   ASN 5   334 334 ASN ASN EEE . n 
A 1 6   LEU 6   335 335 LEU LEU EEE . n 
A 1 7   CYS 7   336 336 CYS CYS EEE . n 
A 1 8   PRO 8   337 337 PRO PRO EEE . n 
A 1 9   PHE 9   338 338 PHE PHE EEE . n 
A 1 10  GLY 10  339 339 GLY GLY EEE . n 
A 1 11  GLU 11  340 340 GLU GLU EEE . n 
A 1 12  VAL 12  341 341 VAL VAL EEE . n 
A 1 13  PHE 13  342 342 PHE PHE EEE . n 
A 1 14  ASN 14  343 343 ASN ASN EEE . n 
A 1 15  ALA 15  344 344 ALA ALA EEE . n 
A 1 16  THR 16  345 345 THR THR EEE . n 
A 1 17  ARG 17  346 346 ARG ARG EEE . n 
A 1 18  PHE 18  347 347 PHE PHE EEE . n 
A 1 19  ALA 19  348 348 ALA ALA EEE . n 
A 1 20  SER 20  349 349 SER SER EEE . n 
A 1 21  VAL 21  350 350 VAL VAL EEE . n 
A 1 22  TYR 22  351 351 TYR TYR EEE . n 
A 1 23  ALA 23  352 352 ALA ALA EEE . n 
A 1 24  TRP 24  353 353 TRP TRP EEE . n 
A 1 25  ASN 25  354 354 ASN ASN EEE . n 
A 1 26  ARG 26  355 355 ARG ARG EEE . n 
A 1 27  LYS 27  356 356 LYS LYS EEE . n 
A 1 28  ARG 28  357 357 ARG ARG EEE . n 
A 1 29  ILE 29  358 358 ILE ILE EEE . n 
A 1 30  SER 30  359 359 SER SER EEE . n 
A 1 31  ASN 31  360 360 ASN ASN EEE . n 
A 1 32  CYS 32  361 361 CYS CYS EEE . n 
A 1 33  VAL 33  362 362 VAL VAL EEE . n 
A 1 34  ALA 34  363 363 ALA ALA EEE . n 
A 1 35  ASP 35  364 364 ASP ASP EEE . n 
A 1 36  TYR 36  365 365 TYR TYR EEE . n 
A 1 37  SER 37  366 366 SER SER EEE . n 
A 1 38  VAL 38  367 367 VAL VAL EEE . n 
A 1 39  LEU 39  368 368 LEU LEU EEE . n 
A 1 40  TYR 40  369 369 TYR TYR EEE . n 
A 1 41  ASN 41  370 370 ASN ASN EEE . n 
A 1 42  SER 42  371 371 SER SER EEE . n 
A 1 43  ALA 43  372 372 ALA ALA EEE . n 
A 1 44  SER 44  373 373 SER SER EEE . n 
A 1 45  PHE 45  374 374 PHE PHE EEE . n 
A 1 46  SER 46  375 375 SER SER EEE . n 
A 1 47  THR 47  376 376 THR THR EEE . n 
A 1 48  PHE 48  377 377 PHE PHE EEE . n 
A 1 49  LYS 49  378 378 LYS LYS EEE . n 
A 1 50  CYS 50  379 379 CYS CYS EEE . n 
A 1 51  TYR 51  380 380 TYR TYR EEE . n 
A 1 52  GLY 52  381 381 GLY GLY EEE . n 
A 1 53  VAL 53  382 382 VAL VAL EEE . n 
A 1 54  SER 54  383 383 SER SER EEE . n 
A 1 55  PRO 55  384 384 PRO PRO EEE . n 
A 1 56  THR 56  385 385 THR THR EEE . n 
A 1 57  LYS 57  386 386 LYS LYS EEE . n 
A 1 58  LEU 58  387 387 LEU LEU EEE . n 
A 1 59  ASN 59  388 388 ASN ASN EEE . n 
A 1 60  ASP 60  389 389 ASP ASP EEE . n 
A 1 61  LEU 61  390 390 LEU LEU EEE . n 
A 1 62  CYS 62  391 391 CYS CYS EEE . n 
A 1 63  PHE 63  392 392 PHE PHE EEE . n 
A 1 64  THR 64  393 393 THR THR EEE . n 
A 1 65  ASN 65  394 394 ASN ASN EEE . n 
A 1 66  VAL 66  395 395 VAL VAL EEE . n 
A 1 67  TYR 67  396 396 TYR TYR EEE . n 
A 1 68  ALA 68  397 397 ALA ALA EEE . n 
A 1 69  ASP 69  398 398 ASP ASP EEE . n 
A 1 70  SER 70  399 399 SER SER EEE . n 
A 1 71  PHE 71  400 400 PHE PHE EEE . n 
A 1 72  VAL 72  401 401 VAL VAL EEE . n 
A 1 73  ILE 73  402 402 ILE ILE EEE . n 
A 1 74  ARG 74  403 403 ARG ARG EEE . n 
A 1 75  GLY 75  404 404 GLY GLY EEE . n 
A 1 76  ASP 76  405 405 ASP ASP EEE . n 
A 1 77  GLU 77  406 406 GLU GLU EEE . n 
A 1 78  VAL 78  407 407 VAL VAL EEE . n 
A 1 79  ARG 79  408 408 ARG ARG EEE . n 
A 1 80  GLN 80  409 409 GLN GLN EEE . n 
A 1 81  ILE 81  410 410 ILE ILE EEE . n 
A 1 82  ALA 82  411 411 ALA ALA EEE . n 
A 1 83  PRO 83  412 412 PRO PRO EEE . n 
A 1 84  GLY 84  413 413 GLY GLY EEE . n 
A 1 85  GLN 85  414 414 GLN GLN EEE . n 
A 1 86  THR 86  415 415 THR THR EEE . n 
A 1 87  GLY 87  416 416 GLY GLY EEE . n 
A 1 88  LYS 88  417 417 LYS LYS EEE . n 
A 1 89  ILE 89  418 418 ILE ILE EEE . n 
A 1 90  ALA 90  419 419 ALA ALA EEE . n 
A 1 91  ASP 91  420 420 ASP ASP EEE . n 
A 1 92  TYR 92  421 421 TYR TYR EEE . n 
A 1 93  ASN 93  422 422 ASN ASN EEE . n 
A 1 94  TYR 94  423 423 TYR TYR EEE . n 
A 1 95  LYS 95  424 424 LYS LYS EEE . n 
A 1 96  LEU 96  425 425 LEU LEU EEE . n 
A 1 97  PRO 97  426 426 PRO PRO EEE . n 
A 1 98  ASP 98  427 427 ASP ASP EEE . n 
A 1 99  ASP 99  428 428 ASP ASP EEE . n 
A 1 100 PHE 100 429 429 PHE PHE EEE . n 
A 1 101 THR 101 430 430 THR THR EEE . n 
A 1 102 GLY 102 431 431 GLY GLY EEE . n 
A 1 103 CYS 103 432 432 CYS CYS EEE . n 
A 1 104 VAL 104 433 433 VAL VAL EEE . n 
A 1 105 ILE 105 434 434 ILE ILE EEE . n 
A 1 106 ALA 106 435 435 ALA ALA EEE . n 
A 1 107 TRP 107 436 436 TRP TRP EEE . n 
A 1 108 ASN 108 437 437 ASN ASN EEE . n 
A 1 109 SER 109 438 438 SER SER EEE . n 
A 1 110 ASN 110 439 439 ASN ASN EEE . n 
A 1 111 ASN 111 440 440 ASN ASN EEE . n 
A 1 112 LEU 112 441 441 LEU LEU EEE . n 
A 1 113 ASP 113 442 442 ASP ASP EEE . n 
A 1 114 SER 114 443 443 SER SER EEE . n 
A 1 115 LYS 115 444 444 LYS LYS EEE . n 
A 1 116 VAL 116 445 445 VAL VAL EEE . n 
A 1 117 GLY 117 446 446 GLY GLY EEE . n 
A 1 118 GLY 118 447 447 GLY GLY EEE . n 
A 1 119 ASN 119 448 448 ASN ASN EEE . n 
A 1 120 TYR 120 449 449 TYR TYR EEE . n 
A 1 121 ASN 121 450 450 ASN ASN EEE . n 
A 1 122 TYR 122 451 451 TYR TYR EEE . n 
A 1 123 LEU 123 452 452 LEU LEU EEE . n 
A 1 124 TYR 124 453 453 TYR TYR EEE . n 
A 1 125 ARG 125 454 454 ARG ARG EEE . n 
A 1 126 LEU 126 455 455 LEU LEU EEE . n 
A 1 127 PHE 127 456 456 PHE PHE EEE . n 
A 1 128 ARG 128 457 457 ARG ARG EEE . n 
A 1 129 LYS 129 458 458 LYS LYS EEE . n 
A 1 130 SER 130 459 459 SER SER EEE . n 
A 1 131 ASN 131 460 460 ASN ASN EEE . n 
A 1 132 LEU 132 461 461 LEU LEU EEE . n 
A 1 133 LYS 133 462 462 LYS LYS EEE . n 
A 1 134 PRO 134 463 463 PRO PRO EEE . n 
A 1 135 PHE 135 464 464 PHE PHE EEE . n 
A 1 136 GLU 136 465 465 GLU GLU EEE . n 
A 1 137 ARG 137 466 466 ARG ARG EEE . n 
A 1 138 ASP 138 467 467 ASP ASP EEE . n 
A 1 139 ILE 139 468 468 ILE ILE EEE . n 
A 1 140 SER 140 469 469 SER SER EEE . n 
A 1 141 THR 141 470 470 THR THR EEE . n 
A 1 142 GLU 142 471 471 GLU GLU EEE . n 
A 1 143 ILE 143 472 472 ILE ILE EEE . n 
A 1 144 TYR 144 473 473 TYR TYR EEE . n 
A 1 145 GLN 145 474 474 GLN GLN EEE . n 
A 1 146 ALA 146 475 475 ALA ALA EEE . n 
A 1 147 GLY 147 476 476 GLY GLY EEE . n 
A 1 148 SER 148 477 477 SER SER EEE . n 
A 1 149 THR 149 478 478 THR THR EEE . n 
A 1 150 PRO 150 479 479 PRO PRO EEE . n 
A 1 151 CYS 151 480 480 CYS CYS EEE . n 
A 1 152 ASN 152 481 481 ASN ASN EEE . n 
A 1 153 GLY 153 482 482 GLY GLY EEE . n 
A 1 154 VAL 154 483 483 VAL VAL EEE . n 
A 1 155 GLU 155 484 484 GLU GLU EEE . n 
A 1 156 GLY 156 485 485 GLY GLY EEE . n 
A 1 157 PHE 157 486 486 PHE PHE EEE . n 
A 1 158 ASN 158 487 487 ASN ASN EEE . n 
A 1 159 CYS 159 488 488 CYS CYS EEE . n 
A 1 160 TYR 160 489 489 TYR TYR EEE . n 
A 1 161 PHE 161 490 490 PHE PHE EEE . n 
A 1 162 PRO 162 491 491 PRO PRO EEE . n 
A 1 163 LEU 163 492 492 LEU LEU EEE . n 
A 1 164 GLN 164 493 493 GLN GLN EEE . n 
A 1 165 SER 165 494 494 SER SER EEE . n 
A 1 166 TYR 166 495 495 TYR TYR EEE . n 
A 1 167 GLY 167 496 496 GLY GLY EEE . n 
A 1 168 PHE 168 497 497 PHE PHE EEE . n 
A 1 169 GLN 169 498 498 GLN GLN EEE . n 
A 1 170 PRO 170 499 499 PRO PRO EEE . n 
A 1 171 THR 171 500 500 THR THR EEE . n 
A 1 172 ASN 172 501 501 ASN ASN EEE . n 
A 1 173 GLY 173 502 502 GLY GLY EEE . n 
A 1 174 VAL 174 503 503 VAL VAL EEE . n 
A 1 175 GLY 175 504 504 GLY GLY EEE . n 
A 1 176 TYR 176 505 505 TYR TYR EEE . n 
A 1 177 GLN 177 506 506 GLN GLN EEE . n 
A 1 178 PRO 178 507 507 PRO PRO EEE . n 
A 1 179 TYR 179 508 508 TYR TYR EEE . n 
A 1 180 ARG 180 509 509 ARG ARG EEE . n 
A 1 181 VAL 181 510 510 VAL VAL EEE . n 
A 1 182 VAL 182 511 511 VAL VAL EEE . n 
A 1 183 VAL 183 512 512 VAL VAL EEE . n 
A 1 184 LEU 184 513 513 LEU LEU EEE . n 
A 1 185 SER 185 514 514 SER SER EEE . n 
A 1 186 PHE 186 515 515 PHE PHE EEE . n 
A 1 187 GLU 187 516 516 GLU GLU EEE . n 
A 1 188 LEU 188 517 517 LEU LEU EEE . n 
A 1 189 LEU 189 518 518 LEU LEU EEE . n 
A 1 190 HIS 190 519 519 HIS HIS EEE . n 
A 1 191 ALA 191 520 520 ALA ALA EEE . n 
A 1 192 PRO 192 521 521 PRO PRO EEE . n 
A 1 193 ALA 193 522 522 ALA ALA EEE . n 
A 1 194 THR 194 523 523 THR THR EEE . n 
A 1 195 VAL 195 524 524 VAL VAL EEE . n 
A 1 196 CYS 196 525 525 CYS CYS EEE . n 
A 1 197 GLY 197 526 526 GLY GLY EEE . n 
A 1 198 PRO 198 527 527 PRO PRO EEE . n 
A 1 199 LYS 199 528 ?   ?   ?   EEE . n 
A 1 200 LYS 200 529 ?   ?   ?   EEE . n 
A 1 201 SER 201 530 ?   ?   ?   EEE . n 
A 1 202 THR 202 531 ?   ?   ?   EEE . n 
A 1 203 ASN 203 532 ?   ?   ?   EEE . n 
A 1 204 LYS 204 533 ?   ?   ?   EEE . n 
A 1 205 HIS 205 534 ?   ?   ?   EEE . n 
A 1 206 HIS 206 535 ?   ?   ?   EEE . n 
A 1 207 HIS 207 536 ?   ?   ?   EEE . n 
A 1 208 HIS 208 537 ?   ?   ?   EEE . n 
A 1 209 HIS 209 538 ?   ?   ?   EEE . n 
A 1 210 HIS 210 539 ?   ?   ?   EEE . n 
B 2 1   GLN 1   1   1   GLN GLN FFF . n 
B 2 2   VAL 2   2   2   VAL VAL FFF . n 
B 2 3   GLN 3   3   3   GLN GLN FFF . n 
B 2 4   LEU 4   4   4   LEU LEU FFF . n 
B 2 5   VAL 5   5   5   VAL VAL FFF . n 
B 2 6   GLU 6   6   6   GLU GLU FFF . n 
B 2 7   SER 7   7   7   SER SER FFF . n 
B 2 8   GLY 8   8   8   GLY GLY FFF . n 
B 2 9   GLY 9   9   9   GLY GLY FFF . n 
B 2 10  GLY 10  10  10  GLY GLY FFF . n 
B 2 11  SER 11  11  11  SER SER FFF . n 
B 2 12  VAL 12  12  12  VAL VAL FFF . n 
B 2 13  GLN 13  13  13  GLN GLN FFF . n 
B 2 14  ALA 14  14  14  ALA ALA FFF . n 
B 2 15  GLY 15  15  15  GLY GLY FFF . n 
B 2 16  GLY 16  16  16  GLY GLY FFF . n 
B 2 17  SER 17  17  17  SER SER FFF . n 
B 2 18  LEU 18  18  18  LEU LEU FFF . n 
B 2 19  THR 19  19  19  THR THR FFF . n 
B 2 20  LEU 20  20  20  LEU LEU FFF . n 
B 2 21  SER 21  21  21  SER SER FFF . n 
B 2 22  CYS 22  22  22  CYS CYS FFF . n 
B 2 23  VAL 23  23  23  VAL VAL FFF . n 
B 2 24  ALA 24  24  24  ALA ALA FFF . n 
B 2 25  SER 25  25  25  SER SER FFF . n 
B 2 26  GLY 26  26  26  GLY GLY FFF . n 
B 2 27  VAL 27  27  27  VAL VAL FFF . n 
B 2 28  THR 28  28  28  THR THR FFF . n 
B 2 29  LEU 29  29  29  LEU LEU FFF . n 
B 2 30  GLY 30  30  30  GLY GLY FFF . n 
B 2 31  ARG 31  31  31  ARG ARG FFF . n 
B 2 32  HIS 32  32  32  HIS HIS FFF . n 
B 2 33  ALA 33  33  33  ALA ALA FFF . n 
B 2 34  ILE 34  34  34  ILE ILE FFF . n 
B 2 35  GLY 35  35  35  GLY GLY FFF . n 
B 2 36  TRP 36  36  36  TRP TRP FFF . n 
B 2 37  PHE 37  37  37  PHE PHE FFF . n 
B 2 38  ARG 38  38  38  ARG ARG FFF . n 
B 2 39  GLN 39  39  39  GLN GLN FFF . n 
B 2 40  ALA 40  40  40  ALA ALA FFF . n 
B 2 41  PRO 41  41  41  PRO PRO FFF . n 
B 2 42  GLY 42  42  42  GLY GLY FFF . n 
B 2 43  LYS 43  43  43  LYS LYS FFF . n 
B 2 44  GLU 44  44  44  GLU GLU FFF . n 
B 2 45  ARG 45  45  45  ARG ARG FFF . n 
B 2 46  GLU 46  46  46  GLU GLU FFF . n 
B 2 47  ARG 47  47  47  ARG ARG FFF . n 
B 2 48  VAL 48  48  48  VAL VAL FFF . n 
B 2 49  SER 49  49  49  SER SER FFF . n 
B 2 50  CYS 50  50  50  CYS CYS FFF . n 
B 2 51  ILE 51  51  51  ILE ILE FFF . n 
B 2 52  ARG 52  52  52  ARG ARG FFF . n 
B 2 53  THR 53  53  53  THR THR FFF . n 
B 2 54  PHE 54  54  54  PHE PHE FFF . n 
B 2 55  ASP 55  55  55  ASP ASP FFF . n 
B 2 56  GLY 56  56  56  GLY GLY FFF . n 
B 2 57  ILE 57  57  57  ILE ILE FFF . n 
B 2 58  THR 58  58  58  THR THR FFF . n 
B 2 59  SER 59  59  59  SER SER FFF . n 
B 2 60  TYR 60  60  60  TYR TYR FFF . n 
B 2 61  VAL 61  61  61  VAL VAL FFF . n 
B 2 62  GLU 62  62  62  GLU GLU FFF . n 
B 2 63  SER 63  63  63  SER SER FFF . n 
B 2 64  THR 64  64  64  THR THR FFF . n 
B 2 65  LYS 65  65  65  LYS LYS FFF . n 
B 2 66  GLY 66  66  66  GLY GLY FFF . n 
B 2 67  ARG 67  67  67  ARG ARG FFF . n 
B 2 68  PHE 68  68  68  PHE PHE FFF . n 
B 2 69  THR 69  69  69  THR THR FFF . n 
B 2 70  ILE 70  70  70  ILE ILE FFF . n 
B 2 71  SER 71  71  71  SER SER FFF . n 
B 2 72  SER 72  72  72  SER SER FFF . n 
B 2 73  ASN 73  73  73  ASN ASN FFF . n 
B 2 74  ASN 74  74  74  ASN ASN FFF . n 
B 2 75  ALA 75  75  75  ALA ALA FFF . n 
B 2 76  MET 76  76  76  MET MET FFF . n 
B 2 77  ASN 77  77  77  ASN ASN FFF . n 
B 2 78  THR 78  78  78  THR THR FFF . n 
B 2 79  VAL 79  79  79  VAL VAL FFF . n 
B 2 80  TYR 80  80  80  TYR TYR FFF . n 
B 2 81  LEU 81  81  81  LEU LEU FFF . n 
B 2 82  GLN 82  82  82  GLN GLN FFF . n 
B 2 83  MET 83  83  83  MET MET FFF . n 
B 2 84  ASN 84  84  84  ASN ASN FFF . n 
B 2 85  SER 85  85  85  SER SER FFF . n 
B 2 86  LEU 86  86  86  LEU LEU FFF . n 
B 2 87  LYS 87  87  87  LYS LYS FFF . n 
B 2 88  PRO 88  88  88  PRO PRO FFF . n 
B 2 89  GLU 89  89  89  GLU GLU FFF . n 
B 2 90  ASP 90  90  90  ASP ASP FFF . n 
B 2 91  THR 91  91  91  THR THR FFF . n 
B 2 92  ALA 92  92  92  ALA ALA FFF . n 
B 2 93  VAL 93  93  93  VAL VAL FFF . n 
B 2 94  TYR 94  94  94  TYR TYR FFF . n 
B 2 95  PHE 95  95  95  PHE PHE FFF . n 
B 2 96  CYS 96  96  96  CYS CYS FFF . n 
B 2 97  ALA 97  97  97  ALA ALA FFF . n 
B 2 98  LEU 98  98  98  LEU LEU FFF . n 
B 2 99  GLY 99  99  99  GLY GLY FFF . n 
B 2 100 VAL 100 100 100 VAL VAL FFF . n 
B 2 101 THR 101 101 101 THR THR FFF . n 
B 2 102 ALA 102 102 102 ALA ALA FFF . n 
B 2 103 ALA 103 103 103 ALA ALA FFF . n 
B 2 104 CYS 104 104 104 CYS CYS FFF . n 
B 2 105 SER 105 105 105 SER SER FFF . n 
B 2 106 ASP 106 106 106 ASP ASP FFF . n 
B 2 107 ASN 107 107 107 ASN ASN FFF . n 
B 2 108 PRO 108 108 108 PRO PRO FFF . n 
B 2 109 TYR 109 109 109 TYR TYR FFF . n 
B 2 110 PHE 110 110 110 PHE PHE FFF . n 
B 2 111 TRP 111 111 111 TRP TRP FFF . n 
B 2 112 GLY 112 112 112 GLY GLY FFF . n 
B 2 113 GLN 113 113 113 GLN GLN FFF . n 
B 2 114 GLY 114 114 114 GLY GLY FFF . n 
B 2 115 THR 115 115 115 THR THR FFF . n 
B 2 116 GLN 116 116 116 GLN GLN FFF . n 
B 2 117 VAL 117 117 117 VAL VAL FFF . n 
B 2 118 THR 118 118 118 THR THR FFF . n 
B 2 119 VAL 119 119 119 VAL VAL FFF . n 
B 2 120 SER 120 120 120 SER SER FFF . n 
B 2 121 SER 121 121 121 SER SER FFF . n 
B 2 122 LYS 122 122 ?   ?   ?   FFF . n 
B 2 123 HIS 123 123 ?   ?   ?   FFF . n 
B 2 124 HIS 124 124 ?   ?   ?   FFF . n 
B 2 125 HIS 125 125 ?   ?   ?   FFF . n 
B 2 126 HIS 126 126 ?   ?   ?   FFF . n 
B 2 127 HIS 127 127 ?   ?   ?   FFF . n 
B 2 128 HIS 128 128 ?   ?   ?   FFF . n 
# 
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 
C 3 NAG 1   601 601 NAG NAG EEE . 
D 4 ACT 1   602 1   ACT ACT EEE . 
E 5 HOH 1   701 303 HOH HOH EEE . 
E 5 HOH 2   702 211 HOH HOH EEE . 
E 5 HOH 3   703 290 HOH HOH EEE . 
E 5 HOH 4   704 235 HOH HOH EEE . 
E 5 HOH 5   705 287 HOH HOH EEE . 
E 5 HOH 6   706 7   HOH HOH EEE . 
E 5 HOH 7   707 161 HOH HOH EEE . 
E 5 HOH 8   708 252 HOH HOH EEE . 
E 5 HOH 9   709 191 HOH HOH EEE . 
E 5 HOH 10  710 171 HOH HOH EEE . 
E 5 HOH 11  711 50  HOH HOH EEE . 
E 5 HOH 12  712 127 HOH HOH EEE . 
E 5 HOH 13  713 93  HOH HOH EEE . 
E 5 HOH 14  714 48  HOH HOH EEE . 
E 5 HOH 15  715 103 HOH HOH EEE . 
E 5 HOH 16  716 129 HOH HOH EEE . 
E 5 HOH 17  717 108 HOH HOH EEE . 
E 5 HOH 18  718 27  HOH HOH EEE . 
E 5 HOH 19  719 241 HOH HOH EEE . 
E 5 HOH 20  720 150 HOH HOH EEE . 
E 5 HOH 21  721 106 HOH HOH EEE . 
E 5 HOH 22  722 283 HOH HOH EEE . 
E 5 HOH 23  723 33  HOH HOH EEE . 
E 5 HOH 24  724 32  HOH HOH EEE . 
E 5 HOH 25  725 13  HOH HOH EEE . 
E 5 HOH 26  726 3   HOH HOH EEE . 
E 5 HOH 27  727 43  HOH HOH EEE . 
E 5 HOH 28  728 168 HOH HOH EEE . 
E 5 HOH 29  729 113 HOH HOH EEE . 
E 5 HOH 30  730 23  HOH HOH EEE . 
E 5 HOH 31  731 34  HOH HOH EEE . 
E 5 HOH 32  732 24  HOH HOH EEE . 
E 5 HOH 33  733 159 HOH HOH EEE . 
E 5 HOH 34  734 6   HOH HOH EEE . 
E 5 HOH 35  735 209 HOH HOH EEE . 
E 5 HOH 36  736 285 HOH HOH EEE . 
E 5 HOH 37  737 21  HOH HOH EEE . 
E 5 HOH 38  738 165 HOH HOH EEE . 
E 5 HOH 39  739 178 HOH HOH EEE . 
E 5 HOH 40  740 169 HOH HOH EEE . 
E 5 HOH 41  741 237 HOH HOH EEE . 
E 5 HOH 42  742 49  HOH HOH EEE . 
E 5 HOH 43  743 4   HOH HOH EEE . 
E 5 HOH 44  744 55  HOH HOH EEE . 
E 5 HOH 45  745 158 HOH HOH EEE . 
E 5 HOH 46  746 131 HOH HOH EEE . 
E 5 HOH 47  747 59  HOH HOH EEE . 
E 5 HOH 48  748 54  HOH HOH EEE . 
E 5 HOH 49  749 188 HOH HOH EEE . 
E 5 HOH 50  750 227 HOH HOH EEE . 
E 5 HOH 51  751 9   HOH HOH EEE . 
E 5 HOH 52  752 16  HOH HOH EEE . 
E 5 HOH 53  753 1   HOH HOH EEE . 
E 5 HOH 54  754 121 HOH HOH EEE . 
E 5 HOH 55  755 62  HOH HOH EEE . 
E 5 HOH 56  756 45  HOH HOH EEE . 
E 5 HOH 57  757 68  HOH HOH EEE . 
E 5 HOH 58  758 66  HOH HOH EEE . 
E 5 HOH 59  759 36  HOH HOH EEE . 
E 5 HOH 60  760 28  HOH HOH EEE . 
E 5 HOH 61  761 2   HOH HOH EEE . 
E 5 HOH 62  762 112 HOH HOH EEE . 
E 5 HOH 63  763 186 HOH HOH EEE . 
E 5 HOH 64  764 53  HOH HOH EEE . 
E 5 HOH 65  765 116 HOH HOH EEE . 
E 5 HOH 66  766 99  HOH HOH EEE . 
E 5 HOH 67  767 286 HOH HOH EEE . 
E 5 HOH 68  768 284 HOH HOH EEE . 
E 5 HOH 69  769 170 HOH HOH EEE . 
E 5 HOH 70  770 204 HOH HOH EEE . 
E 5 HOH 71  771 233 HOH HOH EEE . 
E 5 HOH 72  772 51  HOH HOH EEE . 
E 5 HOH 73  773 187 HOH HOH EEE . 
E 5 HOH 74  774 20  HOH HOH EEE . 
E 5 HOH 75  775 11  HOH HOH EEE . 
E 5 HOH 76  776 70  HOH HOH EEE . 
E 5 HOH 77  777 135 HOH HOH EEE . 
E 5 HOH 78  778 240 HOH HOH EEE . 
E 5 HOH 79  779 81  HOH HOH EEE . 
E 5 HOH 80  780 89  HOH HOH EEE . 
E 5 HOH 81  781 42  HOH HOH EEE . 
E 5 HOH 82  782 263 HOH HOH EEE . 
E 5 HOH 83  783 144 HOH HOH EEE . 
E 5 HOH 84  784 94  HOH HOH EEE . 
E 5 HOH 85  785 39  HOH HOH EEE . 
E 5 HOH 86  786 17  HOH HOH EEE . 
E 5 HOH 87  787 37  HOH HOH EEE . 
E 5 HOH 88  788 173 HOH HOH EEE . 
E 5 HOH 89  789 172 HOH HOH EEE . 
E 5 HOH 90  790 136 HOH HOH EEE . 
E 5 HOH 91  791 41  HOH HOH EEE . 
E 5 HOH 92  792 230 HOH HOH EEE . 
E 5 HOH 93  793 247 HOH HOH EEE . 
E 5 HOH 94  794 12  HOH HOH EEE . 
E 5 HOH 95  795 255 HOH HOH EEE . 
E 5 HOH 96  796 46  HOH HOH EEE . 
E 5 HOH 97  797 88  HOH HOH EEE . 
E 5 HOH 98  798 226 HOH HOH EEE . 
E 5 HOH 99  799 250 HOH HOH EEE . 
E 5 HOH 100 800 153 HOH HOH EEE . 
E 5 HOH 101 801 239 HOH HOH EEE . 
E 5 HOH 102 802 80  HOH HOH EEE . 
E 5 HOH 103 803 65  HOH HOH EEE . 
E 5 HOH 104 804 52  HOH HOH EEE . 
E 5 HOH 105 805 38  HOH HOH EEE . 
E 5 HOH 106 806 19  HOH HOH EEE . 
E 5 HOH 107 807 35  HOH HOH EEE . 
E 5 HOH 108 808 282 HOH HOH EEE . 
E 5 HOH 109 809 15  HOH HOH EEE . 
E 5 HOH 110 810 61  HOH HOH EEE . 
E 5 HOH 111 811 14  HOH HOH EEE . 
E 5 HOH 112 812 75  HOH HOH EEE . 
E 5 HOH 113 813 22  HOH HOH EEE . 
E 5 HOH 114 814 203 HOH HOH EEE . 
E 5 HOH 115 815 189 HOH HOH EEE . 
E 5 HOH 116 816 102 HOH HOH EEE . 
E 5 HOH 117 817 100 HOH HOH EEE . 
E 5 HOH 118 818 82  HOH HOH EEE . 
E 5 HOH 119 819 60  HOH HOH EEE . 
E 5 HOH 120 820 151 HOH HOH EEE . 
E 5 HOH 121 821 26  HOH HOH EEE . 
E 5 HOH 122 822 110 HOH HOH EEE . 
E 5 HOH 123 823 109 HOH HOH EEE . 
E 5 HOH 124 824 44  HOH HOH EEE . 
E 5 HOH 125 825 224 HOH HOH EEE . 
E 5 HOH 126 826 293 HOH HOH EEE . 
E 5 HOH 127 827 31  HOH HOH EEE . 
E 5 HOH 128 828 132 HOH HOH EEE . 
E 5 HOH 129 829 145 HOH HOH EEE . 
E 5 HOH 130 830 117 HOH HOH EEE . 
E 5 HOH 131 831 111 HOH HOH EEE . 
E 5 HOH 132 832 29  HOH HOH EEE . 
E 5 HOH 133 833 57  HOH HOH EEE . 
E 5 HOH 134 834 260 HOH HOH EEE . 
E 5 HOH 135 835 63  HOH HOH EEE . 
E 5 HOH 136 836 85  HOH HOH EEE . 
E 5 HOH 137 837 181 HOH HOH EEE . 
E 5 HOH 138 838 248 HOH HOH EEE . 
E 5 HOH 139 839 97  HOH HOH EEE . 
E 5 HOH 140 840 297 HOH HOH EEE . 
E 5 HOH 141 841 164 HOH HOH EEE . 
E 5 HOH 142 842 90  HOH HOH EEE . 
E 5 HOH 143 843 69  HOH HOH EEE . 
E 5 HOH 144 844 25  HOH HOH EEE . 
E 5 HOH 145 845 231 HOH HOH EEE . 
E 5 HOH 146 846 18  HOH HOH EEE . 
E 5 HOH 147 847 166 HOH HOH EEE . 
E 5 HOH 148 848 122 HOH HOH EEE . 
E 5 HOH 149 849 72  HOH HOH EEE . 
E 5 HOH 150 850 192 HOH HOH EEE . 
E 5 HOH 151 851 179 HOH HOH EEE . 
E 5 HOH 152 852 198 HOH HOH EEE . 
E 5 HOH 153 853 130 HOH HOH EEE . 
E 5 HOH 154 854 180 HOH HOH EEE . 
E 5 HOH 155 855 244 HOH HOH EEE . 
E 5 HOH 156 856 149 HOH HOH EEE . 
E 5 HOH 157 857 216 HOH HOH EEE . 
E 5 HOH 158 858 212 HOH HOH EEE . 
E 5 HOH 159 859 182 HOH HOH EEE . 
E 5 HOH 160 860 83  HOH HOH EEE . 
E 5 HOH 161 861 193 HOH HOH EEE . 
E 5 HOH 162 862 58  HOH HOH EEE . 
E 5 HOH 163 863 91  HOH HOH EEE . 
E 5 HOH 164 864 133 HOH HOH EEE . 
E 5 HOH 165 865 160 HOH HOH EEE . 
E 5 HOH 166 866 219 HOH HOH EEE . 
E 5 HOH 167 867 220 HOH HOH EEE . 
E 5 HOH 168 868 147 HOH HOH EEE . 
E 5 HOH 169 869 268 HOH HOH EEE . 
E 5 HOH 170 870 269 HOH HOH EEE . 
E 5 HOH 171 871 199 HOH HOH EEE . 
E 5 HOH 172 872 294 HOH HOH EEE . 
E 5 HOH 173 873 273 HOH HOH EEE . 
E 5 HOH 174 874 196 HOH HOH EEE . 
E 5 HOH 175 875 265 HOH HOH EEE . 
E 5 HOH 176 876 123 HOH HOH EEE . 
E 5 HOH 177 877 210 HOH HOH EEE . 
E 5 HOH 178 878 202 HOH HOH EEE . 
E 5 HOH 179 879 271 HOH HOH EEE . 
E 5 HOH 180 880 86  HOH HOH EEE . 
E 5 HOH 181 881 222 HOH HOH EEE . 
E 5 HOH 182 882 302 HOH HOH EEE . 
E 5 HOH 183 883 143 HOH HOH EEE . 
E 5 HOH 184 884 118 HOH HOH EEE . 
E 5 HOH 185 885 221 HOH HOH EEE . 
E 5 HOH 186 886 266 HOH HOH EEE . 
E 5 HOH 187 887 275 HOH HOH EEE . 
E 5 HOH 188 888 280 HOH HOH EEE . 
E 5 HOH 189 889 119 HOH HOH EEE . 
E 5 HOH 190 890 264 HOH HOH EEE . 
E 5 HOH 191 891 262 HOH HOH EEE . 
E 5 HOH 192 892 295 HOH HOH EEE . 
E 5 HOH 193 893 296 HOH HOH EEE . 
E 5 HOH 194 894 276 HOH HOH EEE . 
E 5 HOH 195 895 291 HOH HOH EEE . 
E 5 HOH 196 896 274 HOH HOH EEE . 
E 5 HOH 197 897 267 HOH HOH EEE . 
E 5 HOH 198 898 279 HOH HOH EEE . 
E 5 HOH 199 899 289 HOH HOH EEE . 
E 5 HOH 200 900 223 HOH HOH EEE . 
E 5 HOH 201 901 301 HOH HOH EEE . 
E 5 HOH 202 902 261 HOH HOH EEE . 
F 5 HOH 1   201 243 HOH HOH FFF . 
F 5 HOH 2   202 208 HOH HOH FFF . 
F 5 HOH 3   203 194 HOH HOH FFF . 
F 5 HOH 4   204 185 HOH HOH FFF . 
F 5 HOH 5   205 201 HOH HOH FFF . 
F 5 HOH 6   206 207 HOH HOH FFF . 
F 5 HOH 7   207 174 HOH HOH FFF . 
F 5 HOH 8   208 167 HOH HOH FFF . 
F 5 HOH 9   209 298 HOH HOH FFF . 
F 5 HOH 10  210 154 HOH HOH FFF . 
F 5 HOH 11  211 126 HOH HOH FFF . 
F 5 HOH 12  212 105 HOH HOH FFF . 
F 5 HOH 13  213 71  HOH HOH FFF . 
F 5 HOH 14  214 87  HOH HOH FFF . 
F 5 HOH 15  215 195 HOH HOH FFF . 
F 5 HOH 16  216 200 HOH HOH FFF . 
F 5 HOH 17  217 125 HOH HOH FFF . 
F 5 HOH 18  218 238 HOH HOH FFF . 
F 5 HOH 19  219 184 HOH HOH FFF . 
F 5 HOH 20  220 128 HOH HOH FFF . 
F 5 HOH 21  221 242 HOH HOH FFF . 
F 5 HOH 22  222 10  HOH HOH FFF . 
F 5 HOH 23  223 76  HOH HOH FFF . 
F 5 HOH 24  224 78  HOH HOH FFF . 
F 5 HOH 25  225 5   HOH HOH FFF . 
F 5 HOH 26  226 142 HOH HOH FFF . 
F 5 HOH 27  227 214 HOH HOH FFF . 
F 5 HOH 28  228 107 HOH HOH FFF . 
F 5 HOH 29  229 152 HOH HOH FFF . 
F 5 HOH 30  230 139 HOH HOH FFF . 
F 5 HOH 31  231 228 HOH HOH FFF . 
F 5 HOH 32  232 47  HOH HOH FFF . 
F 5 HOH 33  233 98  HOH HOH FFF . 
F 5 HOH 34  234 79  HOH HOH FFF . 
F 5 HOH 35  235 8   HOH HOH FFF . 
F 5 HOH 36  236 84  HOH HOH FFF . 
F 5 HOH 37  237 56  HOH HOH FFF . 
F 5 HOH 38  238 272 HOH HOH FFF . 
F 5 HOH 39  239 162 HOH HOH FFF . 
F 5 HOH 40  240 197 HOH HOH FFF . 
F 5 HOH 41  241 253 HOH HOH FFF . 
F 5 HOH 42  242 104 HOH HOH FFF . 
F 5 HOH 43  243 148 HOH HOH FFF . 
F 5 HOH 44  244 183 HOH HOH FFF . 
F 5 HOH 45  245 163 HOH HOH FFF . 
F 5 HOH 46  246 205 HOH HOH FFF . 
F 5 HOH 47  247 73  HOH HOH FFF . 
F 5 HOH 48  248 67  HOH HOH FFF . 
F 5 HOH 49  249 115 HOH HOH FFF . 
F 5 HOH 50  250 120 HOH HOH FFF . 
F 5 HOH 51  251 175 HOH HOH FFF . 
F 5 HOH 52  252 146 HOH HOH FFF . 
F 5 HOH 53  253 134 HOH HOH FFF . 
F 5 HOH 54  254 92  HOH HOH FFF . 
F 5 HOH 55  255 140 HOH HOH FFF . 
F 5 HOH 56  256 96  HOH HOH FFF . 
F 5 HOH 57  257 218 HOH HOH FFF . 
F 5 HOH 58  258 101 HOH HOH FFF . 
F 5 HOH 59  259 30  HOH HOH FFF . 
F 5 HOH 60  260 229 HOH HOH FFF . 
F 5 HOH 61  261 300 HOH HOH FFF . 
F 5 HOH 62  262 64  HOH HOH FFF . 
F 5 HOH 63  263 155 HOH HOH FFF . 
F 5 HOH 64  264 141 HOH HOH FFF . 
F 5 HOH 65  265 77  HOH HOH FFF . 
F 5 HOH 66  266 190 HOH HOH FFF . 
F 5 HOH 67  267 234 HOH HOH FFF . 
F 5 HOH 68  268 217 HOH HOH FFF . 
F 5 HOH 69  269 95  HOH HOH FFF . 
F 5 HOH 70  270 177 HOH HOH FFF . 
F 5 HOH 71  271 206 HOH HOH FFF . 
F 5 HOH 72  272 176 HOH HOH FFF . 
F 5 HOH 73  273 124 HOH HOH FFF . 
F 5 HOH 74  274 270 HOH HOH FFF . 
F 5 HOH 75  275 288 HOH HOH FFF . 
F 5 HOH 76  276 299 HOH HOH FFF . 
F 5 HOH 77  277 281 HOH HOH FFF . 
F 5 HOH 78  278 215 HOH HOH FFF . 
F 5 HOH 79  279 292 HOH HOH FFF . 
F 5 HOH 80  280 74  HOH HOH FFF . 
F 5 HOH 81  281 277 HOH HOH FFF . 
F 5 HOH 82  282 225 HOH HOH FFF . 
F 5 HOH 83  283 138 HOH HOH FFF . 
F 5 HOH 84  284 156 HOH HOH FFF . 
F 5 HOH 85  285 213 HOH HOH FFF . 
F 5 HOH 86  286 157 HOH HOH FFF . 
F 5 HOH 87  287 114 HOH HOH FFF . 
F 5 HOH 88  288 278 HOH HOH FFF . 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       PISA 
_pdbx_struct_assembly.oligomeric_details   dimeric 
_pdbx_struct_assembly.oligomeric_count     2 
# 
_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 
# 
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)' 1840  ? 
1 MORE         -1    ? 
1 'SSA (A^2)'  15320 ? 
# 
_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 
# 
_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       2021-08-11 
# 
_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             ? 
# 
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       ? ? ? ? ? ? ? ? ? ? ? REFMAC ? ? ? 5.8.0258 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? xia2   ? ? ? .        2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? xia2   ? ? ? .        3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? .        4 
# 
_pdbx_entry_details.entry_id                 7OAO 
_pdbx_entry_details.has_ligand_of_interest   N 
_pdbx_entry_details.compound_details         ? 
_pdbx_entry_details.source_details           ? 
_pdbx_entry_details.nonpolymer_details       ? 
_pdbx_entry_details.sequence_details         ? 
# 
loop_
_pdbx_validate_close_contact.id 
_pdbx_validate_close_contact.PDB_model_num 
_pdbx_validate_close_contact.auth_atom_id_1 
_pdbx_validate_close_contact.auth_asym_id_1 
_pdbx_validate_close_contact.auth_comp_id_1 
_pdbx_validate_close_contact.auth_seq_id_1 
_pdbx_validate_close_contact.PDB_ins_code_1 
_pdbx_validate_close_contact.label_alt_id_1 
_pdbx_validate_close_contact.auth_atom_id_2 
_pdbx_validate_close_contact.auth_asym_id_2 
_pdbx_validate_close_contact.auth_comp_id_2 
_pdbx_validate_close_contact.auth_seq_id_2 
_pdbx_validate_close_contact.PDB_ins_code_2 
_pdbx_validate_close_contact.label_alt_id_2 
_pdbx_validate_close_contact.dist 
1 1 O   EEE HOH 703 ? ? O   EEE HOH 808 ? ? 0.81 
2 1 O   FFF HOH 261 ? ? O   FFF HOH 275 ? ? 1.80 
3 1 OG1 FFF THR 19  ? ? OE1 FFF GLN 82  ? A 2.09 
4 1 O   EEE HOH 819 ? ? O   EEE HOH 881 ? ? 2.11 
5 1 O   EEE HOH 754 ? ? O   EEE HOH 893 ? ? 2.13 
# 
loop_
_pdbx_validate_torsion.id 
_pdbx_validate_torsion.PDB_model_num 
_pdbx_validate_torsion.auth_comp_id 
_pdbx_validate_torsion.auth_asym_id 
_pdbx_validate_torsion.auth_seq_id 
_pdbx_validate_torsion.PDB_ins_code 
_pdbx_validate_torsion.label_alt_id 
_pdbx_validate_torsion.phi 
_pdbx_validate_torsion.psi 
1 1 ASN EEE 422 ? ? -128.61 -52.28 
2 1 ASP FFF 55  ? ? -140.10 -0.05  
# 
loop_
_pdbx_unobs_or_zero_occ_residues.id 
_pdbx_unobs_or_zero_occ_residues.PDB_model_num 
_pdbx_unobs_or_zero_occ_residues.polymer_flag 
_pdbx_unobs_or_zero_occ_residues.occupancy_flag 
_pdbx_unobs_or_zero_occ_residues.auth_asym_id 
_pdbx_unobs_or_zero_occ_residues.auth_comp_id 
_pdbx_unobs_or_zero_occ_residues.auth_seq_id 
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code 
_pdbx_unobs_or_zero_occ_residues.label_asym_id 
_pdbx_unobs_or_zero_occ_residues.label_comp_id 
_pdbx_unobs_or_zero_occ_residues.label_seq_id 
1  1 Y 1 EEE PRO 330 ? A PRO 1   
2  1 Y 1 EEE ASN 331 ? A ASN 2   
3  1 Y 1 EEE LYS 528 ? A LYS 199 
4  1 Y 1 EEE LYS 529 ? A LYS 200 
5  1 Y 1 EEE SER 530 ? A SER 201 
6  1 Y 1 EEE THR 531 ? A THR 202 
7  1 Y 1 EEE ASN 532 ? A ASN 203 
8  1 Y 1 EEE LYS 533 ? A LYS 204 
9  1 Y 1 EEE HIS 534 ? A HIS 205 
10 1 Y 1 EEE HIS 535 ? A HIS 206 
11 1 Y 1 EEE HIS 536 ? A HIS 207 
12 1 Y 1 EEE HIS 537 ? A HIS 208 
13 1 Y 1 EEE HIS 538 ? A HIS 209 
14 1 Y 1 EEE HIS 539 ? A HIS 210 
15 1 Y 1 FFF LYS 122 ? B LYS 122 
16 1 Y 1 FFF HIS 123 ? B HIS 123 
17 1 Y 1 FFF HIS 124 ? B HIS 124 
18 1 Y 1 FFF HIS 125 ? B HIS 125 
19 1 Y 1 FFF HIS 126 ? B HIS 126 
20 1 Y 1 FFF HIS 127 ? B HIS 127 
21 1 Y 1 FFF HIS 128 ? B HIS 128 
# 
loop_
_pdbx_audit_support.funding_organization 
_pdbx_audit_support.country 
_pdbx_audit_support.grant_number 
_pdbx_audit_support.ordinal 
'Wellcome Trust'                                     'United Kingdom' '100209/Z/12/Z)' 1 
'Engineering and Physical Sciences Research Council' 'United Kingdom' EP/S025243/1     2 
# 
loop_
_pdbx_chem_comp_identifier.comp_id 
_pdbx_chem_comp_identifier.type 
_pdbx_chem_comp_identifier.program 
_pdbx_chem_comp_identifier.program_version 
_pdbx_chem_comp_identifier.identifier 
NAG 'CONDENSED IUPAC CARBOHYDRATE SYMBOL' GMML     1.0 DGlcpNAcb                      
NAG 'COMMON NAME'                         GMML     1.0 N-acetyl-b-D-glucopyranosamine 
NAG 'IUPAC CARBOHYDRATE SYMBOL'           PDB-CARE 1.0 b-D-GlcpNAc                    
NAG 'SNFG CARBOHYDRATE SYMBOL'            GMML     1.0 GlcNAc                         
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
3 2-acetamido-2-deoxy-beta-D-glucopyranose NAG 
4 'ACETATE ION'                            ACT 
5 water                                    HOH 
# 
_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                ? 
# 
