data_8Z39
# 
_entry.id   8Z39 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.403 
_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   8Z39         pdb_00008z39 10.2210/pdb8z39/pdb 
WWPDB D_1300046917 ?            ?                   
# 
_pdbx_audit_revision_history.ordinal             1 
_pdbx_audit_revision_history.data_content_type   'Structure model' 
_pdbx_audit_revision_history.major_revision      1 
_pdbx_audit_revision_history.minor_revision      0 
_pdbx_audit_revision_history.revision_date       2025-04-16 
_pdbx_audit_revision_history.part_number         ? 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        8Z39 
_pdbx_database_status.recvd_initial_deposition_date   2024-04-14 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBJ 
_pdbx_database_status.process_site                    PDBJ 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              tsumoto@bioeng.t.u-tokyo.ac.jp 
_pdbx_contact_author.name_first         Kouhei 
_pdbx_contact_author.name_last          Tsumoto 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0001-7643-5164 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Caaveiro, J.M.M.' 1 ? 
'Kaneda, I.'       2 ? 
'Tsumoto, K.'      3 ? 
# 
_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                   ? 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'To Be Published' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            0353 
_citation.journal_id_ISSN           ? 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            ? 
_citation.language                  ? 
_citation.page_first                ? 
_citation.page_last                 ? 
_citation.title                     
;Biophysical insights to improve affinity of antibodies to fluctuated epitope of antigen: A case of anti-Shh antibody 5E1 against Shh antigen.
;
_citation.year                      ? 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      ? 
_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 'Kaneda, I.'       1 ? 
primary 'Matsunaga, R.'    2 ? 
primary 'Nagatoishi, S.'   3 ? 
primary 'Senoo, A.'        4 ? 
primary 'Caaveiro, J.M.M.' 5 ? 
primary 'Kuroda, D.'       6 ? 
primary 'Tsumoto, K.'      7 ? 
# 
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 'Sonic hedgehog protein N-product' 19122.484 1   ? ?    ? ? 
2 polymer     man 'Heavy chain of antibody 5E1'      26318.254 1   ? ?    ? ? 
3 polymer     man 'Light chain of antibody 5E1'      26035.822 1   ? T56A ? ? 
4 non-polymer syn 'CALCIUM ION'                      40.078    2   ? ?    ? ? 
5 non-polymer syn 'ZINC ION'                         65.409    1   ? ?    ? ? 
6 non-polymer syn 'CHLORIDE ION'                     35.453    1   ? ?    ? ? 
7 non-polymer syn 'SULFATE ION'                      96.063    1   ? ?    ? ? 
8 water       nat water                              18.015    625 ? ?    ? ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        'ShhN,Shh N-terminal processed signaling domains,ShhNp' 
# 
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 
;GFGKRRHPKKLTPLAYKQFIPNVAEKTLGASGRYEGKISRNSERFKELTPNYNPDIIFKDEENTGADRLMTQRCKDKLNA
LAISVMNQWPGVKLRVTEGWDEDGHHSEESLHYEGRAVDITTSDRDRSKYGMLARLAVEAGFDWVYYESKAHIHCSVKAE
NSVAAKSGG
;
;GFGKRRHPKKLTPLAYKQFIPNVAEKTLGASGRYEGKISRNSERFKELTPNYNPDIIFKDEENTGADRLMTQRCKDKLNA
LAISVMNQWPGVKLRVTEGWDEDGHHSEESLHYEGRAVDITTSDRDRSKYGMLARLAVEAGFDWVYYESKAHIHCSVKAE
NSVAAKSGG
;
A ? 
2 'polypeptide(L)' no no 
;QVQLQQSGPELVRPGVSVKISCKGSGYTFIDEALHWVKQSHAESLEWIGVIRPYSGETNYNQKFKDKATMTVDISSSTAY
LELARLTSEDSAIYYCARDWERGDFFDYWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSW
NSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKEQKLISEEDLNSAVDHHHHH
H
;
;QVQLQQSGPELVRPGVSVKISCKGSGYTFIDEALHWVKQSHAESLEWIGVIRPYSGETNYNQKFKDKATMTVDISSSTAY
LELARLTSEDSAIYYCARDWERGDFFDYWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSW
NSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKEQKLISEEDLNSAVDHHHHH
H
;
H ? 
3 'polypeptide(L)' no no 
;GDIVMTQTPKFLLVSAGDKVTITCKASQSVSNDLTWYQQKPGQSPKLLIYYASNRYAGVPDRFTGSGYGTDFTFTISTVQ
AEDLAVYFCQQDYGSPPTFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNS
QESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGECEQKLISEEDLNSAVDHHHHHH
;
;GDIVMTQTPKFLLVSAGDKVTITCKASQSVSNDLTWYQQKPGQSPKLLIYYASNRYAGVPDRFTGSGYGTDFTFTISTVQ
AEDLAVYFCQQDYGSPPTFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNS
QESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGECEQKLISEEDLNSAVDHHHHHH
;
L ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
4 'CALCIUM ION'  CA  
5 'ZINC ION'     ZN  
6 'CHLORIDE ION' CL  
7 'SULFATE ION'  SO4 
8 water          HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   GLY n 
1 2   PHE n 
1 3   GLY n 
1 4   LYS n 
1 5   ARG n 
1 6   ARG n 
1 7   HIS n 
1 8   PRO n 
1 9   LYS n 
1 10  LYS n 
1 11  LEU n 
1 12  THR n 
1 13  PRO n 
1 14  LEU n 
1 15  ALA n 
1 16  TYR n 
1 17  LYS n 
1 18  GLN n 
1 19  PHE n 
1 20  ILE n 
1 21  PRO n 
1 22  ASN n 
1 23  VAL n 
1 24  ALA n 
1 25  GLU n 
1 26  LYS n 
1 27  THR n 
1 28  LEU n 
1 29  GLY n 
1 30  ALA n 
1 31  SER n 
1 32  GLY n 
1 33  ARG n 
1 34  TYR n 
1 35  GLU n 
1 36  GLY n 
1 37  LYS n 
1 38  ILE n 
1 39  SER n 
1 40  ARG n 
1 41  ASN n 
1 42  SER n 
1 43  GLU n 
1 44  ARG n 
1 45  PHE n 
1 46  LYS n 
1 47  GLU n 
1 48  LEU n 
1 49  THR n 
1 50  PRO n 
1 51  ASN n 
1 52  TYR n 
1 53  ASN n 
1 54  PRO n 
1 55  ASP n 
1 56  ILE n 
1 57  ILE n 
1 58  PHE n 
1 59  LYS n 
1 60  ASP n 
1 61  GLU n 
1 62  GLU n 
1 63  ASN n 
1 64  THR n 
1 65  GLY n 
1 66  ALA n 
1 67  ASP n 
1 68  ARG n 
1 69  LEU n 
1 70  MET n 
1 71  THR n 
1 72  GLN n 
1 73  ARG n 
1 74  CYS n 
1 75  LYS n 
1 76  ASP n 
1 77  LYS n 
1 78  LEU n 
1 79  ASN n 
1 80  ALA n 
1 81  LEU n 
1 82  ALA n 
1 83  ILE n 
1 84  SER n 
1 85  VAL n 
1 86  MET n 
1 87  ASN n 
1 88  GLN n 
1 89  TRP n 
1 90  PRO n 
1 91  GLY n 
1 92  VAL n 
1 93  LYS n 
1 94  LEU n 
1 95  ARG n 
1 96  VAL n 
1 97  THR n 
1 98  GLU n 
1 99  GLY n 
1 100 TRP n 
1 101 ASP n 
1 102 GLU n 
1 103 ASP n 
1 104 GLY n 
1 105 HIS n 
1 106 HIS n 
1 107 SER n 
1 108 GLU n 
1 109 GLU n 
1 110 SER n 
1 111 LEU n 
1 112 HIS n 
1 113 TYR n 
1 114 GLU n 
1 115 GLY n 
1 116 ARG n 
1 117 ALA n 
1 118 VAL n 
1 119 ASP n 
1 120 ILE n 
1 121 THR n 
1 122 THR n 
1 123 SER n 
1 124 ASP n 
1 125 ARG n 
1 126 ASP n 
1 127 ARG n 
1 128 SER n 
1 129 LYS n 
1 130 TYR n 
1 131 GLY n 
1 132 MET n 
1 133 LEU n 
1 134 ALA n 
1 135 ARG n 
1 136 LEU n 
1 137 ALA n 
1 138 VAL n 
1 139 GLU n 
1 140 ALA n 
1 141 GLY n 
1 142 PHE n 
1 143 ASP n 
1 144 TRP n 
1 145 VAL n 
1 146 TYR n 
1 147 TYR n 
1 148 GLU n 
1 149 SER n 
1 150 LYS n 
1 151 ALA n 
1 152 HIS n 
1 153 ILE n 
1 154 HIS n 
1 155 CYS n 
1 156 SER n 
1 157 VAL n 
1 158 LYS n 
1 159 ALA n 
1 160 GLU n 
1 161 ASN n 
1 162 SER n 
1 163 VAL n 
1 164 ALA n 
1 165 ALA n 
1 166 LYS n 
1 167 SER n 
1 168 GLY n 
1 169 GLY n 
2 1   GLN n 
2 2   VAL n 
2 3   GLN n 
2 4   LEU n 
2 5   GLN n 
2 6   GLN n 
2 7   SER n 
2 8   GLY n 
2 9   PRO n 
2 10  GLU n 
2 11  LEU n 
2 12  VAL n 
2 13  ARG n 
2 14  PRO n 
2 15  GLY n 
2 16  VAL n 
2 17  SER n 
2 18  VAL n 
2 19  LYS n 
2 20  ILE n 
2 21  SER n 
2 22  CYS n 
2 23  LYS n 
2 24  GLY n 
2 25  SER n 
2 26  GLY n 
2 27  TYR n 
2 28  THR n 
2 29  PHE n 
2 30  ILE n 
2 31  ASP n 
2 32  GLU n 
2 33  ALA n 
2 34  LEU n 
2 35  HIS n 
2 36  TRP n 
2 37  VAL n 
2 38  LYS n 
2 39  GLN n 
2 40  SER n 
2 41  HIS n 
2 42  ALA n 
2 43  GLU n 
2 44  SER n 
2 45  LEU n 
2 46  GLU n 
2 47  TRP n 
2 48  ILE n 
2 49  GLY n 
2 50  VAL n 
2 51  ILE n 
2 52  ARG n 
2 53  PRO n 
2 54  TYR n 
2 55  SER n 
2 56  GLY n 
2 57  GLU n 
2 58  THR n 
2 59  ASN n 
2 60  TYR n 
2 61  ASN n 
2 62  GLN n 
2 63  LYS n 
2 64  PHE n 
2 65  LYS n 
2 66  ASP n 
2 67  LYS n 
2 68  ALA n 
2 69  THR n 
2 70  MET n 
2 71  THR n 
2 72  VAL n 
2 73  ASP n 
2 74  ILE n 
2 75  SER n 
2 76  SER n 
2 77  SER n 
2 78  THR n 
2 79  ALA n 
2 80  TYR n 
2 81  LEU n 
2 82  GLU n 
2 83  LEU n 
2 84  ALA n 
2 85  ARG n 
2 86  LEU n 
2 87  THR n 
2 88  SER n 
2 89  GLU n 
2 90  ASP n 
2 91  SER n 
2 92  ALA n 
2 93  ILE n 
2 94  TYR n 
2 95  TYR n 
2 96  CYS n 
2 97  ALA n 
2 98  ARG n 
2 99  ASP n 
2 100 TRP n 
2 101 GLU n 
2 102 ARG n 
2 103 GLY n 
2 104 ASP n 
2 105 PHE n 
2 106 PHE n 
2 107 ASP n 
2 108 TYR n 
2 109 TRP n 
2 110 GLY n 
2 111 GLN n 
2 112 GLY n 
2 113 THR n 
2 114 LEU n 
2 115 VAL n 
2 116 THR n 
2 117 VAL n 
2 118 SER n 
2 119 SER n 
2 120 ALA n 
2 121 SER n 
2 122 THR n 
2 123 LYS n 
2 124 GLY n 
2 125 PRO n 
2 126 SER n 
2 127 VAL n 
2 128 PHE n 
2 129 PRO n 
2 130 LEU n 
2 131 ALA n 
2 132 PRO n 
2 133 SER n 
2 134 SER n 
2 135 LYS n 
2 136 SER n 
2 137 THR n 
2 138 SER n 
2 139 GLY n 
2 140 GLY n 
2 141 THR n 
2 142 ALA n 
2 143 ALA n 
2 144 LEU n 
2 145 GLY n 
2 146 CYS n 
2 147 LEU n 
2 148 VAL n 
2 149 LYS n 
2 150 ASP n 
2 151 TYR n 
2 152 PHE n 
2 153 PRO n 
2 154 GLU n 
2 155 PRO n 
2 156 VAL n 
2 157 THR n 
2 158 VAL n 
2 159 SER n 
2 160 TRP n 
2 161 ASN n 
2 162 SER n 
2 163 GLY n 
2 164 ALA n 
2 165 LEU n 
2 166 THR n 
2 167 SER n 
2 168 GLY n 
2 169 VAL n 
2 170 HIS n 
2 171 THR n 
2 172 PHE n 
2 173 PRO n 
2 174 ALA n 
2 175 VAL n 
2 176 LEU n 
2 177 GLN n 
2 178 SER n 
2 179 SER n 
2 180 GLY n 
2 181 LEU n 
2 182 TYR n 
2 183 SER n 
2 184 LEU n 
2 185 SER n 
2 186 SER n 
2 187 VAL n 
2 188 VAL n 
2 189 THR n 
2 190 VAL n 
2 191 PRO n 
2 192 SER n 
2 193 SER n 
2 194 SER n 
2 195 LEU n 
2 196 GLY n 
2 197 THR n 
2 198 GLN n 
2 199 THR n 
2 200 TYR n 
2 201 ILE n 
2 202 CYS n 
2 203 ASN n 
2 204 VAL n 
2 205 ASN n 
2 206 HIS n 
2 207 LYS n 
2 208 PRO n 
2 209 SER n 
2 210 ASN n 
2 211 THR n 
2 212 LYS n 
2 213 VAL n 
2 214 ASP n 
2 215 LYS n 
2 216 LYS n 
2 217 VAL n 
2 218 GLU n 
2 219 PRO n 
2 220 LYS n 
2 221 GLU n 
2 222 GLN n 
2 223 LYS n 
2 224 LEU n 
2 225 ILE n 
2 226 SER n 
2 227 GLU n 
2 228 GLU n 
2 229 ASP n 
2 230 LEU n 
2 231 ASN n 
2 232 SER n 
2 233 ALA n 
2 234 VAL n 
2 235 ASP n 
2 236 HIS n 
2 237 HIS n 
2 238 HIS n 
2 239 HIS n 
2 240 HIS n 
2 241 HIS n 
3 1   GLY n 
3 2   ASP n 
3 3   ILE n 
3 4   VAL n 
3 5   MET n 
3 6   THR n 
3 7   GLN n 
3 8   THR n 
3 9   PRO n 
3 10  LYS n 
3 11  PHE n 
3 12  LEU n 
3 13  LEU n 
3 14  VAL n 
3 15  SER n 
3 16  ALA n 
3 17  GLY n 
3 18  ASP n 
3 19  LYS n 
3 20  VAL n 
3 21  THR n 
3 22  ILE n 
3 23  THR n 
3 24  CYS n 
3 25  LYS n 
3 26  ALA n 
3 27  SER n 
3 28  GLN n 
3 29  SER n 
3 30  VAL n 
3 31  SER n 
3 32  ASN n 
3 33  ASP n 
3 34  LEU n 
3 35  THR n 
3 36  TRP n 
3 37  TYR n 
3 38  GLN n 
3 39  GLN n 
3 40  LYS n 
3 41  PRO n 
3 42  GLY n 
3 43  GLN n 
3 44  SER n 
3 45  PRO n 
3 46  LYS n 
3 47  LEU n 
3 48  LEU n 
3 49  ILE n 
3 50  TYR n 
3 51  TYR n 
3 52  ALA n 
3 53  SER n 
3 54  ASN n 
3 55  ARG n 
3 56  TYR n 
3 57  ALA n 
3 58  GLY n 
3 59  VAL n 
3 60  PRO n 
3 61  ASP n 
3 62  ARG n 
3 63  PHE n 
3 64  THR n 
3 65  GLY n 
3 66  SER n 
3 67  GLY n 
3 68  TYR n 
3 69  GLY n 
3 70  THR n 
3 71  ASP n 
3 72  PHE n 
3 73  THR n 
3 74  PHE n 
3 75  THR n 
3 76  ILE n 
3 77  SER n 
3 78  THR n 
3 79  VAL n 
3 80  GLN n 
3 81  ALA n 
3 82  GLU n 
3 83  ASP n 
3 84  LEU n 
3 85  ALA n 
3 86  VAL n 
3 87  TYR n 
3 88  PHE n 
3 89  CYS n 
3 90  GLN n 
3 91  GLN n 
3 92  ASP n 
3 93  TYR n 
3 94  GLY n 
3 95  SER n 
3 96  PRO n 
3 97  PRO n 
3 98  THR n 
3 99  PHE n 
3 100 GLY n 
3 101 GLY n 
3 102 GLY n 
3 103 THR n 
3 104 LYS n 
3 105 VAL n 
3 106 GLU n 
3 107 ILE n 
3 108 LYS n 
3 109 ARG n 
3 110 THR n 
3 111 VAL n 
3 112 ALA n 
3 113 ALA n 
3 114 PRO n 
3 115 SER n 
3 116 VAL n 
3 117 PHE n 
3 118 ILE n 
3 119 PHE n 
3 120 PRO n 
3 121 PRO n 
3 122 SER n 
3 123 ASP n 
3 124 GLU n 
3 125 GLN n 
3 126 LEU n 
3 127 LYS n 
3 128 SER n 
3 129 GLY n 
3 130 THR n 
3 131 ALA n 
3 132 SER n 
3 133 VAL n 
3 134 VAL n 
3 135 CYS n 
3 136 LEU n 
3 137 LEU n 
3 138 ASN n 
3 139 ASN n 
3 140 PHE n 
3 141 TYR n 
3 142 PRO n 
3 143 ARG n 
3 144 GLU n 
3 145 ALA n 
3 146 LYS n 
3 147 VAL n 
3 148 GLN n 
3 149 TRP n 
3 150 LYS n 
3 151 VAL n 
3 152 ASP n 
3 153 ASN n 
3 154 ALA n 
3 155 LEU n 
3 156 GLN n 
3 157 SER n 
3 158 GLY n 
3 159 ASN n 
3 160 SER n 
3 161 GLN n 
3 162 GLU n 
3 163 SER n 
3 164 VAL n 
3 165 THR n 
3 166 GLU n 
3 167 GLN n 
3 168 ASP n 
3 169 SER n 
3 170 LYS n 
3 171 ASP n 
3 172 SER n 
3 173 THR n 
3 174 TYR n 
3 175 SER n 
3 176 LEU n 
3 177 SER n 
3 178 SER n 
3 179 THR n 
3 180 LEU n 
3 181 THR n 
3 182 LEU n 
3 183 SER n 
3 184 LYS n 
3 185 ALA n 
3 186 ASP n 
3 187 TYR n 
3 188 GLU n 
3 189 LYS n 
3 190 HIS n 
3 191 LYS n 
3 192 VAL n 
3 193 TYR n 
3 194 ALA n 
3 195 CYS n 
3 196 GLU n 
3 197 VAL n 
3 198 THR n 
3 199 HIS n 
3 200 GLN n 
3 201 GLY n 
3 202 LEU n 
3 203 SER n 
3 204 SER n 
3 205 PRO n 
3 206 VAL n 
3 207 THR n 
3 208 LYS n 
3 209 SER n 
3 210 PHE n 
3 211 ASN n 
3 212 ARG n 
3 213 GLY n 
3 214 GLU n 
3 215 CYS n 
3 216 GLU n 
3 217 GLN n 
3 218 LYS n 
3 219 LEU n 
3 220 ILE n 
3 221 SER n 
3 222 GLU n 
3 223 GLU n 
3 224 ASP n 
3 225 LEU n 
3 226 ASN n 
3 227 SER n 
3 228 ALA n 
3 229 VAL n 
3 230 ASP n 
3 231 HIS n 
3 232 HIS n 
3 233 HIS n 
3 234 HIS n 
3 235 HIS n 
3 236 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' 1 169 human ? SHH ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? 'Escherichia coli BL21(DE3)' 
469008 ? ? ? ? ? ? ? ? ?       ? ? ? ? ? ? ? ? ? ? ? ? 
2 1 sample 'Biological sequence' 1 241 ?     ? IgG ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? 'Homo sapiens'               
9606   ? ? ? ? ? ? ? ? EXPI293 ? ? ? ? ? ? ? ? ? ? ? ? 
3 1 sample 'Biological sequence' 1 236 ?     ? IgG ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? 'Homo sapiens'               
9606   ? ? ? ? ? ? ? ? EXPI293 ? ? ? ? ? ? ? ? ? ? ? ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking' y ALANINE         ? 'C3 H7 N O2'     89.093  
ARG 'L-peptide linking' y ARGININE        ? 'C6 H15 N4 O2 1' 175.209 
ASN 'L-peptide linking' y ASPARAGINE      ? 'C4 H8 N2 O3'    132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4'     133.103 
CA  non-polymer         . 'CALCIUM ION'   ? 'Ca 2'           40.078  
CL  non-polymer         . 'CHLORIDE ION'  ? 'Cl -1'          35.453  
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 
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 
SO4 non-polymer         . 'SULFATE ION'   ? 'O4 S -2'        96.063  
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 
ZN  non-polymer         . 'ZINC ION'      ? 'Zn 2'           65.409  
# 
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   GLY 1   29  ?   ?   ?   A . n 
A 1 2   PHE 2   30  ?   ?   ?   A . n 
A 1 3   GLY 3   31  ?   ?   ?   A . n 
A 1 4   LYS 4   32  ?   ?   ?   A . n 
A 1 5   ARG 5   33  ?   ?   ?   A . n 
A 1 6   ARG 6   34  ?   ?   ?   A . n 
A 1 7   HIS 7   35  ?   ?   ?   A . n 
A 1 8   PRO 8   36  ?   ?   ?   A . n 
A 1 9   LYS 9   37  ?   ?   ?   A . n 
A 1 10  LYS 10  38  ?   ?   ?   A . n 
A 1 11  LEU 11  39  39  LEU LEU A . n 
A 1 12  THR 12  40  40  THR THR A . n 
A 1 13  PRO 13  41  41  PRO PRO A . n 
A 1 14  LEU 14  42  42  LEU LEU A . n 
A 1 15  ALA 15  43  43  ALA ALA A . n 
A 1 16  TYR 16  44  44  TYR TYR A . n 
A 1 17  LYS 17  45  45  LYS LYS A . n 
A 1 18  GLN 18  46  46  GLN GLN A . n 
A 1 19  PHE 19  47  47  PHE PHE A . n 
A 1 20  ILE 20  48  48  ILE ILE A . n 
A 1 21  PRO 21  49  49  PRO PRO A . n 
A 1 22  ASN 22  50  50  ASN ASN A . n 
A 1 23  VAL 23  51  51  VAL VAL A . n 
A 1 24  ALA 24  52  52  ALA ALA A . n 
A 1 25  GLU 25  53  53  GLU GLU A . n 
A 1 26  LYS 26  54  54  LYS LYS A . n 
A 1 27  THR 27  55  55  THR THR A . n 
A 1 28  LEU 28  56  56  LEU LEU A . n 
A 1 29  GLY 29  57  57  GLY GLY A . n 
A 1 30  ALA 30  58  58  ALA ALA A . n 
A 1 31  SER 31  59  59  SER SER A . n 
A 1 32  GLY 32  60  60  GLY GLY A . n 
A 1 33  ARG 33  61  61  ARG ARG A . n 
A 1 34  TYR 34  62  62  TYR TYR A . n 
A 1 35  GLU 35  63  63  GLU GLU A . n 
A 1 36  GLY 36  64  64  GLY GLY A . n 
A 1 37  LYS 37  65  65  LYS LYS A . n 
A 1 38  ILE 38  66  66  ILE ILE A . n 
A 1 39  SER 39  67  67  SER SER A . n 
A 1 40  ARG 40  68  68  ARG ARG A . n 
A 1 41  ASN 41  69  69  ASN ASN A . n 
A 1 42  SER 42  70  70  SER SER A . n 
A 1 43  GLU 43  71  71  GLU GLU A . n 
A 1 44  ARG 44  72  72  ARG ARG A . n 
A 1 45  PHE 45  73  73  PHE PHE A . n 
A 1 46  LYS 46  74  74  LYS LYS A . n 
A 1 47  GLU 47  75  75  GLU GLU A . n 
A 1 48  LEU 48  76  76  LEU LEU A . n 
A 1 49  THR 49  77  77  THR THR A . n 
A 1 50  PRO 50  78  78  PRO PRO A . n 
A 1 51  ASN 51  79  79  ASN ASN A . n 
A 1 52  TYR 52  80  80  TYR TYR A . n 
A 1 53  ASN 53  81  81  ASN ASN A . n 
A 1 54  PRO 54  82  82  PRO PRO A . n 
A 1 55  ASP 55  83  83  ASP ASP A . n 
A 1 56  ILE 56  84  84  ILE ILE A . n 
A 1 57  ILE 57  85  85  ILE ILE A . n 
A 1 58  PHE 58  86  86  PHE PHE A . n 
A 1 59  LYS 59  87  87  LYS LYS A . n 
A 1 60  ASP 60  88  88  ASP ASP A . n 
A 1 61  GLU 61  89  89  GLU GLU A . n 
A 1 62  GLU 62  90  90  GLU GLU A . n 
A 1 63  ASN 63  91  91  ASN ASN A . n 
A 1 64  THR 64  92  92  THR THR A . n 
A 1 65  GLY 65  93  93  GLY GLY A . n 
A 1 66  ALA 66  94  94  ALA ALA A . n 
A 1 67  ASP 67  95  95  ASP ASP A . n 
A 1 68  ARG 68  96  96  ARG ARG A . n 
A 1 69  LEU 69  97  97  LEU LEU A . n 
A 1 70  MET 70  98  98  MET MET A . n 
A 1 71  THR 71  99  99  THR THR A . n 
A 1 72  GLN 72  100 100 GLN GLN A . n 
A 1 73  ARG 73  101 101 ARG ARG A . n 
A 1 74  CYS 74  102 102 CYS CYS A . n 
A 1 75  LYS 75  103 103 LYS LYS A . n 
A 1 76  ASP 76  104 104 ASP ASP A . n 
A 1 77  LYS 77  105 105 LYS LYS A . n 
A 1 78  LEU 78  106 106 LEU LEU A . n 
A 1 79  ASN 79  107 107 ASN ASN A . n 
A 1 80  ALA 80  108 108 ALA ALA A . n 
A 1 81  LEU 81  109 109 LEU LEU A . n 
A 1 82  ALA 82  110 110 ALA ALA A . n 
A 1 83  ILE 83  111 111 ILE ILE A . n 
A 1 84  SER 84  112 112 SER SER A . n 
A 1 85  VAL 85  113 113 VAL VAL A . n 
A 1 86  MET 86  114 114 MET MET A . n 
A 1 87  ASN 87  115 115 ASN ASN A . n 
A 1 88  GLN 88  116 116 GLN GLN A . n 
A 1 89  TRP 89  117 117 TRP TRP A . n 
A 1 90  PRO 90  118 118 PRO PRO A . n 
A 1 91  GLY 91  119 119 GLY GLY A . n 
A 1 92  VAL 92  120 120 VAL VAL A . n 
A 1 93  LYS 93  121 121 LYS LYS A . n 
A 1 94  LEU 94  122 122 LEU LEU A . n 
A 1 95  ARG 95  123 123 ARG ARG A . n 
A 1 96  VAL 96  124 124 VAL VAL A . n 
A 1 97  THR 97  125 125 THR THR A . n 
A 1 98  GLU 98  126 126 GLU GLU A . n 
A 1 99  GLY 99  127 127 GLY GLY A . n 
A 1 100 TRP 100 128 128 TRP TRP A . n 
A 1 101 ASP 101 129 129 ASP ASP A . n 
A 1 102 GLU 102 130 130 GLU GLU A . n 
A 1 103 ASP 103 131 131 ASP ASP A . n 
A 1 104 GLY 104 132 132 GLY GLY A . n 
A 1 105 HIS 105 133 133 HIS HIS A . n 
A 1 106 HIS 106 134 134 HIS HIS A . n 
A 1 107 SER 107 135 135 SER SER A . n 
A 1 108 GLU 108 136 136 GLU GLU A . n 
A 1 109 GLU 109 137 137 GLU GLU A . n 
A 1 110 SER 110 138 138 SER SER A . n 
A 1 111 LEU 111 139 139 LEU LEU A . n 
A 1 112 HIS 112 140 140 HIS HIS A . n 
A 1 113 TYR 113 141 141 TYR TYR A . n 
A 1 114 GLU 114 142 142 GLU GLU A . n 
A 1 115 GLY 115 143 143 GLY GLY A . n 
A 1 116 ARG 116 144 144 ARG ARG A . n 
A 1 117 ALA 117 145 145 ALA ALA A . n 
A 1 118 VAL 118 146 146 VAL VAL A . n 
A 1 119 ASP 119 147 147 ASP ASP A . n 
A 1 120 ILE 120 148 148 ILE ILE A . n 
A 1 121 THR 121 149 149 THR THR A . n 
A 1 122 THR 122 150 150 THR THR A . n 
A 1 123 SER 123 151 151 SER SER A . n 
A 1 124 ASP 124 152 152 ASP ASP A . n 
A 1 125 ARG 125 153 153 ARG ARG A . n 
A 1 126 ASP 126 154 154 ASP ASP A . n 
A 1 127 ARG 127 155 155 ARG ARG A . n 
A 1 128 SER 128 156 156 SER SER A . n 
A 1 129 LYS 129 157 157 LYS LYS A . n 
A 1 130 TYR 130 158 158 TYR TYR A . n 
A 1 131 GLY 131 159 159 GLY GLY A . n 
A 1 132 MET 132 160 160 MET MET A . n 
A 1 133 LEU 133 161 161 LEU LEU A . n 
A 1 134 ALA 134 162 162 ALA ALA A . n 
A 1 135 ARG 135 163 163 ARG ARG A . n 
A 1 136 LEU 136 164 164 LEU LEU A . n 
A 1 137 ALA 137 165 165 ALA ALA A . n 
A 1 138 VAL 138 166 166 VAL VAL A . n 
A 1 139 GLU 139 167 167 GLU GLU A . n 
A 1 140 ALA 140 168 168 ALA ALA A . n 
A 1 141 GLY 141 169 169 GLY GLY A . n 
A 1 142 PHE 142 170 170 PHE PHE A . n 
A 1 143 ASP 143 171 171 ASP ASP A . n 
A 1 144 TRP 144 172 172 TRP TRP A . n 
A 1 145 VAL 145 173 173 VAL VAL A . n 
A 1 146 TYR 146 174 174 TYR TYR A . n 
A 1 147 TYR 147 175 175 TYR TYR A . n 
A 1 148 GLU 148 176 176 GLU GLU A . n 
A 1 149 SER 149 177 177 SER SER A . n 
A 1 150 LYS 150 178 178 LYS LYS A . n 
A 1 151 ALA 151 179 179 ALA ALA A . n 
A 1 152 HIS 152 180 180 HIS HIS A . n 
A 1 153 ILE 153 181 181 ILE ILE A . n 
A 1 154 HIS 154 182 182 HIS HIS A . n 
A 1 155 CYS 155 183 183 CYS CYS A . n 
A 1 156 SER 156 184 184 SER SER A . n 
A 1 157 VAL 157 185 185 VAL VAL A . n 
A 1 158 LYS 158 186 186 LYS LYS A . n 
A 1 159 ALA 159 187 187 ALA ALA A . n 
A 1 160 GLU 160 188 188 GLU GLU A . n 
A 1 161 ASN 161 189 189 ASN ASN A . n 
A 1 162 SER 162 190 ?   ?   ?   A . n 
A 1 163 VAL 163 191 ?   ?   ?   A . n 
A 1 164 ALA 164 192 ?   ?   ?   A . n 
A 1 165 ALA 165 193 ?   ?   ?   A . n 
A 1 166 LYS 166 194 ?   ?   ?   A . n 
A 1 167 SER 167 195 ?   ?   ?   A . n 
A 1 168 GLY 168 196 ?   ?   ?   A . n 
A 1 169 GLY 169 197 ?   ?   ?   A . n 
B 2 1   GLN 1   1   1   GLN GLN H . n 
B 2 2   VAL 2   2   2   VAL VAL H . n 
B 2 3   GLN 3   3   3   GLN GLN H . n 
B 2 4   LEU 4   4   4   LEU LEU H . n 
B 2 5   GLN 5   5   5   GLN GLN H . n 
B 2 6   GLN 6   6   6   GLN GLN H . n 
B 2 7   SER 7   7   7   SER SER H . n 
B 2 8   GLY 8   8   8   GLY GLY H . n 
B 2 9   PRO 9   9   9   PRO PRO H . n 
B 2 10  GLU 10  10  10  GLU GLU H . n 
B 2 11  LEU 11  11  11  LEU LEU H . n 
B 2 12  VAL 12  12  12  VAL VAL H . n 
B 2 13  ARG 13  13  13  ARG ARG H . n 
B 2 14  PRO 14  14  14  PRO PRO H . n 
B 2 15  GLY 15  15  15  GLY GLY H . n 
B 2 16  VAL 16  16  16  VAL VAL H . n 
B 2 17  SER 17  17  17  SER SER H . n 
B 2 18  VAL 18  18  18  VAL VAL H . n 
B 2 19  LYS 19  19  19  LYS LYS H . n 
B 2 20  ILE 20  20  20  ILE ILE H . n 
B 2 21  SER 21  21  21  SER SER H . n 
B 2 22  CYS 22  22  22  CYS CYS H . n 
B 2 23  LYS 23  23  23  LYS LYS H . n 
B 2 24  GLY 24  24  24  GLY GLY H . n 
B 2 25  SER 25  25  25  SER SER H . n 
B 2 26  GLY 26  26  26  GLY GLY H . n 
B 2 27  TYR 27  27  27  TYR TYR H . n 
B 2 28  THR 28  28  28  THR THR H . n 
B 2 29  PHE 29  29  29  PHE PHE H . n 
B 2 30  ILE 30  30  30  ILE ILE H . n 
B 2 31  ASP 31  31  31  ASP ASP H . n 
B 2 32  GLU 32  32  32  GLU GLU H . n 
B 2 33  ALA 33  33  33  ALA ALA H . n 
B 2 34  LEU 34  34  34  LEU LEU H . n 
B 2 35  HIS 35  35  35  HIS HIS H . n 
B 2 36  TRP 36  36  36  TRP TRP H . n 
B 2 37  VAL 37  37  37  VAL VAL H . n 
B 2 38  LYS 38  38  38  LYS LYS H . n 
B 2 39  GLN 39  39  39  GLN GLN H . n 
B 2 40  SER 40  40  40  SER SER H . n 
B 2 41  HIS 41  41  41  HIS HIS H . n 
B 2 42  ALA 42  42  42  ALA ALA H . n 
B 2 43  GLU 43  43  43  GLU GLU H . n 
B 2 44  SER 44  44  44  SER SER H . n 
B 2 45  LEU 45  45  45  LEU LEU H . n 
B 2 46  GLU 46  46  46  GLU GLU H . n 
B 2 47  TRP 47  47  47  TRP TRP H . n 
B 2 48  ILE 48  48  48  ILE ILE H . n 
B 2 49  GLY 49  49  49  GLY GLY H . n 
B 2 50  VAL 50  50  50  VAL VAL H . n 
B 2 51  ILE 51  51  51  ILE ILE H . n 
B 2 52  ARG 52  52  52  ARG ARG H . n 
B 2 53  PRO 53  53  53  PRO PRO H . n 
B 2 54  TYR 54  54  54  TYR TYR H . n 
B 2 55  SER 55  55  55  SER SER H . n 
B 2 56  GLY 56  56  56  GLY GLY H . n 
B 2 57  GLU 57  57  57  GLU GLU H . n 
B 2 58  THR 58  58  58  THR THR H . n 
B 2 59  ASN 59  59  59  ASN ASN H . n 
B 2 60  TYR 60  60  60  TYR TYR H . n 
B 2 61  ASN 61  61  61  ASN ASN H . n 
B 2 62  GLN 62  62  62  GLN GLN H . n 
B 2 63  LYS 63  63  63  LYS LYS H . n 
B 2 64  PHE 64  64  64  PHE PHE H . n 
B 2 65  LYS 65  65  65  LYS LYS H . n 
B 2 66  ASP 66  66  66  ASP ASP H . n 
B 2 67  LYS 67  67  67  LYS LYS H . n 
B 2 68  ALA 68  68  68  ALA ALA H . n 
B 2 69  THR 69  69  69  THR THR H . n 
B 2 70  MET 70  70  70  MET MET H . n 
B 2 71  THR 71  71  71  THR THR H . n 
B 2 72  VAL 72  72  72  VAL VAL H . n 
B 2 73  ASP 73  73  73  ASP ASP H . n 
B 2 74  ILE 74  74  74  ILE ILE H . n 
B 2 75  SER 75  75  75  SER SER H . n 
B 2 76  SER 76  76  76  SER SER H . n 
B 2 77  SER 77  77  77  SER SER H . n 
B 2 78  THR 78  78  78  THR THR H . n 
B 2 79  ALA 79  79  79  ALA ALA H . n 
B 2 80  TYR 80  80  80  TYR TYR H . n 
B 2 81  LEU 81  81  81  LEU LEU H . n 
B 2 82  GLU 82  82  82  GLU GLU H . n 
B 2 83  LEU 83  83  83  LEU LEU H . n 
B 2 84  ALA 84  84  84  ALA ALA H . n 
B 2 85  ARG 85  85  85  ARG ARG H . n 
B 2 86  LEU 86  86  86  LEU LEU H . n 
B 2 87  THR 87  87  87  THR THR H . n 
B 2 88  SER 88  88  88  SER SER H . n 
B 2 89  GLU 89  89  89  GLU GLU H . n 
B 2 90  ASP 90  90  90  ASP ASP H . n 
B 2 91  SER 91  91  91  SER SER H . n 
B 2 92  ALA 92  92  92  ALA ALA H . n 
B 2 93  ILE 93  93  93  ILE ILE H . n 
B 2 94  TYR 94  94  94  TYR TYR H . n 
B 2 95  TYR 95  95  95  TYR TYR H . n 
B 2 96  CYS 96  96  96  CYS CYS H . n 
B 2 97  ALA 97  97  97  ALA ALA H . n 
B 2 98  ARG 98  98  98  ARG ARG H . n 
B 2 99  ASP 99  99  99  ASP ASP H . n 
B 2 100 TRP 100 100 100 TRP TRP H . n 
B 2 101 GLU 101 101 101 GLU GLU H . n 
B 2 102 ARG 102 102 102 ARG ARG H . n 
B 2 103 GLY 103 103 103 GLY GLY H . n 
B 2 104 ASP 104 104 104 ASP ASP H . n 
B 2 105 PHE 105 105 105 PHE PHE H . n 
B 2 106 PHE 106 106 106 PHE PHE H . n 
B 2 107 ASP 107 107 107 ASP ASP H . n 
B 2 108 TYR 108 108 108 TYR TYR H . n 
B 2 109 TRP 109 109 109 TRP TRP H . n 
B 2 110 GLY 110 110 110 GLY GLY H . n 
B 2 111 GLN 111 111 111 GLN GLN H . n 
B 2 112 GLY 112 112 112 GLY GLY H . n 
B 2 113 THR 113 113 113 THR THR H . n 
B 2 114 LEU 114 114 114 LEU LEU H . n 
B 2 115 VAL 115 115 115 VAL VAL H . n 
B 2 116 THR 116 116 116 THR THR H . n 
B 2 117 VAL 117 117 117 VAL VAL H . n 
B 2 118 SER 118 118 118 SER SER H . n 
B 2 119 SER 119 119 119 SER SER H . n 
B 2 120 ALA 120 120 120 ALA ALA H . n 
B 2 121 SER 121 121 121 SER SER H . n 
B 2 122 THR 122 122 122 THR THR H . n 
B 2 123 LYS 123 123 123 LYS LYS H . n 
B 2 124 GLY 124 124 124 GLY GLY H . n 
B 2 125 PRO 125 125 125 PRO PRO H . n 
B 2 126 SER 126 126 126 SER SER H . n 
B 2 127 VAL 127 127 127 VAL VAL H . n 
B 2 128 PHE 128 128 128 PHE PHE H . n 
B 2 129 PRO 129 129 129 PRO PRO H . n 
B 2 130 LEU 130 130 130 LEU LEU H . n 
B 2 131 ALA 131 131 131 ALA ALA H . n 
B 2 132 PRO 132 132 132 PRO PRO H . n 
B 2 133 SER 133 133 133 SER SER H . n 
B 2 134 SER 134 134 ?   ?   ?   H . n 
B 2 135 LYS 135 135 ?   ?   ?   H . n 
B 2 136 SER 136 136 ?   ?   ?   H . n 
B 2 137 THR 137 137 ?   ?   ?   H . n 
B 2 138 SER 138 138 ?   ?   ?   H . n 
B 2 139 GLY 139 139 139 GLY GLY H . n 
B 2 140 GLY 140 140 140 GLY GLY H . n 
B 2 141 THR 141 141 141 THR THR H . n 
B 2 142 ALA 142 142 142 ALA ALA H . n 
B 2 143 ALA 143 143 143 ALA ALA H . n 
B 2 144 LEU 144 144 144 LEU LEU H . n 
B 2 145 GLY 145 145 145 GLY GLY H . n 
B 2 146 CYS 146 146 146 CYS CYS H . n 
B 2 147 LEU 147 147 147 LEU LEU H . n 
B 2 148 VAL 148 148 148 VAL VAL H . n 
B 2 149 LYS 149 149 149 LYS LYS H . n 
B 2 150 ASP 150 150 150 ASP ASP H . n 
B 2 151 TYR 151 151 151 TYR TYR H . n 
B 2 152 PHE 152 152 152 PHE PHE H . n 
B 2 153 PRO 153 153 153 PRO PRO H . n 
B 2 154 GLU 154 154 154 GLU GLU H . n 
B 2 155 PRO 155 155 155 PRO PRO H . n 
B 2 156 VAL 156 156 156 VAL VAL H . n 
B 2 157 THR 157 157 157 THR THR H . n 
B 2 158 VAL 158 158 158 VAL VAL H . n 
B 2 159 SER 159 159 159 SER SER H . n 
B 2 160 TRP 160 160 160 TRP TRP H . n 
B 2 161 ASN 161 161 161 ASN ASN H . n 
B 2 162 SER 162 162 162 SER SER H . n 
B 2 163 GLY 163 163 163 GLY GLY H . n 
B 2 164 ALA 164 164 164 ALA ALA H . n 
B 2 165 LEU 165 165 165 LEU LEU H . n 
B 2 166 THR 166 166 166 THR THR H . n 
B 2 167 SER 167 167 167 SER SER H . n 
B 2 168 GLY 168 168 168 GLY GLY H . n 
B 2 169 VAL 169 169 169 VAL VAL H . n 
B 2 170 HIS 170 170 170 HIS HIS H . n 
B 2 171 THR 171 171 171 THR THR H . n 
B 2 172 PHE 172 172 172 PHE PHE H . n 
B 2 173 PRO 173 173 173 PRO PRO H . n 
B 2 174 ALA 174 174 174 ALA ALA H . n 
B 2 175 VAL 175 175 175 VAL VAL H . n 
B 2 176 LEU 176 176 176 LEU LEU H . n 
B 2 177 GLN 177 177 177 GLN GLN H . n 
B 2 178 SER 178 178 178 SER SER H . n 
B 2 179 SER 179 179 179 SER SER H . n 
B 2 180 GLY 180 180 180 GLY GLY H . n 
B 2 181 LEU 181 181 181 LEU LEU H . n 
B 2 182 TYR 182 182 182 TYR TYR H . n 
B 2 183 SER 183 183 183 SER SER H . n 
B 2 184 LEU 184 184 184 LEU LEU H . n 
B 2 185 SER 185 185 185 SER SER H . n 
B 2 186 SER 186 186 186 SER SER H . n 
B 2 187 VAL 187 187 187 VAL VAL H . n 
B 2 188 VAL 188 188 188 VAL VAL H . n 
B 2 189 THR 189 189 189 THR THR H . n 
B 2 190 VAL 190 190 190 VAL VAL H . n 
B 2 191 PRO 191 191 191 PRO PRO H . n 
B 2 192 SER 192 192 192 SER SER H . n 
B 2 193 SER 193 193 193 SER SER H . n 
B 2 194 SER 194 194 194 SER SER H . n 
B 2 195 LEU 195 195 195 LEU LEU H . n 
B 2 196 GLY 196 196 196 GLY GLY H . n 
B 2 197 THR 197 197 197 THR THR H . n 
B 2 198 GLN 198 198 198 GLN GLN H . n 
B 2 199 THR 199 199 199 THR THR H . n 
B 2 200 TYR 200 200 200 TYR TYR H . n 
B 2 201 ILE 201 201 201 ILE ILE H . n 
B 2 202 CYS 202 202 202 CYS CYS H . n 
B 2 203 ASN 203 203 203 ASN ASN H . n 
B 2 204 VAL 204 204 204 VAL VAL H . n 
B 2 205 ASN 205 205 205 ASN ASN H . n 
B 2 206 HIS 206 206 206 HIS HIS H . n 
B 2 207 LYS 207 207 207 LYS LYS H . n 
B 2 208 PRO 208 208 208 PRO PRO H . n 
B 2 209 SER 209 209 209 SER SER H . n 
B 2 210 ASN 210 210 210 ASN ASN H . n 
B 2 211 THR 211 211 211 THR THR H . n 
B 2 212 LYS 212 212 212 LYS LYS H . n 
B 2 213 VAL 213 213 213 VAL VAL H . n 
B 2 214 ASP 214 214 214 ASP ASP H . n 
B 2 215 LYS 215 215 215 LYS LYS H . n 
B 2 216 LYS 216 216 216 LYS LYS H . n 
B 2 217 VAL 217 217 217 VAL VAL H . n 
B 2 218 GLU 218 218 218 GLU GLU H . n 
B 2 219 PRO 219 219 219 PRO PRO H . n 
B 2 220 LYS 220 220 ?   ?   ?   H . n 
B 2 221 GLU 221 221 ?   ?   ?   H . n 
B 2 222 GLN 222 222 ?   ?   ?   H . n 
B 2 223 LYS 223 223 ?   ?   ?   H . n 
B 2 224 LEU 224 224 ?   ?   ?   H . n 
B 2 225 ILE 225 225 ?   ?   ?   H . n 
B 2 226 SER 226 226 ?   ?   ?   H . n 
B 2 227 GLU 227 227 ?   ?   ?   H . n 
B 2 228 GLU 228 228 ?   ?   ?   H . n 
B 2 229 ASP 229 229 ?   ?   ?   H . n 
B 2 230 LEU 230 230 ?   ?   ?   H . n 
B 2 231 ASN 231 231 ?   ?   ?   H . n 
B 2 232 SER 232 232 ?   ?   ?   H . n 
B 2 233 ALA 233 233 ?   ?   ?   H . n 
B 2 234 VAL 234 234 ?   ?   ?   H . n 
B 2 235 ASP 235 235 ?   ?   ?   H . n 
B 2 236 HIS 236 236 ?   ?   ?   H . n 
B 2 237 HIS 237 237 ?   ?   ?   H . n 
B 2 238 HIS 238 238 ?   ?   ?   H . n 
B 2 239 HIS 239 239 ?   ?   ?   H . n 
B 2 240 HIS 240 240 ?   ?   ?   H . n 
B 2 241 HIS 241 241 ?   ?   ?   H . n 
C 3 1   GLY 1   0   0   GLY GLY L . n 
C 3 2   ASP 2   1   1   ASP ASP L . n 
C 3 3   ILE 3   2   2   ILE ILE L . n 
C 3 4   VAL 4   3   3   VAL VAL L . n 
C 3 5   MET 5   4   4   MET MET L . n 
C 3 6   THR 6   5   5   THR THR L . n 
C 3 7   GLN 7   6   6   GLN GLN L . n 
C 3 8   THR 8   7   7   THR THR L . n 
C 3 9   PRO 9   8   8   PRO PRO L . n 
C 3 10  LYS 10  9   9   LYS LYS L . n 
C 3 11  PHE 11  10  10  PHE PHE L . n 
C 3 12  LEU 12  11  11  LEU LEU L . n 
C 3 13  LEU 13  12  12  LEU LEU L . n 
C 3 14  VAL 14  13  13  VAL VAL L . n 
C 3 15  SER 15  14  14  SER SER L . n 
C 3 16  ALA 16  15  15  ALA ALA L . n 
C 3 17  GLY 17  16  16  GLY GLY L . n 
C 3 18  ASP 18  17  17  ASP ASP L . n 
C 3 19  LYS 19  18  18  LYS LYS L . n 
C 3 20  VAL 20  19  19  VAL VAL L . n 
C 3 21  THR 21  20  20  THR THR L . n 
C 3 22  ILE 22  21  21  ILE ILE L . n 
C 3 23  THR 23  22  22  THR THR L . n 
C 3 24  CYS 24  23  23  CYS CYS L . n 
C 3 25  LYS 25  24  24  LYS LYS L . n 
C 3 26  ALA 26  25  25  ALA ALA L . n 
C 3 27  SER 27  26  26  SER SER L . n 
C 3 28  GLN 28  27  27  GLN GLN L . n 
C 3 29  SER 29  28  28  SER SER L . n 
C 3 30  VAL 30  29  29  VAL VAL L . n 
C 3 31  SER 31  30  30  SER SER L . n 
C 3 32  ASN 32  31  31  ASN ASN L . n 
C 3 33  ASP 33  32  32  ASP ASP L . n 
C 3 34  LEU 34  33  33  LEU LEU L . n 
C 3 35  THR 35  34  34  THR THR L . n 
C 3 36  TRP 36  35  35  TRP TRP L . n 
C 3 37  TYR 37  36  36  TYR TYR L . n 
C 3 38  GLN 38  37  37  GLN GLN L . n 
C 3 39  GLN 39  38  38  GLN GLN L . n 
C 3 40  LYS 40  39  39  LYS LYS L . n 
C 3 41  PRO 41  40  40  PRO PRO L . n 
C 3 42  GLY 42  41  41  GLY GLY L . n 
C 3 43  GLN 43  42  42  GLN GLN L . n 
C 3 44  SER 44  43  43  SER SER L . n 
C 3 45  PRO 45  44  44  PRO PRO L . n 
C 3 46  LYS 46  45  45  LYS LYS L . n 
C 3 47  LEU 47  46  46  LEU LEU L . n 
C 3 48  LEU 48  47  47  LEU LEU L . n 
C 3 49  ILE 49  48  48  ILE ILE L . n 
C 3 50  TYR 50  49  49  TYR TYR L . n 
C 3 51  TYR 51  50  50  TYR TYR L . n 
C 3 52  ALA 52  51  51  ALA ALA L . n 
C 3 53  SER 53  52  52  SER SER L . n 
C 3 54  ASN 54  53  53  ASN ASN L . n 
C 3 55  ARG 55  54  54  ARG ARG L . n 
C 3 56  TYR 56  55  55  TYR TYR L . n 
C 3 57  ALA 57  56  56  ALA ALA L . n 
C 3 58  GLY 58  57  57  GLY GLY L . n 
C 3 59  VAL 59  58  58  VAL VAL L . n 
C 3 60  PRO 60  59  59  PRO PRO L . n 
C 3 61  ASP 61  60  60  ASP ASP L . n 
C 3 62  ARG 62  61  61  ARG ARG L . n 
C 3 63  PHE 63  62  62  PHE PHE L . n 
C 3 64  THR 64  63  63  THR THR L . n 
C 3 65  GLY 65  64  64  GLY GLY L . n 
C 3 66  SER 66  65  65  SER SER L . n 
C 3 67  GLY 67  66  66  GLY GLY L . n 
C 3 68  TYR 68  67  67  TYR TYR L . n 
C 3 69  GLY 69  68  68  GLY GLY L . n 
C 3 70  THR 70  69  69  THR THR L . n 
C 3 71  ASP 71  70  70  ASP ASP L . n 
C 3 72  PHE 72  71  71  PHE PHE L . n 
C 3 73  THR 73  72  72  THR THR L . n 
C 3 74  PHE 74  73  73  PHE PHE L . n 
C 3 75  THR 75  74  74  THR THR L . n 
C 3 76  ILE 76  75  75  ILE ILE L . n 
C 3 77  SER 77  76  76  SER SER L . n 
C 3 78  THR 78  77  77  THR THR L . n 
C 3 79  VAL 79  78  78  VAL VAL L . n 
C 3 80  GLN 80  79  79  GLN GLN L . n 
C 3 81  ALA 81  80  80  ALA ALA L . n 
C 3 82  GLU 82  81  81  GLU GLU L . n 
C 3 83  ASP 83  82  82  ASP ASP L . n 
C 3 84  LEU 84  83  83  LEU LEU L . n 
C 3 85  ALA 85  84  84  ALA ALA L . n 
C 3 86  VAL 86  85  85  VAL VAL L . n 
C 3 87  TYR 87  86  86  TYR TYR L . n 
C 3 88  PHE 88  87  87  PHE PHE L . n 
C 3 89  CYS 89  88  88  CYS CYS L . n 
C 3 90  GLN 90  89  89  GLN GLN L . n 
C 3 91  GLN 91  90  90  GLN GLN L . n 
C 3 92  ASP 92  91  91  ASP ASP L . n 
C 3 93  TYR 93  92  92  TYR TYR L . n 
C 3 94  GLY 94  93  93  GLY GLY L . n 
C 3 95  SER 95  94  94  SER SER L . n 
C 3 96  PRO 96  95  95  PRO PRO L . n 
C 3 97  PRO 97  96  96  PRO PRO L . n 
C 3 98  THR 98  97  97  THR THR L . n 
C 3 99  PHE 99  98  98  PHE PHE L . n 
C 3 100 GLY 100 99  99  GLY GLY L . n 
C 3 101 GLY 101 100 100 GLY GLY L . n 
C 3 102 GLY 102 101 101 GLY GLY L . n 
C 3 103 THR 103 102 102 THR THR L . n 
C 3 104 LYS 104 103 103 LYS LYS L . n 
C 3 105 VAL 105 104 104 VAL VAL L . n 
C 3 106 GLU 106 105 105 GLU GLU L . n 
C 3 107 ILE 107 106 106 ILE ILE L . n 
C 3 108 LYS 108 107 107 LYS LYS L . n 
C 3 109 ARG 109 108 108 ARG ARG L . n 
C 3 110 THR 110 109 109 THR THR L . n 
C 3 111 VAL 111 110 110 VAL VAL L . n 
C 3 112 ALA 112 111 111 ALA ALA L . n 
C 3 113 ALA 113 112 112 ALA ALA L . n 
C 3 114 PRO 114 113 113 PRO PRO L . n 
C 3 115 SER 115 114 114 SER SER L . n 
C 3 116 VAL 116 115 115 VAL VAL L . n 
C 3 117 PHE 117 116 116 PHE PHE L . n 
C 3 118 ILE 118 117 117 ILE ILE L . n 
C 3 119 PHE 119 118 118 PHE PHE L . n 
C 3 120 PRO 120 119 119 PRO PRO L . n 
C 3 121 PRO 121 120 120 PRO PRO L . n 
C 3 122 SER 122 121 121 SER SER L . n 
C 3 123 ASP 123 122 122 ASP ASP L . n 
C 3 124 GLU 124 123 123 GLU GLU L . n 
C 3 125 GLN 125 124 124 GLN GLN L . n 
C 3 126 LEU 126 125 125 LEU LEU L . n 
C 3 127 LYS 127 126 126 LYS LYS L . n 
C 3 128 SER 128 127 127 SER SER L . n 
C 3 129 GLY 129 128 128 GLY GLY L . n 
C 3 130 THR 130 129 129 THR THR L . n 
C 3 131 ALA 131 130 130 ALA ALA L . n 
C 3 132 SER 132 131 131 SER SER L . n 
C 3 133 VAL 133 132 132 VAL VAL L . n 
C 3 134 VAL 134 133 133 VAL VAL L . n 
C 3 135 CYS 135 134 134 CYS CYS L . n 
C 3 136 LEU 136 135 135 LEU LEU L . n 
C 3 137 LEU 137 136 136 LEU LEU L . n 
C 3 138 ASN 138 137 137 ASN ASN L . n 
C 3 139 ASN 139 138 138 ASN ASN L . n 
C 3 140 PHE 140 139 139 PHE PHE L . n 
C 3 141 TYR 141 140 140 TYR TYR L . n 
C 3 142 PRO 142 141 141 PRO PRO L . n 
C 3 143 ARG 143 142 142 ARG ARG L . n 
C 3 144 GLU 144 143 143 GLU GLU L . n 
C 3 145 ALA 145 144 144 ALA ALA L . n 
C 3 146 LYS 146 145 145 LYS LYS L . n 
C 3 147 VAL 147 146 146 VAL VAL L . n 
C 3 148 GLN 148 147 147 GLN GLN L . n 
C 3 149 TRP 149 148 148 TRP TRP L . n 
C 3 150 LYS 150 149 149 LYS LYS L . n 
C 3 151 VAL 151 150 150 VAL VAL L . n 
C 3 152 ASP 152 151 151 ASP ASP L . n 
C 3 153 ASN 153 152 152 ASN ASN L . n 
C 3 154 ALA 154 153 153 ALA ALA L . n 
C 3 155 LEU 155 154 154 LEU LEU L . n 
C 3 156 GLN 156 155 155 GLN GLN L . n 
C 3 157 SER 157 156 156 SER SER L . n 
C 3 158 GLY 158 157 157 GLY GLY L . n 
C 3 159 ASN 159 158 158 ASN ASN L . n 
C 3 160 SER 160 159 159 SER SER L . n 
C 3 161 GLN 161 160 160 GLN GLN L . n 
C 3 162 GLU 162 161 161 GLU GLU L . n 
C 3 163 SER 163 162 162 SER SER L . n 
C 3 164 VAL 164 163 163 VAL VAL L . n 
C 3 165 THR 165 164 164 THR THR L . n 
C 3 166 GLU 166 165 165 GLU GLU L . n 
C 3 167 GLN 167 166 166 GLN GLN L . n 
C 3 168 ASP 168 167 167 ASP ASP L . n 
C 3 169 SER 169 168 168 SER SER L . n 
C 3 170 LYS 170 169 169 LYS LYS L . n 
C 3 171 ASP 171 170 170 ASP ASP L . n 
C 3 172 SER 172 171 171 SER SER L . n 
C 3 173 THR 173 172 172 THR THR L . n 
C 3 174 TYR 174 173 173 TYR TYR L . n 
C 3 175 SER 175 174 174 SER SER L . n 
C 3 176 LEU 176 175 175 LEU LEU L . n 
C 3 177 SER 177 176 176 SER SER L . n 
C 3 178 SER 178 177 177 SER SER L . n 
C 3 179 THR 179 178 178 THR THR L . n 
C 3 180 LEU 180 179 179 LEU LEU L . n 
C 3 181 THR 181 180 180 THR THR L . n 
C 3 182 LEU 182 181 181 LEU LEU L . n 
C 3 183 SER 183 182 182 SER SER L . n 
C 3 184 LYS 184 183 183 LYS LYS L . n 
C 3 185 ALA 185 184 184 ALA ALA L . n 
C 3 186 ASP 186 185 185 ASP ASP L . n 
C 3 187 TYR 187 186 186 TYR TYR L . n 
C 3 188 GLU 188 187 187 GLU GLU L . n 
C 3 189 LYS 189 188 188 LYS LYS L . n 
C 3 190 HIS 190 189 189 HIS HIS L . n 
C 3 191 LYS 191 190 190 LYS LYS L . n 
C 3 192 VAL 192 191 191 VAL VAL L . n 
C 3 193 TYR 193 192 192 TYR TYR L . n 
C 3 194 ALA 194 193 193 ALA ALA L . n 
C 3 195 CYS 195 194 194 CYS CYS L . n 
C 3 196 GLU 196 195 195 GLU GLU L . n 
C 3 197 VAL 197 196 196 VAL VAL L . n 
C 3 198 THR 198 197 197 THR THR L . n 
C 3 199 HIS 199 198 198 HIS HIS L . n 
C 3 200 GLN 200 199 199 GLN GLN L . n 
C 3 201 GLY 201 200 200 GLY GLY L . n 
C 3 202 LEU 202 201 201 LEU LEU L . n 
C 3 203 SER 203 202 202 SER SER L . n 
C 3 204 SER 204 203 203 SER SER L . n 
C 3 205 PRO 205 204 204 PRO PRO L . n 
C 3 206 VAL 206 205 205 VAL VAL L . n 
C 3 207 THR 207 206 206 THR THR L . n 
C 3 208 LYS 208 207 207 LYS LYS L . n 
C 3 209 SER 209 208 208 SER SER L . n 
C 3 210 PHE 210 209 209 PHE PHE L . n 
C 3 211 ASN 211 210 210 ASN ASN L . n 
C 3 212 ARG 212 211 211 ARG ARG L . n 
C 3 213 GLY 213 212 212 GLY GLY L . n 
C 3 214 GLU 214 213 ?   ?   ?   L . n 
C 3 215 CYS 215 214 ?   ?   ?   L . n 
C 3 216 GLU 216 215 ?   ?   ?   L . n 
C 3 217 GLN 217 216 ?   ?   ?   L . n 
C 3 218 LYS 218 217 ?   ?   ?   L . n 
C 3 219 LEU 219 218 ?   ?   ?   L . n 
C 3 220 ILE 220 219 ?   ?   ?   L . n 
C 3 221 SER 221 220 ?   ?   ?   L . n 
C 3 222 GLU 222 221 ?   ?   ?   L . n 
C 3 223 GLU 223 222 ?   ?   ?   L . n 
C 3 224 ASP 224 223 ?   ?   ?   L . n 
C 3 225 LEU 225 224 ?   ?   ?   L . n 
C 3 226 ASN 226 225 ?   ?   ?   L . n 
C 3 227 SER 227 226 ?   ?   ?   L . n 
C 3 228 ALA 228 227 ?   ?   ?   L . n 
C 3 229 VAL 229 228 ?   ?   ?   L . n 
C 3 230 ASP 230 229 ?   ?   ?   L . n 
C 3 231 HIS 231 230 ?   ?   ?   L . n 
C 3 232 HIS 232 231 ?   ?   ?   L . n 
C 3 233 HIS 233 232 ?   ?   ?   L . n 
C 3 234 HIS 234 233 ?   ?   ?   L . n 
C 3 235 HIS 235 234 ?   ?   ?   L . n 
C 3 236 HIS 236 235 ?   ?   ?   L . n 
# 
loop_
_pdbx_entity_instance_feature.ordinal 
_pdbx_entity_instance_feature.comp_id 
_pdbx_entity_instance_feature.asym_id 
_pdbx_entity_instance_feature.seq_num 
_pdbx_entity_instance_feature.auth_comp_id 
_pdbx_entity_instance_feature.auth_asym_id 
_pdbx_entity_instance_feature.auth_seq_num 
_pdbx_entity_instance_feature.feature_type 
_pdbx_entity_instance_feature.details 
1 CA ? ? CA ? ? 'SUBJECT OF INVESTIGATION' ? 
2 ZN ? ? ZN ? ? 'SUBJECT OF INVESTIGATION' ? 
# 
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 
D 4 CA  1   401 401 CA  CA  A . 
E 4 CA  1   402 402 CA  CA  A . 
F 5 ZN  1   403 404 ZN  ZN  A . 
G 6 CL  1   404 1   CL  CL  A . 
H 7 SO4 1   405 11  SO4 SO4 A . 
I 8 HOH 1   501 460 HOH HOH A . 
I 8 HOH 2   502 562 HOH HOH A . 
I 8 HOH 3   503 339 HOH HOH A . 
I 8 HOH 4   504 525 HOH HOH A . 
I 8 HOH 5   505 390 HOH HOH A . 
I 8 HOH 6   506 571 HOH HOH A . 
I 8 HOH 7   507 391 HOH HOH A . 
I 8 HOH 8   508 411 HOH HOH A . 
I 8 HOH 9   509 53  HOH HOH A . 
I 8 HOH 10  510 303 HOH HOH A . 
I 8 HOH 11  511 530 HOH HOH A . 
I 8 HOH 12  512 58  HOH HOH A . 
I 8 HOH 13  513 577 HOH HOH A . 
I 8 HOH 14  514 230 HOH HOH A . 
I 8 HOH 15  515 572 HOH HOH A . 
I 8 HOH 16  516 46  HOH HOH A . 
I 8 HOH 17  517 578 HOH HOH A . 
I 8 HOH 18  518 537 HOH HOH A . 
I 8 HOH 19  519 285 HOH HOH A . 
I 8 HOH 20  520 620 HOH HOH A . 
I 8 HOH 21  521 292 HOH HOH A . 
I 8 HOH 22  522 399 HOH HOH A . 
I 8 HOH 23  523 187 HOH HOH A . 
I 8 HOH 24  524 574 HOH HOH A . 
I 8 HOH 25  525 375 HOH HOH A . 
I 8 HOH 26  526 554 HOH HOH A . 
I 8 HOH 27  527 450 HOH HOH A . 
I 8 HOH 28  528 80  HOH HOH A . 
I 8 HOH 29  529 288 HOH HOH A . 
I 8 HOH 30  530 52  HOH HOH A . 
I 8 HOH 31  531 232 HOH HOH A . 
I 8 HOH 32  532 40  HOH HOH A . 
I 8 HOH 33  533 122 HOH HOH A . 
I 8 HOH 34  534 414 HOH HOH A . 
I 8 HOH 35  535 396 HOH HOH A . 
I 8 HOH 36  536 210 HOH HOH A . 
I 8 HOH 37  537 146 HOH HOH A . 
I 8 HOH 38  538 1   HOH HOH A . 
I 8 HOH 39  539 87  HOH HOH A . 
I 8 HOH 40  540 103 HOH HOH A . 
I 8 HOH 41  541 365 HOH HOH A . 
I 8 HOH 42  542 446 HOH HOH A . 
I 8 HOH 43  543 379 HOH HOH A . 
I 8 HOH 44  544 126 HOH HOH A . 
I 8 HOH 45  545 458 HOH HOH A . 
I 8 HOH 46  546 447 HOH HOH A . 
I 8 HOH 47  547 30  HOH HOH A . 
I 8 HOH 48  548 546 HOH HOH A . 
I 8 HOH 49  549 55  HOH HOH A . 
I 8 HOH 50  550 170 HOH HOH A . 
I 8 HOH 51  551 277 HOH HOH A . 
I 8 HOH 52  552 149 HOH HOH A . 
I 8 HOH 53  553 139 HOH HOH A . 
I 8 HOH 54  554 334 HOH HOH A . 
I 8 HOH 55  555 136 HOH HOH A . 
I 8 HOH 56  556 300 HOH HOH A . 
I 8 HOH 57  557 623 HOH HOH A . 
I 8 HOH 58  558 247 HOH HOH A . 
I 8 HOH 59  559 412 HOH HOH A . 
I 8 HOH 60  560 311 HOH HOH A . 
I 8 HOH 61  561 622 HOH HOH A . 
I 8 HOH 62  562 579 HOH HOH A . 
I 8 HOH 63  563 290 HOH HOH A . 
I 8 HOH 64  564 173 HOH HOH A . 
I 8 HOH 65  565 456 HOH HOH A . 
I 8 HOH 66  566 345 HOH HOH A . 
I 8 HOH 67  567 462 HOH HOH A . 
I 8 HOH 68  568 199 HOH HOH A . 
I 8 HOH 69  569 62  HOH HOH A . 
I 8 HOH 70  570 101 HOH HOH A . 
I 8 HOH 71  571 191 HOH HOH A . 
I 8 HOH 72  572 573 HOH HOH A . 
I 8 HOH 73  573 91  HOH HOH A . 
I 8 HOH 74  574 215 HOH HOH A . 
I 8 HOH 75  575 455 HOH HOH A . 
I 8 HOH 76  576 54  HOH HOH A . 
I 8 HOH 77  577 120 HOH HOH A . 
I 8 HOH 78  578 242 HOH HOH A . 
I 8 HOH 79  579 11  HOH HOH A . 
I 8 HOH 80  580 459 HOH HOH A . 
I 8 HOH 81  581 555 HOH HOH A . 
I 8 HOH 82  582 378 HOH HOH A . 
I 8 HOH 83  583 565 HOH HOH A . 
I 8 HOH 84  584 393 HOH HOH A . 
I 8 HOH 85  585 231 HOH HOH A . 
I 8 HOH 86  586 214 HOH HOH A . 
I 8 HOH 87  587 82  HOH HOH A . 
I 8 HOH 88  588 560 HOH HOH A . 
I 8 HOH 89  589 200 HOH HOH A . 
I 8 HOH 90  590 576 HOH HOH A . 
I 8 HOH 91  591 434 HOH HOH A . 
I 8 HOH 92  592 451 HOH HOH A . 
I 8 HOH 93  593 141 HOH HOH A . 
I 8 HOH 94  594 449 HOH HOH A . 
I 8 HOH 95  595 453 HOH HOH A . 
I 8 HOH 96  596 461 HOH HOH A . 
I 8 HOH 97  597 575 HOH HOH A . 
I 8 HOH 98  598 229 HOH HOH A . 
I 8 HOH 99  599 626 HOH HOH A . 
I 8 HOH 100 600 557 HOH HOH A . 
I 8 HOH 101 601 448 HOH HOH A . 
I 8 HOH 102 602 320 HOH HOH A . 
I 8 HOH 103 603 395 HOH HOH A . 
I 8 HOH 104 604 279 HOH HOH A . 
I 8 HOH 105 605 257 HOH HOH A . 
I 8 HOH 106 606 348 HOH HOH A . 
I 8 HOH 107 607 392 HOH HOH A . 
I 8 HOH 108 608 343 HOH HOH A . 
I 8 HOH 109 609 132 HOH HOH A . 
I 8 HOH 110 610 327 HOH HOH A . 
I 8 HOH 111 611 625 HOH HOH A . 
I 8 HOH 112 612 374 HOH HOH A . 
I 8 HOH 113 613 195 HOH HOH A . 
I 8 HOH 114 614 526 HOH HOH A . 
I 8 HOH 115 615 61  HOH HOH A . 
I 8 HOH 116 616 256 HOH HOH A . 
I 8 HOH 117 617 167 HOH HOH A . 
I 8 HOH 118 618 457 HOH HOH A . 
I 8 HOH 119 619 397 HOH HOH A . 
I 8 HOH 120 620 624 HOH HOH A . 
I 8 HOH 121 621 221 HOH HOH A . 
I 8 HOH 122 622 452 HOH HOH A . 
I 8 HOH 123 623 220 HOH HOH A . 
I 8 HOH 124 624 398 HOH HOH A . 
I 8 HOH 125 625 325 HOH HOH A . 
I 8 HOH 126 626 108 HOH HOH A . 
I 8 HOH 127 627 454 HOH HOH A . 
I 8 HOH 128 628 337 HOH HOH A . 
I 8 HOH 129 629 394 HOH HOH A . 
I 8 HOH 130 630 153 HOH HOH A . 
I 8 HOH 131 631 556 HOH HOH A . 
I 8 HOH 132 632 621 HOH HOH A . 
I 8 HOH 133 633 619 HOH HOH A . 
I 8 HOH 134 634 547 HOH HOH A . 
J 8 HOH 1   301 570 HOH HOH H . 
J 8 HOH 2   302 386 HOH HOH H . 
J 8 HOH 3   303 427 HOH HOH H . 
J 8 HOH 4   304 387 HOH HOH H . 
J 8 HOH 5   305 338 HOH HOH H . 
J 8 HOH 6   306 389 HOH HOH H . 
J 8 HOH 7   307 430 HOH HOH H . 
J 8 HOH 8   308 402 HOH HOH H . 
J 8 HOH 9   309 417 HOH HOH H . 
J 8 HOH 10  310 161 HOH HOH H . 
J 8 HOH 11  311 164 HOH HOH H . 
J 8 HOH 12  312 310 HOH HOH H . 
J 8 HOH 13  313 436 HOH HOH H . 
J 8 HOH 14  314 514 HOH HOH H . 
J 8 HOH 15  315 566 HOH HOH H . 
J 8 HOH 16  316 382 HOH HOH H . 
J 8 HOH 17  317 516 HOH HOH H . 
J 8 HOH 18  318 13  HOH HOH H . 
J 8 HOH 19  319 477 HOH HOH H . 
J 8 HOH 20  320 424 HOH HOH H . 
J 8 HOH 21  321 367 HOH HOH H . 
J 8 HOH 22  322 151 HOH HOH H . 
J 8 HOH 23  323 235 HOH HOH H . 
J 8 HOH 24  324 47  HOH HOH H . 
J 8 HOH 25  325 304 HOH HOH H . 
J 8 HOH 26  326 416 HOH HOH H . 
J 8 HOH 27  327 236 HOH HOH H . 
J 8 HOH 28  328 241 HOH HOH H . 
J 8 HOH 29  329 355 HOH HOH H . 
J 8 HOH 30  330 340 HOH HOH H . 
J 8 HOH 31  331 3   HOH HOH H . 
J 8 HOH 32  332 561 HOH HOH H . 
J 8 HOH 33  333 127 HOH HOH H . 
J 8 HOH 34  334 20  HOH HOH H . 
J 8 HOH 35  335 9   HOH HOH H . 
J 8 HOH 36  336 154 HOH HOH H . 
J 8 HOH 37  337 202 HOH HOH H . 
J 8 HOH 38  338 372 HOH HOH H . 
J 8 HOH 39  339 226 HOH HOH H . 
J 8 HOH 40  340 282 HOH HOH H . 
J 8 HOH 41  341 538 HOH HOH H . 
J 8 HOH 42  342 69  HOH HOH H . 
J 8 HOH 43  343 57  HOH HOH H . 
J 8 HOH 44  344 254 HOH HOH H . 
J 8 HOH 45  345 134 HOH HOH H . 
J 8 HOH 46  346 510 HOH HOH H . 
J 8 HOH 47  347 431 HOH HOH H . 
J 8 HOH 48  348 425 HOH HOH H . 
J 8 HOH 49  349 123 HOH HOH H . 
J 8 HOH 50  350 130 HOH HOH H . 
J 8 HOH 51  351 106 HOH HOH H . 
J 8 HOH 52  352 6   HOH HOH H . 
J 8 HOH 53  353 171 HOH HOH H . 
J 8 HOH 54  354 211 HOH HOH H . 
J 8 HOH 55  355 43  HOH HOH H . 
J 8 HOH 56  356 206 HOH HOH H . 
J 8 HOH 57  357 35  HOH HOH H . 
J 8 HOH 58  358 186 HOH HOH H . 
J 8 HOH 59  359 466 HOH HOH H . 
J 8 HOH 60  360 155 HOH HOH H . 
J 8 HOH 61  361 175 HOH HOH H . 
J 8 HOH 62  362 205 HOH HOH H . 
J 8 HOH 63  363 268 HOH HOH H . 
J 8 HOH 64  364 405 HOH HOH H . 
J 8 HOH 65  365 362 HOH HOH H . 
J 8 HOH 66  366 31  HOH HOH H . 
J 8 HOH 67  367 181 HOH HOH H . 
J 8 HOH 68  368 330 HOH HOH H . 
J 8 HOH 69  369 264 HOH HOH H . 
J 8 HOH 70  370 66  HOH HOH H . 
J 8 HOH 71  371 298 HOH HOH H . 
J 8 HOH 72  372 476 HOH HOH H . 
J 8 HOH 73  373 160 HOH HOH H . 
J 8 HOH 74  374 105 HOH HOH H . 
J 8 HOH 75  375 125 HOH HOH H . 
J 8 HOH 76  376 143 HOH HOH H . 
J 8 HOH 77  377 102 HOH HOH H . 
J 8 HOH 78  378 463 HOH HOH H . 
J 8 HOH 79  379 2   HOH HOH H . 
J 8 HOH 80  380 369 HOH HOH H . 
J 8 HOH 81  381 313 HOH HOH H . 
J 8 HOH 82  382 17  HOH HOH H . 
J 8 HOH 83  383 38  HOH HOH H . 
J 8 HOH 84  384 124 HOH HOH H . 
J 8 HOH 85  385 129 HOH HOH H . 
J 8 HOH 86  386 185 HOH HOH H . 
J 8 HOH 87  387 44  HOH HOH H . 
J 8 HOH 88  388 324 HOH HOH H . 
J 8 HOH 89  389 616 HOH HOH H . 
J 8 HOH 90  390 601 HOH HOH H . 
J 8 HOH 91  391 95  HOH HOH H . 
J 8 HOH 92  392 5   HOH HOH H . 
J 8 HOH 93  393 189 HOH HOH H . 
J 8 HOH 94  394 415 HOH HOH H . 
J 8 HOH 95  395 72  HOH HOH H . 
J 8 HOH 96  396 117 HOH HOH H . 
J 8 HOH 97  397 90  HOH HOH H . 
J 8 HOH 98  398 196 HOH HOH H . 
J 8 HOH 99  399 74  HOH HOH H . 
J 8 HOH 100 400 190 HOH HOH H . 
J 8 HOH 101 401 422 HOH HOH H . 
J 8 HOH 102 402 318 HOH HOH H . 
J 8 HOH 103 403 615 HOH HOH H . 
J 8 HOH 104 404 37  HOH HOH H . 
J 8 HOH 105 405 464 HOH HOH H . 
J 8 HOH 106 406 493 HOH HOH H . 
J 8 HOH 107 407 495 HOH HOH H . 
J 8 HOH 108 408 25  HOH HOH H . 
J 8 HOH 109 409 467 HOH HOH H . 
J 8 HOH 110 410 7   HOH HOH H . 
J 8 HOH 111 411 289 HOH HOH H . 
J 8 HOH 112 412 255 HOH HOH H . 
J 8 HOH 113 413 440 HOH HOH H . 
J 8 HOH 114 414 42  HOH HOH H . 
J 8 HOH 115 415 297 HOH HOH H . 
J 8 HOH 116 416 212 HOH HOH H . 
J 8 HOH 117 417 109 HOH HOH H . 
J 8 HOH 118 418 550 HOH HOH H . 
J 8 HOH 119 419 184 HOH HOH H . 
J 8 HOH 120 420 511 HOH HOH H . 
J 8 HOH 121 421 429 HOH HOH H . 
J 8 HOH 122 422 260 HOH HOH H . 
J 8 HOH 123 423 110 HOH HOH H . 
J 8 HOH 124 424 152 HOH HOH H . 
J 8 HOH 125 425 360 HOH HOH H . 
J 8 HOH 126 426 71  HOH HOH H . 
J 8 HOH 127 427 84  HOH HOH H . 
J 8 HOH 128 428 364 HOH HOH H . 
J 8 HOH 129 429 49  HOH HOH H . 
J 8 HOH 130 430 553 HOH HOH H . 
J 8 HOH 131 431 478 HOH HOH H . 
J 8 HOH 132 432 24  HOH HOH H . 
J 8 HOH 133 433 507 HOH HOH H . 
J 8 HOH 134 434 29  HOH HOH H . 
J 8 HOH 135 435 88  HOH HOH H . 
J 8 HOH 136 436 328 HOH HOH H . 
J 8 HOH 137 437 21  HOH HOH H . 
J 8 HOH 138 438 433 HOH HOH H . 
J 8 HOH 139 439 388 HOH HOH H . 
J 8 HOH 140 440 177 HOH HOH H . 
J 8 HOH 141 441 568 HOH HOH H . 
J 8 HOH 142 442 92  HOH HOH H . 
J 8 HOH 143 443 237 HOH HOH H . 
J 8 HOH 144 444 89  HOH HOH H . 
J 8 HOH 145 445 423 HOH HOH H . 
J 8 HOH 146 446 432 HOH HOH H . 
J 8 HOH 147 447 162 HOH HOH H . 
J 8 HOH 148 448 465 HOH HOH H . 
J 8 HOH 149 449 209 HOH HOH H . 
J 8 HOH 150 450 246 HOH HOH H . 
J 8 HOH 151 451 12  HOH HOH H . 
J 8 HOH 152 452 468 HOH HOH H . 
J 8 HOH 153 453 158 HOH HOH H . 
J 8 HOH 154 454 347 HOH HOH H . 
J 8 HOH 155 455 441 HOH HOH H . 
J 8 HOH 156 456 138 HOH HOH H . 
J 8 HOH 157 457 494 HOH HOH H . 
J 8 HOH 158 458 403 HOH HOH H . 
J 8 HOH 159 459 137 HOH HOH H . 
J 8 HOH 160 460 587 HOH HOH H . 
J 8 HOH 161 461 96  HOH HOH H . 
J 8 HOH 162 462 270 HOH HOH H . 
J 8 HOH 163 463 349 HOH HOH H . 
J 8 HOH 164 464 418 HOH HOH H . 
J 8 HOH 165 465 64  HOH HOH H . 
J 8 HOH 166 466 249 HOH HOH H . 
J 8 HOH 167 467 322 HOH HOH H . 
J 8 HOH 168 468 518 HOH HOH H . 
J 8 HOH 169 469 370 HOH HOH H . 
J 8 HOH 170 470 156 HOH HOH H . 
J 8 HOH 171 471 262 HOH HOH H . 
J 8 HOH 172 472 179 HOH HOH H . 
J 8 HOH 173 473 588 HOH HOH H . 
J 8 HOH 174 474 274 HOH HOH H . 
J 8 HOH 175 475 233 HOH HOH H . 
J 8 HOH 176 476 346 HOH HOH H . 
J 8 HOH 177 477 590 HOH HOH H . 
J 8 HOH 178 478 604 HOH HOH H . 
J 8 HOH 179 479 607 HOH HOH H . 
J 8 HOH 180 480 293 HOH HOH H . 
J 8 HOH 181 481 116 HOH HOH H . 
J 8 HOH 182 482 435 HOH HOH H . 
J 8 HOH 183 483 408 HOH HOH H . 
J 8 HOH 184 484 273 HOH HOH H . 
J 8 HOH 185 485 240 HOH HOH H . 
J 8 HOH 186 486 544 HOH HOH H . 
J 8 HOH 187 487 243 HOH HOH H . 
J 8 HOH 188 488 363 HOH HOH H . 
J 8 HOH 189 489 551 HOH HOH H . 
J 8 HOH 190 490 301 HOH HOH H . 
J 8 HOH 191 491 404 HOH HOH H . 
J 8 HOH 192 492 419 HOH HOH H . 
J 8 HOH 193 493 512 HOH HOH H . 
J 8 HOH 194 494 234 HOH HOH H . 
J 8 HOH 195 495 545 HOH HOH H . 
J 8 HOH 196 496 333 HOH HOH H . 
J 8 HOH 197 497 295 HOH HOH H . 
J 8 HOH 198 498 421 HOH HOH H . 
J 8 HOH 199 499 131 HOH HOH H . 
J 8 HOH 200 500 245 HOH HOH H . 
J 8 HOH 201 501 614 HOH HOH H . 
J 8 HOH 202 502 580 HOH HOH H . 
J 8 HOH 203 503 271 HOH HOH H . 
J 8 HOH 204 504 606 HOH HOH H . 
J 8 HOH 205 505 244 HOH HOH H . 
J 8 HOH 206 506 350 HOH HOH H . 
J 8 HOH 207 507 336 HOH HOH H . 
J 8 HOH 208 508 603 HOH HOH H . 
J 8 HOH 209 509 261 HOH HOH H . 
J 8 HOH 210 510 589 HOH HOH H . 
J 8 HOH 211 511 97  HOH HOH H . 
J 8 HOH 212 512 558 HOH HOH H . 
J 8 HOH 213 513 420 HOH HOH H . 
J 8 HOH 214 514 294 HOH HOH H . 
J 8 HOH 215 515 376 HOH HOH H . 
J 8 HOH 216 516 508 HOH HOH H . 
J 8 HOH 217 517 569 HOH HOH H . 
J 8 HOH 218 518 275 HOH HOH H . 
J 8 HOH 219 519 469 HOH HOH H . 
J 8 HOH 220 520 194 HOH HOH H . 
J 8 HOH 221 521 15  HOH HOH H . 
J 8 HOH 222 522 543 HOH HOH H . 
J 8 HOH 223 523 305 HOH HOH H . 
J 8 HOH 224 524 217 HOH HOH H . 
J 8 HOH 225 525 481 HOH HOH H . 
J 8 HOH 226 526 426 HOH HOH H . 
J 8 HOH 227 527 407 HOH HOH H . 
J 8 HOH 228 528 428 HOH HOH H . 
J 8 HOH 229 529 492 HOH HOH H . 
J 8 HOH 230 530 224 HOH HOH H . 
J 8 HOH 231 531 439 HOH HOH H . 
J 8 HOH 232 532 513 HOH HOH H . 
J 8 HOH 233 533 18  HOH HOH H . 
J 8 HOH 234 534 605 HOH HOH H . 
J 8 HOH 235 535 583 HOH HOH H . 
J 8 HOH 236 536 406 HOH HOH H . 
K 8 HOH 1   301 472 HOH HOH L . 
K 8 HOH 2   302 354 HOH HOH L . 
K 8 HOH 3   303 384 HOH HOH L . 
K 8 HOH 4   304 83  HOH HOH L . 
K 8 HOH 5   305 227 HOH HOH L . 
K 8 HOH 6   306 542 HOH HOH L . 
K 8 HOH 7   307 73  HOH HOH L . 
K 8 HOH 8   308 331 HOH HOH L . 
K 8 HOH 9   309 267 HOH HOH L . 
K 8 HOH 10  310 278 HOH HOH L . 
K 8 HOH 11  311 344 HOH HOH L . 
K 8 HOH 12  312 524 HOH HOH L . 
K 8 HOH 13  313 309 HOH HOH L . 
K 8 HOH 14  314 539 HOH HOH L . 
K 8 HOH 15  315 250 HOH HOH L . 
K 8 HOH 16  316 113 HOH HOH L . 
K 8 HOH 17  317 371 HOH HOH L . 
K 8 HOH 18  318 150 HOH HOH L . 
K 8 HOH 19  319 178 HOH HOH L . 
K 8 HOH 20  320 272 HOH HOH L . 
K 8 HOH 21  321 176 HOH HOH L . 
K 8 HOH 22  322 533 HOH HOH L . 
K 8 HOH 23  323 169 HOH HOH L . 
K 8 HOH 24  324 485 HOH HOH L . 
K 8 HOH 25  325 32  HOH HOH L . 
K 8 HOH 26  326 86  HOH HOH L . 
K 8 HOH 27  327 335 HOH HOH L . 
K 8 HOH 28  328 118 HOH HOH L . 
K 8 HOH 29  329 299 HOH HOH L . 
K 8 HOH 30  330 487 HOH HOH L . 
K 8 HOH 31  331 584 HOH HOH L . 
K 8 HOH 32  332 356 HOH HOH L . 
K 8 HOH 33  333 361 HOH HOH L . 
K 8 HOH 34  334 94  HOH HOH L . 
K 8 HOH 35  335 618 HOH HOH L . 
K 8 HOH 36  336 564 HOH HOH L . 
K 8 HOH 37  337 302 HOH HOH L . 
K 8 HOH 38  338 121 HOH HOH L . 
K 8 HOH 39  339 253 HOH HOH L . 
K 8 HOH 40  340 119 HOH HOH L . 
K 8 HOH 41  341 166 HOH HOH L . 
K 8 HOH 42  342 85  HOH HOH L . 
K 8 HOH 43  343 23  HOH HOH L . 
K 8 HOH 44  344 502 HOH HOH L . 
K 8 HOH 45  345 536 HOH HOH L . 
K 8 HOH 46  346 68  HOH HOH L . 
K 8 HOH 47  347 8   HOH HOH L . 
K 8 HOH 48  348 159 HOH HOH L . 
K 8 HOH 49  349 385 HOH HOH L . 
K 8 HOH 50  350 519 HOH HOH L . 
K 8 HOH 51  351 594 HOH HOH L . 
K 8 HOH 52  352 28  HOH HOH L . 
K 8 HOH 53  353 323 HOH HOH L . 
K 8 HOH 54  354 228 HOH HOH L . 
K 8 HOH 55  355 67  HOH HOH L . 
K 8 HOH 56  356 182 HOH HOH L . 
K 8 HOH 57  357 527 HOH HOH L . 
K 8 HOH 58  358 470 HOH HOH L . 
K 8 HOH 59  359 16  HOH HOH L . 
K 8 HOH 60  360 204 HOH HOH L . 
K 8 HOH 61  361 592 HOH HOH L . 
K 8 HOH 62  362 41  HOH HOH L . 
K 8 HOH 63  363 56  HOH HOH L . 
K 8 HOH 64  364 496 HOH HOH L . 
K 8 HOH 65  365 581 HOH HOH L . 
K 8 HOH 66  366 50  HOH HOH L . 
K 8 HOH 67  367 135 HOH HOH L . 
K 8 HOH 68  368 283 HOH HOH L . 
K 8 HOH 69  369 591 HOH HOH L . 
K 8 HOH 70  370 442 HOH HOH L . 
K 8 HOH 71  371 76  HOH HOH L . 
K 8 HOH 72  372 541 HOH HOH L . 
K 8 HOH 73  373 437 HOH HOH L . 
K 8 HOH 74  374 79  HOH HOH L . 
K 8 HOH 75  375 491 HOH HOH L . 
K 8 HOH 76  376 216 HOH HOH L . 
K 8 HOH 77  377 443 HOH HOH L . 
K 8 HOH 78  378 598 HOH HOH L . 
K 8 HOH 79  379 198 HOH HOH L . 
K 8 HOH 80  380 19  HOH HOH L . 
K 8 HOH 81  381 266 HOH HOH L . 
K 8 HOH 82  382 276 HOH HOH L . 
K 8 HOH 83  383 148 HOH HOH L . 
K 8 HOH 84  384 193 HOH HOH L . 
K 8 HOH 85  385 45  HOH HOH L . 
K 8 HOH 86  386 78  HOH HOH L . 
K 8 HOH 87  387 59  HOH HOH L . 
K 8 HOH 88  388 144 HOH HOH L . 
K 8 HOH 89  389 70  HOH HOH L . 
K 8 HOH 90  390 183 HOH HOH L . 
K 8 HOH 91  391 99  HOH HOH L . 
K 8 HOH 92  392 157 HOH HOH L . 
K 8 HOH 93  393 486 HOH HOH L . 
K 8 HOH 94  394 34  HOH HOH L . 
K 8 HOH 95  395 27  HOH HOH L . 
K 8 HOH 96  396 81  HOH HOH L . 
K 8 HOH 97  397 479 HOH HOH L . 
K 8 HOH 98  398 473 HOH HOH L . 
K 8 HOH 99  399 115 HOH HOH L . 
K 8 HOH 100 400 269 HOH HOH L . 
K 8 HOH 101 401 10  HOH HOH L . 
K 8 HOH 102 402 238 HOH HOH L . 
K 8 HOH 103 403 595 HOH HOH L . 
K 8 HOH 104 404 33  HOH HOH L . 
K 8 HOH 105 405 165 HOH HOH L . 
K 8 HOH 106 406 104 HOH HOH L . 
K 8 HOH 107 407 77  HOH HOH L . 
K 8 HOH 108 408 100 HOH HOH L . 
K 8 HOH 109 409 111 HOH HOH L . 
K 8 HOH 110 410 410 HOH HOH L . 
K 8 HOH 111 411 480 HOH HOH L . 
K 8 HOH 112 412 4   HOH HOH L . 
K 8 HOH 113 413 286 HOH HOH L . 
K 8 HOH 114 414 208 HOH HOH L . 
K 8 HOH 115 415 63  HOH HOH L . 
K 8 HOH 116 416 39  HOH HOH L . 
K 8 HOH 117 417 60  HOH HOH L . 
K 8 HOH 118 418 192 HOH HOH L . 
K 8 HOH 119 419 314 HOH HOH L . 
K 8 HOH 120 420 593 HOH HOH L . 
K 8 HOH 121 421 133 HOH HOH L . 
K 8 HOH 122 422 308 HOH HOH L . 
K 8 HOH 123 423 312 HOH HOH L . 
K 8 HOH 124 424 380 HOH HOH L . 
K 8 HOH 125 425 535 HOH HOH L . 
K 8 HOH 126 426 284 HOH HOH L . 
K 8 HOH 127 427 528 HOH HOH L . 
K 8 HOH 128 428 400 HOH HOH L . 
K 8 HOH 129 429 306 HOH HOH L . 
K 8 HOH 130 430 529 HOH HOH L . 
K 8 HOH 131 431 353 HOH HOH L . 
K 8 HOH 132 432 140 HOH HOH L . 
K 8 HOH 133 433 248 HOH HOH L . 
K 8 HOH 134 434 36  HOH HOH L . 
K 8 HOH 135 435 474 HOH HOH L . 
K 8 HOH 136 436 26  HOH HOH L . 
K 8 HOH 137 437 75  HOH HOH L . 
K 8 HOH 138 438 617 HOH HOH L . 
K 8 HOH 139 439 549 HOH HOH L . 
K 8 HOH 140 440 147 HOH HOH L . 
K 8 HOH 141 441 352 HOH HOH L . 
K 8 HOH 142 442 142 HOH HOH L . 
K 8 HOH 143 443 145 HOH HOH L . 
K 8 HOH 144 444 296 HOH HOH L . 
K 8 HOH 145 445 366 HOH HOH L . 
K 8 HOH 146 446 609 HOH HOH L . 
K 8 HOH 147 447 532 HOH HOH L . 
K 8 HOH 148 448 445 HOH HOH L . 
K 8 HOH 149 449 48  HOH HOH L . 
K 8 HOH 150 450 22  HOH HOH L . 
K 8 HOH 151 451 517 HOH HOH L . 
K 8 HOH 152 452 499 HOH HOH L . 
K 8 HOH 153 453 174 HOH HOH L . 
K 8 HOH 154 454 504 HOH HOH L . 
K 8 HOH 155 455 321 HOH HOH L . 
K 8 HOH 156 456 627 HOH HOH L . 
K 8 HOH 157 457 509 HOH HOH L . 
K 8 HOH 158 458 500 HOH HOH L . 
K 8 HOH 159 459 490 HOH HOH L . 
K 8 HOH 160 460 251 HOH HOH L . 
K 8 HOH 161 461 201 HOH HOH L . 
K 8 HOH 162 462 484 HOH HOH L . 
K 8 HOH 163 463 128 HOH HOH L . 
K 8 HOH 164 464 319 HOH HOH L . 
K 8 HOH 165 465 280 HOH HOH L . 
K 8 HOH 166 466 180 HOH HOH L . 
K 8 HOH 167 467 107 HOH HOH L . 
K 8 HOH 168 468 98  HOH HOH L . 
K 8 HOH 169 469 93  HOH HOH L . 
K 8 HOH 170 470 534 HOH HOH L . 
K 8 HOH 171 471 613 HOH HOH L . 
K 8 HOH 172 472 265 HOH HOH L . 
K 8 HOH 173 473 258 HOH HOH L . 
K 8 HOH 174 474 14  HOH HOH L . 
K 8 HOH 175 475 317 HOH HOH L . 
K 8 HOH 176 476 114 HOH HOH L . 
K 8 HOH 177 477 316 HOH HOH L . 
K 8 HOH 178 478 342 HOH HOH L . 
K 8 HOH 179 479 172 HOH HOH L . 
K 8 HOH 180 480 287 HOH HOH L . 
K 8 HOH 181 481 163 HOH HOH L . 
K 8 HOH 182 482 368 HOH HOH L . 
K 8 HOH 183 483 65  HOH HOH L . 
K 8 HOH 184 484 596 HOH HOH L . 
K 8 HOH 185 485 168 HOH HOH L . 
K 8 HOH 186 486 559 HOH HOH L . 
K 8 HOH 187 487 112 HOH HOH L . 
K 8 HOH 188 488 291 HOH HOH L . 
K 8 HOH 189 489 401 HOH HOH L . 
K 8 HOH 190 490 600 HOH HOH L . 
K 8 HOH 191 491 341 HOH HOH L . 
K 8 HOH 192 492 51  HOH HOH L . 
K 8 HOH 193 493 197 HOH HOH L . 
K 8 HOH 194 494 207 HOH HOH L . 
K 8 HOH 195 495 585 HOH HOH L . 
K 8 HOH 196 496 358 HOH HOH L . 
K 8 HOH 197 497 611 HOH HOH L . 
K 8 HOH 198 498 188 HOH HOH L . 
K 8 HOH 199 499 383 HOH HOH L . 
K 8 HOH 200 500 610 HOH HOH L . 
K 8 HOH 201 501 326 HOH HOH L . 
K 8 HOH 202 502 351 HOH HOH L . 
K 8 HOH 203 503 219 HOH HOH L . 
K 8 HOH 204 504 489 HOH HOH L . 
K 8 HOH 205 505 523 HOH HOH L . 
K 8 HOH 206 506 612 HOH HOH L . 
K 8 HOH 207 507 315 HOH HOH L . 
K 8 HOH 208 508 239 HOH HOH L . 
K 8 HOH 209 509 488 HOH HOH L . 
K 8 HOH 210 510 413 HOH HOH L . 
K 8 HOH 211 511 608 HOH HOH L . 
K 8 HOH 212 512 252 HOH HOH L . 
K 8 HOH 213 513 373 HOH HOH L . 
K 8 HOH 214 514 540 HOH HOH L . 
K 8 HOH 215 515 357 HOH HOH L . 
K 8 HOH 216 516 482 HOH HOH L . 
K 8 HOH 217 517 602 HOH HOH L . 
K 8 HOH 218 518 586 HOH HOH L . 
K 8 HOH 219 519 483 HOH HOH L . 
K 8 HOH 220 520 444 HOH HOH L . 
K 8 HOH 221 521 531 HOH HOH L . 
K 8 HOH 222 522 582 HOH HOH L . 
K 8 HOH 223 523 498 HOH HOH L . 
K 8 HOH 224 524 203 HOH HOH L . 
K 8 HOH 225 525 259 HOH HOH L . 
K 8 HOH 226 526 522 HOH HOH L . 
K 8 HOH 227 527 218 HOH HOH L . 
K 8 HOH 228 528 281 HOH HOH L . 
K 8 HOH 229 529 332 HOH HOH L . 
K 8 HOH 230 530 222 HOH HOH L . 
K 8 HOH 231 531 630 HOH HOH L . 
K 8 HOH 232 532 263 HOH HOH L . 
K 8 HOH 233 533 471 HOH HOH L . 
K 8 HOH 234 534 501 HOH HOH L . 
K 8 HOH 235 535 497 HOH HOH L . 
K 8 HOH 236 536 359 HOH HOH L . 
K 8 HOH 237 537 520 HOH HOH L . 
K 8 HOH 238 538 438 HOH HOH L . 
K 8 HOH 239 539 223 HOH HOH L . 
K 8 HOH 240 540 515 HOH HOH L . 
K 8 HOH 241 541 563 HOH HOH L . 
K 8 HOH 242 542 521 HOH HOH L . 
K 8 HOH 243 543 506 HOH HOH L . 
K 8 HOH 244 544 213 HOH HOH L . 
K 8 HOH 245 545 629 HOH HOH L . 
K 8 HOH 246 546 409 HOH HOH L . 
K 8 HOH 247 547 567 HOH HOH L . 
K 8 HOH 248 548 628 HOH HOH L . 
K 8 HOH 249 549 307 HOH HOH L . 
K 8 HOH 250 550 597 HOH HOH L . 
K 8 HOH 251 551 503 HOH HOH L . 
K 8 HOH 252 552 505 HOH HOH L . 
K 8 HOH 253 553 225 HOH HOH L . 
K 8 HOH 254 554 599 HOH HOH L . 
K 8 HOH 255 555 548 HOH HOH L . 
# 
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  ? ? ? 5.8.0238 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS     ? ? ? 20180409 2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? Aimless ? ? ? 0.7.3    3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER  ? ? ? 2.8.2    4 
# 
_cell.angle_alpha                  90.00 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   109.24 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.00 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     8Z39 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     97.519 
_cell.length_a_esd                 ? 
_cell.length_b                     70.005 
_cell.length_b_esd                 ? 
_cell.length_c                     119.974 
_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             ? 
_cell.pdbx_esd_method              ? 
# 
_symmetry.entry_id                         8Z39 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                5 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'C 1 2 1' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   8Z39 
_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             2.70 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          54.52 
_exptl_crystal.description                  ? 
_exptl_crystal.F_000                        ? 
_exptl_crystal.id                           1 
_exptl_crystal.preparation                  ? 
_exptl_crystal.size_max                     ? 
_exptl_crystal.size_mid                     ? 
_exptl_crystal.size_min                     ? 
_exptl_crystal.size_rad                     ? 
_exptl_crystal.colour_lustre                ? 
_exptl_crystal.colour_modifier              ? 
_exptl_crystal.colour_primary               ? 
_exptl_crystal.density_meas                 ? 
_exptl_crystal.density_meas_esd             ? 
_exptl_crystal.density_meas_gt              ? 
_exptl_crystal.density_meas_lt              ? 
_exptl_crystal.density_meas_temp            ? 
_exptl_crystal.density_meas_temp_esd        ? 
_exptl_crystal.density_meas_temp_gt         ? 
_exptl_crystal.density_meas_temp_lt         ? 
_exptl_crystal.pdbx_crystal_image_url       ? 
_exptl_crystal.pdbx_crystal_image_format    ? 
_exptl_crystal.pdbx_mosaicity               ? 
_exptl_crystal.pdbx_mosaicity_esd           ? 
_exptl_crystal.pdbx_mosaic_method           ? 
_exptl_crystal.pdbx_mosaic_block_size       ? 
_exptl_crystal.pdbx_mosaic_block_size_esd   ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'VAPOR DIFFUSION, SITTING DROP' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              ? 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    '200mM NaCl, 20% PEG 3350' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            293.15 
# 
_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 PILATUS3 S 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         2018-12-18 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   1.0000 
_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                        'PHOTON FACTORY BEAMLINE BL-5A' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        1.0000 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   BL-5A 
_diffrn_source.pdbx_synchrotron_site       'Photon Factory' 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       8Z39 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.8 
_reflns.d_resolution_low                               48.65 
_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                                     70681 
_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                           99.9 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                5.1 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          10.6 
_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                                0.043 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.996 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.088 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
_reflns_shell.d_res_high                                    1.80 
_reflns_shell.d_res_low                                     1.84 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           2.1 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             4192 
_reflns_shell.percent_possible_obs                          ? 
_reflns_shell.Rmerge_F_all                                  ? 
_reflns_shell.Rmerge_F_obs                                  ? 
_reflns_shell.meanI_over_sigI_gt                            ? 
_reflns_shell.meanI_over_uI_all                             ? 
_reflns_shell.meanI_over_uI_gt                              ? 
_reflns_shell.number_measured_gt                            ? 
_reflns_shell.number_unique_gt                              ? 
_reflns_shell.percent_possible_gt                           ? 
_reflns_shell.Rmerge_F_gt                                   ? 
_reflns_shell.Rmerge_I_gt                                   ? 
_reflns_shell.pdbx_redundancy                               4.8 
_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                               0.403 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.759 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          100.0 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  0.790 
_reflns_shell.pdbx_Rsym_value                               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal             ? 
_reflns_shell.pdbx_percent_possible_spherical               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous   ? 
_reflns_shell.pdbx_percent_possible_spherical_anomalous     ? 
_reflns_shell.pdbx_redundancy_anomalous                     ? 
_reflns_shell.pdbx_CC_half_anomalous                        ? 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous             ? 
_reflns_shell.pdbx_percent_possible_anomalous               ? 
# 
_refine.aniso_B[1][1]                            1.56 
_refine.aniso_B[1][2]                            0.00 
_refine.aniso_B[1][3]                            -1.21 
_refine.aniso_B[2][2]                            -1.43 
_refine.aniso_B[2][3]                            0.00 
_refine.aniso_B[3][3]                            0.57 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               29.707 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.967 
_refine.correlation_coeff_Fo_to_Fc_free          0.954 
_refine.details                                  'HYDROGENS HAVE BEEN ADDED IN THE 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                                 8Z39 
_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                            1.80 
_refine.ls_d_res_low                             48.65 
_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                     67860 
_refine.ls_number_reflns_R_free                  2817 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.87 
_refine.ls_percent_reflns_R_free                 4.0 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.18107 
_refine.ls_R_factor_R_free                       0.20775 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.17992 
_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 
_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               THROUGHOUT 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       'MAXIMUM LIKELIHOOD' 
_refine.pdbx_R_Free_selection_details            RANDOM 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       0.109 
_refine.pdbx_overall_ESU_R_Free                  0.105 
_refine.pdbx_solvent_vdw_probe_radii             1.20 
_refine.pdbx_solvent_ion_probe_radii             0.80 
_refine.pdbx_solvent_shrinkage_radii             0.80 
_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                             6.300 
_refine.overall_SU_ML                            0.099 
_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                         1 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       1.80 
_refine_hist.d_res_low                        48.65 
_refine_hist.number_atoms_solvent             625 
_refine_hist.number_atoms_total               5121 
_refine_hist.number_reflns_all                ? 
_refine_hist.number_reflns_obs                ? 
_refine_hist.number_reflns_R_free             ? 
_refine_hist.number_reflns_R_work             ? 
_refine_hist.R_factor_all                     ? 
_refine_hist.R_factor_obs                     ? 
_refine_hist.R_factor_R_free                  ? 
_refine_hist.R_factor_R_work                  ? 
_refine_hist.pdbx_number_residues_total       ? 
_refine_hist.pdbx_B_iso_mean_ligand           ? 
_refine_hist.pdbx_B_iso_mean_solvent          ? 
_refine_hist.pdbx_number_atoms_protein        4487 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         9 
_refine_hist.pdbx_number_atoms_lipid          ? 
_refine_hist.pdbx_number_atoms_carb           ? 
_refine_hist.pdbx_pseudo_atom_details         ? 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.criterion 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.number 
_refine_ls_restr.rejects 
_refine_ls_restr.type 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' ? 0.012  0.013  4698 ? r_bond_refined_d             ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.017  4222 ? r_bond_other_d               ? ? 
'X-RAY DIFFRACTION' ? 1.676  1.646  6408 ? r_angle_refined_deg          ? ? 
'X-RAY DIFFRACTION' ? 1.379  1.576  9874 ? r_angle_other_deg            ? ? 
'X-RAY DIFFRACTION' ? 17.279 5.249  623  ? r_dihedral_angle_1_deg       ? ? 
'X-RAY DIFFRACTION' ? 32.160 23.304 224  ? r_dihedral_angle_2_deg       ? ? 
'X-RAY DIFFRACTION' ? 13.650 15.000 772  ? r_dihedral_angle_3_deg       ? ? 
'X-RAY DIFFRACTION' ? 18.751 15.000 21   ? r_dihedral_angle_4_deg       ? ? 
'X-RAY DIFFRACTION' ? 0.072  0.200  618  ? r_chiral_restr               ? ? 
'X-RAY DIFFRACTION' ? 0.009  0.020  5880 ? r_gen_planes_refined         ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.020  967  ? r_gen_planes_other           ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_nbd_refined                ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_nbd_other                  ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_nbtor_refined              ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_nbtor_other                ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_xyhbond_nbd_refined        ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_xyhbond_nbd_other          ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_metal_ion_refined          ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_metal_ion_other            ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_vdw_refined       ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_vdw_other         ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_hbond_refined     ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_hbond_other       ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_metal_ion_refined ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_metal_ion_other   ? ? 
'X-RAY DIFFRACTION' ? 1.103  1.760  2342 ? r_mcbond_it                  ? ? 
'X-RAY DIFFRACTION' ? 1.097  1.757  2340 ? r_mcbond_other               ? ? 
'X-RAY DIFFRACTION' ? 1.845  2.631  2929 ? r_mcangle_it                 ? ? 
'X-RAY DIFFRACTION' ? 1.846  2.630  2929 ? r_mcangle_other              ? ? 
'X-RAY DIFFRACTION' ? 1.403  1.912  2356 ? r_scbond_it                  ? ? 
'X-RAY DIFFRACTION' ? 1.403  1.913  2353 ? r_scbond_other               ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_scangle_it                 ? ? 
'X-RAY DIFFRACTION' ? 2.296  2.796  3457 ? r_scangle_other              ? ? 
'X-RAY DIFFRACTION' ? 5.067  21.933 5340 ? r_long_range_B_refined       ? ? 
'X-RAY DIFFRACTION' ? 4.925  20.962 5174 ? r_long_range_B_other         ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_rigid_bond_restr           ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_sphericity_free            ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_sphericity_bonded          ? ? 
# 
_refine_ls_shell.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_ls_shell.d_res_high                       1.800 
_refine_ls_shell.d_res_low                        1.847 
_refine_ls_shell.number_reflns_all                ? 
_refine_ls_shell.number_reflns_obs                ? 
_refine_ls_shell.number_reflns_R_free             208 
_refine_ls_shell.number_reflns_R_work             4973 
_refine_ls_shell.percent_reflns_obs               99.94 
_refine_ls_shell.percent_reflns_R_free            ? 
_refine_ls_shell.R_factor_all                     ? 
_refine_ls_shell.R_factor_obs                     ? 
_refine_ls_shell.R_factor_R_free_error            ? 
_refine_ls_shell.R_factor_R_work                  0.290 
_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   20 
_refine_ls_shell.pdbx_phase_error                 ? 
_refine_ls_shell.pdbx_fsc_work                    ? 
_refine_ls_shell.pdbx_fsc_free                    ? 
_refine_ls_shell.R_factor_R_free                  0.296 
# 
_struct.entry_id                     8Z39 
_struct.title                        'Crystal structure of Sonic hedgehog in complex with antibody 5E1 mutant L-T56A with metals' 
_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        8Z39 
_struct_keywords.text            
'Sonic hedgehog protein (SHH), antibody, flexible/fluctuated epitope, affinity improvement, IMMUNE SYSTEM' 
_struct_keywords.pdbx_keywords   'IMMUNE SYSTEM' 
# 
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 4 ? 
F N N 5 ? 
G N N 6 ? 
H N N 7 ? 
I N N 8 ? 
J N N 8 ? 
K N N 8 ? 
# 
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 SHH_HUMAN Q15465 ? 1 
;GFGKRRHPKKLTPLAYKQFIPNVAEKTLGASGRYEGKISRNSERFKELTPNYNPDIIFKDEENTGADRLMTQRCKDKLNA
LAISVMNQWPGVKLRVTEGWDEDGHHSEESLHYEGRAVDITTSDRDRSKYGMLARLAVEAGFDWVYYESKAHIHCSVKAE
NSVAAKSGG
;
29 
2 PDB 8Z39      8Z39   ? 2 ? 1  
3 PDB 8Z39      8Z39   ? 3 ? 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 8Z39 A 1 ? 169 ? Q15465 29 ? 197 ? 29 197 
2 2 8Z39 H 1 ? 241 ? 8Z39   1  ? 241 ? 1  241 
3 3 8Z39 L 1 ? 236 ? 8Z39   0  ? 235 ? 0  235 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_pdbx_struct_assembly.oligomeric_details   trimeric 
_pdbx_struct_assembly.oligomeric_count     3 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D,E,F,G,H,I,J,K 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'gel filtration' 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1  AA1 GLU A 43  ? LEU A 48  ? GLU A 71  LEU A 76  5 ? 6  
HELX_P HELX_P2  AA2 GLY A 65  ? ASP A 67  ? GLY A 93  ASP A 95  5 ? 3  
HELX_P HELX_P3  AA3 THR A 71  ? TRP A 89  ? THR A 99  TRP A 117 1 ? 19 
HELX_P HELX_P4  AA4 SER A 110 ? GLY A 115 ? SER A 138 GLY A 143 5 ? 6  
HELX_P HELX_P5  AA5 ASP A 126 ? SER A 128 ? ASP A 154 SER A 156 5 ? 3  
HELX_P HELX_P6  AA6 LYS A 129 ? ALA A 140 ? LYS A 157 ALA A 168 1 ? 12 
HELX_P HELX_P7  AA7 THR B 28  ? GLU B 32  ? THR H 28  GLU H 32  5 ? 5  
HELX_P HELX_P8  AA8 GLN B 62  ? LYS B 65  ? GLN H 62  LYS H 65  5 ? 4  
HELX_P HELX_P9  AA9 ILE B 74  ? SER B 76  ? ILE H 74  SER H 76  5 ? 3  
HELX_P HELX_P10 AB1 THR B 87  ? SER B 91  ? THR H 87  SER H 91  5 ? 5  
HELX_P HELX_P11 AB2 SER B 162 ? ALA B 164 ? SER H 162 ALA H 164 5 ? 3  
HELX_P HELX_P12 AB3 SER B 193 ? LEU B 195 ? SER H 193 LEU H 195 5 ? 3  
HELX_P HELX_P13 AB4 LYS B 207 ? ASN B 210 ? LYS H 207 ASN H 210 5 ? 4  
HELX_P HELX_P14 AB5 GLN C 80  ? LEU C 84  ? GLN L 79  LEU L 83  5 ? 5  
HELX_P HELX_P15 AB6 SER C 122 ? SER C 128 ? SER L 121 SER L 127 1 ? 7  
HELX_P HELX_P16 AB7 LYS C 184 ? GLU C 188 ? LYS L 183 GLU L 187 1 ? 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 ? ? B CYS 22  SG  ? ? ? 1_555 B CYS 96  SG ? ? H CYS 22  H CYS 96  1_555 ? ? ? ? ? ? ? 2.088 ? ? 
disulf2  disulf ? ? B CYS 146 SG  ? ? ? 1_555 B CYS 202 SG ? ? H CYS 146 H CYS 202 1_555 ? ? ? ? ? ? ? 2.032 ? ? 
disulf3  disulf ? ? C CYS 24  SG  A ? ? 1_555 C CYS 89  SG ? ? L CYS 23  L CYS 88  1_555 ? ? ? ? ? ? ? 2.174 ? ? 
disulf4  disulf ? ? C CYS 24  SG  B ? ? 1_555 C CYS 89  SG ? ? L CYS 23  L CYS 88  1_555 ? ? ? ? ? ? ? 2.003 ? ? 
disulf5  disulf ? ? C CYS 135 SG  ? ? ? 1_555 C CYS 195 SG ? ? L CYS 134 L CYS 194 1_555 ? ? ? ? ? ? ? 1.988 ? ? 
metalc1  metalc ? ? A GLU 61  OE1 ? ? ? 1_555 D CA  .   CA ? ? A GLU 89  A CA  401 1_555 ? ? ? ? ? ? ? 2.398 ? ? 
metalc2  metalc ? ? A GLU 61  OE2 ? ? ? 1_555 D CA  .   CA ? ? A GLU 89  A CA  401 1_555 ? ? ? ? ? ? ? 2.381 ? ? 
metalc3  metalc ? ? A GLU 62  OE1 ? ? ? 1_555 D CA  .   CA ? ? A GLU 90  A CA  401 1_555 ? ? ? ? ? ? ? 2.628 ? ? 
metalc4  metalc ? ? A GLU 62  OE2 ? ? ? 1_555 D CA  .   CA ? ? A GLU 90  A CA  401 1_555 ? ? ? ? ? ? ? 2.515 ? ? 
metalc5  metalc ? ? A GLU 62  OE2 ? ? ? 1_555 E CA  .   CA ? ? A GLU 90  A CA  402 1_555 ? ? ? ? ? ? ? 2.338 ? ? 
metalc6  metalc ? ? A ASP 67  OD1 ? ? ? 1_555 D CA  .   CA ? ? A ASP 95  A CA  401 1_555 ? ? ? ? ? ? ? 2.550 ? ? 
metalc7  metalc ? ? A ASP 67  OD2 ? ? ? 1_555 D CA  .   CA ? ? A ASP 95  A CA  401 1_555 ? ? ? ? ? ? ? 2.467 ? ? 
metalc8  metalc ? ? A THR 97  O   ? ? ? 1_555 D CA  .   CA ? ? A THR 125 A CA  401 1_555 ? ? ? ? ? ? ? 2.281 ? ? 
metalc9  metalc ? ? A GLU 98  OE2 ? ? ? 1_555 D CA  .   CA ? ? A GLU 126 A CA  401 1_555 ? ? ? ? ? ? ? 2.300 ? ? 
metalc10 metalc ? ? A GLU 98  OE1 ? ? ? 1_555 E CA  .   CA ? ? A GLU 126 A CA  402 1_555 ? ? ? ? ? ? ? 2.487 ? ? 
metalc11 metalc ? ? A GLU 98  OE2 ? ? ? 1_555 E CA  .   CA ? ? A GLU 126 A CA  402 1_555 ? ? ? ? ? ? ? 2.660 ? ? 
metalc12 metalc ? ? A ASP 101 OD1 ? ? ? 1_555 E CA  .   CA ? ? A ASP 129 A CA  402 1_555 ? ? ? ? ? ? ? 2.327 ? ? 
metalc13 metalc ? ? A ASP 103 OD2 ? ? ? 1_555 E CA  .   CA ? ? A ASP 131 A CA  402 1_555 ? ? ? ? ? ? ? 2.530 ? ? 
metalc14 metalc ? ? A HIS 112 NE2 ? ? ? 1_555 F ZN  .   ZN ? ? A HIS 140 A ZN  403 1_555 ? ? ? ? ? ? ? 1.929 ? ? 
metalc15 metalc ? ? A ASP 119 OD1 ? ? ? 1_555 F ZN  .   ZN ? ? A ASP 147 A ZN  403 1_555 ? ? ? ? ? ? ? 1.942 ? ? 
metalc16 metalc ? ? A HIS 154 ND1 ? ? ? 1_555 F ZN  .   ZN ? ? A HIS 182 A ZN  403 1_555 ? ? ? ? ? ? ? 2.029 ? ? 
metalc17 metalc ? ? E CA  .   CA  ? ? ? 1_555 I HOH .   O  ? ? A CA  402 A HOH 512 1_555 ? ? ? ? ? ? ? 2.479 ? ? 
metalc18 metalc ? ? E CA  .   CA  ? ? ? 1_555 I HOH .   O  ? ? A CA  402 A HOH 573 1_555 ? ? ? ? ? ? ? 2.420 ? ? 
metalc19 metalc ? ? E CA  .   CA  ? ? ? 1_555 I HOH .   O  ? ? A CA  402 A HOH 585 1_555 ? ? ? ? ? ? ? 3.189 ? ? 
metalc20 metalc ? ? F ZN  .   ZN  ? ? ? 1_555 H SO4 .   O1 B ? A ZN  403 A SO4 405 1_555 ? ? ? ? ? ? ? 2.311 ? ? 
metalc21 metalc ? ? F ZN  .   ZN  ? ? ? 1_555 I HOH .   O  A ? A ZN  403 A HOH 506 1_555 ? ? ? ? ? ? ? 2.096 ? ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
disulf ? ? 
metalc ? ? 
# 
loop_
_pdbx_struct_conn_angle.id 
_pdbx_struct_conn_angle.ptnr1_label_atom_id 
_pdbx_struct_conn_angle.ptnr1_label_alt_id 
_pdbx_struct_conn_angle.ptnr1_label_asym_id 
_pdbx_struct_conn_angle.ptnr1_label_comp_id 
_pdbx_struct_conn_angle.ptnr1_label_seq_id 
_pdbx_struct_conn_angle.ptnr1_auth_atom_id 
_pdbx_struct_conn_angle.ptnr1_auth_asym_id 
_pdbx_struct_conn_angle.ptnr1_auth_comp_id 
_pdbx_struct_conn_angle.ptnr1_auth_seq_id 
_pdbx_struct_conn_angle.ptnr1_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr1_symmetry 
_pdbx_struct_conn_angle.ptnr2_label_atom_id 
_pdbx_struct_conn_angle.ptnr2_label_alt_id 
_pdbx_struct_conn_angle.ptnr2_label_asym_id 
_pdbx_struct_conn_angle.ptnr2_label_comp_id 
_pdbx_struct_conn_angle.ptnr2_label_seq_id 
_pdbx_struct_conn_angle.ptnr2_auth_atom_id 
_pdbx_struct_conn_angle.ptnr2_auth_asym_id 
_pdbx_struct_conn_angle.ptnr2_auth_comp_id 
_pdbx_struct_conn_angle.ptnr2_auth_seq_id 
_pdbx_struct_conn_angle.ptnr2_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr2_symmetry 
_pdbx_struct_conn_angle.ptnr3_label_atom_id 
_pdbx_struct_conn_angle.ptnr3_label_alt_id 
_pdbx_struct_conn_angle.ptnr3_label_asym_id 
_pdbx_struct_conn_angle.ptnr3_label_comp_id 
_pdbx_struct_conn_angle.ptnr3_label_seq_id 
_pdbx_struct_conn_angle.ptnr3_auth_atom_id 
_pdbx_struct_conn_angle.ptnr3_auth_asym_id 
_pdbx_struct_conn_angle.ptnr3_auth_comp_id 
_pdbx_struct_conn_angle.ptnr3_auth_seq_id 
_pdbx_struct_conn_angle.ptnr3_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr3_symmetry 
_pdbx_struct_conn_angle.value 
_pdbx_struct_conn_angle.value_esd 
1  OE1 ? A GLU 61  ? A GLU 89  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OE2 ? A GLU 61  ? A GLU 89  ? 1_555 54.5  ? 
2  OE1 ? A GLU 61  ? A GLU 89  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OE1 ? A GLU 62  ? A GLU 90  ? 1_555 73.4  ? 
3  OE2 ? A GLU 61  ? A GLU 89  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OE1 ? A GLU 62  ? A GLU 90  ? 1_555 80.6  ? 
4  OE1 ? A GLU 61  ? A GLU 89  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OE2 ? A GLU 62  ? A GLU 90  ? 1_555 111.3 ? 
5  OE2 ? A GLU 61  ? A GLU 89  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OE2 ? A GLU 62  ? A GLU 90  ? 1_555 78.5  ? 
6  OE1 ? A GLU 62  ? A GLU 90  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OE2 ? A GLU 62  ? A GLU 90  ? 1_555 49.8  ? 
7  OE1 ? A GLU 61  ? A GLU 89  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OD1 ? A ASP 67  ? A ASP 95  ? 1_555 139.2 ? 
8  OE2 ? A GLU 61  ? A GLU 89  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OD1 ? A ASP 67  ? A ASP 95  ? 1_555 160.4 ? 
9  OE1 ? A GLU 62  ? A GLU 90  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OD1 ? A ASP 67  ? A ASP 95  ? 1_555 90.4  ? 
10 OE2 ? A GLU 62  ? A GLU 90  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OD1 ? A ASP 67  ? A ASP 95  ? 1_555 82.3  ? 
11 OE1 ? A GLU 61  ? A GLU 89  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OD2 ? A ASP 67  ? A ASP 95  ? 1_555 88.0  ? 
12 OE2 ? A GLU 61  ? A GLU 89  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OD2 ? A ASP 67  ? A ASP 95  ? 1_555 141.7 ? 
13 OE1 ? A GLU 62  ? A GLU 90  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OD2 ? A ASP 67  ? A ASP 95  ? 1_555 81.3  ? 
14 OE2 ? A GLU 62  ? A GLU 90  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OD2 ? A ASP 67  ? A ASP 95  ? 1_555 113.5 ? 
15 OD1 ? A ASP 67  ? A ASP 95  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OD2 ? A ASP 67  ? A ASP 95  ? 1_555 52.1  ? 
16 OE1 ? A GLU 61  ? A GLU 89  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 O   ? A THR 97  ? A THR 125 ? 1_555 94.8  ? 
17 OE2 ? A GLU 61  ? A GLU 89  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 O   ? A THR 97  ? A THR 125 ? 1_555 107.3 ? 
18 OE1 ? A GLU 62  ? A GLU 90  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 O   ? A THR 97  ? A THR 125 ? 1_555 158.6 ? 
19 OE2 ? A GLU 62  ? A GLU 90  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 O   ? A THR 97  ? A THR 125 ? 1_555 150.2 ? 
20 OD1 ? A ASP 67  ? A ASP 95  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 O   ? A THR 97  ? A THR 125 ? 1_555 87.3  ? 
21 OD2 ? A ASP 67  ? A ASP 95  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 O   ? A THR 97  ? A THR 125 ? 1_555 80.5  ? 
22 OE1 ? A GLU 61  ? A GLU 89  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OE2 ? A GLU 98  ? A GLU 126 ? 1_555 134.4 ? 
23 OE2 ? A GLU 61  ? A GLU 89  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OE2 ? A GLU 98  ? A GLU 126 ? 1_555 82.4  ? 
24 OE1 ? A GLU 62  ? A GLU 90  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OE2 ? A GLU 98  ? A GLU 126 ? 1_555 117.5 ? 
25 OE2 ? A GLU 62  ? A GLU 90  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OE2 ? A GLU 98  ? A GLU 126 ? 1_555 68.0  ? 
26 OD1 ? A ASP 67  ? A ASP 95  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OE2 ? A GLU 98  ? A GLU 126 ? 1_555 86.4  ? 
27 OD2 ? A ASP 67  ? A ASP 95  ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OE2 ? A GLU 98  ? A GLU 126 ? 1_555 135.9 ? 
28 O   ? A THR 97  ? A THR 125 ? 1_555 CA ? D CA . ? A CA 401 ? 1_555 OE2 ? A GLU 98  ? A GLU 126 ? 1_555 83.6  ? 
29 OE2 ? A GLU 62  ? A GLU 90  ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 OE1 ? A GLU 98  ? A GLU 126 ? 1_555 113.6 ? 
30 OE2 ? A GLU 62  ? A GLU 90  ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 OE2 ? A GLU 98  ? A GLU 126 ? 1_555 65.0  ? 
31 OE1 ? A GLU 98  ? A GLU 126 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 OE2 ? A GLU 98  ? A GLU 126 ? 1_555 48.9  ? 
32 OE2 ? A GLU 62  ? A GLU 90  ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 OD1 ? A ASP 101 ? A ASP 129 ? 1_555 157.2 ? 
33 OE1 ? A GLU 98  ? A GLU 126 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 OD1 ? A ASP 101 ? A ASP 129 ? 1_555 87.8  ? 
34 OE2 ? A GLU 98  ? A GLU 126 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 OD1 ? A ASP 101 ? A ASP 129 ? 1_555 136.7 ? 
35 OE2 ? A GLU 62  ? A GLU 90  ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 OD2 ? A ASP 103 ? A ASP 131 ? 1_555 90.1  ? 
36 OE1 ? A GLU 98  ? A GLU 126 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 OD2 ? A ASP 103 ? A ASP 131 ? 1_555 141.1 ? 
37 OE2 ? A GLU 98  ? A GLU 126 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 OD2 ? A ASP 103 ? A ASP 131 ? 1_555 136.2 ? 
38 OD1 ? A ASP 101 ? A ASP 129 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 OD2 ? A ASP 103 ? A ASP 131 ? 1_555 76.5  ? 
39 OE2 ? A GLU 62  ? A GLU 90  ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 O   ? I HOH .   ? A HOH 512 ? 1_555 75.1  ? 
40 OE1 ? A GLU 98  ? A GLU 126 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 O   ? I HOH .   ? A HOH 512 ? 1_555 86.9  ? 
41 OE2 ? A GLU 98  ? A GLU 126 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 O   ? I HOH .   ? A HOH 512 ? 1_555 79.6  ? 
42 OD1 ? A ASP 101 ? A ASP 129 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 O   ? I HOH .   ? A HOH 512 ? 1_555 99.3  ? 
43 OD2 ? A ASP 103 ? A ASP 131 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 O   ? I HOH .   ? A HOH 512 ? 1_555 130.3 ? 
44 OE2 ? A GLU 62  ? A GLU 90  ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 O   ? I HOH .   ? A HOH 573 ? 1_555 90.5  ? 
45 OE1 ? A GLU 98  ? A GLU 126 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 O   ? I HOH .   ? A HOH 573 ? 1_555 74.2  ? 
46 OE2 ? A GLU 98  ? A GLU 126 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 O   ? I HOH .   ? A HOH 573 ? 1_555 69.9  ? 
47 OD1 ? A ASP 101 ? A ASP 129 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 O   ? I HOH .   ? A HOH 573 ? 1_555 103.6 ? 
48 OD2 ? A ASP 103 ? A ASP 131 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 O   ? I HOH .   ? A HOH 573 ? 1_555 75.3  ? 
49 O   ? I HOH .   ? A HOH 512 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 O   ? I HOH .   ? A HOH 573 ? 1_555 149.5 ? 
50 OE2 ? A GLU 62  ? A GLU 90  ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 O   ? I HOH .   ? A HOH 585 ? 1_555 89.2  ? 
51 OE1 ? A GLU 98  ? A GLU 126 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 O   ? I HOH .   ? A HOH 585 ? 1_555 140.0 ? 
52 OE2 ? A GLU 98  ? A GLU 126 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 O   ? I HOH .   ? A HOH 585 ? 1_555 142.3 ? 
53 OD1 ? A ASP 101 ? A ASP 129 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 O   ? I HOH .   ? A HOH 585 ? 1_555 68.5  ? 
54 OD2 ? A ASP 103 ? A ASP 131 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 O   ? I HOH .   ? A HOH 585 ? 1_555 65.7  ? 
55 O   ? I HOH .   ? A HOH 512 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 O   ? I HOH .   ? A HOH 585 ? 1_555 66.9  ? 
56 O   ? I HOH .   ? A HOH 573 ? 1_555 CA ? E CA . ? A CA 402 ? 1_555 O   ? I HOH .   ? A HOH 585 ? 1_555 140.9 ? 
57 NE2 ? A HIS 112 ? A HIS 140 ? 1_555 ZN ? F ZN . ? A ZN 403 ? 1_555 OD1 ? A ASP 119 ? A ASP 147 ? 1_555 116.0 ? 
58 NE2 ? A HIS 112 ? A HIS 140 ? 1_555 ZN ? F ZN . ? A ZN 403 ? 1_555 ND1 ? A HIS 154 ? A HIS 182 ? 1_555 107.4 ? 
59 OD1 ? A ASP 119 ? A ASP 147 ? 1_555 ZN ? F ZN . ? A ZN 403 ? 1_555 ND1 ? A HIS 154 ? A HIS 182 ? 1_555 107.1 ? 
60 NE2 ? A HIS 112 ? A HIS 140 ? 1_555 ZN ? F ZN . ? A ZN 403 ? 1_555 O1  B H SO4 .   ? A SO4 405 ? 1_555 83.0  ? 
61 OD1 ? A ASP 119 ? A ASP 147 ? 1_555 ZN ? F ZN . ? A ZN 403 ? 1_555 O1  B H SO4 .   ? A SO4 405 ? 1_555 132.7 ? 
62 ND1 ? A HIS 154 ? A HIS 182 ? 1_555 ZN ? F ZN . ? A ZN 403 ? 1_555 O1  B H SO4 .   ? A SO4 405 ? 1_555 107.1 ? 
63 NE2 ? A HIS 112 ? A HIS 140 ? 1_555 ZN ? F ZN . ? A ZN 403 ? 1_555 O   A I HOH .   ? A HOH 506 ? 1_555 115.7 ? 
64 OD1 ? A ASP 119 ? A ASP 147 ? 1_555 ZN ? F ZN . ? A ZN 403 ? 1_555 O   A I HOH .   ? A HOH 506 ? 1_555 105.3 ? 
65 ND1 ? A HIS 154 ? A HIS 182 ? 1_555 ZN ? F ZN . ? A ZN 403 ? 1_555 O   A I HOH .   ? A HOH 506 ? 1_555 104.5 ? 
66 O1  B H SO4 .   ? A SO4 405 ? 1_555 ZN ? F ZN . ? A ZN 403 ? 1_555 O   A I HOH .   ? A HOH 506 ? 1_555 34.2  ? 
# 
loop_
_pdbx_modification_feature.ordinal 
_pdbx_modification_feature.label_comp_id 
_pdbx_modification_feature.label_asym_id 
_pdbx_modification_feature.label_seq_id 
_pdbx_modification_feature.label_alt_id 
_pdbx_modification_feature.modified_residue_label_comp_id 
_pdbx_modification_feature.modified_residue_label_asym_id 
_pdbx_modification_feature.modified_residue_label_seq_id 
_pdbx_modification_feature.modified_residue_label_alt_id 
_pdbx_modification_feature.auth_comp_id 
_pdbx_modification_feature.auth_asym_id 
_pdbx_modification_feature.auth_seq_id 
_pdbx_modification_feature.PDB_ins_code 
_pdbx_modification_feature.symmetry 
_pdbx_modification_feature.modified_residue_auth_comp_id 
_pdbx_modification_feature.modified_residue_auth_asym_id 
_pdbx_modification_feature.modified_residue_auth_seq_id 
_pdbx_modification_feature.modified_residue_PDB_ins_code 
_pdbx_modification_feature.modified_residue_symmetry 
_pdbx_modification_feature.comp_id_linking_atom 
_pdbx_modification_feature.modified_residue_id_linking_atom 
_pdbx_modification_feature.modified_residue_id 
_pdbx_modification_feature.ref_pcm_id 
_pdbx_modification_feature.ref_comp_id 
_pdbx_modification_feature.type 
_pdbx_modification_feature.category 
1 CYS B 22  ? CYS B 96  ? CYS H 22  ? 1_555 CYS H 96  ? 1_555 SG SG . . . None 'Disulfide bridge' 
2 CYS B 146 ? CYS B 202 ? CYS H 146 ? 1_555 CYS H 202 ? 1_555 SG SG . . . None 'Disulfide bridge' 
3 CYS C 24  A CYS C 89  ? CYS L 23  ? 1_555 CYS L 88  ? 1_555 SG SG . . . None 'Disulfide bridge' 
4 CYS C 24  B CYS C 89  ? CYS L 23  ? 1_555 CYS L 88  ? 1_555 SG SG . . . None 'Disulfide bridge' 
5 CYS C 135 ? CYS C 195 ? CYS L 134 ? 1_555 CYS L 194 ? 1_555 SG SG . . . None 'Disulfide bridge' 
# 
loop_
_struct_mon_prot_cis.pdbx_id 
_struct_mon_prot_cis.label_comp_id 
_struct_mon_prot_cis.label_seq_id 
_struct_mon_prot_cis.label_asym_id 
_struct_mon_prot_cis.label_alt_id 
_struct_mon_prot_cis.pdbx_PDB_ins_code 
_struct_mon_prot_cis.auth_comp_id 
_struct_mon_prot_cis.auth_seq_id 
_struct_mon_prot_cis.auth_asym_id 
_struct_mon_prot_cis.pdbx_label_comp_id_2 
_struct_mon_prot_cis.pdbx_label_seq_id_2 
_struct_mon_prot_cis.pdbx_label_asym_id_2 
_struct_mon_prot_cis.pdbx_PDB_ins_code_2 
_struct_mon_prot_cis.pdbx_auth_comp_id_2 
_struct_mon_prot_cis.pdbx_auth_seq_id_2 
_struct_mon_prot_cis.pdbx_auth_asym_id_2 
_struct_mon_prot_cis.pdbx_PDB_model_num 
_struct_mon_prot_cis.pdbx_omega_angle 
1 ILE 20  A . ? ILE 48  A PRO 21  A ? PRO 49  A 1 1.78  
2 PHE 152 B . ? PHE 152 H PRO 153 B ? PRO 153 H 1 -5.89 
3 GLU 154 B . ? GLU 154 H PRO 155 B ? PRO 155 H 1 -8.01 
4 THR 8   C . ? THR 7   L PRO 9   C ? PRO 8   L 1 -6.54 
5 SER 95  C . ? SER 94  L PRO 96  C ? PRO 95  L 1 0.53  
6 TYR 141 C . ? TYR 140 L PRO 142 C ? PRO 141 L 1 -3.86 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 6 ? 
AA2 ? 2 ? 
AA3 ? 4 ? 
AA4 ? 6 ? 
AA5 ? 4 ? 
AA6 ? 4 ? 
AA7 ? 4 ? 
AA8 ? 3 ? 
AA9 ? 4 ? 
AB1 ? 6 ? 
AB2 ? 4 ? 
AB3 ? 4 ? 
AB4 ? 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 
AA1 5 6 ? parallel      
AA2 1 2 ? anti-parallel 
AA3 1 2 ? anti-parallel 
AA3 2 3 ? anti-parallel 
AA3 3 4 ? anti-parallel 
AA4 1 2 ? parallel      
AA4 2 3 ? anti-parallel 
AA4 3 4 ? anti-parallel 
AA4 4 5 ? anti-parallel 
AA4 5 6 ? anti-parallel 
AA5 1 2 ? parallel      
AA5 2 3 ? anti-parallel 
AA5 3 4 ? anti-parallel 
AA6 1 2 ? anti-parallel 
AA6 2 3 ? anti-parallel 
AA6 3 4 ? anti-parallel 
AA7 1 2 ? anti-parallel 
AA7 2 3 ? anti-parallel 
AA7 3 4 ? anti-parallel 
AA8 1 2 ? anti-parallel 
AA8 2 3 ? anti-parallel 
AA9 1 2 ? anti-parallel 
AA9 2 3 ? anti-parallel 
AA9 3 4 ? anti-parallel 
AB1 1 2 ? parallel      
AB1 2 3 ? anti-parallel 
AB1 3 4 ? anti-parallel 
AB1 4 5 ? anti-parallel 
AB1 5 6 ? anti-parallel 
AB2 1 2 ? parallel      
AB2 2 3 ? anti-parallel 
AB2 3 4 ? anti-parallel 
AB3 1 2 ? anti-parallel 
AB3 2 3 ? anti-parallel 
AB3 3 4 ? anti-parallel 
AB4 1 2 ? anti-parallel 
AB4 2 3 ? anti-parallel 
AB4 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 PHE A 19  ? ILE A 20  ? PHE A 47  ILE A 48  
AA1 2 TRP A 144 ? SER A 149 ? TRP A 172 SER A 177 
AA1 3 HIS A 152 ? SER A 156 ? HIS A 180 SER A 184 
AA1 4 ALA A 117 ? THR A 122 ? ALA A 145 THR A 150 
AA1 5 LEU A 94  ? GLU A 98  ? LEU A 122 GLU A 126 
AA1 6 ILE A 56  ? PHE A 58  ? ILE A 84  PHE A 86  
AA2 1 THR A 49  ? PRO A 50  ? THR A 77  PRO A 78  
AA2 2 LEU A 69  ? MET A 70  ? LEU A 97  MET A 98  
AA3 1 GLN B 3   ? GLN B 6   ? GLN H 3   GLN H 6   
AA3 2 VAL B 18  ? SER B 25  ? VAL H 18  SER H 25  
AA3 3 THR B 78  ? LEU B 83  ? THR H 78  LEU H 83  
AA3 4 ALA B 68  ? ASP B 73  ? ALA H 68  ASP H 73  
AA4 1 GLU B 10  ? VAL B 12  ? GLU H 10  VAL H 12  
AA4 2 THR B 113 ? VAL B 117 ? THR H 113 VAL H 117 
AA4 3 ALA B 92  ? ARG B 98  ? ALA H 92  ARG H 98  
AA4 4 LEU B 34  ? SER B 40  ? LEU H 34  SER H 40  
AA4 5 SER B 44  ? ILE B 51  ? SER H 44  ILE H 51  
AA4 6 THR B 58  ? TYR B 60  ? THR H 58  TYR H 60  
AA5 1 GLU B 10  ? VAL B 12  ? GLU H 10  VAL H 12  
AA5 2 THR B 113 ? VAL B 117 ? THR H 113 VAL H 117 
AA5 3 ALA B 92  ? ARG B 98  ? ALA H 92  ARG H 98  
AA5 4 TYR B 108 ? TRP B 109 ? TYR H 108 TRP H 109 
AA6 1 SER B 126 ? LEU B 130 ? SER H 126 LEU H 130 
AA6 2 THR B 141 ? TYR B 151 ? THR H 141 TYR H 151 
AA6 3 TYR B 182 ? PRO B 191 ? TYR H 182 PRO H 191 
AA6 4 VAL B 169 ? THR B 171 ? VAL H 169 THR H 171 
AA7 1 SER B 126 ? LEU B 130 ? SER H 126 LEU H 130 
AA7 2 THR B 141 ? TYR B 151 ? THR H 141 TYR H 151 
AA7 3 TYR B 182 ? PRO B 191 ? TYR H 182 PRO H 191 
AA7 4 VAL B 175 ? LEU B 176 ? VAL H 175 LEU H 176 
AA8 1 THR B 157 ? TRP B 160 ? THR H 157 TRP H 160 
AA8 2 ILE B 201 ? HIS B 206 ? ILE H 201 HIS H 206 
AA8 3 THR B 211 ? LYS B 216 ? THR H 211 LYS H 216 
AA9 1 MET C 5   ? THR C 8   ? MET L 4   THR L 7   
AA9 2 VAL C 20  ? ALA C 26  ? VAL L 19  ALA L 25  
AA9 3 ASP C 71  ? ILE C 76  ? ASP L 70  ILE L 75  
AA9 4 PHE C 63  ? GLY C 67  ? PHE L 62  GLY L 66  
AB1 1 PHE C 11  ? SER C 15  ? PHE L 10  SER L 14  
AB1 2 THR C 103 ? LYS C 108 ? THR L 102 LYS L 107 
AB1 3 ALA C 85  ? GLN C 91  ? ALA L 84  GLN L 90  
AB1 4 LEU C 34  ? GLN C 39  ? LEU L 33  GLN L 38  
AB1 5 LYS C 46  ? TYR C 50  ? LYS L 45  TYR L 49  
AB1 6 ASN C 54  ? ARG C 55  ? ASN L 53  ARG L 54  
AB2 1 PHE C 11  ? SER C 15  ? PHE L 10  SER L 14  
AB2 2 THR C 103 ? LYS C 108 ? THR L 102 LYS L 107 
AB2 3 ALA C 85  ? GLN C 91  ? ALA L 84  GLN L 90  
AB2 4 THR C 98  ? PHE C 99  ? THR L 97  PHE L 98  
AB3 1 SER C 115 ? PHE C 119 ? SER L 114 PHE L 118 
AB3 2 THR C 130 ? PHE C 140 ? THR L 129 PHE L 139 
AB3 3 TYR C 174 ? SER C 183 ? TYR L 173 SER L 182 
AB3 4 SER C 160 ? VAL C 164 ? SER L 159 VAL L 163 
AB4 1 ALA C 154 ? LEU C 155 ? ALA L 153 LEU L 154 
AB4 2 LYS C 146 ? VAL C 151 ? LYS L 145 VAL L 150 
AB4 3 VAL C 192 ? THR C 198 ? VAL L 191 THR L 197 
AB4 4 VAL C 206 ? ASN C 211 ? VAL L 205 ASN L 210 
# 
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 20  ? N ILE A 48  O VAL A 145 ? O VAL A 173 
AA1 2 3 N TYR A 146 ? N TYR A 174 O HIS A 154 ? O HIS A 182 
AA1 3 4 O CYS A 155 ? O CYS A 183 N VAL A 118 ? N VAL A 146 
AA1 4 5 O ASP A 119 ? O ASP A 147 N GLU A 98  ? N GLU A 126 
AA1 5 6 O VAL A 96  ? O VAL A 124 N ILE A 57  ? N ILE A 85  
AA2 1 2 N THR A 49  ? N THR A 77  O MET A 70  ? O MET A 98  
AA3 1 2 N GLN B 5   ? N GLN H 5   O LYS B 23  ? O LYS H 23  
AA3 2 3 N CYS B 22  ? N CYS H 22  O ALA B 79  ? O ALA H 79  
AA3 3 4 O THR B 78  ? O THR H 78  N ASP B 73  ? N ASP H 73  
AA4 1 2 N GLU B 10  ? N GLU H 10  O THR B 116 ? O THR H 116 
AA4 2 3 O VAL B 115 ? O VAL H 115 N ALA B 92  ? N ALA H 92  
AA4 3 4 O ALA B 97  ? O ALA H 97  N HIS B 35  ? N HIS H 35  
AA4 4 5 N LYS B 38  ? N LYS H 38  O GLU B 46  ? O GLU H 46  
AA4 5 6 N VAL B 50  ? N VAL H 50  O ASN B 59  ? O ASN H 59  
AA5 1 2 N GLU B 10  ? N GLU H 10  O THR B 116 ? O THR H 116 
AA5 2 3 O VAL B 115 ? O VAL H 115 N ALA B 92  ? N ALA H 92  
AA5 3 4 N ARG B 98  ? N ARG H 98  O TYR B 108 ? O TYR H 108 
AA6 1 2 N SER B 126 ? N SER H 126 O LYS B 149 ? O LYS H 149 
AA6 2 3 N VAL B 148 ? N VAL H 148 O LEU B 184 ? O LEU H 184 
AA6 3 4 O VAL B 187 ? O VAL H 187 N HIS B 170 ? N HIS H 170 
AA7 1 2 N SER B 126 ? N SER H 126 O LYS B 149 ? O LYS H 149 
AA7 2 3 N VAL B 148 ? N VAL H 148 O LEU B 184 ? O LEU H 184 
AA7 3 4 O SER B 183 ? O SER H 183 N VAL B 175 ? N VAL H 175 
AA8 1 2 N SER B 159 ? N SER H 159 O ASN B 203 ? O ASN H 203 
AA8 2 3 N HIS B 206 ? N HIS H 206 O THR B 211 ? O THR H 211 
AA9 1 2 N THR C 8   ? N THR L 7   O THR C 23  ? O THR L 22  
AA9 2 3 N CYS C 24  ? N CYS L 23  O PHE C 72  ? O PHE L 71  
AA9 3 4 O THR C 73  ? O THR L 72  N SER C 66  ? N SER L 65  
AB1 1 2 N LEU C 12  ? N LEU L 11  O GLU C 106 ? O GLU L 105 
AB1 2 3 O VAL C 105 ? O VAL L 104 N ALA C 85  ? N ALA L 84  
AB1 3 4 O PHE C 88  ? O PHE L 87  N TYR C 37  ? N TYR L 36  
AB1 4 5 N TRP C 36  ? N TRP L 35  O LEU C 48  ? O LEU L 47  
AB1 5 6 N TYR C 50  ? N TYR L 49  O ASN C 54  ? O ASN L 53  
AB2 1 2 N LEU C 12  ? N LEU L 11  O GLU C 106 ? O GLU L 105 
AB2 2 3 O VAL C 105 ? O VAL L 104 N ALA C 85  ? N ALA L 84  
AB2 3 4 N GLN C 91  ? N GLN L 90  O THR C 98  ? O THR L 97  
AB3 1 2 N PHE C 119 ? N PHE L 118 O VAL C 134 ? O VAL L 133 
AB3 2 3 N PHE C 140 ? N PHE L 139 O TYR C 174 ? O TYR L 173 
AB3 3 4 O THR C 179 ? O THR L 178 N GLN C 161 ? N GLN L 160 
AB4 1 2 O ALA C 154 ? O ALA L 153 N VAL C 151 ? N VAL L 150 
AB4 2 3 N GLN C 148 ? N GLN L 147 O GLU C 196 ? O GLU L 195 
AB4 3 4 N VAL C 197 ? N VAL L 196 O VAL C 206 ? O VAL L 205 
# 
_pdbx_entry_details.entry_id                   8Z39 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.has_protein_modification   Y 
# 
_pdbx_validate_close_contact.id               1 
_pdbx_validate_close_contact.PDB_model_num    1 
_pdbx_validate_close_contact.auth_atom_id_1   O 
_pdbx_validate_close_contact.auth_asym_id_1   A 
_pdbx_validate_close_contact.auth_comp_id_1   HOH 
_pdbx_validate_close_contact.auth_seq_id_1    509 
_pdbx_validate_close_contact.PDB_ins_code_1   ? 
_pdbx_validate_close_contact.label_alt_id_1   ? 
_pdbx_validate_close_contact.auth_atom_id_2   O 
_pdbx_validate_close_contact.auth_asym_id_2   A 
_pdbx_validate_close_contact.auth_comp_id_2   HOH 
_pdbx_validate_close_contact.auth_seq_id_2    608 
_pdbx_validate_close_contact.PDB_ins_code_2   ? 
_pdbx_validate_close_contact.label_alt_id_2   ? 
_pdbx_validate_close_contact.dist             2.12 
# 
loop_
_pdbx_validate_rmsd_bond.id 
_pdbx_validate_rmsd_bond.PDB_model_num 
_pdbx_validate_rmsd_bond.auth_atom_id_1 
_pdbx_validate_rmsd_bond.auth_asym_id_1 
_pdbx_validate_rmsd_bond.auth_comp_id_1 
_pdbx_validate_rmsd_bond.auth_seq_id_1 
_pdbx_validate_rmsd_bond.PDB_ins_code_1 
_pdbx_validate_rmsd_bond.label_alt_id_1 
_pdbx_validate_rmsd_bond.auth_atom_id_2 
_pdbx_validate_rmsd_bond.auth_asym_id_2 
_pdbx_validate_rmsd_bond.auth_comp_id_2 
_pdbx_validate_rmsd_bond.auth_seq_id_2 
_pdbx_validate_rmsd_bond.PDB_ins_code_2 
_pdbx_validate_rmsd_bond.label_alt_id_2 
_pdbx_validate_rmsd_bond.bond_value 
_pdbx_validate_rmsd_bond.bond_target_value 
_pdbx_validate_rmsd_bond.bond_deviation 
_pdbx_validate_rmsd_bond.bond_standard_deviation 
_pdbx_validate_rmsd_bond.linker_flag 
1 1 CG A ASN 50  ? ? OD1 A ASN 50  ? ? 1.372 1.235 0.137 0.022 N 
2 1 CD H GLU 101 ? ? OE1 H GLU 101 ? ? 1.398 1.252 0.146 0.011 N 
3 1 CD H GLU 154 ? ? OE2 H GLU 154 ? ? 1.356 1.252 0.104 0.011 N 
# 
loop_
_pdbx_validate_torsion.id 
_pdbx_validate_torsion.PDB_model_num 
_pdbx_validate_torsion.auth_comp_id 
_pdbx_validate_torsion.auth_asym_id 
_pdbx_validate_torsion.auth_seq_id 
_pdbx_validate_torsion.PDB_ins_code 
_pdbx_validate_torsion.label_alt_id 
_pdbx_validate_torsion.phi 
_pdbx_validate_torsion.psi 
1 1 ASN A 50  ? ? -65.67  30.16   
2 1 ALA A 58  ? ? -106.67 -113.53 
3 1 SER H 44  ? ? 54.32   -133.58 
4 1 ASP H 150 ? ? 75.67   58.63   
5 1 SER L 30  ? ? 50.46   -124.40 
6 1 ALA L 51  ? ? 67.80   -33.84  
# 
_pdbx_validate_peptide_omega.id               1 
_pdbx_validate_peptide_omega.PDB_model_num    1 
_pdbx_validate_peptide_omega.auth_comp_id_1   PHE 
_pdbx_validate_peptide_omega.auth_asym_id_1   H 
_pdbx_validate_peptide_omega.auth_seq_id_1    105 
_pdbx_validate_peptide_omega.PDB_ins_code_1   ? 
_pdbx_validate_peptide_omega.label_alt_id_1   ? 
_pdbx_validate_peptide_omega.auth_comp_id_2   PHE 
_pdbx_validate_peptide_omega.auth_asym_id_2   H 
_pdbx_validate_peptide_omega.auth_seq_id_2    106 
_pdbx_validate_peptide_omega.PDB_ins_code_2   ? 
_pdbx_validate_peptide_omega.label_alt_id_2   ? 
_pdbx_validate_peptide_omega.omega            -148.40 
# 
loop_
_pdbx_struct_special_symmetry.id 
_pdbx_struct_special_symmetry.PDB_model_num 
_pdbx_struct_special_symmetry.auth_asym_id 
_pdbx_struct_special_symmetry.auth_comp_id 
_pdbx_struct_special_symmetry.auth_seq_id 
_pdbx_struct_special_symmetry.PDB_ins_code 
_pdbx_struct_special_symmetry.label_asym_id 
_pdbx_struct_special_symmetry.label_comp_id 
_pdbx_struct_special_symmetry.label_seq_id 
1 1 H HOH 480 ? J HOH . 
2 1 H HOH 518 ? J HOH . 
# 
loop_
_pdbx_refine_tls.id 
_pdbx_refine_tls.pdbx_refine_id 
_pdbx_refine_tls.details 
_pdbx_refine_tls.method 
_pdbx_refine_tls.origin_x 
_pdbx_refine_tls.origin_y 
_pdbx_refine_tls.origin_z 
_pdbx_refine_tls.T[1][1] 
_pdbx_refine_tls.T[1][1]_esd 
_pdbx_refine_tls.T[1][2] 
_pdbx_refine_tls.T[1][2]_esd 
_pdbx_refine_tls.T[1][3] 
_pdbx_refine_tls.T[1][3]_esd 
_pdbx_refine_tls.T[2][2] 
_pdbx_refine_tls.T[2][2]_esd 
_pdbx_refine_tls.T[2][3] 
_pdbx_refine_tls.T[2][3]_esd 
_pdbx_refine_tls.T[3][3] 
_pdbx_refine_tls.T[3][3]_esd 
_pdbx_refine_tls.L[1][1] 
_pdbx_refine_tls.L[1][1]_esd 
_pdbx_refine_tls.L[1][2] 
_pdbx_refine_tls.L[1][2]_esd 
_pdbx_refine_tls.L[1][3] 
_pdbx_refine_tls.L[1][3]_esd 
_pdbx_refine_tls.L[2][2] 
_pdbx_refine_tls.L[2][2]_esd 
_pdbx_refine_tls.L[2][3] 
_pdbx_refine_tls.L[2][3]_esd 
_pdbx_refine_tls.L[3][3] 
_pdbx_refine_tls.L[3][3]_esd 
_pdbx_refine_tls.S[1][1] 
_pdbx_refine_tls.S[1][1]_esd 
_pdbx_refine_tls.S[1][2] 
_pdbx_refine_tls.S[1][2]_esd 
_pdbx_refine_tls.S[1][3] 
_pdbx_refine_tls.S[1][3]_esd 
_pdbx_refine_tls.S[2][1] 
_pdbx_refine_tls.S[2][1]_esd 
_pdbx_refine_tls.S[2][2] 
_pdbx_refine_tls.S[2][2]_esd 
_pdbx_refine_tls.S[2][3] 
_pdbx_refine_tls.S[2][3]_esd 
_pdbx_refine_tls.S[3][1] 
_pdbx_refine_tls.S[3][1]_esd 
_pdbx_refine_tls.S[3][2] 
_pdbx_refine_tls.S[3][2]_esd 
_pdbx_refine_tls.S[3][3] 
_pdbx_refine_tls.S[3][3]_esd 
1 'X-RAY DIFFRACTION' ? refined 2.5006   14.8637 57.5834 0.1639 ? -0.0423 ? -0.0321 ? 0.0488 ? -0.0093 ? 0.0415 ? 1.4504 ? 0.1722  
? 0.7255 ? 5.1696 ? -0.0322 ? 3.2553 ? 0.0995  ? -0.1308 ? 0.0601 ? 0.3709 ? -0.1246 ? 0.2704 ? 0.2203  ? -0.2641 ? 0.0251 ? 
2 'X-RAY DIFFRACTION' ? refined -7.6258  12.1166 18.4022 0.0352 ? -0.0245 ? -0.0052 ? 0.0326 ? 0.0131  ? 0.0113 ? 1.5614 ? -0.0175 
? 1.1700 ? 1.1648 ? -0.0447 ? 2.7818 ? -0.0255 ? 0.0345  ? 0.0712 ? 0.1613 ? -0.0574 ? 0.0355 ? -0.0283 ? 0.1623  ? 0.0829 ? 
3 'X-RAY DIFFRACTION' ? refined -20.3410 -1.6659 21.6242 0.0875 ? -0.0771 ? -0.0234 ? 0.0881 ? 0.0114  ? 0.0447 ? 1.0526 ? 0.1440  
? 1.3809 ? 0.4565 ? 0.3944  ? 2.0364 ? 0.0949  ? -0.0797 ? 0.0062 ? 0.0845 ? -0.1049 ? 0.0962 ? 0.2216  ? -0.1903 ? 0.0099 ? 
# 
loop_
_pdbx_refine_tls_group.id 
_pdbx_refine_tls_group.pdbx_refine_id 
_pdbx_refine_tls_group.refine_tls_id 
_pdbx_refine_tls_group.beg_label_asym_id 
_pdbx_refine_tls_group.beg_label_seq_id 
_pdbx_refine_tls_group.beg_auth_asym_id 
_pdbx_refine_tls_group.beg_auth_seq_id 
_pdbx_refine_tls_group.beg_PDB_ins_code 
_pdbx_refine_tls_group.end_label_asym_id 
_pdbx_refine_tls_group.end_label_seq_id 
_pdbx_refine_tls_group.end_auth_asym_id 
_pdbx_refine_tls_group.end_auth_seq_id 
_pdbx_refine_tls_group.end_PDB_ins_code 
_pdbx_refine_tls_group.selection 
_pdbx_refine_tls_group.selection_details 
1 'X-RAY DIFFRACTION' 1 ? ? A 39 ? ? ? A 189 ? ? ? 
2 'X-RAY DIFFRACTION' 2 ? ? H 1  ? ? ? H 219 ? ? ? 
3 'X-RAY DIFFRACTION' 3 ? ? L 0  ? ? ? L 212 ? ? ? 
# 
loop_
_pdbx_distant_solvent_atoms.id 
_pdbx_distant_solvent_atoms.PDB_model_num 
_pdbx_distant_solvent_atoms.auth_atom_id 
_pdbx_distant_solvent_atoms.label_alt_id 
_pdbx_distant_solvent_atoms.auth_asym_id 
_pdbx_distant_solvent_atoms.auth_comp_id 
_pdbx_distant_solvent_atoms.auth_seq_id 
_pdbx_distant_solvent_atoms.PDB_ins_code 
_pdbx_distant_solvent_atoms.neighbor_macromolecule_distance 
_pdbx_distant_solvent_atoms.neighbor_ligand_distance 
1 1 O ? H HOH 536 ? 6.09 . 
2 1 O ? L HOH 555 ? 6.05 . 
# 
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 A GLY 29  ? A GLY 1   
2  1 Y 1 A PHE 30  ? A PHE 2   
3  1 Y 1 A GLY 31  ? A GLY 3   
4  1 Y 1 A LYS 32  ? A LYS 4   
5  1 Y 1 A ARG 33  ? A ARG 5   
6  1 Y 1 A ARG 34  ? A ARG 6   
7  1 Y 1 A HIS 35  ? A HIS 7   
8  1 Y 1 A PRO 36  ? A PRO 8   
9  1 Y 1 A LYS 37  ? A LYS 9   
10 1 Y 1 A LYS 38  ? A LYS 10  
11 1 Y 1 A SER 190 ? A SER 162 
12 1 Y 1 A VAL 191 ? A VAL 163 
13 1 Y 1 A ALA 192 ? A ALA 164 
14 1 Y 1 A ALA 193 ? A ALA 165 
15 1 Y 1 A LYS 194 ? A LYS 166 
16 1 Y 1 A SER 195 ? A SER 167 
17 1 Y 1 A GLY 196 ? A GLY 168 
18 1 Y 1 A GLY 197 ? A GLY 169 
19 1 Y 1 H SER 134 ? B SER 134 
20 1 Y 1 H LYS 135 ? B LYS 135 
21 1 Y 1 H SER 136 ? B SER 136 
22 1 Y 1 H THR 137 ? B THR 137 
23 1 Y 1 H SER 138 ? B SER 138 
24 1 Y 1 H LYS 220 ? B LYS 220 
25 1 Y 1 H GLU 221 ? B GLU 221 
26 1 Y 1 H GLN 222 ? B GLN 222 
27 1 Y 1 H LYS 223 ? B LYS 223 
28 1 Y 1 H LEU 224 ? B LEU 224 
29 1 Y 1 H ILE 225 ? B ILE 225 
30 1 Y 1 H SER 226 ? B SER 226 
31 1 Y 1 H GLU 227 ? B GLU 227 
32 1 Y 1 H GLU 228 ? B GLU 228 
33 1 Y 1 H ASP 229 ? B ASP 229 
34 1 Y 1 H LEU 230 ? B LEU 230 
35 1 Y 1 H ASN 231 ? B ASN 231 
36 1 Y 1 H SER 232 ? B SER 232 
37 1 Y 1 H ALA 233 ? B ALA 233 
38 1 Y 1 H VAL 234 ? B VAL 234 
39 1 Y 1 H ASP 235 ? B ASP 235 
40 1 Y 1 H HIS 236 ? B HIS 236 
41 1 Y 1 H HIS 237 ? B HIS 237 
42 1 Y 1 H HIS 238 ? B HIS 238 
43 1 Y 1 H HIS 239 ? B HIS 239 
44 1 Y 1 H HIS 240 ? B HIS 240 
45 1 Y 1 H HIS 241 ? B HIS 241 
46 1 Y 1 L GLU 213 ? C GLU 214 
47 1 Y 1 L CYS 214 ? C CYS 215 
48 1 Y 1 L GLU 215 ? C GLU 216 
49 1 Y 1 L GLN 216 ? C GLN 217 
50 1 Y 1 L LYS 217 ? C LYS 218 
51 1 Y 1 L LEU 218 ? C LEU 219 
52 1 Y 1 L ILE 219 ? C ILE 220 
53 1 Y 1 L SER 220 ? C SER 221 
54 1 Y 1 L GLU 221 ? C GLU 222 
55 1 Y 1 L GLU 222 ? C GLU 223 
56 1 Y 1 L ASP 223 ? C ASP 224 
57 1 Y 1 L LEU 224 ? C LEU 225 
58 1 Y 1 L ASN 225 ? C ASN 226 
59 1 Y 1 L SER 226 ? C SER 227 
60 1 Y 1 L ALA 227 ? C ALA 228 
61 1 Y 1 L VAL 228 ? C VAL 229 
62 1 Y 1 L ASP 229 ? C ASP 230 
63 1 Y 1 L HIS 230 ? C HIS 231 
64 1 Y 1 L HIS 231 ? C HIS 232 
65 1 Y 1 L HIS 232 ? C HIS 233 
66 1 Y 1 L HIS 233 ? C HIS 234 
67 1 Y 1 L HIS 234 ? C HIS 235 
68 1 Y 1 L HIS 235 ? C HIS 236 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
ALA N    N  N N 1   
ALA CA   C  N S 2   
ALA C    C  N N 3   
ALA O    O  N N 4   
ALA CB   C  N N 5   
ALA OXT  O  N N 6   
ALA H    H  N N 7   
ALA H2   H  N N 8   
ALA HA   H  N N 9   
ALA HB1  H  N N 10  
ALA HB2  H  N N 11  
ALA HB3  H  N N 12  
ALA HXT  H  N N 13  
ARG N    N  N N 14  
ARG CA   C  N S 15  
ARG C    C  N N 16  
ARG O    O  N N 17  
ARG CB   C  N N 18  
ARG CG   C  N N 19  
ARG CD   C  N N 20  
ARG NE   N  N N 21  
ARG CZ   C  N N 22  
ARG NH1  N  N N 23  
ARG NH2  N  N N 24  
ARG OXT  O  N N 25  
ARG H    H  N N 26  
ARG H2   H  N N 27  
ARG HA   H  N N 28  
ARG HB2  H  N N 29  
ARG HB3  H  N N 30  
ARG HG2  H  N N 31  
ARG HG3  H  N N 32  
ARG HD2  H  N N 33  
ARG HD3  H  N N 34  
ARG HE   H  N N 35  
ARG HH11 H  N N 36  
ARG HH12 H  N N 37  
ARG HH21 H  N N 38  
ARG HH22 H  N N 39  
ARG HXT  H  N N 40  
ASN N    N  N N 41  
ASN CA   C  N S 42  
ASN C    C  N N 43  
ASN O    O  N N 44  
ASN CB   C  N N 45  
ASN CG   C  N N 46  
ASN OD1  O  N N 47  
ASN ND2  N  N N 48  
ASN OXT  O  N N 49  
ASN H    H  N N 50  
ASN H2   H  N N 51  
ASN HA   H  N N 52  
ASN HB2  H  N N 53  
ASN HB3  H  N N 54  
ASN HD21 H  N N 55  
ASN HD22 H  N N 56  
ASN HXT  H  N N 57  
ASP N    N  N N 58  
ASP CA   C  N S 59  
ASP C    C  N N 60  
ASP O    O  N N 61  
ASP CB   C  N N 62  
ASP CG   C  N N 63  
ASP OD1  O  N N 64  
ASP OD2  O  N N 65  
ASP OXT  O  N N 66  
ASP H    H  N N 67  
ASP H2   H  N N 68  
ASP HA   H  N N 69  
ASP HB2  H  N N 70  
ASP HB3  H  N N 71  
ASP HD2  H  N N 72  
ASP HXT  H  N N 73  
CA  CA   CA N N 74  
CL  CL   CL N N 75  
CYS N    N  N N 76  
CYS CA   C  N R 77  
CYS C    C  N N 78  
CYS O    O  N N 79  
CYS CB   C  N N 80  
CYS SG   S  N N 81  
CYS OXT  O  N N 82  
CYS H    H  N N 83  
CYS H2   H  N N 84  
CYS HA   H  N N 85  
CYS HB2  H  N N 86  
CYS HB3  H  N N 87  
CYS HG   H  N N 88  
CYS HXT  H  N N 89  
GLN N    N  N N 90  
GLN CA   C  N S 91  
GLN C    C  N N 92  
GLN O    O  N N 93  
GLN CB   C  N N 94  
GLN CG   C  N N 95  
GLN CD   C  N N 96  
GLN OE1  O  N N 97  
GLN NE2  N  N N 98  
GLN OXT  O  N N 99  
GLN H    H  N N 100 
GLN H2   H  N N 101 
GLN HA   H  N N 102 
GLN HB2  H  N N 103 
GLN HB3  H  N N 104 
GLN HG2  H  N N 105 
GLN HG3  H  N N 106 
GLN HE21 H  N N 107 
GLN HE22 H  N N 108 
GLN HXT  H  N N 109 
GLU N    N  N N 110 
GLU CA   C  N S 111 
GLU C    C  N N 112 
GLU O    O  N N 113 
GLU CB   C  N N 114 
GLU CG   C  N N 115 
GLU CD   C  N N 116 
GLU OE1  O  N N 117 
GLU OE2  O  N N 118 
GLU OXT  O  N N 119 
GLU H    H  N N 120 
GLU H2   H  N N 121 
GLU HA   H  N N 122 
GLU HB2  H  N N 123 
GLU HB3  H  N N 124 
GLU HG2  H  N N 125 
GLU HG3  H  N N 126 
GLU HE2  H  N N 127 
GLU HXT  H  N N 128 
GLY N    N  N N 129 
GLY CA   C  N N 130 
GLY C    C  N N 131 
GLY O    O  N N 132 
GLY OXT  O  N N 133 
GLY H    H  N N 134 
GLY H2   H  N N 135 
GLY HA2  H  N N 136 
GLY HA3  H  N N 137 
GLY HXT  H  N N 138 
HIS N    N  N N 139 
HIS CA   C  N S 140 
HIS C    C  N N 141 
HIS O    O  N N 142 
HIS CB   C  N N 143 
HIS CG   C  Y N 144 
HIS ND1  N  Y N 145 
HIS CD2  C  Y N 146 
HIS CE1  C  Y N 147 
HIS NE2  N  Y N 148 
HIS OXT  O  N N 149 
HIS H    H  N N 150 
HIS H2   H  N N 151 
HIS HA   H  N N 152 
HIS HB2  H  N N 153 
HIS HB3  H  N N 154 
HIS HD1  H  N N 155 
HIS HD2  H  N N 156 
HIS HE1  H  N N 157 
HIS HE2  H  N N 158 
HIS HXT  H  N N 159 
HOH O    O  N N 160 
HOH H1   H  N N 161 
HOH H2   H  N N 162 
ILE N    N  N N 163 
ILE CA   C  N S 164 
ILE C    C  N N 165 
ILE O    O  N N 166 
ILE CB   C  N S 167 
ILE CG1  C  N N 168 
ILE CG2  C  N N 169 
ILE CD1  C  N N 170 
ILE OXT  O  N N 171 
ILE H    H  N N 172 
ILE H2   H  N N 173 
ILE HA   H  N N 174 
ILE HB   H  N N 175 
ILE HG12 H  N N 176 
ILE HG13 H  N N 177 
ILE HG21 H  N N 178 
ILE HG22 H  N N 179 
ILE HG23 H  N N 180 
ILE HD11 H  N N 181 
ILE HD12 H  N N 182 
ILE HD13 H  N N 183 
ILE HXT  H  N N 184 
LEU N    N  N N 185 
LEU CA   C  N S 186 
LEU C    C  N N 187 
LEU O    O  N N 188 
LEU CB   C  N N 189 
LEU CG   C  N N 190 
LEU CD1  C  N N 191 
LEU CD2  C  N N 192 
LEU OXT  O  N N 193 
LEU H    H  N N 194 
LEU H2   H  N N 195 
LEU HA   H  N N 196 
LEU HB2  H  N N 197 
LEU HB3  H  N N 198 
LEU HG   H  N N 199 
LEU HD11 H  N N 200 
LEU HD12 H  N N 201 
LEU HD13 H  N N 202 
LEU HD21 H  N N 203 
LEU HD22 H  N N 204 
LEU HD23 H  N N 205 
LEU HXT  H  N N 206 
LYS N    N  N N 207 
LYS CA   C  N S 208 
LYS C    C  N N 209 
LYS O    O  N N 210 
LYS CB   C  N N 211 
LYS CG   C  N N 212 
LYS CD   C  N N 213 
LYS CE   C  N N 214 
LYS NZ   N  N N 215 
LYS OXT  O  N N 216 
LYS H    H  N N 217 
LYS H2   H  N N 218 
LYS HA   H  N N 219 
LYS HB2  H  N N 220 
LYS HB3  H  N N 221 
LYS HG2  H  N N 222 
LYS HG3  H  N N 223 
LYS HD2  H  N N 224 
LYS HD3  H  N N 225 
LYS HE2  H  N N 226 
LYS HE3  H  N N 227 
LYS HZ1  H  N N 228 
LYS HZ2  H  N N 229 
LYS HZ3  H  N N 230 
LYS HXT  H  N N 231 
MET N    N  N N 232 
MET CA   C  N S 233 
MET C    C  N N 234 
MET O    O  N N 235 
MET CB   C  N N 236 
MET CG   C  N N 237 
MET SD   S  N N 238 
MET CE   C  N N 239 
MET OXT  O  N N 240 
MET H    H  N N 241 
MET H2   H  N N 242 
MET HA   H  N N 243 
MET HB2  H  N N 244 
MET HB3  H  N N 245 
MET HG2  H  N N 246 
MET HG3  H  N N 247 
MET HE1  H  N N 248 
MET HE2  H  N N 249 
MET HE3  H  N N 250 
MET HXT  H  N N 251 
PHE N    N  N N 252 
PHE CA   C  N S 253 
PHE C    C  N N 254 
PHE O    O  N N 255 
PHE CB   C  N N 256 
PHE CG   C  Y N 257 
PHE CD1  C  Y N 258 
PHE CD2  C  Y N 259 
PHE CE1  C  Y N 260 
PHE CE2  C  Y N 261 
PHE CZ   C  Y N 262 
PHE OXT  O  N N 263 
PHE H    H  N N 264 
PHE H2   H  N N 265 
PHE HA   H  N N 266 
PHE HB2  H  N N 267 
PHE HB3  H  N N 268 
PHE HD1  H  N N 269 
PHE HD2  H  N N 270 
PHE HE1  H  N N 271 
PHE HE2  H  N N 272 
PHE HZ   H  N N 273 
PHE HXT  H  N N 274 
PRO N    N  N N 275 
PRO CA   C  N S 276 
PRO C    C  N N 277 
PRO O    O  N N 278 
PRO CB   C  N N 279 
PRO CG   C  N N 280 
PRO CD   C  N N 281 
PRO OXT  O  N N 282 
PRO H    H  N N 283 
PRO HA   H  N N 284 
PRO HB2  H  N N 285 
PRO HB3  H  N N 286 
PRO HG2  H  N N 287 
PRO HG3  H  N N 288 
PRO HD2  H  N N 289 
PRO HD3  H  N N 290 
PRO HXT  H  N N 291 
SER N    N  N N 292 
SER CA   C  N S 293 
SER C    C  N N 294 
SER O    O  N N 295 
SER CB   C  N N 296 
SER OG   O  N N 297 
SER OXT  O  N N 298 
SER H    H  N N 299 
SER H2   H  N N 300 
SER HA   H  N N 301 
SER HB2  H  N N 302 
SER HB3  H  N N 303 
SER HG   H  N N 304 
SER HXT  H  N N 305 
SO4 S    S  N N 306 
SO4 O1   O  N N 307 
SO4 O2   O  N N 308 
SO4 O3   O  N N 309 
SO4 O4   O  N N 310 
THR N    N  N N 311 
THR CA   C  N S 312 
THR C    C  N N 313 
THR O    O  N N 314 
THR CB   C  N R 315 
THR OG1  O  N N 316 
THR CG2  C  N N 317 
THR OXT  O  N N 318 
THR H    H  N N 319 
THR H2   H  N N 320 
THR HA   H  N N 321 
THR HB   H  N N 322 
THR HG1  H  N N 323 
THR HG21 H  N N 324 
THR HG22 H  N N 325 
THR HG23 H  N N 326 
THR HXT  H  N N 327 
TRP N    N  N N 328 
TRP CA   C  N S 329 
TRP C    C  N N 330 
TRP O    O  N N 331 
TRP CB   C  N N 332 
TRP CG   C  Y N 333 
TRP CD1  C  Y N 334 
TRP CD2  C  Y N 335 
TRP NE1  N  Y N 336 
TRP CE2  C  Y N 337 
TRP CE3  C  Y N 338 
TRP CZ2  C  Y N 339 
TRP CZ3  C  Y N 340 
TRP CH2  C  Y N 341 
TRP OXT  O  N N 342 
TRP H    H  N N 343 
TRP H2   H  N N 344 
TRP HA   H  N N 345 
TRP HB2  H  N N 346 
TRP HB3  H  N N 347 
TRP HD1  H  N N 348 
TRP HE1  H  N N 349 
TRP HE3  H  N N 350 
TRP HZ2  H  N N 351 
TRP HZ3  H  N N 352 
TRP HH2  H  N N 353 
TRP HXT  H  N N 354 
TYR N    N  N N 355 
TYR CA   C  N S 356 
TYR C    C  N N 357 
TYR O    O  N N 358 
TYR CB   C  N N 359 
TYR CG   C  Y N 360 
TYR CD1  C  Y N 361 
TYR CD2  C  Y N 362 
TYR CE1  C  Y N 363 
TYR CE2  C  Y N 364 
TYR CZ   C  Y N 365 
TYR OH   O  N N 366 
TYR OXT  O  N N 367 
TYR H    H  N N 368 
TYR H2   H  N N 369 
TYR HA   H  N N 370 
TYR HB2  H  N N 371 
TYR HB3  H  N N 372 
TYR HD1  H  N N 373 
TYR HD2  H  N N 374 
TYR HE1  H  N N 375 
TYR HE2  H  N N 376 
TYR HH   H  N N 377 
TYR HXT  H  N N 378 
VAL N    N  N N 379 
VAL CA   C  N S 380 
VAL C    C  N N 381 
VAL O    O  N N 382 
VAL CB   C  N N 383 
VAL CG1  C  N N 384 
VAL CG2  C  N N 385 
VAL OXT  O  N N 386 
VAL H    H  N N 387 
VAL H2   H  N N 388 
VAL HA   H  N N 389 
VAL HB   H  N N 390 
VAL HG11 H  N N 391 
VAL HG12 H  N N 392 
VAL HG13 H  N N 393 
VAL HG21 H  N N 394 
VAL HG22 H  N N 395 
VAL HG23 H  N N 396 
VAL HXT  H  N N 397 
ZN  ZN   ZN N N 398 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ARG N   CA   sing N N 13  
ARG N   H    sing N N 14  
ARG N   H2   sing N N 15  
ARG CA  C    sing N N 16  
ARG CA  CB   sing N N 17  
ARG CA  HA   sing N N 18  
ARG C   O    doub N N 19  
ARG C   OXT  sing N N 20  
ARG CB  CG   sing N N 21  
ARG CB  HB2  sing N N 22  
ARG CB  HB3  sing N N 23  
ARG CG  CD   sing N N 24  
ARG CG  HG2  sing N N 25  
ARG CG  HG3  sing N N 26  
ARG CD  NE   sing N N 27  
ARG CD  HD2  sing N N 28  
ARG CD  HD3  sing N N 29  
ARG NE  CZ   sing N N 30  
ARG NE  HE   sing N N 31  
ARG CZ  NH1  sing N N 32  
ARG CZ  NH2  doub N N 33  
ARG NH1 HH11 sing N N 34  
ARG NH1 HH12 sing N N 35  
ARG NH2 HH21 sing N N 36  
ARG NH2 HH22 sing N N 37  
ARG OXT HXT  sing N N 38  
ASN N   CA   sing N N 39  
ASN N   H    sing N N 40  
ASN N   H2   sing N N 41  
ASN CA  C    sing N N 42  
ASN CA  CB   sing N N 43  
ASN CA  HA   sing N N 44  
ASN C   O    doub N N 45  
ASN C   OXT  sing N N 46  
ASN CB  CG   sing N N 47  
ASN CB  HB2  sing N N 48  
ASN CB  HB3  sing N N 49  
ASN CG  OD1  doub N N 50  
ASN CG  ND2  sing N N 51  
ASN ND2 HD21 sing N N 52  
ASN ND2 HD22 sing N N 53  
ASN OXT HXT  sing N N 54  
ASP N   CA   sing N N 55  
ASP N   H    sing N N 56  
ASP N   H2   sing N N 57  
ASP CA  C    sing N N 58  
ASP CA  CB   sing N N 59  
ASP CA  HA   sing N N 60  
ASP C   O    doub N N 61  
ASP C   OXT  sing N N 62  
ASP CB  CG   sing N N 63  
ASP CB  HB2  sing N N 64  
ASP CB  HB3  sing N N 65  
ASP CG  OD1  doub N N 66  
ASP CG  OD2  sing N N 67  
ASP OD2 HD2  sing N N 68  
ASP OXT HXT  sing N N 69  
CYS N   CA   sing N N 70  
CYS N   H    sing N N 71  
CYS N   H2   sing N N 72  
CYS CA  C    sing N N 73  
CYS CA  CB   sing N N 74  
CYS CA  HA   sing N N 75  
CYS C   O    doub N N 76  
CYS C   OXT  sing N N 77  
CYS CB  SG   sing N N 78  
CYS CB  HB2  sing N N 79  
CYS CB  HB3  sing N N 80  
CYS SG  HG   sing N N 81  
CYS OXT HXT  sing N N 82  
GLN N   CA   sing N N 83  
GLN N   H    sing N N 84  
GLN N   H2   sing N N 85  
GLN CA  C    sing N N 86  
GLN CA  CB   sing N N 87  
GLN CA  HA   sing N N 88  
GLN C   O    doub N N 89  
GLN C   OXT  sing N N 90  
GLN CB  CG   sing N N 91  
GLN CB  HB2  sing N N 92  
GLN CB  HB3  sing N N 93  
GLN CG  CD   sing N N 94  
GLN CG  HG2  sing N N 95  
GLN CG  HG3  sing N N 96  
GLN CD  OE1  doub N N 97  
GLN CD  NE2  sing N N 98  
GLN NE2 HE21 sing N N 99  
GLN NE2 HE22 sing N N 100 
GLN OXT HXT  sing N N 101 
GLU N   CA   sing N N 102 
GLU N   H    sing N N 103 
GLU N   H2   sing N N 104 
GLU CA  C    sing N N 105 
GLU CA  CB   sing N N 106 
GLU CA  HA   sing N N 107 
GLU C   O    doub N N 108 
GLU C   OXT  sing N N 109 
GLU CB  CG   sing N N 110 
GLU CB  HB2  sing N N 111 
GLU CB  HB3  sing N N 112 
GLU CG  CD   sing N N 113 
GLU CG  HG2  sing N N 114 
GLU CG  HG3  sing N N 115 
GLU CD  OE1  doub N N 116 
GLU CD  OE2  sing N N 117 
GLU OE2 HE2  sing N N 118 
GLU OXT HXT  sing N N 119 
GLY N   CA   sing N N 120 
GLY N   H    sing N N 121 
GLY N   H2   sing N N 122 
GLY CA  C    sing N N 123 
GLY CA  HA2  sing N N 124 
GLY CA  HA3  sing N N 125 
GLY C   O    doub N N 126 
GLY C   OXT  sing N N 127 
GLY OXT HXT  sing N N 128 
HIS N   CA   sing N N 129 
HIS N   H    sing N N 130 
HIS N   H2   sing N N 131 
HIS CA  C    sing N N 132 
HIS CA  CB   sing N N 133 
HIS CA  HA   sing N N 134 
HIS C   O    doub N N 135 
HIS C   OXT  sing N N 136 
HIS CB  CG   sing N N 137 
HIS CB  HB2  sing N N 138 
HIS CB  HB3  sing N N 139 
HIS CG  ND1  sing Y N 140 
HIS CG  CD2  doub Y N 141 
HIS ND1 CE1  doub Y N 142 
HIS ND1 HD1  sing N N 143 
HIS CD2 NE2  sing Y N 144 
HIS CD2 HD2  sing N N 145 
HIS CE1 NE2  sing Y N 146 
HIS CE1 HE1  sing N N 147 
HIS NE2 HE2  sing N N 148 
HIS OXT HXT  sing N N 149 
HOH O   H1   sing N N 150 
HOH O   H2   sing N N 151 
ILE N   CA   sing N N 152 
ILE N   H    sing N N 153 
ILE N   H2   sing N N 154 
ILE CA  C    sing N N 155 
ILE CA  CB   sing N N 156 
ILE CA  HA   sing N N 157 
ILE C   O    doub N N 158 
ILE C   OXT  sing N N 159 
ILE CB  CG1  sing N N 160 
ILE CB  CG2  sing N N 161 
ILE CB  HB   sing N N 162 
ILE CG1 CD1  sing N N 163 
ILE CG1 HG12 sing N N 164 
ILE CG1 HG13 sing N N 165 
ILE CG2 HG21 sing N N 166 
ILE CG2 HG22 sing N N 167 
ILE CG2 HG23 sing N N 168 
ILE CD1 HD11 sing N N 169 
ILE CD1 HD12 sing N N 170 
ILE CD1 HD13 sing N N 171 
ILE OXT HXT  sing N N 172 
LEU N   CA   sing N N 173 
LEU N   H    sing N N 174 
LEU N   H2   sing N N 175 
LEU CA  C    sing N N 176 
LEU CA  CB   sing N N 177 
LEU CA  HA   sing N N 178 
LEU C   O    doub N N 179 
LEU C   OXT  sing N N 180 
LEU CB  CG   sing N N 181 
LEU CB  HB2  sing N N 182 
LEU CB  HB3  sing N N 183 
LEU CG  CD1  sing N N 184 
LEU CG  CD2  sing N N 185 
LEU CG  HG   sing N N 186 
LEU CD1 HD11 sing N N 187 
LEU CD1 HD12 sing N N 188 
LEU CD1 HD13 sing N N 189 
LEU CD2 HD21 sing N N 190 
LEU CD2 HD22 sing N N 191 
LEU CD2 HD23 sing N N 192 
LEU OXT HXT  sing N N 193 
LYS N   CA   sing N N 194 
LYS N   H    sing N N 195 
LYS N   H2   sing N N 196 
LYS CA  C    sing N N 197 
LYS CA  CB   sing N N 198 
LYS CA  HA   sing N N 199 
LYS C   O    doub N N 200 
LYS C   OXT  sing N N 201 
LYS CB  CG   sing N N 202 
LYS CB  HB2  sing N N 203 
LYS CB  HB3  sing N N 204 
LYS CG  CD   sing N N 205 
LYS CG  HG2  sing N N 206 
LYS CG  HG3  sing N N 207 
LYS CD  CE   sing N N 208 
LYS CD  HD2  sing N N 209 
LYS CD  HD3  sing N N 210 
LYS CE  NZ   sing N N 211 
LYS CE  HE2  sing N N 212 
LYS CE  HE3  sing N N 213 
LYS NZ  HZ1  sing N N 214 
LYS NZ  HZ2  sing N N 215 
LYS NZ  HZ3  sing N N 216 
LYS OXT HXT  sing N N 217 
MET N   CA   sing N N 218 
MET N   H    sing N N 219 
MET N   H2   sing N N 220 
MET CA  C    sing N N 221 
MET CA  CB   sing N N 222 
MET CA  HA   sing N N 223 
MET C   O    doub N N 224 
MET C   OXT  sing N N 225 
MET CB  CG   sing N N 226 
MET CB  HB2  sing N N 227 
MET CB  HB3  sing N N 228 
MET CG  SD   sing N N 229 
MET CG  HG2  sing N N 230 
MET CG  HG3  sing N N 231 
MET SD  CE   sing N N 232 
MET CE  HE1  sing N N 233 
MET CE  HE2  sing N N 234 
MET CE  HE3  sing N N 235 
MET OXT HXT  sing N N 236 
PHE N   CA   sing N N 237 
PHE N   H    sing N N 238 
PHE N   H2   sing N N 239 
PHE CA  C    sing N N 240 
PHE CA  CB   sing N N 241 
PHE CA  HA   sing N N 242 
PHE C   O    doub N N 243 
PHE C   OXT  sing N N 244 
PHE CB  CG   sing N N 245 
PHE CB  HB2  sing N N 246 
PHE CB  HB3  sing N N 247 
PHE CG  CD1  doub Y N 248 
PHE CG  CD2  sing Y N 249 
PHE CD1 CE1  sing Y N 250 
PHE CD1 HD1  sing N N 251 
PHE CD2 CE2  doub Y N 252 
PHE CD2 HD2  sing N N 253 
PHE CE1 CZ   doub Y N 254 
PHE CE1 HE1  sing N N 255 
PHE CE2 CZ   sing Y N 256 
PHE CE2 HE2  sing N N 257 
PHE CZ  HZ   sing N N 258 
PHE OXT HXT  sing N N 259 
PRO N   CA   sing N N 260 
PRO N   CD   sing N N 261 
PRO N   H    sing N N 262 
PRO CA  C    sing N N 263 
PRO CA  CB   sing N N 264 
PRO CA  HA   sing N N 265 
PRO C   O    doub N N 266 
PRO C   OXT  sing N N 267 
PRO CB  CG   sing N N 268 
PRO CB  HB2  sing N N 269 
PRO CB  HB3  sing N N 270 
PRO CG  CD   sing N N 271 
PRO CG  HG2  sing N N 272 
PRO CG  HG3  sing N N 273 
PRO CD  HD2  sing N N 274 
PRO CD  HD3  sing N N 275 
PRO OXT HXT  sing N N 276 
SER N   CA   sing N N 277 
SER N   H    sing N N 278 
SER N   H2   sing N N 279 
SER CA  C    sing N N 280 
SER CA  CB   sing N N 281 
SER CA  HA   sing N N 282 
SER C   O    doub N N 283 
SER C   OXT  sing N N 284 
SER CB  OG   sing N N 285 
SER CB  HB2  sing N N 286 
SER CB  HB3  sing N N 287 
SER OG  HG   sing N N 288 
SER OXT HXT  sing N N 289 
SO4 S   O1   doub N N 290 
SO4 S   O2   doub N N 291 
SO4 S   O3   sing N N 292 
SO4 S   O4   sing N N 293 
THR N   CA   sing N N 294 
THR N   H    sing N N 295 
THR N   H2   sing N N 296 
THR CA  C    sing N N 297 
THR CA  CB   sing N N 298 
THR CA  HA   sing N N 299 
THR C   O    doub N N 300 
THR C   OXT  sing N N 301 
THR CB  OG1  sing N N 302 
THR CB  CG2  sing N N 303 
THR CB  HB   sing N N 304 
THR OG1 HG1  sing N N 305 
THR CG2 HG21 sing N N 306 
THR CG2 HG22 sing N N 307 
THR CG2 HG23 sing N N 308 
THR OXT HXT  sing N N 309 
TRP N   CA   sing N N 310 
TRP N   H    sing N N 311 
TRP N   H2   sing N N 312 
TRP CA  C    sing N N 313 
TRP CA  CB   sing N N 314 
TRP CA  HA   sing N N 315 
TRP C   O    doub N N 316 
TRP C   OXT  sing N N 317 
TRP CB  CG   sing N N 318 
TRP CB  HB2  sing N N 319 
TRP CB  HB3  sing N N 320 
TRP CG  CD1  doub Y N 321 
TRP CG  CD2  sing Y N 322 
TRP CD1 NE1  sing Y N 323 
TRP CD1 HD1  sing N N 324 
TRP CD2 CE2  doub Y N 325 
TRP CD2 CE3  sing Y N 326 
TRP NE1 CE2  sing Y N 327 
TRP NE1 HE1  sing N N 328 
TRP CE2 CZ2  sing Y N 329 
TRP CE3 CZ3  doub Y N 330 
TRP CE3 HE3  sing N N 331 
TRP CZ2 CH2  doub Y N 332 
TRP CZ2 HZ2  sing N N 333 
TRP CZ3 CH2  sing Y N 334 
TRP CZ3 HZ3  sing N N 335 
TRP CH2 HH2  sing N N 336 
TRP OXT HXT  sing N N 337 
TYR N   CA   sing N N 338 
TYR N   H    sing N N 339 
TYR N   H2   sing N N 340 
TYR CA  C    sing N N 341 
TYR CA  CB   sing N N 342 
TYR CA  HA   sing N N 343 
TYR C   O    doub N N 344 
TYR C   OXT  sing N N 345 
TYR CB  CG   sing N N 346 
TYR CB  HB2  sing N N 347 
TYR CB  HB3  sing N N 348 
TYR CG  CD1  doub Y N 349 
TYR CG  CD2  sing Y N 350 
TYR CD1 CE1  sing Y N 351 
TYR CD1 HD1  sing N N 352 
TYR CD2 CE2  doub Y N 353 
TYR CD2 HD2  sing N N 354 
TYR CE1 CZ   doub Y N 355 
TYR CE1 HE1  sing N N 356 
TYR CE2 CZ   sing Y N 357 
TYR CE2 HE2  sing N N 358 
TYR CZ  OH   sing N N 359 
TYR OH  HH   sing N N 360 
TYR OXT HXT  sing N N 361 
VAL N   CA   sing N N 362 
VAL N   H    sing N N 363 
VAL N   H2   sing N N 364 
VAL CA  C    sing N N 365 
VAL CA  CB   sing N N 366 
VAL CA  HA   sing N N 367 
VAL C   O    doub N N 368 
VAL C   OXT  sing N N 369 
VAL CB  CG1  sing N N 370 
VAL CB  CG2  sing N N 371 
VAL CB  HB   sing N N 372 
VAL CG1 HG11 sing N N 373 
VAL CG1 HG12 sing N N 374 
VAL CG1 HG13 sing N N 375 
VAL CG2 HG21 sing N N 376 
VAL CG2 HG22 sing N N 377 
VAL CG2 HG23 sing N N 378 
VAL OXT HXT  sing N N 379 
# 
loop_
_pdbx_audit_support.funding_organization 
_pdbx_audit_support.country 
_pdbx_audit_support.grant_number 
_pdbx_audit_support.ordinal 
'Japan Society for the Promotion of Science (JSPS)'        Japan 
'JP18H02082, JP18H05425, 16H02420, JP19H05766, JP19H05760, JP20H02531' 1 
'Japan Agency for Medical Research and Development (AMED)' Japan JP23ama121033 2 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   3MXW 
_pdbx_initial_refinement_model.details          ? 
# 
_atom_sites.entry_id                    8Z39 
_atom_sites.Cartn_transf_matrix[1][1]   ? 
_atom_sites.Cartn_transf_matrix[1][2]   ? 
_atom_sites.Cartn_transf_matrix[1][3]   ? 
_atom_sites.Cartn_transf_matrix[2][1]   ? 
_atom_sites.Cartn_transf_matrix[2][2]   ? 
_atom_sites.Cartn_transf_matrix[2][3]   ? 
_atom_sites.Cartn_transf_matrix[3][1]   ? 
_atom_sites.Cartn_transf_matrix[3][2]   ? 
_atom_sites.Cartn_transf_matrix[3][3]   ? 
_atom_sites.Cartn_transf_vector[1]      ? 
_atom_sites.Cartn_transf_vector[2]      ? 
_atom_sites.Cartn_transf_vector[3]      ? 
_atom_sites.Cartn_transform_axes        ? 
_atom_sites.fract_transf_matrix[1][1]   0.010254 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.003580 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.014285 
_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]   0.008828 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
C  
CA 
CL 
N  
O  
S  
ZN 
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
ATOM   1    N  N   . LEU A 1 11  ? 21.475  6.605   61.731  1.00 61.09  ? 39  LEU A N   1 
ATOM   2    C  CA  . LEU A 1 11  ? 20.121  6.719   61.099  1.00 56.86  ? 39  LEU A CA  1 
ATOM   3    C  C   . LEU A 1 11  ? 20.001  5.824   59.854  1.00 54.68  ? 39  LEU A C   1 
ATOM   4    O  O   . LEU A 1 11  ? 20.773  6.004   58.874  1.00 55.62  ? 39  LEU A O   1 
ATOM   5    C  CB  . LEU A 1 11  ? 19.859  8.186   60.746  1.00 56.98  ? 39  LEU A CB  1 
ATOM   6    C  CG  . LEU A 1 11  ? 19.700  9.138   61.935  1.00 58.23  ? 39  LEU A CG  1 
ATOM   7    C  CD1 . LEU A 1 11  ? 19.071  10.447  61.485  1.00 55.85  ? 39  LEU A CD1 1 
ATOM   8    C  CD2 . LEU A 1 11  ? 18.878  8.508   63.063  1.00 58.68  ? 39  LEU A CD2 1 
ATOM   9    N  N   . THR A 1 12  ? 19.015  4.926   59.867  1.00 50.94  ? 40  THR A N   1 
ATOM   10   C  CA  . THR A 1 12  ? 18.739  3.967   58.765  1.00 48.61  ? 40  THR A CA  1 
ATOM   11   C  C   . THR A 1 12  ? 17.432  4.362   58.074  1.00 41.92  ? 40  THR A C   1 
ATOM   12   O  O   . THR A 1 12  ? 16.385  4.523   58.704  1.00 37.83  ? 40  THR A O   1 
ATOM   13   C  CB  . THR A 1 12  ? 18.742  2.537   59.313  1.00 52.09  ? 40  THR A CB  1 
ATOM   14   O  OG1 . THR A 1 12  ? 17.651  2.474   60.229  1.00 54.95  ? 40  THR A OG1 1 
ATOM   15   C  CG2 . THR A 1 12  ? 20.019  2.170   60.037  1.00 54.03  ? 40  THR A CG2 1 
ATOM   16   N  N   . PRO A 1 13  ? 17.451  4.527   56.737  1.00 39.79  ? 41  PRO A N   1 
ATOM   17   C  CA  . PRO A 1 13  ? 16.248  4.936   56.009  1.00 36.01  ? 41  PRO A CA  1 
ATOM   18   C  C   . PRO A 1 13  ? 15.160  3.866   56.192  1.00 34.97  ? 41  PRO A C   1 
ATOM   19   O  O   . PRO A 1 13  ? 15.499  2.715   56.361  1.00 35.75  ? 41  PRO A O   1 
ATOM   20   C  CB  . PRO A 1 13  ? 16.699  5.078   54.547  1.00 36.71  ? 41  PRO A CB  1 
ATOM   21   C  CG  . PRO A 1 13  ? 18.019  4.327   54.453  1.00 40.92  ? 41  PRO A CG  1 
ATOM   22   C  CD  . PRO A 1 13  ? 18.607  4.298   55.857  1.00 41.73  ? 41  PRO A CD  1 
ATOM   23   N  N   . LEU A 1 14  ? 13.884  4.248   56.244  1.00 32.22  ? 42  LEU A N   1 
ATOM   24   C  CA  . LEU A 1 14  ? 12.772  3.267   56.180  1.00 31.58  ? 42  LEU A CA  1 
ATOM   25   C  C   . LEU A 1 14  ? 12.766  2.657   54.781  1.00 31.24  ? 42  LEU A C   1 
ATOM   26   O  O   . LEU A 1 14  ? 13.096  3.373   53.792  1.00 31.19  ? 42  LEU A O   1 
ATOM   27   C  CB  . LEU A 1 14  ? 11.398  3.889   56.427  1.00 29.96  ? 42  LEU A CB  1 
ATOM   28   C  CG  . LEU A 1 14  ? 10.938  3.964   57.871  1.00 30.54  ? 42  LEU A CG  1 
ATOM   29   C  CD1 . LEU A 1 14  ? 11.814  4.947   58.648  1.00 30.66  ? 42  LEU A CD1 1 
ATOM   30   C  CD2 . LEU A 1 14  ? 9.465   4.375   57.952  1.00 29.77  ? 42  LEU A CD2 1 
ATOM   31   N  N   . ALA A 1 15  ? 12.361  1.398   54.707  1.00 32.21  ? 43  ALA A N   1 
ATOM   32   C  CA  . ALA A 1 15  ? 12.180  0.660   53.431  1.00 32.66  ? 43  ALA A CA  1 
ATOM   33   C  C   . ALA A 1 15  ? 10.835  1.064   52.819  1.00 31.02  ? 43  ALA A C   1 
ATOM   34   O  O   . ALA A 1 15  ? 9.915   1.503   53.536  1.00 29.64  ? 43  ALA A O   1 
ATOM   35   C  CB  . ALA A 1 15  ? 12.252  -0.818  53.655  1.00 34.77  ? 43  ALA A CB  1 
ATOM   36   N  N   . TYR A 1 16  ? 10.715  0.865   51.516  1.00 31.88  ? 44  TYR A N   1 
ATOM   37   C  CA  . TYR A 1 16  ? 9.463   1.147   50.783  1.00 30.63  ? 44  TYR A CA  1 
ATOM   38   C  C   . TYR A 1 16  ? 8.326   0.335   51.436  1.00 29.45  ? 44  TYR A C   1 
ATOM   39   O  O   . TYR A 1 16  ? 8.522   -0.864  51.661  1.00 30.80  ? 44  TYR A O   1 
ATOM   40   C  CB  . TYR A 1 16  ? 9.680   0.861   49.301  1.00 32.61  ? 44  TYR A CB  1 
ATOM   41   C  CG  . TYR A 1 16  ? 8.531   1.290   48.425  1.00 32.78  ? 44  TYR A CG  1 
ATOM   42   C  CD1 . TYR A 1 16  ? 7.970   2.544   48.575  1.00 31.97  ? 44  TYR A CD1 1 
ATOM   43   C  CD2 . TYR A 1 16  ? 7.977   0.425   47.475  1.00 35.01  ? 44  TYR A CD2 1 
ATOM   44   C  CE1 . TYR A 1 16  ? 6.886   2.943   47.808  1.00 31.96  ? 44  TYR A CE1 1 
ATOM   45   C  CE2 . TYR A 1 16  ? 6.899   0.820   46.694  1.00 34.59  ? 44  TYR A CE2 1 
ATOM   46   C  CZ  . TYR A 1 16  ? 6.347   2.075   46.874  1.00 33.71  ? 44  TYR A CZ  1 
ATOM   47   O  OH  . TYR A 1 16  ? 5.286   2.531   46.142  1.00 34.55  ? 44  TYR A OH  1 
ATOM   48   N  N   . LYS A 1 17  ? 7.222   1.016   51.769  1.00 26.65  ? 45  LYS A N   1 
ATOM   49   C  CA  . LYS A 1 17  ? 5.950   0.508   52.357  1.00 27.16  ? 45  LYS A CA  1 
ATOM   50   C  C   . LYS A 1 17  ? 6.136   0.192   53.873  1.00 28.17  ? 45  LYS A C   1 
ATOM   51   O  O   . LYS A 1 17  ? 5.141   -0.204  54.507  1.00 29.53  ? 45  LYS A O   1 
ATOM   52   C  CB  . LYS A 1 17  ? 5.407   -0.692  51.583  1.00 28.93  ? 45  LYS A CB  1 
ATOM   53   C  CG  . LYS A 1 17  ? 5.092   -0.384  50.116  1.00 29.10  ? 45  LYS A CG  1 
ATOM   54   C  CD  . LYS A 1 17  ? 3.913   0.560   49.937  1.00 27.80  ? 45  LYS A CD  1 
ATOM   55   C  CE  . LYS A 1 17  ? 3.645   0.813   48.462  1.00 28.28  ? 45  LYS A CE  1 
ATOM   56   N  NZ  . LYS A 1 17  ? 2.409   1.590   48.193  1.00 27.46  ? 45  LYS A NZ  1 
ATOM   57   N  N   . GLN A 1 18  ? 7.334   0.473   54.413  1.00 28.75  ? 46  GLN A N   1 
ATOM   58   C  CA  . GLN A 1 18  ? 7.605   0.212   55.876  1.00 29.67  ? 46  GLN A CA  1 
ATOM   59   C  C   . GLN A 1 18  ? 6.800   1.224   56.672  1.00 28.05  ? 46  GLN A C   1 
ATOM   60   O  O   . GLN A 1 18  ? 6.686   2.405   56.221  1.00 25.27  ? 46  GLN A O   1 
ATOM   61   C  CB  . GLN A 1 18  ? 9.080   0.342   56.255  1.00 31.25  ? 46  GLN A CB  1 
ATOM   62   C  CG  . GLN A 1 18  ? 9.378   0.058   57.743  1.00 32.90  ? 46  GLN A CG  1 
ATOM   63   C  CD  . GLN A 1 18  ? 10.855  -0.113  58.007  1.00 34.99  ? 46  GLN A CD  1 
ATOM   64   O  OE1 . GLN A 1 18  ? 11.704  0.226   57.156  1.00 37.08  ? 46  GLN A OE1 1 
ATOM   65   N  NE2 . GLN A 1 18  ? 11.170  -0.609  59.245  1.00 36.79  ? 46  GLN A NE2 1 
ATOM   66   N  N   . PHE A 1 19  ? 6.316   0.830   57.854  1.00 29.23  ? 47  PHE A N   1 
ATOM   67   C  CA  . PHE A 1 19  ? 5.624   1.757   58.768  1.00 28.97  ? 47  PHE A CA  1 
ATOM   68   C  C   . PHE A 1 19  ? 6.144   1.549   60.192  1.00 30.13  ? 47  PHE A C   1 
ATOM   69   O  O   . PHE A 1 19  ? 6.339   0.397   60.607  1.00 31.50  ? 47  PHE A O   1 
ATOM   70   C  CB  . PHE A 1 19  ? 4.105   1.614   58.713  1.00 30.46  ? 47  PHE A CB  1 
ATOM   71   C  CG  . PHE A 1 19  ? 3.604   0.208   58.789  1.00 34.22  ? 47  PHE A CG  1 
ATOM   72   C  CD1 . PHE A 1 19  ? 3.442   -0.550  57.638  1.00 34.91  ? 47  PHE A CD1 1 
ATOM   73   C  CD2 . PHE A 1 19  ? 3.382   -0.394  60.019  1.00 36.16  ? 47  PHE A CD2 1 
ATOM   74   C  CE1 . PHE A 1 19  ? 3.014   -1.858  57.710  1.00 37.76  ? 47  PHE A CE1 1 
ATOM   75   C  CE2 . PHE A 1 19  ? 2.964   -1.708  60.088  1.00 38.54  ? 47  PHE A CE2 1 
ATOM   76   C  CZ  . PHE A 1 19  ? 2.793   -2.446  58.938  1.00 40.01  ? 47  PHE A CZ  1 
ATOM   77   N  N   . ILE A 1 20  ? 6.312   2.674   60.878  1.00 29.74  ? 48  ILE A N   1 
ATOM   78   C  CA  . ILE A 1 20  ? 6.875   2.736   62.273  1.00 31.64  ? 48  ILE A CA  1 
ATOM   79   C  C   . ILE A 1 20  ? 5.989   3.652   63.112  1.00 32.05  ? 48  ILE A C   1 
ATOM   80   O  O   . ILE A 1 20  ? 5.730   4.805   62.734  1.00 29.15  ? 48  ILE A O   1 
ATOM   81   C  CB  . ILE A 1 20  ? 8.342   3.199   62.242  1.00 31.59  ? 48  ILE A CB  1 
ATOM   82   C  CG1 . ILE A 1 20  ? 9.191   2.161   61.505  1.00 32.97  ? 48  ILE A CG1 1 
ATOM   83   C  CG2 . ILE A 1 20  ? 8.872   3.458   63.653  1.00 33.07  ? 48  ILE A CG2 1 
ATOM   84   C  CD1 . ILE A 1 20  ? 10.564  2.649   61.138  1.00 33.21  ? 48  ILE A CD1 1 
ATOM   85   N  N   . PRO A 1 21  ? 5.506   3.149   64.283  1.00 35.72  ? 49  PRO A N   1 
ATOM   86   C  CA  . PRO A 1 21  ? 5.839   1.803   64.761  1.00 37.53  ? 49  PRO A CA  1 
ATOM   87   C  C   . PRO A 1 21  ? 5.134   0.767   63.872  1.00 38.35  ? 49  PRO A C   1 
ATOM   88   O  O   . PRO A 1 21  ? 4.279   1.186   63.111  1.00 35.66  ? 49  PRO A O   1 
ATOM   89   C  CB  . PRO A 1 21  ? 5.298   1.758   66.199  1.00 40.15  ? 49  PRO A CB  1 
ATOM   90   C  CG  . PRO A 1 21  ? 4.153   2.750   66.169  1.00 39.53  ? 49  PRO A CG  1 
ATOM   91   C  CD  . PRO A 1 21  ? 4.591   3.840   65.204  1.00 37.14  ? 49  PRO A CD  1 
ATOM   92   N  N   . ASN A 1 22  ? 5.504   -0.502  64.062  1.00 41.77  ? 50  ASN A N   1 
ATOM   93   C  CA  . ASN A 1 22  ? 5.087   -1.765  63.378  1.00 43.56  ? 50  ASN A CA  1 
ATOM   94   C  C   . ASN A 1 22  ? 3.613   -2.169  63.580  1.00 43.90  ? 50  ASN A C   1 
ATOM   95   O  O   . ASN A 1 22  ? 3.361   -3.387  63.604  1.00 47.29  ? 50  ASN A O   1 
ATOM   96   C  CB  . ASN A 1 22  ? 5.768   -2.961  64.048  1.00 50.43  ? 50  ASN A CB  1 
ATOM   97   C  CG  . ASN A 1 22  ? 7.080   -3.408  63.423  1.00 53.14  ? 50  ASN A CG  1 
ATOM   98   O  OD1 . ASN A 1 22  ? 8.078   -3.683  64.323  1.00 54.48  ? 50  ASN A OD1 1 
ATOM   99   N  ND2 . ASN A 1 22  ? 7.140   -3.456  62.000  1.00 56.57  ? 50  ASN A ND2 1 
ATOM   100  N  N   . VAL A 1 23  ? 2.683   -1.237  63.763  1.00 42.02  ? 51  VAL A N   1 
ATOM   101  C  CA  . VAL A 1 23  ? 1.246   -1.490  64.082  1.00 43.19  ? 51  VAL A CA  1 
ATOM   102  C  C   . VAL A 1 23  ? 0.390   -0.577  63.206  1.00 41.71  ? 51  VAL A C   1 
ATOM   103  O  O   . VAL A 1 23  ? 0.947   0.347   62.605  1.00 40.12  ? 51  VAL A O   1 
ATOM   104  C  CB  . VAL A 1 23  ? 0.959   -1.253  65.576  1.00 45.29  ? 51  VAL A CB  1 
ATOM   105  C  CG1 . VAL A 1 23  ? 1.729   -2.222  66.463  1.00 47.31  ? 51  VAL A CG1 1 
ATOM   106  C  CG2 . VAL A 1 23  ? 1.248   0.177   65.988  1.00 43.18  ? 51  VAL A CG2 1 
ATOM   107  N  N   . ALA A 1 24  ? -0.920  -0.817  63.163  1.00 43.83  ? 52  ALA A N   1 
ATOM   108  C  CA  . ALA A 1 24  ? -1.869  -0.019  62.363  1.00 43.09  ? 52  ALA A CA  1 
ATOM   109  C  C   . ALA A 1 24  ? -1.839  1.409   62.904  1.00 41.85  ? 52  ALA A C   1 
ATOM   110  O  O   . ALA A 1 24  ? -1.630  1.599   64.142  1.00 42.24  ? 52  ALA A O   1 
ATOM   111  C  CB  . ALA A 1 24  ? -3.262  -0.603  62.388  1.00 45.48  ? 52  ALA A CB  1 
ATOM   112  N  N   . GLU A 1 25  ? -2.018  2.369   61.990  1.00 39.61  ? 53  GLU A N   1 
ATOM   113  C  CA  . GLU A 1 25  ? -1.950  3.817   62.265  1.00 38.17  ? 53  GLU A CA  1 
ATOM   114  C  C   . GLU A 1 25  ? -2.915  4.176   63.404  1.00 40.45  ? 53  GLU A C   1 
ATOM   115  O  O   . GLU A 1 25  ? -2.546  4.974   64.286  1.00 39.43  ? 53  GLU A O   1 
ATOM   116  C  CB  . GLU A 1 25  ? -2.331  4.609   61.021  1.00 36.15  ? 53  GLU A CB  1 
ATOM   117  C  CG  . GLU A 1 25  ? -2.328  6.109   61.277  1.00 34.95  ? 53  GLU A CG  1 
ATOM   118  C  CD  . GLU A 1 25  ? -2.494  6.961   60.027  1.00 33.08  ? 53  GLU A CD  1 
ATOM   119  O  OE1 . GLU A 1 25  ? -3.308  6.564   59.144  1.00 33.15  ? 53  GLU A OE1 1 
ATOM   120  O  OE2 . GLU A 1 25  ? -1.835  8.014   59.933  1.00 30.46  ? 53  GLU A OE2 1 
ATOM   121  N  N   . LYS A 1 26  ? -4.144  3.678   63.345  1.00 42.60  ? 54  LYS A N   1 
ATOM   122  C  CA  . LYS A 1 26  ? -5.201  4.192   64.237  1.00 45.98  ? 54  LYS A CA  1 
ATOM   123  C  C   . LYS A 1 26  ? -5.216  3.397   65.547  1.00 47.37  ? 54  LYS A C   1 
ATOM   124  O  O   . LYS A 1 26  ? -6.180  3.596   66.281  1.00 50.25  ? 54  LYS A O   1 
ATOM   125  C  CB  . LYS A 1 26  ? -6.513  4.265   63.459  1.00 48.56  ? 54  LYS A CB  1 
ATOM   126  C  CG  . LYS A 1 26  ? -6.336  5.044   62.160  1.00 48.17  ? 54  LYS A CG  1 
ATOM   127  C  CD  . LYS A 1 26  ? -7.562  5.737   61.618  1.00 50.42  ? 54  LYS A CD  1 
ATOM   128  C  CE  . LYS A 1 26  ? -7.383  6.118   60.158  1.00 48.76  ? 54  LYS A CE  1 
ATOM   129  N  NZ  . LYS A 1 26  ? -8.609  5.862   59.362  1.00 50.53  ? 54  LYS A NZ  1 
ATOM   130  N  N   . THR A 1 27  ? -4.166  2.612   65.856  1.00 46.57  ? 55  THR A N   1 
ATOM   131  C  CA  . THR A 1 27  ? -4.022  1.867   67.142  1.00 49.42  ? 55  THR A CA  1 
ATOM   132  C  C   . THR A 1 27  ? -3.339  2.738   68.206  1.00 49.86  ? 55  THR A C   1 
ATOM   133  O  O   . THR A 1 27  ? -2.591  3.704   67.859  1.00 47.97  ? 55  THR A O   1 
ATOM   134  C  CB  . THR A 1 27  ? -3.208  0.568   67.041  1.00 49.22  ? 55  THR A CB  1 
ATOM   135  O  OG1 . THR A 1 27  ? -1.849  0.863   66.664  1.00 46.59  ? 55  THR A OG1 1 
ATOM   136  C  CG2 . THR A 1 27  ? -3.815  -0.424  66.074  1.00 50.00  ? 55  THR A CG2 1 
ATOM   137  N  N   . LEU A 1 28  ? -3.538  2.356   69.468  1.00 53.09  ? 56  LEU A N   1 
ATOM   138  C  CA  . LEU A 1 28  ? -3.171  3.186   70.637  1.00 54.35  ? 56  LEU A CA  1 
ATOM   139  C  C   . LEU A 1 28  ? -1.669  3.495   70.608  1.00 52.19  ? 56  LEU A C   1 
ATOM   140  O  O   . LEU A 1 28  ? -1.318  4.652   70.915  1.00 53.26  ? 56  LEU A O   1 
ATOM   141  C  CB  . LEU A 1 28  ? -3.569  2.445   71.913  1.00 58.66  ? 56  LEU A CB  1 
ATOM   142  C  CG  . LEU A 1 28  ? -3.201  3.161   73.208  1.00 60.75  ? 56  LEU A CG  1 
ATOM   143  C  CD1 . LEU A 1 28  ? -3.942  4.489   73.305  1.00 61.22  ? 56  LEU A CD1 1 
ATOM   144  C  CD2 . LEU A 1 28  ? -3.495  2.279   74.411  1.00 64.68  ? 56  LEU A CD2 1 
ATOM   145  N  N   . GLY A 1 29  ? -0.820  2.522   70.227  1.00 51.27  ? 57  GLY A N   1 
ATOM   146  C  CA  . GLY A 1 29  ? 0.650   2.666   70.271  1.00 49.63  ? 57  GLY A CA  1 
ATOM   147  C  C   . GLY A 1 29  ? 1.163   3.539   69.138  1.00 46.63  ? 57  GLY A C   1 
ATOM   148  O  O   . GLY A 1 29  ? 2.358   3.890   69.128  1.00 46.36  ? 57  GLY A O   1 
ATOM   149  N  N   . ALA A 1 30  ? 0.312   3.844   68.165  1.00 45.18  ? 58  ALA A N   1 
ATOM   150  C  CA  . ALA A 1 30  ? 0.697   4.663   66.991  1.00 41.71  ? 58  ALA A CA  1 
ATOM   151  C  C   . ALA A 1 30  ? 0.055   6.049   67.162  1.00 40.50  ? 58  ALA A C   1 
ATOM   152  O  O   . ALA A 1 30  ? 0.414   6.710   68.198  1.00 41.51  ? 58  ALA A O   1 
ATOM   153  C  CB  . ALA A 1 30  ? 0.315   3.917   65.726  1.00 40.91  ? 58  ALA A CB  1 
ATOM   154  N  N   . SER A 1 31  ? -0.904  6.419   66.293  1.00 39.22  ? 59  SER A N   1 
ATOM   155  C  CA  . SER A 1 31  ? -1.550  7.761   66.284  1.00 38.81  ? 59  SER A CA  1 
ATOM   156  C  C   . SER A 1 31  ? -2.941  7.675   66.907  1.00 41.15  ? 59  SER A C   1 
ATOM   157  O  O   . SER A 1 31  ? -3.514  8.728   67.193  1.00 41.74  ? 59  SER A O   1 
ATOM   158  C  CB  . SER A 1 31  ? -1.597  8.353   64.888  1.00 36.26  ? 59  SER A CB  1 
ATOM   159  O  OG  . SER A 1 31  ? -0.283  8.673   64.438  1.00 34.50  ? 59  SER A OG  1 
ATOM   160  N  N   . GLY A 1 32  ? -3.469  6.461   67.113  1.00 43.81  ? 60  GLY A N   1 
ATOM   161  C  CA  . GLY A 1 32  ? -4.767  6.259   67.783  1.00 47.63  ? 60  GLY A CA  1 
ATOM   162  C  C   . GLY A 1 32  ? -5.929  6.697   66.911  1.00 48.96  ? 60  GLY A C   1 
ATOM   163  O  O   . GLY A 1 32  ? -5.700  7.066   65.725  1.00 46.32  ? 60  GLY A O   1 
ATOM   164  N  N   . ARG A 1 33  ? -7.148  6.635   67.450  1.00 54.46  ? 61  ARG A N   1 
ATOM   165  C  CA  . ARG A 1 33  ? -8.367  6.467   66.623  1.00 57.73  ? 61  ARG A CA  1 
ATOM   166  C  C   . ARG A 1 33  ? -8.781  7.789   65.963  1.00 57.63  ? 61  ARG A C   1 
ATOM   167  O  O   . ARG A 1 33  ? -8.455  8.885   66.488  1.00 55.24  ? 61  ARG A O   1 
ATOM   168  C  CB  . ARG A 1 33  ? -9.498  5.861   67.447  1.00 64.31  ? 61  ARG A CB  1 
ATOM   169  C  CG  . ARG A 1 33  ? -10.307 6.879   68.230  1.00 68.45  ? 61  ARG A CG  1 
ATOM   170  C  CD  . ARG A 1 33  ? -11.389 6.238   69.082  1.00 74.41  ? 61  ARG A CD  1 
ATOM   171  N  NE  . ARG A 1 33  ? -11.904 7.254   69.981  1.00 78.27  ? 61  ARG A NE  1 
ATOM   172  C  CZ  . ARG A 1 33  ? -12.650 8.291   69.610  1.00 80.28  ? 61  ARG A CZ  1 
ATOM   173  N  NH1 . ARG A 1 33  ? -13.016 8.448   68.348  1.00 79.02  ? 61  ARG A NH1 1 
ATOM   174  N  NH2 . ARG A 1 33  ? -13.040 9.172   70.515  1.00 83.49  ? 61  ARG A NH2 1 
ATOM   175  N  N   . TYR A 1 34  ? -9.466  7.641   64.822  1.00 58.00  ? 62  TYR A N   1 
ATOM   176  C  CA  . TYR A 1 34  ? -10.154 8.691   64.033  1.00 58.22  ? 62  TYR A CA  1 
ATOM   177  C  C   . TYR A 1 34  ? -11.274 9.307   64.882  1.00 62.49  ? 62  TYR A C   1 
ATOM   178  O  O   . TYR A 1 34  ? -12.172 8.572   65.309  1.00 66.05  ? 62  TYR A O   1 
ATOM   179  C  CB  . TYR A 1 34  ? -10.680 8.053   62.747  1.00 57.79  ? 62  TYR A CB  1 
ATOM   180  C  CG  . TYR A 1 34  ? -11.253 9.019   61.747  1.00 58.16  ? 62  TYR A CG  1 
ATOM   181  C  CD1 . TYR A 1 34  ? -10.449 9.975   61.152  1.00 56.15  ? 62  TYR A CD1 1 
ATOM   182  C  CD2 . TYR A 1 34  ? -12.587 8.975   61.380  1.00 61.91  ? 62  TYR A CD2 1 
ATOM   183  C  CE1 . TYR A 1 34  ? -10.958 10.877  60.232  1.00 56.51  ? 62  TYR A CE1 1 
ATOM   184  C  CE2 . TYR A 1 34  ? -13.110 9.858   60.447  1.00 62.56  ? 62  TYR A CE2 1 
ATOM   185  C  CZ  . TYR A 1 34  ? -12.290 10.811  59.865  1.00 59.56  ? 62  TYR A CZ  1 
ATOM   186  O  OH  . TYR A 1 34  ? -12.777 11.706  58.956  1.00 60.20  ? 62  TYR A OH  1 
ATOM   187  N  N   . GLU A 1 35  ? -11.214 10.612  65.140  1.00 63.26  ? 63  GLU A N   1 
ATOM   188  C  CA  . GLU A 1 35  ? -12.218 11.337  65.962  1.00 67.84  ? 63  GLU A CA  1 
ATOM   189  C  C   . GLU A 1 35  ? -13.183 12.080  65.022  1.00 68.21  ? 63  GLU A C   1 
ATOM   190  O  O   . GLU A 1 35  ? -13.966 12.955  65.518  1.00 71.95  ? 63  GLU A O   1 
ATOM   191  C  CB  . GLU A 1 35  ? -11.488 12.232  66.964  1.00 68.69  ? 63  GLU A CB  1 
ATOM   192  C  CG  . GLU A 1 35  ? -10.487 11.447  67.798  1.00 69.89  ? 63  GLU A CG  1 
ATOM   193  C  CD  . GLU A 1 35  ? -9.948  12.129  69.044  1.00 72.43  ? 63  GLU A CD  1 
ATOM   194  O  OE1 . GLU A 1 35  ? -10.345 13.277  69.319  1.00 75.40  ? 63  GLU A OE1 1 
ATOM   195  O  OE2 . GLU A 1 35  ? -9.124  11.501  69.736  1.00 74.42  ? 63  GLU A OE2 1 
ATOM   196  N  N   . GLY A 1 36  ? -13.087 11.786  63.707  1.00 65.66  ? 64  GLY A N   1 
ATOM   197  C  CA  . GLY A 1 36  ? -14.084 12.210  62.707  1.00 66.68  ? 64  GLY A CA  1 
ATOM   198  C  C   . GLY A 1 36  ? -13.629 13.417  61.909  1.00 64.24  ? 64  GLY A C   1 
ATOM   199  O  O   . GLY A 1 36  ? -12.727 14.133  62.365  1.00 62.47  ? 64  GLY A O   1 
ATOM   200  N  N   . LYS A 1 37  ? -14.244 13.615  60.744  1.00 65.08  ? 65  LYS A N   1 
ATOM   201  C  CA  . LYS A 1 37  ? -13.871 14.632  59.729  1.00 63.63  ? 65  LYS A CA  1 
ATOM   202  C  C   . LYS A 1 37  ? -14.062 16.037  60.315  1.00 64.01  ? 65  LYS A C   1 
ATOM   203  O  O   . LYS A 1 37  ? -15.067 16.248  61.010  1.00 66.77  ? 65  LYS A O   1 
ATOM   204  C  CB  . LYS A 1 37  ? -14.719 14.397  58.474  1.00 66.31  ? 65  LYS A CB  1 
ATOM   205  C  CG  . LYS A 1 37  ? -14.592 15.415  57.350  1.00 66.56  ? 65  LYS A CG  1 
ATOM   206  C  CD  . LYS A 1 37  ? -15.486 15.059  56.171  1.00 70.33  ? 65  LYS A CD  1 
ATOM   207  C  CE  . LYS A 1 37  ? -15.167 15.806  54.891  1.00 70.17  ? 65  LYS A CE  1 
ATOM   208  N  NZ  . LYS A 1 37  ? -14.873 14.872  53.772  1.00 70.33  ? 65  LYS A NZ  1 
ATOM   209  N  N   . ILE A 1 38  ? -13.120 16.950  60.040  1.00 60.52  ? 66  ILE A N   1 
ATOM   210  C  CA  . ILE A 1 38  ? -13.224 18.412  60.343  1.00 60.60  ? 66  ILE A CA  1 
ATOM   211  C  C   . ILE A 1 38  ? -13.436 19.172  59.028  1.00 59.48  ? 66  ILE A C   1 
ATOM   212  O  O   . ILE A 1 38  ? -12.571 19.093  58.144  1.00 54.97  ? 66  ILE A O   1 
ATOM   213  C  CB  . ILE A 1 38  ? -11.983 18.918  61.106  1.00 57.83  ? 66  ILE A CB  1 
ATOM   214  C  CG1 . ILE A 1 38  ? -11.868 18.275  62.492  1.00 58.84  ? 66  ILE A CG1 1 
ATOM   215  C  CG2 . ILE A 1 38  ? -11.988 20.434  61.190  1.00 58.12  ? 66  ILE A CG2 1 
ATOM   216  C  CD1 . ILE A 1 38  ? -10.541 18.521  63.176  1.00 56.32  ? 66  ILE A CD1 1 
ATOM   217  N  N   . SER A 1 39  ? -14.548 19.890  58.912  1.00 62.85  ? 67  SER A N   1 
ATOM   218  C  CA  . SER A 1 39  ? -14.839 20.772  57.755  1.00 64.47  ? 67  SER A CA  1 
ATOM   219  C  C   . SER A 1 39  ? -14.649 22.242  58.165  1.00 65.05  ? 67  SER A C   1 
ATOM   220  O  O   . SER A 1 39  ? -14.560 22.542  59.388  1.00 64.85  ? 67  SER A O   1 
ATOM   221  C  CB  . SER A 1 39  ? -16.223 20.503  57.178  1.00 68.70  ? 67  SER A CB  1 
ATOM   222  O  OG  . SER A 1 39  ? -17.133 21.560  57.466  1.00 72.25  ? 67  SER A OG  1 
ATOM   223  N  N   . ARG A 1 40  ? -14.591 23.107  57.152  1.00 65.18  ? 68  ARG A N   1 
ATOM   224  C  CA  . ARG A 1 40  ? -14.330 24.564  57.251  1.00 67.31  ? 68  ARG A CA  1 
ATOM   225  C  C   . ARG A 1 40  ? -15.458 25.234  58.059  1.00 74.37  ? 68  ARG A C   1 
ATOM   226  O  O   . ARG A 1 40  ? -15.190 26.271  58.708  1.00 75.85  ? 68  ARG A O   1 
ATOM   227  C  CB  . ARG A 1 40  ? -14.188 25.083  55.816  1.00 65.15  ? 68  ARG A CB  1 
ATOM   228  C  CG  . ARG A 1 40  ? -13.515 26.435  55.675  1.00 63.73  ? 68  ARG A CG  1 
ATOM   229  C  CD  . ARG A 1 40  ? -13.416 26.839  54.214  1.00 62.32  ? 68  ARG A CD  1 
ATOM   230  N  NE  . ARG A 1 40  ? -12.238 26.286  53.544  1.00 57.73  ? 68  ARG A NE  1 
ATOM   231  C  CZ  . ARG A 1 40  ? -10.988 26.679  53.750  1.00 54.15  ? 68  ARG A CZ  1 
ATOM   232  N  NH1 . ARG A 1 40  ? -10.728 27.612  54.644  1.00 54.62  ? 68  ARG A NH1 1 
ATOM   233  N  NH2 . ARG A 1 40  ? -9.988  26.120  53.086  1.00 51.00  ? 68  ARG A NH2 1 
ATOM   234  N  N   . ASN A 1 41  ? -16.667 24.654  58.020  1.00 81.25  ? 69  ASN A N   1 
ATOM   235  C  CA  . ASN A 1 41  ? -17.874 25.064  58.800  1.00 89.16  ? 69  ASN A CA  1 
ATOM   236  C  C   . ASN A 1 41  ? -17.634 24.830  60.302  1.00 90.48  ? 69  ASN A C   1 
ATOM   237  O  O   . ASN A 1 41  ? -17.946 25.734  61.104  1.00 91.68  ? 69  ASN A O   1 
ATOM   238  C  CB  . ASN A 1 41  ? -19.117 24.286  58.335  1.00 93.69  ? 69  ASN A CB  1 
ATOM   239  C  CG  . ASN A 1 41  ? -20.445 24.821  58.841  1.00 100.66 ? 69  ASN A CG  1 
ATOM   240  O  OD1 . ASN A 1 41  ? -20.560 25.981  59.240  1.00 104.72 ? 69  ASN A OD1 1 
ATOM   241  N  ND2 . ASN A 1 41  ? -21.478 23.990  58.795  1.00 104.61 ? 69  ASN A ND2 1 
ATOM   242  N  N   . SER A 1 42  ? -17.076 23.662  60.652  1.00 88.61  ? 70  SER A N   1 
ATOM   243  C  CA  . SER A 1 42  ? -17.104 23.042  62.006  1.00 88.93  ? 70  SER A CA  1 
ATOM   244  C  C   . SER A 1 42  ? -16.606 24.003  63.093  1.00 87.10  ? 70  SER A C   1 
ATOM   245  O  O   . SER A 1 42  ? -15.843 24.945  62.779  1.00 85.27  ? 70  SER A O   1 
ATOM   246  C  CB  . SER A 1 42  ? -16.286 21.778  62.023  1.00 85.74  ? 70  SER A CB  1 
ATOM   247  O  OG  . SER A 1 42  ? -14.904 22.097  61.986  1.00 83.83  ? 70  SER A OG  1 
ATOM   248  N  N   . GLU A 1 43  ? -16.991 23.721  64.339  1.00 87.45  ? 71  GLU A N   1 
ATOM   249  C  CA  . GLU A 1 43  ? -16.412 24.356  65.547  1.00 86.56  ? 71  GLU A CA  1 
ATOM   250  C  C   . GLU A 1 43  ? -14.979 23.846  65.718  1.00 80.94  ? 71  GLU A C   1 
ATOM   251  O  O   . GLU A 1 43  ? -14.117 24.647  66.089  1.00 80.80  ? 71  GLU A O   1 
ATOM   252  C  CB  . GLU A 1 43  ? -17.270 24.065  66.780  1.00 91.31  ? 71  GLU A CB  1 
ATOM   253  C  CG  . GLU A 1 43  ? -16.928 24.936  67.979  1.00 92.85  ? 71  GLU A CG  1 
ATOM   254  C  CD  . GLU A 1 43  ? -17.414 26.378  67.914  1.00 95.14  ? 71  GLU A CD  1 
ATOM   255  O  OE1 . GLU A 1 43  ? -17.218 27.036  66.871  1.00 93.26  ? 71  GLU A OE1 1 
ATOM   256  O  OE2 . GLU A 1 43  ? -17.980 26.843  68.916  1.00 98.67  ? 71  GLU A OE2 1 
ATOM   257  N  N   . ARG A 1 44  ? -14.726 22.571  65.424  1.00 77.36  ? 72  ARG A N   1 
ATOM   258  C  CA  . ARG A 1 44  ? -13.385 21.946  65.592  1.00 72.82  ? 72  ARG A CA  1 
ATOM   259  C  C   . ARG A 1 44  ? -12.380 22.525  64.581  1.00 67.61  ? 72  ARG A C   1 
ATOM   260  O  O   . ARG A 1 44  ? -11.154 22.240  64.742  1.00 64.17  ? 72  ARG A O   1 
ATOM   261  C  CB  . ARG A 1 44  ? -13.480 20.418  65.487  1.00 72.71  ? 72  ARG A CB  1 
ATOM   262  C  CG  . ARG A 1 44  ? -13.699 19.720  66.824  1.00 75.42  ? 72  ARG A CG  1 
ATOM   263  C  CD  . ARG A 1 44  ? -14.073 18.255  66.685  1.00 76.23  ? 72  ARG A CD  1 
ATOM   264  N  NE  . ARG A 1 44  ? -12.940 17.391  66.349  1.00 73.09  ? 72  ARG A NE  1 
ATOM   265  C  CZ  . ARG A 1 44  ? -12.878 16.554  65.298  1.00 71.81  ? 72  ARG A CZ  1 
ATOM   266  N  NH1 . ARG A 1 44  ? -11.796 15.811  65.112  1.00 68.33  ? 72  ARG A NH1 1 
ATOM   267  N  NH2 . ARG A 1 44  ? -13.891 16.442  64.447  1.00 73.66  ? 72  ARG A NH2 1 
ATOM   268  N  N   . PHE A 1 45  ? -12.842 23.297  63.586  1.00 66.69  ? 73  PHE A N   1 
ATOM   269  C  CA  . PHE A 1 45  ? -11.971 23.961  62.572  1.00 63.45  ? 73  PHE A CA  1 
ATOM   270  C  C   . PHE A 1 45  ? -10.972 24.889  63.267  1.00 62.56  ? 73  PHE A C   1 
ATOM   271  O  O   . PHE A 1 45  ? -9.822  25.004  62.792  1.00 58.00  ? 73  PHE A O   1 
ATOM   272  C  CB  . PHE A 1 45  ? -12.783 24.772  61.561  1.00 64.35  ? 73  PHE A CB  1 
ATOM   273  C  CG  . PHE A 1 45  ? -11.972 25.274  60.392  1.00 60.80  ? 73  PHE A CG  1 
ATOM   274  C  CD1 . PHE A 1 45  ? -11.296 24.390  59.575  1.00 57.13  ? 73  PHE A CD1 1 
ATOM   275  C  CD2 . PHE A 1 45  ? -11.898 26.627  60.098  1.00 61.63  ? 73  PHE A CD2 1 
ATOM   276  C  CE1 . PHE A 1 45  ? -10.563 24.845  58.490  1.00 55.34  ? 73  PHE A CE1 1 
ATOM   277  C  CE2 . PHE A 1 45  ? -11.171 27.081  59.007  1.00 58.76  ? 73  PHE A CE2 1 
ATOM   278  C  CZ  . PHE A 1 45  ? -10.503 26.188  58.206  1.00 55.97  ? 73  PHE A CZ  1 
ATOM   279  N  N   . LYS A 1 46  ? -11.429 25.515  64.358  1.00 66.52  ? 74  LYS A N   1 
ATOM   280  C  CA  . LYS A 1 46  ? -10.703 26.514  65.184  1.00 67.47  ? 74  LYS A CA  1 
ATOM   281  C  C   . LYS A 1 46  ? -9.531  25.850  65.917  1.00 65.01  ? 74  LYS A C   1 
ATOM   282  O  O   . LYS A 1 46  ? -8.567  26.556  66.201  1.00 63.44  ? 74  LYS A O   1 
ATOM   283  C  CB  . LYS A 1 46  ? -11.665 27.159  66.187  1.00 73.54  ? 74  LYS A CB  1 
ATOM   284  C  CG  . LYS A 1 46  ? -12.997 27.651  65.620  1.00 78.19  ? 74  LYS A CG  1 
ATOM   285  C  CD  . LYS A 1 46  ? -12.924 28.384  64.280  1.00 77.68  ? 74  LYS A CD  1 
ATOM   286  C  CE  . LYS A 1 46  ? -14.248 29.017  63.893  1.00 82.41  ? 74  LYS A CE  1 
ATOM   287  N  NZ  . LYS A 1 46  ? -14.066 30.299  63.171  1.00 82.70  ? 74  LYS A NZ  1 
ATOM   288  N  N   . GLU A 1 47  ? -9.595  24.542  66.181  1.00 64.65  ? 75  GLU A N   1 
ATOM   289  C  CA  . GLU A 1 47  ? -8.477  23.754  66.777  1.00 63.29  ? 75  GLU A CA  1 
ATOM   290  C  C   . GLU A 1 47  ? -7.320  23.593  65.764  1.00 58.30  ? 75  GLU A C   1 
ATOM   291  O  O   . GLU A 1 47  ? -6.214  23.152  66.174  1.00 54.85  ? 75  GLU A O   1 
ATOM   292  C  CB  . GLU A 1 47  ? -8.976  22.377  67.228  1.00 65.59  ? 75  GLU A CB  1 
ATOM   293  C  CG  . GLU A 1 47  ? -10.273 22.410  68.026  1.00 71.35  ? 75  GLU A CG  1 
ATOM   294  C  CD  . GLU A 1 47  ? -10.601 21.135  68.797  1.00 74.32  ? 75  GLU A CD  1 
ATOM   295  O  OE1 . GLU A 1 47  ? -11.713 21.051  69.388  1.00 79.39  ? 75  GLU A OE1 1 
ATOM   296  O  OE2 . GLU A 1 47  ? -9.739  20.234  68.829  1.00 73.02  ? 75  GLU A OE2 1 
ATOM   297  N  N   . LEU A 1 48  ? -7.572  23.871  64.475  1.00 56.95  ? 76  LEU A N   1 
ATOM   298  C  CA  . LEU A 1 48  ? -6.546  23.851  63.390  1.00 52.02  ? 76  LEU A CA  1 
ATOM   299  C  C   . LEU A 1 48  ? -5.932  25.239  63.272  1.00 50.84  ? 76  LEU A C   1 
ATOM   300  O  O   . LEU A 1 48  ? -6.681  26.233  63.226  1.00 53.72  ? 76  LEU A O   1 
ATOM   301  C  CB  . LEU A 1 48  ? -7.166  23.467  62.049  1.00 51.53  ? 76  LEU A CB  1 
ATOM   302  C  CG  . LEU A 1 48  ? -7.876  22.121  62.020  1.00 53.34  ? 76  LEU A CG  1 
ATOM   303  C  CD1 . LEU A 1 48  ? -8.420  21.859  60.620  1.00 53.80  ? 76  LEU A CD1 1 
ATOM   304  C  CD2 . LEU A 1 48  ? -6.942  21.002  62.474  1.00 51.04  ? 76  LEU A CD2 1 
ATOM   305  N  N   . THR A 1 49  ? -4.611  25.278  63.212  1.00 47.52  ? 77  THR A N   1 
ATOM   306  C  CA  . THR A 1 49  ? -3.805  26.518  63.224  1.00 46.52  ? 77  THR A CA  1 
ATOM   307  C  C   . THR A 1 49  ? -2.867  26.465  62.022  1.00 40.30  ? 77  THR A C   1 
ATOM   308  O  O   . THR A 1 49  ? -2.297  25.418  61.734  1.00 38.04  ? 77  THR A O   1 
ATOM   309  C  CB  . THR A 1 49  ? -3.070  26.613  64.562  1.00 48.63  ? 77  THR A CB  1 
ATOM   310  O  OG1 . THR A 1 49  ? -2.338  27.829  64.487  1.00 52.73  ? 77  THR A OG1 1 
ATOM   311  C  CG2 . THR A 1 49  ? -2.159  25.436  64.827  1.00 47.95  ? 77  THR A CG2 1 
ATOM   312  N  N   . PRO A 1 50  ? -2.683  27.566  61.269  1.00 37.58  ? 78  PRO A N   1 
ATOM   313  C  CA  . PRO A 1 50  ? -1.800  27.535  60.099  1.00 34.42  ? 78  PRO A CA  1 
ATOM   314  C  C   . PRO A 1 50  ? -0.309  27.590  60.454  1.00 31.46  ? 78  PRO A C   1 
ATOM   315  O  O   . PRO A 1 50  ? 0.058   28.401  61.288  1.00 32.95  ? 78  PRO A O   1 
ATOM   316  C  CB  . PRO A 1 50  ? -2.179  28.797  59.326  1.00 35.54  ? 78  PRO A CB  1 
ATOM   317  C  CG  . PRO A 1 50  ? -2.685  29.741  60.398  1.00 38.62  ? 78  PRO A CG  1 
ATOM   318  C  CD  . PRO A 1 50  ? -3.311  28.871  61.475  1.00 39.69  ? 78  PRO A CD  1 
ATOM   319  N  N   . ASN A 1 51  ? 0.511   26.787  59.790  1.00 28.57  ? 79  ASN A N   1 
ATOM   320  C  CA  . ASN A 1 51  ? 1.991   26.766  59.950  1.00 27.03  ? 79  ASN A CA  1 
ATOM   321  C  C   . ASN A 1 51  ? 2.613   27.732  58.926  1.00 26.26  ? 79  ASN A C   1 
ATOM   322  O  O   . ASN A 1 51  ? 2.432   27.510  57.708  1.00 25.28  ? 79  ASN A O   1 
ATOM   323  C  CB  . ASN A 1 51  ? 2.528   25.336  59.858  1.00 26.55  ? 79  ASN A CB  1 
ATOM   324  C  CG  . ASN A 1 51  ? 4.029   25.229  60.098  1.00 26.75  ? 79  ASN A CG  1 
ATOM   325  O  OD1 . ASN A 1 51  ? 4.787   26.027  59.593  1.00 27.46  ? 79  ASN A OD1 1 
ATOM   326  N  ND2 . ASN A 1 51  ? 4.472   24.216  60.826  1.00 26.14  ? 79  ASN A ND2 1 
ATOM   327  N  N   . TYR A 1 52  ? 3.307   28.782  59.387  1.00 25.70  ? 80  TYR A N   1 
ATOM   328  C  CA  . TYR A 1 52  ? 3.969   29.780  58.504  1.00 25.99  ? 80  TYR A CA  1 
ATOM   329  C  C   . TYR A 1 52  ? 5.497   29.716  58.642  1.00 25.47  ? 80  TYR A C   1 
ATOM   330  O  O   . TYR A 1 52  ? 6.190   30.733  58.440  1.00 25.64  ? 80  TYR A O   1 
ATOM   331  C  CB  . TYR A 1 52  ? 3.408   31.174  58.773  1.00 27.70  ? 80  TYR A CB  1 
ATOM   332  C  CG  . TYR A 1 52  ? 1.983   31.353  58.315  1.00 29.01  ? 80  TYR A CG  1 
ATOM   333  C  CD1 . TYR A 1 52  ? 1.657   31.278  56.953  1.00 28.83  ? 80  TYR A CD1 1 
ATOM   334  C  CD2 . TYR A 1 52  ? 0.959   31.607  59.215  1.00 30.89  ? 80  TYR A CD2 1 
ATOM   335  C  CE1 . TYR A 1 52  ? 0.353   31.427  56.512  1.00 29.83  ? 80  TYR A CE1 1 
ATOM   336  C  CE2 . TYR A 1 52  ? -0.351  31.766  58.781  1.00 33.34  ? 80  TYR A CE2 1 
ATOM   337  C  CZ  . TYR A 1 52  ? -0.657  31.634  57.425  1.00 31.95  ? 80  TYR A CZ  1 
ATOM   338  O  OH  . TYR A 1 52  ? -1.948  31.790  57.017  1.00 33.85  ? 80  TYR A OH  1 
ATOM   339  N  N   . ASN A 1 53  ? 6.015   28.537  58.978  1.00 24.51  ? 81  ASN A N   1 
ATOM   340  C  CA  . ASN A 1 53  ? 7.488   28.312  59.093  1.00 24.61  ? 81  ASN A CA  1 
ATOM   341  C  C   . ASN A 1 53  ? 8.138   28.656  57.759  1.00 24.77  ? 81  ASN A C   1 
ATOM   342  O  O   . ASN A 1 53  ? 7.829   27.999  56.771  1.00 23.98  ? 81  ASN A O   1 
ATOM   343  C  CB  . ASN A 1 53  ? 7.794   26.888  59.519  1.00 23.42  ? 81  ASN A CB  1 
ATOM   344  C  CG  . ASN A 1 53  ? 9.259   26.616  59.842  1.00 23.75  ? 81  ASN A CG  1 
ATOM   345  O  OD1 . ASN A 1 53  ? 10.133  27.336  59.361  1.00 24.05  ? 81  ASN A OD1 1 
ATOM   346  N  ND2 . ASN A 1 53  ? 9.522   25.608  60.674  1.00 23.99  ? 81  ASN A ND2 1 
ATOM   347  N  N   . PRO A 1 54  ? 9.030   29.671  57.681  1.00 26.51  ? 82  PRO A N   1 
ATOM   348  C  CA  . PRO A 1 54  ? 9.614   30.081  56.405  1.00 26.86  ? 82  PRO A CA  1 
ATOM   349  C  C   . PRO A 1 54  ? 10.494  28.969  55.834  1.00 26.34  ? 82  PRO A C   1 
ATOM   350  O  O   . PRO A 1 54  ? 10.783  29.031  54.659  1.00 26.87  ? 82  PRO A O   1 
ATOM   351  C  CB  . PRO A 1 54  ? 10.448  31.342  56.693  1.00 29.27  ? 82  PRO A CB  1 
ATOM   352  C  CG  . PRO A 1 54  ? 10.647  31.324  58.208  1.00 29.71  ? 82  PRO A CG  1 
ATOM   353  C  CD  . PRO A 1 54  ? 9.515   30.500  58.787  1.00 27.91  ? 82  PRO A CD  1 
ATOM   354  N  N   . ASP A 1 55  ? 10.844  27.952  56.613  1.00 25.10  ? 83  ASP A N   1 
ATOM   355  C  CA  . ASP A 1 55  ? 11.759  26.883  56.117  1.00 25.26  ? 83  ASP A CA  1 
ATOM   356  C  C   . ASP A 1 55  ? 11.000  25.597  55.720  1.00 22.90  ? 83  ASP A C   1 
ATOM   357  O  O   . ASP A 1 55  ? 11.637  24.541  55.652  1.00 23.01  ? 83  ASP A O   1 
ATOM   358  C  CB  . ASP A 1 55  ? 12.883  26.636  57.118  1.00 26.84  ? 83  ASP A CB  1 
ATOM   359  C  CG  . ASP A 1 55  ? 13.879  27.771  57.175  1.00 29.48  ? 83  ASP A CG  1 
ATOM   360  O  OD1 . ASP A 1 55  ? 14.297  28.247  56.081  1.00 30.25  ? 83  ASP A OD1 1 
ATOM   361  O  OD2 . ASP A 1 55  ? 14.203  28.217  58.314  1.00 31.37  ? 83  ASP A OD2 1 
ATOM   362  N  N   . ILE A 1 56  ? 9.676   25.656  55.580  1.00 21.87  ? 84  ILE A N   1 
ATOM   363  C  CA  . ILE A 1 56  ? 8.819   24.530  55.092  1.00 21.01  ? 84  ILE A CA  1 
ATOM   364  C  C   . ILE A 1 56  ? 8.195   24.985  53.791  1.00 20.58  ? 84  ILE A C   1 
ATOM   365  O  O   . ILE A 1 56  ? 7.631   26.092  53.775  1.00 20.76  ? 84  ILE A O   1 
ATOM   366  C  CB  . ILE A 1 56  ? 7.770   24.047  56.102  1.00 20.58  ? 84  ILE A CB  1 
ATOM   367  C  CG1 . ILE A 1 56  ? 8.457   23.658  57.409  1.00 21.58  ? 84  ILE A CG1 1 
ATOM   368  C  CG2 . ILE A 1 56  ? 6.999   22.874  55.517  1.00 19.27  ? 84  ILE A CG2 1 
ATOM   369  C  CD1 . ILE A 1 56  ? 7.555   23.207  58.510  1.00 22.41  ? 84  ILE A CD1 1 
ATOM   370  N  N   . ILE A 1 57  ? 8.291   24.162  52.744  1.00 20.87  ? 85  ILE A N   1 
ATOM   371  C  CA  . ILE A 1 57  ? 7.648   24.492  51.434  1.00 21.65  ? 85  ILE A CA  1 
ATOM   372  C  C   . ILE A 1 57  ? 6.274   23.843  51.485  1.00 20.71  ? 85  ILE A C   1 
ATOM   373  O  O   . ILE A 1 57  ? 6.245   22.634  51.752  1.00 19.50  ? 85  ILE A O   1 
ATOM   374  C  CB  . ILE A 1 57  ? 8.416   23.947  50.232  1.00 22.65  ? 85  ILE A CB  1 
ATOM   375  C  CG1 . ILE A 1 57  ? 9.843   24.476  50.202  1.00 24.35  ? 85  ILE A CG1 1 
ATOM   376  C  CG2 . ILE A 1 57  ? 7.655   24.249  48.942  1.00 22.82  ? 85  ILE A CG2 1 
ATOM   377  C  CD1 . ILE A 1 57  ? 9.885   25.961  50.256  1.00 27.44  ? 85  ILE A CD1 1 
ATOM   378  N  N   . PHE A 1 58  ? 5.212   24.619  51.274  1.00 20.81  ? 86  PHE A N   1 
ATOM   379  C  CA  . PHE A 1 58  ? 3.824   24.083  51.192  1.00 20.45  ? 86  PHE A CA  1 
ATOM   380  C  C   . PHE A 1 58  ? 3.367   24.090  49.738  1.00 20.88  ? 86  PHE A C   1 
ATOM   381  O  O   . PHE A 1 58  ? 3.324   25.145  49.163  1.00 21.64  ? 86  PHE A O   1 
ATOM   382  C  CB  . PHE A 1 58  ? 2.893   24.873  52.101  1.00 21.72  ? 86  PHE A CB  1 
ATOM   383  C  CG  . PHE A 1 58  ? 3.161   24.604  53.565  1.00 21.91  ? 86  PHE A CG  1 
ATOM   384  C  CD1 . PHE A 1 58  ? 2.520   23.569  54.217  1.00 21.73  ? 86  PHE A CD1 1 
ATOM   385  C  CD2 . PHE A 1 58  ? 4.057   25.390  54.284  1.00 23.18  ? 86  PHE A CD2 1 
ATOM   386  C  CE1 . PHE A 1 58  ? 2.758   23.316  55.565  1.00 23.01  ? 86  PHE A CE1 1 
ATOM   387  C  CE2 . PHE A 1 58  ? 4.283   25.145  55.637  1.00 22.37  ? 86  PHE A CE2 1 
ATOM   388  C  CZ  . PHE A 1 58  ? 3.633   24.123  56.280  1.00 22.81  ? 86  PHE A CZ  1 
ATOM   389  N  N   . LYS A 1 59  ? 3.031   22.928  49.181  1.00 20.55  ? 87  LYS A N   1 
ATOM   390  C  CA  . LYS A 1 59  ? 2.666   22.831  47.738  1.00 20.40  ? 87  LYS A CA  1 
ATOM   391  C  C   . LYS A 1 59  ? 1.484   23.759  47.493  1.00 21.88  ? 87  LYS A C   1 
ATOM   392  O  O   . LYS A 1 59  ? 1.521   24.541  46.527  1.00 23.42  ? 87  LYS A O   1 
ATOM   393  C  CB  . LYS A 1 59  ? 2.419   21.363  47.363  1.00 20.29  ? 87  LYS A CB  1 
ATOM   394  C  CG  . LYS A 1 59  ? 2.193   21.125  45.851  1.00 21.05  ? 87  LYS A CG  1 
ATOM   395  C  CD  . LYS A 1 59  ? 2.062   19.680  45.500  1.00 21.19  ? 87  LYS A CD  1 
ATOM   396  C  CE  . LYS A 1 59  ? 1.798   19.406  44.030  1.00 22.93  ? 87  LYS A CE  1 
ATOM   397  N  NZ  . LYS A 1 59  ? 1.567   17.954  43.828  1.00 23.70  ? 87  LYS A NZ  1 
ATOM   398  N  N   . ASP A 1 60  ? 0.420   23.625  48.274  1.00 22.70  ? 88  ASP A N   1 
ATOM   399  C  CA  . ASP A 1 60  ? -0.798  24.472  48.183  1.00 24.82  ? 88  ASP A CA  1 
ATOM   400  C  C   . ASP A 1 60  ? -1.285  24.550  46.729  1.00 25.94  ? 88  ASP A C   1 
ATOM   401  O  O   . ASP A 1 60  ? -1.754  25.620  46.325  1.00 26.54  ? 88  ASP A O   1 
ATOM   402  C  CB  . ASP A 1 60  ? -0.531  25.888  48.722  1.00 26.78  ? 88  ASP A CB  1 
ATOM   403  C  CG  . ASP A 1 60  ? -1.793  26.707  48.898  1.00 29.72  ? 88  ASP A CG  1 
ATOM   404  O  OD1 . ASP A 1 60  ? -2.867  26.119  49.142  1.00 30.92  ? 88  ASP A OD1 1 
ATOM   405  O  OD2 . ASP A 1 60  ? -1.695  27.943  48.774  1.00 33.66  ? 88  ASP A OD2 1 
ATOM   406  N  N   . GLU A 1 61  ? -1.235  23.436  46.001  1.00 26.08  ? 89  GLU A N   1 
ATOM   407  C  CA  . GLU A 1 61  ? -1.812  23.341  44.629  1.00 27.70  ? 89  GLU A CA  1 
ATOM   408  C  C   . GLU A 1 61  ? -3.302  23.742  44.685  1.00 30.23  ? 89  GLU A C   1 
ATOM   409  O  O   . GLU A 1 61  ? -3.847  24.227  43.620  1.00 32.63  ? 89  GLU A O   1 
ATOM   410  C  CB  . GLU A 1 61  ? -1.469  21.949  44.063  1.00 26.85  ? 89  GLU A CB  1 
ATOM   411  C  CG  . GLU A 1 61  ? -2.252  20.741  44.604  1.00 26.39  ? 89  GLU A CG  1 
ATOM   412  C  CD  . GLU A 1 61  ? -2.009  20.284  46.042  1.00 24.28  ? 89  GLU A CD  1 
ATOM   413  O  OE1 . GLU A 1 61  ? -1.109  20.845  46.688  1.00 24.27  ? 89  GLU A OE1 1 
ATOM   414  O  OE2 . GLU A 1 61  ? -2.704  19.355  46.513  1.00 24.00  ? 89  GLU A OE2 1 
ATOM   415  N  N   . GLU A 1 62  ? -3.964  23.570  45.838  1.00 30.65  ? 90  GLU A N   1 
ATOM   416  C  CA  . GLU A 1 62  ? -5.389  23.966  46.044  1.00 33.90  ? 90  GLU A CA  1 
ATOM   417  C  C   . GLU A 1 62  ? -5.557  25.493  45.894  1.00 35.89  ? 90  GLU A C   1 
ATOM   418  O  O   . GLU A 1 62  ? -6.666  25.946  45.535  1.00 38.15  ? 90  GLU A O   1 
ATOM   419  C  CB  . GLU A 1 62  ? -5.883  23.530  47.429  1.00 33.20  ? 90  GLU A CB  1 
ATOM   420  C  CG  . GLU A 1 62  ? -5.841  22.027  47.661  1.00 32.45  ? 90  GLU A CG  1 
ATOM   421  C  CD  . GLU A 1 62  ? -4.534  21.463  48.201  1.00 29.73  ? 90  GLU A CD  1 
ATOM   422  O  OE1 . GLU A 1 62  ? -3.481  22.113  48.038  1.00 29.16  ? 90  GLU A OE1 1 
ATOM   423  O  OE2 . GLU A 1 62  ? -4.556  20.383  48.777  1.00 29.99  ? 90  GLU A OE2 1 
ATOM   424  N  N   . ASN A 1 63  ? -4.513  26.271  46.195  1.00 36.09  ? 91  ASN A N   1 
ATOM   425  C  CA  . ASN A 1 63  ? -4.556  27.757  46.308  1.00 38.42  ? 91  ASN A CA  1 
ATOM   426  C  C   . ASN A 1 63  ? -5.560  28.167  47.393  1.00 37.24  ? 91  ASN A C   1 
ATOM   427  O  O   . ASN A 1 63  ? -6.255  29.163  47.203  1.00 38.98  ? 91  ASN A O   1 
ATOM   428  C  CB  . ASN A 1 63  ? -4.821  28.426  44.952  1.00 43.21  ? 91  ASN A CB  1 
ATOM   429  C  CG  . ASN A 1 63  ? -3.593  28.404  44.059  1.00 46.87  ? 91  ASN A CG  1 
ATOM   430  O  OD1 . ASN A 1 63  ? -2.494  28.784  44.486  1.00 49.75  ? 91  ASN A OD1 1 
ATOM   431  N  ND2 . ASN A 1 63  ? -3.769  27.993  42.806  1.00 50.92  ? 91  ASN A ND2 1 
ATOM   432  N  N   . THR A 1 64  ? -5.585  27.444  48.516  1.00 34.82  ? 92  THR A N   1 
ATOM   433  C  CA  . THR A 1 64  ? -6.478  27.726  49.675  1.00 34.91  ? 92  THR A CA  1 
ATOM   434  C  C   . THR A 1 64  ? -5.697  27.885  50.987  1.00 33.65  ? 92  THR A C   1 
ATOM   435  O  O   . THR A 1 64  ? -6.330  28.318  51.955  1.00 35.36  ? 92  THR A O   1 
ATOM   436  C  CB  . THR A 1 64  ? -7.483  26.592  49.902  1.00 34.73  ? 92  THR A CB  1 
ATOM   437  O  OG1 . THR A 1 64  ? -6.735  25.404  50.131  1.00 31.52  ? 92  THR A OG1 1 
ATOM   438  C  CG2 . THR A 1 64  ? -8.442  26.413  48.743  1.00 36.56  ? 92  THR A CG2 1 
ATOM   439  N  N   . GLY A 1 65  ? -4.425  27.495  51.022  1.00 31.20  ? 93  GLY A N   1 
ATOM   440  C  CA  . GLY A 1 65  ? -3.613  27.414  52.261  1.00 30.40  ? 93  GLY A CA  1 
ATOM   441  C  C   . GLY A 1 65  ? -3.989  26.225  53.150  1.00 29.85  ? 93  GLY A C   1 
ATOM   442  O  O   . GLY A 1 65  ? -3.526  26.174  54.311  1.00 29.20  ? 93  GLY A O   1 
ATOM   443  N  N   . ALA A 1 66  ? -4.782  25.257  52.660  1.00 30.11  ? 94  ALA A N   1 
ATOM   444  C  CA  . ALA A 1 66  ? -5.258  24.119  53.482  1.00 29.49  ? 94  ALA A CA  1 
ATOM   445  C  C   . ALA A 1 66  ? -4.058  23.281  53.938  1.00 27.05  ? 94  ALA A C   1 
ATOM   446  O  O   . ALA A 1 66  ? -4.052  22.775  55.090  1.00 27.54  ? 94  ALA A O   1 
ATOM   447  C  CB  . ALA A 1 66  ? -6.282  23.298  52.717  1.00 31.10  ? 94  ALA A CB  1 
ATOM   448  N  N   . ASP A 1 67  ? -3.047  23.159  53.085  1.00 24.84  ? 95  ASP A N   1 
ATOM   449  C  CA  . ASP A 1 67  ? -1.854  22.314  53.356  1.00 23.12  ? 95  ASP A CA  1 
ATOM   450  C  C   . ASP A 1 67  ? -1.152  22.794  54.639  1.00 23.12  ? 95  ASP A C   1 
ATOM   451  O  O   . ASP A 1 67  ? -0.521  21.961  55.288  1.00 21.82  ? 95  ASP A O   1 
ATOM   452  C  CB  . ASP A 1 67  ? -0.861  22.322  52.202  1.00 21.55  ? 95  ASP A CB  1 
ATOM   453  C  CG  . ASP A 1 67  ? -1.334  21.486  51.006  1.00 22.18  ? 95  ASP A CG  1 
ATOM   454  O  OD1 . ASP A 1 67  ? -2.256  20.643  51.177  1.00 21.90  ? 95  ASP A OD1 1 
ATOM   455  O  OD2 . ASP A 1 67  ? -0.784  21.715  49.937  1.00 21.51  ? 95  ASP A OD2 1 
ATOM   456  N  N   . ARG A 1 68  ? -1.255  24.091  54.937  1.00 24.78  ? 96  ARG A N   1 
ATOM   457  C  CA  . ARG A 1 68  ? -0.634  24.703  56.138  1.00 25.10  ? 96  ARG A CA  1 
ATOM   458  C  C   . ARG A 1 68  ? -1.422  24.366  57.400  1.00 26.81  ? 96  ARG A C   1 
ATOM   459  O  O   . ARG A 1 68  ? -0.839  24.612  58.506  1.00 26.81  ? 96  ARG A O   1 
ATOM   460  C  CB  . ARG A 1 68  ? -0.597  26.224  56.006  1.00 27.17  ? 96  ARG A CB  1 
ATOM   461  C  CG  . ARG A 1 68  ? 0.448   26.734  55.038  1.00 26.71  ? 96  ARG A CG  1 
ATOM   462  C  CD  . ARG A 1 68  ? 0.448   28.256  54.967  1.00 28.78  ? 96  ARG A CD  1 
ATOM   463  N  NE  . ARG A 1 68  ? 1.335   28.671  53.893  1.00 28.35  ? 96  ARG A NE  1 
ATOM   464  C  CZ  . ARG A 1 68  ? 2.662   28.707  53.986  1.00 29.38  ? 96  ARG A CZ  1 
ATOM   465  N  NH1 . ARG A 1 68  ? 3.284   28.435  55.140  1.00 27.86  ? 96  ARG A NH1 1 
ATOM   466  N  NH2 . ARG A 1 68  ? 3.362   29.031  52.905  1.00 29.29  ? 96  ARG A NH2 1 
ATOM   467  N  N   . LEU A 1 69  ? -2.720  24.026  57.287  1.00 28.12  ? 97  LEU A N   1 
ATOM   468  C  CA  . LEU A 1 69  ? -3.592  23.859  58.474  1.00 30.06  ? 97  LEU A CA  1 
ATOM   469  C  C   . LEU A 1 69  ? -3.374  22.466  59.064  1.00 28.92  ? 97  LEU A C   1 
ATOM   470  O  O   . LEU A 1 69  ? -3.371  21.480  58.330  1.00 27.88  ? 97  LEU A O   1 
ATOM   471  C  CB  . LEU A 1 69  ? -5.057  24.099  58.101  1.00 32.92  ? 97  LEU A CB  1 
ATOM   472  C  CG  . LEU A 1 69  ? -5.472  25.541  57.874  1.00 35.31  ? 97  LEU A CG  1 
ATOM   473  C  CD1 . LEU A 1 69  ? -6.943  25.620  57.481  1.00 38.15  ? 97  LEU A CD1 1 
ATOM   474  C  CD2 . LEU A 1 69  ? -5.223  26.357  59.124  1.00 36.86  ? 97  LEU A CD2 1 
ATOM   475  N  N   . MET A 1 70  ? -3.204  22.374  60.383  1.00 29.33  ? 98  MET A N   1 
ATOM   476  C  CA  . MET A 1 70  ? -2.932  21.102  61.093  1.00 28.78  ? 98  MET A CA  1 
ATOM   477  C  C   . MET A 1 70  ? -3.125  21.307  62.598  1.00 30.35  ? 98  MET A C   1 
ATOM   478  O  O   . MET A 1 70  ? -3.312  22.466  63.015  1.00 31.16  ? 98  MET A O   1 
ATOM   479  C  CB  . MET A 1 70  ? -1.502  20.633  60.815  1.00 28.20  ? 98  MET A CB  1 
ATOM   480  C  CG  . MET A 1 70  ? -0.419  21.581  61.313  1.00 28.44  ? 98  MET A CG  1 
ATOM   481  S  SD  . MET A 1 70  ? 1.166   21.248  60.542  1.00 28.76  ? 98  MET A SD  1 
ATOM   482  C  CE  . MET A 1 70  ? 0.779   21.578  58.808  1.00 27.42  ? 98  MET A CE  1 
ATOM   483  N  N   . THR A 1 71  ? -3.092  20.237  63.394  1.00 30.26  ? 99  THR A N   1 
ATOM   484  C  CA  . THR A 1 71  ? -3.199  20.351  64.872  1.00 32.46  ? 99  THR A CA  1 
ATOM   485  C  C   . THR A 1 71  ? -1.903  20.886  65.484  1.00 31.68  ? 99  THR A C   1 
ATOM   486  O  O   . THR A 1 71  ? -0.838  20.881  64.827  1.00 28.66  ? 99  THR A O   1 
ATOM   487  C  CB  . THR A 1 71  ? -3.547  19.003  65.508  1.00 33.33  ? 99  THR A CB  1 
ATOM   488  O  OG1 . THR A 1 71  ? -2.473  18.125  65.193  1.00 30.99  ? 99  THR A OG1 1 
ATOM   489  C  CG2 . THR A 1 71  ? -4.881  18.464  65.039  1.00 34.72  ? 99  THR A CG2 1 
ATOM   490  N  N   . GLN A 1 72  ? -1.981  21.296  66.759  1.00 34.60  ? 100 GLN A N   1 
ATOM   491  C  CA  . GLN A 1 72  ? -0.818  21.833  67.500  1.00 35.22  ? 100 GLN A CA  1 
ATOM   492  C  C   . GLN A 1 72  ? 0.332   20.802  67.517  1.00 33.66  ? 100 GLN A C   1 
ATOM   493  O  O   . GLN A 1 72  ? 1.507   21.187  67.199  1.00 33.83  ? 100 GLN A O   1 
ATOM   494  C  CB  . GLN A 1 72  ? -1.200  22.217  68.938  1.00 38.57  ? 100 GLN A CB  1 
ATOM   495  C  CG  . GLN A 1 72  ? -0.049  22.909  69.646  1.00 39.60  ? 100 GLN A CG  1 
ATOM   496  C  CD  . GLN A 1 72  ? 0.292   24.203  68.932  1.00 38.99  ? 100 GLN A CD  1 
ATOM   497  O  OE1 . GLN A 1 72  ? -0.611  25.054  68.805  1.00 41.10  ? 100 GLN A OE1 1 
ATOM   498  N  NE2 . GLN A 1 72  ? 1.563   24.339  68.435  1.00 36.82  ? 100 GLN A NE2 1 
ATOM   499  N  N   . ARG A 1 73  ? 0.013   19.523  67.807  1.00 34.63  ? 101 ARG A N   1 
ATOM   500  C  CA  . ARG A 1 73  ? 1.028   18.422  67.875  1.00 33.49  ? 101 ARG A CA  1 
ATOM   501  C  C   . ARG A 1 73  ? 1.645   18.212  66.485  1.00 30.93  ? 101 ARG A C   1 
ATOM   502  O  O   . ARG A 1 73  ? 2.864   18.009  66.362  1.00 29.61  ? 101 ARG A O   1 
ATOM   503  C  CB  . ARG A 1 73  ? 0.412   17.135  68.441  1.00 34.73  ? 101 ARG A CB  1 
ATOM   504  C  CG  . ARG A 1 73  ? 1.394   15.989  68.622  1.00 33.82  ? 101 ARG A CG  1 
ATOM   505  C  CD  . ARG A 1 73  ? 0.762   14.832  69.388  1.00 35.63  ? 101 ARG A CD  1 
ATOM   506  N  NE  . ARG A 1 73  ? 1.717   13.748  69.558  1.00 34.76  ? 101 ARG A NE  1 
ATOM   507  C  CZ  . ARG A 1 73  ? 2.616   13.661  70.529  1.00 36.10  ? 101 ARG A CZ  1 
ATOM   508  N  NH1 . ARG A 1 73  ? 2.670   14.608  71.452  1.00 37.47  ? 101 ARG A NH1 1 
ATOM   509  N  NH2 . ARG A 1 73  ? 3.453   12.633  70.571  1.00 35.59  ? 101 ARG A NH2 1 
ATOM   510  N  N   . CYS A 1 74  ? 0.824   18.230  65.442  1.00 31.26  ? 102 CYS A N   1 
ATOM   511  C  CA  . CYS A 1 74  ? 1.304   18.074  64.048  1.00 28.70  ? 102 CYS A CA  1 
ATOM   512  C  C   . CYS A 1 74  ? 2.309   19.189  63.746  1.00 28.10  ? 102 CYS A C   1 
ATOM   513  O  O   . CYS A 1 74  ? 3.434   18.883  63.316  1.00 26.23  ? 102 CYS A O   1 
ATOM   514  C  CB  . CYS A 1 74  ? 0.139   18.107  63.085  1.00 29.31  ? 102 CYS A CB  1 
ATOM   515  S  SG  . CYS A 1 74  ? 0.604   17.401  61.482  1.00 27.07  ? 102 CYS A SG  1 
ATOM   516  N  N   . LYS A 1 75  ? 1.942   20.432  64.067  1.00 30.23  ? 103 LYS A N   1 
ATOM   517  C  CA  . LYS A 1 75  ? 2.841   21.619  63.884  1.00 30.65  ? 103 LYS A CA  1 
ATOM   518  C  C   . LYS A 1 75  ? 4.184   21.365  64.564  1.00 29.08  ? 103 LYS A C   1 
ATOM   519  O  O   . LYS A 1 75  ? 5.247   21.635  63.952  1.00 26.09  ? 103 LYS A O   1 
ATOM   520  C  CB  . LYS A 1 75  ? 2.321   22.872  64.581  1.00 34.64  ? 103 LYS A CB  1 
ATOM   521  C  CG  . LYS A 1 75  ? 1.337   23.735  63.831  1.00 37.79  ? 103 LYS A CG  1 
ATOM   522  C  CD  . LYS A 1 75  ? 1.189   25.084  64.525  1.00 40.27  ? 103 LYS A CD  1 
ATOM   523  C  CE  . LYS A 1 75  ? 0.879   26.173  63.528  1.00 42.20  ? 103 LYS A CE  1 
ATOM   524  N  NZ  . LYS A 1 75  ? 0.374   27.391  64.197  1.00 44.57  ? 103 LYS A NZ  1 
ATOM   525  N  N   . ASP A 1 76  ? 4.119   20.911  65.813  1.00 29.62  ? 104 ASP A N   1 
ATOM   526  C  CA  . ASP A 1 76  ? 5.323   20.784  66.664  1.00 30.62  ? 104 ASP A CA  1 
ATOM   527  C  C   . ASP A 1 76  ? 6.267   19.749  66.038  1.00 28.96  ? 104 ASP A C   1 
ATOM   528  O  O   . ASP A 1 76  ? 7.491   20.049  65.852  1.00 29.18  ? 104 ASP A O   1 
ATOM   529  C  CB  . ASP A 1 76  ? 4.945   20.518  68.132  1.00 33.90  ? 104 ASP A CB  1 
ATOM   530  C  CG  . ASP A 1 76  ? 4.104   21.615  68.823  1.00 35.51  ? 104 ASP A CG  1 
ATOM   531  O  OD1 . ASP A 1 76  ? 4.031   22.771  68.330  1.00 35.20  ? 104 ASP A OD1 1 
ATOM   532  O  OD2 . ASP A 1 76  ? 3.481   21.287  69.842  1.00 39.26  ? 104 ASP A OD2 1 
ATOM   533  N  N   . LYS A 1 77  ? 5.738   18.592  65.627  1.00 27.37  ? 105 LYS A N   1 
ATOM   534  C  CA  . LYS A 1 77  ? 6.628   17.542  65.077  1.00 26.77  ? 105 LYS A CA  1 
ATOM   535  C  C   . LYS A 1 77  ? 7.170   18.046  63.714  1.00 25.17  ? 105 LYS A C   1 
ATOM   536  O  O   . LYS A 1 77  ? 8.399   17.881  63.427  1.00 26.61  ? 105 LYS A O   1 
ATOM   537  C  CB  . LYS A 1 77  ? 5.911   16.183  64.964  1.00 26.87  ? 105 LYS A CB  1 
ATOM   538  C  CG  . LYS A 1 77  ? 5.338   15.601  66.247  1.00 28.31  ? 105 LYS A CG  1 
ATOM   539  C  CD  . LYS A 1 77  ? 6.109   15.899  67.512  1.00 29.79  ? 105 LYS A CD  1 
ATOM   540  C  CE  . LYS A 1 77  ? 5.563   15.112  68.682  1.00 31.65  ? 105 LYS A CE  1 
ATOM   541  N  NZ  . LYS A 1 77  ? 6.263   15.468  69.937  1.00 33.49  ? 105 LYS A NZ  1 
ATOM   542  N  N   . LEU A 1 78  ? 6.260   18.694  62.946  1.00 24.39  ? 106 LEU A N   1 
ATOM   543  C  CA  . LEU A 1 78  ? 6.627   19.208  61.596  1.00 23.19  ? 106 LEU A CA  1 
ATOM   544  C  C   . LEU A 1 78  ? 7.762   20.236  61.751  1.00 23.85  ? 106 LEU A C   1 
ATOM   545  O  O   . LEU A 1 78  ? 8.785   20.108  61.040  1.00 23.78  ? 106 LEU A O   1 
ATOM   546  C  CB  . LEU A 1 78  ? 5.408   19.776  60.859  1.00 22.99  ? 106 LEU A CB  1 
ATOM   547  C  CG  . LEU A 1 78  ? 5.629   20.012  59.365  1.00 22.32  ? 106 LEU A CG  1 
ATOM   548  C  CD1 . LEU A 1 78  ? 5.643   18.697  58.579  1.00 22.69  ? 106 LEU A CD1 1 
ATOM   549  C  CD2 . LEU A 1 78  ? 4.583   20.954  58.841  1.00 23.27  ? 106 LEU A CD2 1 
ATOM   550  N  N   . ASN A 1 79  ? 7.679   21.131  62.745  1.00 24.44  ? 107 ASN A N   1 
ATOM   551  C  CA  . ASN A 1 79  ? 8.688   22.205  62.926  1.00 25.53  ? 107 ASN A CA  1 
ATOM   552  C  C   . ASN A 1 79  ? 10.010  21.508  63.295  1.00 26.39  ? 107 ASN A C   1 
ATOM   553  O  O   . ASN A 1 79  ? 11.075  21.920  62.803  1.00 27.33  ? 107 ASN A O   1 
ATOM   554  C  CB  . ASN A 1 79  ? 8.197   23.285  63.901  1.00 26.75  ? 107 ASN A CB  1 
ATOM   555  C  CG  . ASN A 1 79  ? 7.161   24.223  63.311  1.00 26.93  ? 107 ASN A CG  1 
ATOM   556  O  OD1 . ASN A 1 79  ? 7.072   24.412  62.094  1.00 27.38  ? 107 ASN A OD1 1 
ATOM   557  N  ND2 . ASN A 1 79  ? 6.281   24.749  64.149  1.00 28.05  ? 107 ASN A ND2 1 
ATOM   558  N  N   . ALA A 1 80  ? 9.965   20.468  64.144  1.00 27.65  ? 108 ALA A N   1 
ATOM   559  C  CA  . ALA A 1 80  ? 11.202  19.746  64.521  1.00 27.99  ? 108 ALA A CA  1 
ATOM   560  C  C   . ALA A 1 80  ? 11.839  19.143  63.258  1.00 26.22  ? 108 ALA A C   1 
ATOM   561  O  O   . ALA A 1 80  ? 13.064  19.240  63.056  1.00 26.83  ? 108 ALA A O   1 
ATOM   562  C  CB  . ALA A 1 80  ? 10.916  18.736  65.611  1.00 29.50  ? 108 ALA A CB  1 
ATOM   563  N  N   . LEU A 1 81  ? 11.031  18.512  62.419  1.00 25.84  ? 109 LEU A N   1 
ATOM   564  C  CA  . LEU A 1 81  ? 11.523  17.820  61.205  1.00 25.77  ? 109 LEU A CA  1 
ATOM   565  C  C   . LEU A 1 81  ? 12.117  18.843  60.208  1.00 25.19  ? 109 LEU A C   1 
ATOM   566  O  O   . LEU A 1 81  ? 13.122  18.508  59.521  1.00 26.61  ? 109 LEU A O   1 
ATOM   567  C  CB  . LEU A 1 81  ? 10.341  17.043  60.595  1.00 24.75  ? 109 LEU A CB  1 
ATOM   568  C  CG  . LEU A 1 81  ? 10.658  16.344  59.276  1.00 25.01  ? 109 LEU A CG  1 
ATOM   569  C  CD1 . LEU A 1 81  ? 11.819  15.371  59.427  1.00 25.78  ? 109 LEU A CD1 1 
ATOM   570  C  CD2 . LEU A 1 81  ? 9.428   15.633  58.754  1.00 24.62  ? 109 LEU A CD2 1 
ATOM   571  N  N   . ALA A 1 82  ? 11.586  20.077  60.185  1.00 25.03  ? 110 ALA A N   1 
ATOM   572  C  CA  . ALA A 1 82  ? 12.095  21.149  59.295  1.00 24.58  ? 110 ALA A CA  1 
ATOM   573  C  C   . ALA A 1 82  ? 13.571  21.367  59.600  1.00 25.81  ? 110 ALA A C   1 
ATOM   574  O  O   . ALA A 1 82  ? 14.356  21.546  58.653  1.00 24.71  ? 110 ALA A O   1 
ATOM   575  C  CB  . ALA A 1 82  ? 11.346  22.445  59.467  1.00 24.42  ? 110 ALA A CB  1 
ATOM   576  N  N   . ILE A 1 83  ? 13.907  21.396  60.908  1.00 26.95  ? 111 ILE A N   1 
ATOM   577  C  CA  . ILE A 1 83  ? 15.297  21.654  61.364  1.00 28.49  ? 111 ILE A CA  1 
ATOM   578  C  C   . ILE A 1 83  ? 16.204  20.482  60.921  1.00 28.87  ? 111 ILE A C   1 
ATOM   579  O  O   . ILE A 1 83  ? 17.322  20.715  60.365  1.00 30.63  ? 111 ILE A O   1 
ATOM   580  C  CB  . ILE A 1 83  ? 15.326  21.884  62.893  1.00 29.66  ? 111 ILE A CB  1 
ATOM   581  C  CG1 . ILE A 1 83  ? 14.541  23.156  63.253  1.00 29.93  ? 111 ILE A CG1 1 
ATOM   582  C  CG2 . ILE A 1 83  ? 16.762  21.899  63.369  1.00 32.18  ? 111 ILE A CG2 1 
ATOM   583  C  CD1 . ILE A 1 83  ? 14.371  23.439  64.754  1.00 31.82  ? 111 ILE A CD1 1 
ATOM   584  N  N   . SER A 1 84  ? 15.747  19.247  61.158  1.00 28.45  ? 112 SER A N   1 
ATOM   585  C  CA  . SER A 1 84  ? 16.594  18.043  60.893  1.00 29.94  ? 112 SER A CA  1 
ATOM   586  C  C   . SER A 1 84  ? 16.780  17.823  59.376  1.00 27.90  ? 112 SER A C   1 
ATOM   587  O  O   . SER A 1 84  ? 17.864  17.405  58.958  1.00 28.46  ? 112 SER A O   1 
ATOM   588  C  CB  . SER A 1 84  ? 16.109  16.802  61.609  1.00 30.17  ? 112 SER A CB  1 
ATOM   589  O  OG  . SER A 1 84  ? 14.831  16.360  61.172  1.00 28.76  ? 112 SER A OG  1 
ATOM   590  N  N   . VAL A 1 85  ? 15.817  18.210  58.556  1.00 26.96  ? 113 VAL A N   1 
ATOM   591  C  CA  . VAL A 1 85  ? 15.997  18.122  57.075  1.00 27.24  ? 113 VAL A CA  1 
ATOM   592  C  C   . VAL A 1 85  ? 17.113  19.075  56.619  1.00 28.93  ? 113 VAL A C   1 
ATOM   593  O  O   . VAL A 1 85  ? 17.982  18.641  55.835  1.00 30.03  ? 113 VAL A O   1 
ATOM   594  C  CB  . VAL A 1 85  ? 14.662  18.373  56.359  1.00 25.82  ? 113 VAL A CB  1 
ATOM   595  C  CG1 . VAL A 1 85  ? 14.830  18.592  54.862  1.00 25.76  ? 113 VAL A CG1 1 
ATOM   596  C  CG2 . VAL A 1 85  ? 13.705  17.228  56.654  1.00 25.49  ? 113 VAL A CG2 1 
ATOM   597  N  N   . MET A 1 86  ? 17.125  20.326  57.091  1.00 30.29  ? 114 MET A N   1 
ATOM   598  C  CA  . MET A 1 86  ? 18.125  21.337  56.628  1.00 32.38  ? 114 MET A CA  1 
ATOM   599  C  C   . MET A 1 86  ? 19.522  20.871  57.063  1.00 34.81  ? 114 MET A C   1 
ATOM   600  O  O   . MET A 1 86  ? 20.504  21.079  56.307  1.00 35.92  ? 114 MET A O   1 
ATOM   601  C  CB  . MET A 1 86  ? 17.802  22.726  57.180  1.00 33.00  ? 114 MET A CB  1 
ATOM   602  C  CG  . MET A 1 86  ? 16.568  23.328  56.536  1.00 31.48  ? 114 MET A CG  1 
ATOM   603  S  SD  . MET A 1 86  ? 16.207  25.020  57.043  1.00 32.64  ? 114 MET A SD  1 
ATOM   604  C  CE  . MET A 1 86  ? 15.822  24.792  58.785  1.00 33.43  ? 114 MET A CE  1 
ATOM   605  N  N   . ASN A 1 87  ? 19.585  20.209  58.215  1.00 35.18  ? 115 ASN A N   1 
ATOM   606  C  CA  A ASN A 1 87  ? 20.851  19.688  58.791  0.50 37.77  ? 115 ASN A CA  1 
ATOM   607  C  CA  B ASN A 1 87  ? 20.842  19.678  58.801  0.50 37.97  ? 115 ASN A CA  1 
ATOM   608  C  C   . ASN A 1 87  ? 21.321  18.492  57.950  1.00 38.57  ? 115 ASN A C   1 
ATOM   609  O  O   . ASN A 1 87  ? 22.534  18.417  57.674  1.00 39.95  ? 115 ASN A O   1 
ATOM   610  C  CB  A ASN A 1 87  ? 20.694  19.366  60.280  0.50 38.08  ? 115 ASN A CB  1 
ATOM   611  C  CB  B ASN A 1 87  ? 20.659  19.335  60.283  0.50 38.51  ? 115 ASN A CB  1 
ATOM   612  C  CG  A ASN A 1 87  ? 21.933  18.742  60.890  0.50 40.89  ? 115 ASN A CG  1 
ATOM   613  C  CG  B ASN A 1 87  ? 20.677  20.561  61.176  0.50 39.45  ? 115 ASN A CG  1 
ATOM   614  O  OD1 A ASN A 1 87  ? 23.038  19.286  60.784  0.50 43.41  ? 115 ASN A OD1 1 
ATOM   615  O  OD1 B ASN A 1 87  ? 21.092  21.635  60.748  0.50 40.95  ? 115 ASN A OD1 1 
ATOM   616  N  ND2 A ASN A 1 87  ? 21.753  17.601  61.536  0.50 40.41  ? 115 ASN A ND2 1 
ATOM   617  N  ND2 B ASN A 1 87  ? 20.256  20.410  62.432  0.50 40.08  ? 115 ASN A ND2 1 
ATOM   618  N  N   . GLN A 1 88  ? 20.394  17.623  57.529  1.00 36.42  ? 116 GLN A N   1 
ATOM   619  C  CA  . GLN A 1 88  ? 20.734  16.391  56.763  1.00 37.21  ? 116 GLN A CA  1 
ATOM   620  C  C   . GLN A 1 88  ? 21.329  16.733  55.387  1.00 37.79  ? 116 GLN A C   1 
ATOM   621  O  O   . GLN A 1 88  ? 22.366  16.151  55.026  1.00 41.02  ? 116 GLN A O   1 
ATOM   622  C  CB  . GLN A 1 88  ? 19.491  15.524  56.595  1.00 35.08  ? 116 GLN A CB  1 
ATOM   623  C  CG  . GLN A 1 88  ? 19.808  14.117  56.105  1.00 36.20  ? 116 GLN A CG  1 
ATOM   624  C  CD  . GLN A 1 88  ? 20.506  13.258  57.131  1.00 38.74  ? 116 GLN A CD  1 
ATOM   625  O  OE1 . GLN A 1 88  ? 20.510  13.566  58.327  1.00 39.20  ? 116 GLN A OE1 1 
ATOM   626  N  NE2 . GLN A 1 88  ? 21.147  12.190  56.665  1.00 40.10  ? 116 GLN A NE2 1 
ATOM   627  N  N   . TRP A 1 89  ? 20.695  17.617  54.627  1.00 36.48  ? 117 TRP A N   1 
ATOM   628  C  CA  . TRP A 1 89  ? 21.109  17.958  53.240  1.00 37.16  ? 117 TRP A CA  1 
ATOM   629  C  C   . TRP A 1 89  ? 21.217  19.470  53.092  1.00 38.72  ? 117 TRP A C   1 
ATOM   630  O  O   . TRP A 1 89  ? 20.202  20.162  53.059  1.00 37.25  ? 117 TRP A O   1 
ATOM   631  C  CB  . TRP A 1 89  ? 20.117  17.379  52.230  1.00 34.93  ? 117 TRP A CB  1 
ATOM   632  C  CG  . TRP A 1 89  ? 19.846  15.908  52.317  1.00 33.92  ? 117 TRP A CG  1 
ATOM   633  C  CD1 . TRP A 1 89  ? 20.625  14.902  51.823  1.00 35.52  ? 117 TRP A CD1 1 
ATOM   634  C  CD2 . TRP A 1 89  ? 18.679  15.272  52.874  1.00 30.91  ? 117 TRP A CD2 1 
ATOM   635  N  NE1 . TRP A 1 89  ? 20.041  13.689  52.068  1.00 34.09  ? 117 TRP A NE1 1 
ATOM   636  C  CE2 . TRP A 1 89  ? 18.844  13.882  52.701  1.00 31.34  ? 117 TRP A CE2 1 
ATOM   637  C  CE3 . TRP A 1 89  ? 17.502  15.736  53.484  1.00 28.54  ? 117 TRP A CE3 1 
ATOM   638  C  CZ2 . TRP A 1 89  ? 17.886  12.958  53.125  1.00 29.64  ? 117 TRP A CZ2 1 
ATOM   639  C  CZ3 . TRP A 1 89  ? 16.586  14.822  53.943  1.00 26.65  ? 117 TRP A CZ3 1 
ATOM   640  C  CH2 . TRP A 1 89  ? 16.745  13.459  53.714  1.00 27.28  ? 117 TRP A CH2 1 
ATOM   641  N  N   . PRO A 1 90  ? 22.444  20.033  52.989  1.00 42.46  ? 118 PRO A N   1 
ATOM   642  C  CA  . PRO A 1 90  ? 22.631  21.464  52.755  1.00 43.71  ? 118 PRO A CA  1 
ATOM   643  C  C   . PRO A 1 90  ? 21.801  22.027  51.592  1.00 42.48  ? 118 PRO A C   1 
ATOM   644  O  O   . PRO A 1 90  ? 21.903  21.531  50.478  1.00 43.08  ? 118 PRO A O   1 
ATOM   645  C  CB  . PRO A 1 90  ? 24.130  21.612  52.425  1.00 47.51  ? 118 PRO A CB  1 
ATOM   646  C  CG  . PRO A 1 90  ? 24.788  20.399  53.067  1.00 48.68  ? 118 PRO A CG  1 
ATOM   647  C  CD  . PRO A 1 90  ? 23.724  19.315  53.107  1.00 45.69  ? 118 PRO A CD  1 
ATOM   648  N  N   . GLY A 1 91  ? 21.015  23.068  51.888  1.00 40.72  ? 119 GLY A N   1 
ATOM   649  C  CA  . GLY A 1 91  ? 20.258  23.827  50.880  1.00 39.89  ? 119 GLY A CA  1 
ATOM   650  C  C   . GLY A 1 91  ? 18.884  23.216  50.635  1.00 36.67  ? 119 GLY A C   1 
ATOM   651  O  O   . GLY A 1 91  ? 18.099  23.828  49.907  1.00 36.69  ? 119 GLY A O   1 
ATOM   652  N  N   . VAL A 1 92  ? 18.588  22.072  51.234  1.00 34.42  ? 120 VAL A N   1 
ATOM   653  C  CA  . VAL A 1 92  ? 17.298  21.361  51.018  1.00 31.87  ? 120 VAL A CA  1 
ATOM   654  C  C   . VAL A 1 92  ? 16.364  21.672  52.175  1.00 30.47  ? 120 VAL A C   1 
ATOM   655  O  O   . VAL A 1 92  ? 16.833  21.807  53.344  1.00 30.67  ? 120 VAL A O   1 
ATOM   656  C  CB  . VAL A 1 92  ? 17.494  19.847  50.842  1.00 31.84  ? 120 VAL A CB  1 
ATOM   657  C  CG1 . VAL A 1 92  ? 16.151  19.113  50.802  1.00 29.68  ? 120 VAL A CG1 1 
ATOM   658  C  CG2 . VAL A 1 92  ? 18.317  19.548  49.598  1.00 33.83  ? 120 VAL A CG2 1 
ATOM   659  N  N   . LYS A 1 93  ? 15.069  21.726  51.877  1.00 28.44  ? 121 LYS A N   1 
ATOM   660  C  CA  . LYS A 1 93  ? 14.021  21.963  52.904  1.00 26.86  ? 121 LYS A CA  1 
ATOM   661  C  C   . LYS A 1 93  ? 12.975  20.863  52.910  1.00 24.86  ? 121 LYS A C   1 
ATOM   662  O  O   . LYS A 1 93  ? 12.775  20.189  51.863  1.00 22.62  ? 121 LYS A O   1 
ATOM   663  C  CB  . LYS A 1 93  ? 13.396  23.339  52.675  1.00 28.00  ? 121 LYS A CB  1 
ATOM   664  C  CG  . LYS A 1 93  ? 14.349  24.445  53.106  1.00 30.90  ? 121 LYS A CG  1 
ATOM   665  C  CD  . LYS A 1 93  ? 14.048  25.755  52.588  1.00 33.46  ? 121 LYS A CD  1 
ATOM   666  C  CE  . LYS A 1 93  ? 15.094  26.764  53.010  1.00 36.28  ? 121 LYS A CE  1 
ATOM   667  N  NZ  . LYS A 1 93  ? 14.533  28.120  52.888  1.00 38.28  ? 121 LYS A NZ  1 
ATOM   668  N  N   . LEU A 1 94  ? 12.298  20.744  54.049  1.00 23.39  ? 122 LEU A N   1 
ATOM   669  C  CA  . LEU A 1 94  ? 11.055  19.934  54.163  1.00 21.76  ? 122 LEU A CA  1 
ATOM   670  C  C   . LEU A 1 94  ? 9.965   20.521  53.252  1.00 20.72  ? 122 LEU A C   1 
ATOM   671  O  O   . LEU A 1 94  ? 9.843   21.767  53.166  1.00 20.38  ? 122 LEU A O   1 
ATOM   672  C  CB  . LEU A 1 94  ? 10.633  19.917  55.625  1.00 21.41  ? 122 LEU A CB  1 
ATOM   673  C  CG  . LEU A 1 94  ? 9.325   19.213  55.971  1.00 20.73  ? 122 LEU A CG  1 
ATOM   674  C  CD1 . LEU A 1 94  ? 9.393   17.710  55.668  1.00 20.51  ? 122 LEU A CD1 1 
ATOM   675  C  CD2 . LEU A 1 94  ? 9.021   19.466  57.449  1.00 21.29  ? 122 LEU A CD2 1 
ATOM   676  N  N   . ARG A 1 95  ? 9.175   19.656  52.610  1.00 20.15  ? 123 ARG A N   1 
ATOM   677  C  CA  . ARG A 1 95  ? 8.041   20.076  51.722  1.00 19.02  ? 123 ARG A CA  1 
ATOM   678  C  C   . ARG A 1 95  ? 6.789   19.266  52.075  1.00 18.41  ? 123 ARG A C   1 
ATOM   679  O  O   . ARG A 1 95  ? 6.910   18.057  52.290  1.00 18.19  ? 123 ARG A O   1 
ATOM   680  C  CB  . ARG A 1 95  ? 8.449   19.902  50.264  1.00 19.03  ? 123 ARG A CB  1 
ATOM   681  C  CG  . ARG A 1 95  ? 7.334   20.135  49.247  1.00 19.21  ? 123 ARG A CG  1 
ATOM   682  C  CD  . ARG A 1 95  ? 7.948   20.360  47.885  1.00 19.80  ? 123 ARG A CD  1 
ATOM   683  N  NE  . ARG A 1 95  ? 6.941   20.362  46.826  1.00 20.36  ? 123 ARG A NE  1 
ATOM   684  C  CZ  . ARG A 1 95  ? 6.413   19.259  46.284  1.00 20.10  ? 123 ARG A CZ  1 
ATOM   685  N  NH1 . ARG A 1 95  ? 6.816   18.054  46.641  1.00 19.45  ? 123 ARG A NH1 1 
ATOM   686  N  NH2 . ARG A 1 95  ? 5.513   19.379  45.304  1.00 21.57  ? 123 ARG A NH2 1 
ATOM   687  N  N   . VAL A 1 96  ? 5.668   19.949  52.254  1.00 18.58  ? 124 VAL A N   1 
ATOM   688  C  CA  . VAL A 1 96  ? 4.332   19.348  52.506  1.00 18.24  ? 124 VAL A CA  1 
ATOM   689  C  C   . VAL A 1 96  ? 3.506   19.395  51.212  1.00 18.59  ? 124 VAL A C   1 
ATOM   690  O  O   . VAL A 1 96  ? 3.316   20.487  50.680  1.00 19.67  ? 124 VAL A O   1 
ATOM   691  C  CB  . VAL A 1 96  ? 3.635   20.100  53.635  1.00 18.89  ? 124 VAL A CB  1 
ATOM   692  C  CG1 . VAL A 1 96  ? 2.214   19.609  53.852  1.00 19.40  ? 124 VAL A CG1 1 
ATOM   693  C  CG2 . VAL A 1 96  ? 4.422   19.926  54.915  1.00 19.74  ? 124 VAL A CG2 1 
ATOM   694  N  N   . THR A 1 97  ? 2.967   18.271  50.772  1.00 18.76  ? 125 THR A N   1 
ATOM   695  C  CA  . THR A 1 97  ? 2.098   18.216  49.563  1.00 19.61  ? 125 THR A CA  1 
ATOM   696  C  C   . THR A 1 97  ? 0.626   18.255  50.023  1.00 20.10  ? 125 THR A C   1 
ATOM   697  O  O   . THR A 1 97  ? -0.245  18.761  49.290  1.00 20.83  ? 125 THR A O   1 
ATOM   698  C  CB  . THR A 1 97  ? 2.416   16.971  48.719  1.00 19.70  ? 125 THR A CB  1 
ATOM   699  O  OG1 . THR A 1 97  ? 2.234   15.772  49.474  1.00 19.83  ? 125 THR A OG1 1 
ATOM   700  C  CG2 . THR A 1 97  ? 3.824   16.959  48.176  1.00 19.90  ? 125 THR A CG2 1 
ATOM   701  N  N   . GLU A 1 98  ? 0.357   17.694  51.207  1.00 20.05  ? 126 GLU A N   1 
ATOM   702  C  CA  . GLU A 1 98  ? -0.991  17.633  51.820  1.00 21.23  ? 126 GLU A CA  1 
ATOM   703  C  C   . GLU A 1 98  ? -0.864  17.800  53.346  1.00 21.52  ? 126 GLU A C   1 
ATOM   704  O  O   . GLU A 1 98  ? -0.071  17.065  53.959  1.00 21.33  ? 126 GLU A O   1 
ATOM   705  C  CB  . GLU A 1 98  ? -1.616  16.269  51.565  1.00 22.88  ? 126 GLU A CB  1 
ATOM   706  C  CG  . GLU A 1 98  ? -2.131  16.122  50.131  1.00 24.68  ? 126 GLU A CG  1 
ATOM   707  C  CD  . GLU A 1 98  ? -3.347  16.998  49.845  1.00 26.48  ? 126 GLU A CD  1 
ATOM   708  O  OE1 . GLU A 1 98  ? -4.443  16.618  50.234  1.00 31.54  ? 126 GLU A OE1 1 
ATOM   709  O  OE2 . GLU A 1 98  ? -3.224  18.091  49.277  1.00 27.83  ? 126 GLU A OE2 1 
ATOM   710  N  N   . GLY A 1 99  ? -1.706  18.627  53.925  1.00 22.18  ? 127 GLY A N   1 
ATOM   711  C  CA  . GLY A 1 99  ? -1.895  18.719  55.388  1.00 22.79  ? 127 GLY A CA  1 
ATOM   712  C  C   . GLY A 1 99  ? -3.336  18.389  55.706  1.00 24.86  ? 127 GLY A C   1 
ATOM   713  O  O   . GLY A 1 99  ? -3.792  17.268  55.371  1.00 25.69  ? 127 GLY A O   1 
ATOM   714  N  N   . TRP A 1 100 ? -4.075  19.346  56.231  1.00 26.12  ? 128 TRP A N   1 
ATOM   715  C  CA  . TRP A 1 100 ? -5.530  19.194  56.361  1.00 28.54  ? 128 TRP A CA  1 
ATOM   716  C  C   . TRP A 1 100 ? -6.114  19.094  54.950  1.00 30.10  ? 128 TRP A C   1 
ATOM   717  O  O   . TRP A 1 100 ? -5.633  19.818  54.051  1.00 30.36  ? 128 TRP A O   1 
ATOM   718  C  CB  . TRP A 1 100 ? -6.112  20.329  57.163  1.00 29.86  ? 128 TRP A CB  1 
ATOM   719  C  CG  . TRP A 1 100 ? -7.602  20.294  57.238  1.00 32.30  ? 128 TRP A CG  1 
ATOM   720  C  CD1 . TRP A 1 100 ? -8.370  19.425  57.957  1.00 34.32  ? 128 TRP A CD1 1 
ATOM   721  C  CD2 . TRP A 1 100 ? -8.506  21.190  56.583  1.00 34.47  ? 128 TRP A CD2 1 
ATOM   722  N  NE1 . TRP A 1 100 ? -9.697  19.717  57.796  1.00 36.77  ? 128 TRP A NE1 1 
ATOM   723  C  CE2 . TRP A 1 100 ? -9.814  20.778  56.934  1.00 37.38  ? 128 TRP A CE2 1 
ATOM   724  C  CE3 . TRP A 1 100 ? -8.347  22.262  55.698  1.00 34.28  ? 128 TRP A CE3 1 
ATOM   725  C  CZ2 . TRP A 1 100 ? -10.951 21.438  56.456  1.00 40.28  ? 128 TRP A CZ2 1 
ATOM   726  C  CZ3 . TRP A 1 100 ? -9.469  22.916  55.236  1.00 37.11  ? 128 TRP A CZ3 1 
ATOM   727  C  CH2 . TRP A 1 100 ? -10.755 22.500  55.601  1.00 39.97  ? 128 TRP A CH2 1 
ATOM   728  N  N   . ASP A 1 101 ? -7.059  18.179  54.741  1.00 31.49  ? 129 ASP A N   1 
ATOM   729  C  CA  . ASP A 1 101 ? -7.628  17.974  53.383  1.00 33.06  ? 129 ASP A CA  1 
ATOM   730  C  C   . ASP A 1 101 ? -9.154  18.138  53.426  1.00 36.28  ? 129 ASP A C   1 
ATOM   731  O  O   . ASP A 1 101 ? -9.835  17.514  54.274  1.00 37.41  ? 129 ASP A O   1 
ATOM   732  C  CB  . ASP A 1 101 ? -7.152  16.655  52.767  1.00 32.57  ? 129 ASP A CB  1 
ATOM   733  C  CG  . ASP A 1 101 ? -7.720  16.496  51.364  1.00 34.64  ? 129 ASP A CG  1 
ATOM   734  O  OD1 . ASP A 1 101 ? -7.637  17.528  50.582  1.00 34.69  ? 129 ASP A OD1 1 
ATOM   735  O  OD2 . ASP A 1 101 ? -8.341  15.423  51.099  1.00 35.32  ? 129 ASP A OD2 1 
ATOM   736  N  N   . GLU A 1 102 ? -9.681  18.943  52.503  1.00 38.67  ? 130 GLU A N   1 
ATOM   737  C  CA  . GLU A 1 102 ? -11.139 19.072  52.258  1.00 42.92  ? 130 GLU A CA  1 
ATOM   738  C  C   . GLU A 1 102 ? -11.511 18.576  50.836  1.00 44.33  ? 130 GLU A C   1 
ATOM   739  O  O   . GLU A 1 102 ? -12.691 18.729  50.470  1.00 48.16  ? 130 GLU A O   1 
ATOM   740  C  CB  . GLU A 1 102 ? -11.554 20.522  52.541  1.00 44.55  ? 130 GLU A CB  1 
ATOM   741  C  CG  . GLU A 1 102 ? -10.687 21.551  51.834  1.00 43.03  ? 130 GLU A CG  1 
ATOM   742  C  CD  . GLU A 1 102 ? -11.104 23.014  51.901  1.00 45.02  ? 130 GLU A CD  1 
ATOM   743  O  OE1 . GLU A 1 102 ? -12.211 23.312  52.406  1.00 47.02  ? 130 GLU A OE1 1 
ATOM   744  O  OE2 . GLU A 1 102 ? -10.293 23.865  51.429  1.00 43.64  ? 130 GLU A OE2 1 
ATOM   745  N  N   . ASP A 1 103 ? -10.587 17.985  50.063  1.00 43.60  ? 131 ASP A N   1 
ATOM   746  C  CA  . ASP A 1 103 ? -10.828 17.562  48.642  1.00 45.79  ? 131 ASP A CA  1 
ATOM   747  C  C   . ASP A 1 103 ? -11.222 16.074  48.521  1.00 46.47  ? 131 ASP A C   1 
ATOM   748  O  O   . ASP A 1 103 ? -11.529 15.629  47.371  1.00 47.09  ? 131 ASP A O   1 
ATOM   749  C  CB  . ASP A 1 103 ? -9.589  17.771  47.755  1.00 44.37  ? 131 ASP A CB  1 
ATOM   750  C  CG  . ASP A 1 103 ? -8.980  19.164  47.779  1.00 43.89  ? 131 ASP A CG  1 
ATOM   751  O  OD1 . ASP A 1 103 ? -9.714  20.131  47.441  1.00 43.82  ? 131 ASP A OD1 1 
ATOM   752  O  OD2 . ASP A 1 103 ? -7.749  19.261  48.121  1.00 41.89  ? 131 ASP A OD2 1 
ATOM   753  N  N   . GLY A 1 104 ? -11.213 15.319  49.630  1.00 46.28  ? 132 GLY A N   1 
ATOM   754  C  CA  . GLY A 1 104 ? -11.453 13.859  49.653  1.00 46.05  ? 132 GLY A CA  1 
ATOM   755  C  C   . GLY A 1 104 ? -10.370 13.085  48.911  1.00 44.16  ? 132 GLY A C   1 
ATOM   756  O  O   . GLY A 1 104 ? -10.684 12.004  48.322  1.00 45.45  ? 132 GLY A O   1 
ATOM   757  N  N   . HIS A 1 105 ? -9.127  13.565  48.955  1.00 41.28  ? 133 HIS A N   1 
ATOM   758  C  CA  . HIS A 1 105 ? -7.969  13.015  48.204  1.00 40.34  ? 133 HIS A CA  1 
ATOM   759  C  C   . HIS A 1 105 ? -7.186  11.988  49.041  1.00 39.02  ? 133 HIS A C   1 
ATOM   760  O  O   . HIS A 1 105 ? -5.981  11.794  48.772  1.00 38.17  ? 133 HIS A O   1 
ATOM   761  C  CB  . HIS A 1 105 ? -7.104  14.182  47.684  1.00 39.68  ? 133 HIS A CB  1 
ATOM   762  C  CG  . HIS A 1 105 ? -7.550  14.695  46.348  1.00 42.04  ? 133 HIS A CG  1 
ATOM   763  N  ND1 . HIS A 1 105 ? -6.749  15.520  45.554  1.00 41.96  ? 133 HIS A ND1 1 
ATOM   764  C  CD2 . HIS A 1 105 ? -8.676  14.457  45.634  1.00 44.74  ? 133 HIS A CD2 1 
ATOM   765  C  CE1 . HIS A 1 105 ? -7.393  15.764  44.414  1.00 44.28  ? 133 HIS A CE1 1 
ATOM   766  N  NE2 . HIS A 1 105 ? -8.574  15.122  44.441  1.00 44.49  ? 133 HIS A NE2 1 
ATOM   767  N  N   . HIS A 1 106 ? -7.837  11.310  49.986  1.00 40.39  ? 134 HIS A N   1 
ATOM   768  C  CA  . HIS A 1 106 ? -7.168  10.358  50.907  1.00 40.34  ? 134 HIS A CA  1 
ATOM   769  C  C   . HIS A 1 106 ? -8.053  9.146   51.150  1.00 43.00  ? 134 HIS A C   1 
ATOM   770  O  O   . HIS A 1 106 ? -9.140  9.088   50.535  1.00 45.35  ? 134 HIS A O   1 
ATOM   771  C  CB  . HIS A 1 106 ? -6.803  11.073  52.213  1.00 38.79  ? 134 HIS A CB  1 
ATOM   772  C  CG  . HIS A 1 106 ? -5.835  12.164  51.960  1.00 37.04  ? 134 HIS A CG  1 
ATOM   773  N  ND1 . HIS A 1 106 ? -4.496  11.917  51.760  1.00 36.93  ? 134 HIS A ND1 1 
ATOM   774  C  CD2 . HIS A 1 106 ? -6.017  13.486  51.804  1.00 37.42  ? 134 HIS A CD2 1 
ATOM   775  C  CE1 . HIS A 1 106 ? -3.866  13.056  51.544  1.00 36.06  ? 134 HIS A CE1 1 
ATOM   776  N  NE2 . HIS A 1 106 ? -4.782  14.053  51.580  1.00 36.66  ? 134 HIS A NE2 1 
ATOM   777  N  N   . SER A 1 107 ? -7.605  8.237   52.029  1.00 43.31  ? 135 SER A N   1 
ATOM   778  C  CA  . SER A 1 107 ? -8.407  7.074   52.493  1.00 46.54  ? 135 SER A CA  1 
ATOM   779  C  C   . SER A 1 107 ? -9.701  7.605   53.127  1.00 49.13  ? 135 SER A C   1 
ATOM   780  O  O   . SER A 1 107 ? -9.757  8.816   53.464  1.00 48.10  ? 135 SER A O   1 
ATOM   781  C  CB  . SER A 1 107 ? -7.619  6.170   53.429  1.00 46.18  ? 135 SER A CB  1 
ATOM   782  O  OG  . SER A 1 107 ? -6.974  6.921   54.452  1.00 45.68  ? 135 SER A OG  1 
ATOM   783  N  N   . GLU A 1 108 ? -10.690 6.729   53.311  1.00 50.55  ? 136 GLU A N   1 
ATOM   784  C  CA  . GLU A 1 108 ? -12.095 7.092   53.628  1.00 53.43  ? 136 GLU A CA  1 
ATOM   785  C  C   . GLU A 1 108 ? -12.210 7.804   54.984  1.00 52.41  ? 136 GLU A C   1 
ATOM   786  O  O   . GLU A 1 108 ? -13.181 8.611   55.141  1.00 55.34  ? 136 GLU A O   1 
ATOM   787  C  CB  . GLU A 1 108 ? -12.953 5.834   53.647  1.00 56.75  ? 136 GLU A CB  1 
ATOM   788  C  CG  . GLU A 1 108 ? -14.426 6.134   53.674  1.00 61.68  ? 136 GLU A CG  1 
ATOM   789  C  CD  . GLU A 1 108 ? -15.245 4.875   53.842  1.00 65.94  ? 136 GLU A CD  1 
ATOM   790  O  OE1 . GLU A 1 108 ? -15.086 3.963   53.008  1.00 66.95  ? 136 GLU A OE1 1 
ATOM   791  O  OE2 . GLU A 1 108 ? -15.998 4.793   54.833  1.00 70.30  ? 136 GLU A OE2 1 
ATOM   792  N  N   . GLU A 1 109 ? -11.353 7.460   55.949  1.00 48.58  ? 137 GLU A N   1 
ATOM   793  C  CA  . GLU A 1 109 ? -11.319 8.138   57.276  1.00 48.04  ? 137 GLU A CA  1 
ATOM   794  C  C   . GLU A 1 109 ? -9.879  8.551   57.574  1.00 43.45  ? 137 GLU A C   1 
ATOM   795  O  O   . GLU A 1 109 ? -9.309  8.142   58.611  1.00 42.98  ? 137 GLU A O   1 
ATOM   796  C  CB  . GLU A 1 109 ? -11.897 7.238   58.357  1.00 50.72  ? 137 GLU A CB  1 
ATOM   797  C  CG  . GLU A 1 109 ? -13.413 7.235   58.354  1.00 55.18  ? 137 GLU A CG  1 
ATOM   798  C  CD  . GLU A 1 109 ? -14.026 6.321   59.399  1.00 58.49  ? 137 GLU A CD  1 
ATOM   799  O  OE1 . GLU A 1 109 ? -13.250 5.569   60.033  1.00 57.63  ? 137 GLU A OE1 1 
ATOM   800  O  OE2 . GLU A 1 109 ? -15.269 6.365   59.580  1.00 62.04  ? 137 GLU A OE2 1 
ATOM   801  N  N   . SER A 1 110 ? -9.313  9.311   56.658  1.00 39.35  ? 138 SER A N   1 
ATOM   802  C  CA  . SER A 1 110 ? -7.907  9.756   56.706  1.00 35.59  ? 138 SER A CA  1 
ATOM   803  C  C   . SER A 1 110 ? -7.714  10.671  57.928  1.00 35.08  ? 138 SER A C   1 
ATOM   804  O  O   . SER A 1 110 ? -8.572  11.546  58.154  1.00 35.76  ? 138 SER A O   1 
ATOM   805  C  CB  . SER A 1 110 ? -7.586  10.473  55.449  1.00 33.79  ? 138 SER A CB  1 
ATOM   806  O  OG  . SER A 1 110 ? -6.265  10.929  55.459  1.00 30.32  ? 138 SER A OG  1 
ATOM   807  N  N   . LEU A 1 111 ? -6.628  10.502  58.667  1.00 33.64  ? 139 LEU A N   1 
ATOM   808  C  CA  . LEU A 1 111 ? -6.207  11.529  59.664  1.00 33.31  ? 139 LEU A CA  1 
ATOM   809  C  C   . LEU A 1 111 ? -5.979  12.891  58.985  1.00 31.60  ? 139 LEU A C   1 
ATOM   810  O  O   . LEU A 1 111 ? -6.021  13.892  59.715  1.00 31.59  ? 139 LEU A O   1 
ATOM   811  C  CB  . LEU A 1 111 ? -4.978  11.026  60.427  1.00 32.47  ? 139 LEU A CB  1 
ATOM   812  C  CG  . LEU A 1 111 ? -5.271  9.880   61.393  1.00 34.75  ? 139 LEU A CG  1 
ATOM   813  C  CD1 . LEU A 1 111 ? -4.057  9.570   62.254  1.00 34.36  ? 139 LEU A CD1 1 
ATOM   814  C  CD2 . LEU A 1 111 ? -6.462  10.204  62.267  1.00 37.72  ? 139 LEU A CD2 1 
ATOM   815  N  N   . HIS A 1 112 ? -5.854  12.982  57.653  1.00 29.47  ? 140 HIS A N   1 
ATOM   816  C  CA  . HIS A 1 112 ? -5.733  14.300  56.982  1.00 29.00  ? 140 HIS A CA  1 
ATOM   817  C  C   . HIS A 1 112 ? -7.023  15.098  57.194  1.00 30.87  ? 140 HIS A C   1 
ATOM   818  O  O   . HIS A 1 112 ? -6.933  16.320  57.288  1.00 30.07  ? 140 HIS A O   1 
ATOM   819  C  CB  . HIS A 1 112 ? -5.393  14.192  55.481  1.00 27.65  ? 140 HIS A CB  1 
ATOM   820  C  CG  . HIS A 1 112 ? -4.027  13.668  55.179  1.00 25.86  ? 140 HIS A CG  1 
ATOM   821  N  ND1 . HIS A 1 112 ? -2.914  14.500  54.985  1.00 24.43  ? 140 HIS A ND1 1 
ATOM   822  C  CD2 . HIS A 1 112 ? -3.621  12.400  54.951  1.00 25.96  ? 140 HIS A CD2 1 
ATOM   823  C  CE1 . HIS A 1 112 ? -1.877  13.725  54.687  1.00 23.16  ? 140 HIS A CE1 1 
ATOM   824  N  NE2 . HIS A 1 112 ? -2.320  12.410  54.606  1.00 23.96  ? 140 HIS A NE2 1 
ATOM   825  N  N   . TYR A 1 113 ? -8.172  14.437  57.283  1.00 32.92  ? 141 TYR A N   1 
ATOM   826  C  CA  . TYR A 1 113 ? -9.489  15.104  57.343  1.00 36.56  ? 141 TYR A CA  1 
ATOM   827  C  C   . TYR A 1 113 ? -9.648  15.840  58.684  1.00 38.31  ? 141 TYR A C   1 
ATOM   828  O  O   . TYR A 1 113 ? -10.548 16.705  58.789  1.00 40.04  ? 141 TYR A O   1 
ATOM   829  C  CB  . TYR A 1 113 ? -10.592 14.085  57.056  1.00 39.73  ? 141 TYR A CB  1 
ATOM   830  C  CG  . TYR A 1 113 ? -10.511 13.415  55.699  1.00 39.70  ? 141 TYR A CG  1 
ATOM   831  C  CD1 . TYR A 1 113 ? -9.868  14.014  54.619  1.00 38.66  ? 141 TYR A CD1 1 
ATOM   832  C  CD2 . TYR A 1 113 ? -11.095 12.180  55.477  1.00 41.95  ? 141 TYR A CD2 1 
ATOM   833  C  CE1 . TYR A 1 113 ? -9.794  13.399  53.370  1.00 38.90  ? 141 TYR A CE1 1 
ATOM   834  C  CE2 . TYR A 1 113 ? -11.060 11.565  54.228  1.00 42.39  ? 141 TYR A CE2 1 
ATOM   835  C  CZ  . TYR A 1 113 ? -10.393 12.166  53.166  1.00 40.70  ? 141 TYR A CZ  1 
ATOM   836  O  OH  . TYR A 1 113 ? -10.347 11.559  51.926  1.00 40.43  ? 141 TYR A OH  1 
ATOM   837  N  N   . GLU A 1 114 ? -8.824  15.532  59.687  1.00 38.21  ? 142 GLU A N   1 
ATOM   838  C  CA  . GLU A 1 114 ? -8.890  16.235  61.001  1.00 40.93  ? 142 GLU A CA  1 
ATOM   839  C  C   . GLU A 1 114 ? -7.541  16.885  61.328  1.00 38.49  ? 142 GLU A C   1 
ATOM   840  O  O   . GLU A 1 114 ? -7.334  17.230  62.506  1.00 39.50  ? 142 GLU A O   1 
ATOM   841  C  CB  . GLU A 1 114 ? -9.398  15.318  62.117  1.00 44.26  ? 142 GLU A CB  1 
ATOM   842  C  CG  . GLU A 1 114 ? -8.653  14.013  62.308  1.00 44.02  ? 142 GLU A CG  1 
ATOM   843  C  CD  . GLU A 1 114 ? -9.224  13.214  63.472  1.00 48.22  ? 142 GLU A CD  1 
ATOM   844  O  OE1 . GLU A 1 114 ? -9.252  13.761  64.599  1.00 50.80  ? 142 GLU A OE1 1 
ATOM   845  O  OE2 . GLU A 1 114 ? -9.692  12.079  63.264  1.00 50.33  ? 142 GLU A OE2 1 
ATOM   846  N  N   . GLY A 1 115 ? -6.705  17.120  60.317  1.00 35.38  ? 143 GLY A N   1 
ATOM   847  C  CA  . GLY A 1 115 ? -5.503  17.956  60.464  1.00 33.95  ? 143 GLY A CA  1 
ATOM   848  C  C   . GLY A 1 115 ? -4.384  17.270  61.226  1.00 32.93  ? 143 GLY A C   1 
ATOM   849  O  O   . GLY A 1 115 ? -3.478  17.987  61.707  1.00 32.51  ? 143 GLY A O   1 
ATOM   850  N  N   . ARG A 1 116 ? -4.365  15.940  61.263  1.00 32.98  ? 144 ARG A N   1 
ATOM   851  C  CA  . ARG A 1 116 ? -3.414  15.155  62.089  1.00 32.25  ? 144 ARG A CA  1 
ATOM   852  C  C   . ARG A 1 116 ? -2.398  14.439  61.199  1.00 29.14  ? 144 ARG A C   1 
ATOM   853  O  O   . ARG A 1 116 ? -1.677  13.598  61.700  1.00 28.41  ? 144 ARG A O   1 
ATOM   854  C  CB  . ARG A 1 116 ? -4.174  14.171  62.979  1.00 35.28  ? 144 ARG A CB  1 
ATOM   855  C  CG  . ARG A 1 116 ? -4.853  14.837  64.164  1.00 39.09  ? 144 ARG A CG  1 
ATOM   856  C  CD  . ARG A 1 116 ? -5.813  13.907  64.887  1.00 43.09  ? 144 ARG A CD  1 
ATOM   857  N  NE  . ARG A 1 116 ? -5.207  12.635  65.273  1.00 43.66  ? 144 ARG A NE  1 
ATOM   858  C  CZ  . ARG A 1 116 ? -5.890  11.534  65.550  1.00 46.56  ? 144 ARG A CZ  1 
ATOM   859  N  NH1 . ARG A 1 116 ? -7.213  11.516  65.484  1.00 48.49  ? 144 ARG A NH1 1 
ATOM   860  N  NH2 . ARG A 1 116 ? -5.240  10.444  65.902  1.00 48.32  ? 144 ARG A NH2 1 
ATOM   861  N  N   . ALA A 1 117 ? -2.341  14.734  59.903  1.00 27.49  ? 145 ALA A N   1 
ATOM   862  C  CA  . ALA A 1 117 ? -1.363  14.070  59.030  1.00 25.65  ? 145 ALA A CA  1 
ATOM   863  C  C   . ALA A 1 117 ? -0.829  15.038  57.985  1.00 24.17  ? 145 ALA A C   1 
ATOM   864  O  O   . ALA A 1 117 ? -1.496  16.004  57.599  1.00 24.37  ? 145 ALA A O   1 
ATOM   865  C  CB  . ALA A 1 117 ? -1.954  12.845  58.356  1.00 26.15  ? 145 ALA A CB  1 
ATOM   866  N  N   . VAL A 1 118 ? 0.389   14.757  57.561  1.00 23.35  ? 146 VAL A N   1 
ATOM   867  C  CA  . VAL A 1 118 ? 1.056   15.497  56.469  1.00 22.97  ? 146 VAL A CA  1 
ATOM   868  C  C   . VAL A 1 118 ? 1.633   14.458  55.522  1.00 21.66  ? 146 VAL A C   1 
ATOM   869  O  O   . VAL A 1 118 ? 2.138   13.398  55.989  1.00 20.70  ? 146 VAL A O   1 
ATOM   870  C  CB  . VAL A 1 118 ? 2.122   16.474  56.999  1.00 23.70  ? 146 VAL A CB  1 
ATOM   871  C  CG1 . VAL A 1 118 ? 1.476   17.707  57.612  1.00 25.05  ? 146 VAL A CG1 1 
ATOM   872  C  CG2 . VAL A 1 118 ? 3.031   15.800  58.002  1.00 24.42  ? 146 VAL A CG2 1 
ATOM   873  N  N   . ASP A 1 119 ? 1.507   14.708  54.213  1.00 19.76  ? 147 ASP A N   1 
ATOM   874  C  CA  . ASP A 1 119 ? 2.361   13.991  53.252  1.00 19.44  ? 147 ASP A CA  1 
ATOM   875  C  C   . ASP A 1 119 ? 3.535   14.909  52.945  1.00 18.25  ? 147 ASP A C   1 
ATOM   876  O  O   . ASP A 1 119 ? 3.283   16.097  52.676  1.00 19.75  ? 147 ASP A O   1 
ATOM   877  C  CB  . ASP A 1 119 ? 1.562   13.554  52.027  1.00 20.30  ? 147 ASP A CB  1 
ATOM   878  C  CG  . ASP A 1 119 ? 0.429   12.592  52.406  1.00 21.31  ? 147 ASP A CG  1 
ATOM   879  O  OD1 . ASP A 1 119 ? 0.637   11.705  53.369  1.00 21.05  ? 147 ASP A OD1 1 
ATOM   880  O  OD2 . ASP A 1 119 ? -0.688  12.748  51.797  1.00 21.03  ? 147 ASP A OD2 1 
ATOM   881  N  N   . ILE A 1 120 ? 4.732   14.346  52.884  1.00 18.07  ? 148 ILE A N   1 
ATOM   882  C  CA  . ILE A 1 120 ? 5.971   15.143  52.777  1.00 18.41  ? 148 ILE A CA  1 
ATOM   883  C  C   . ILE A 1 120 ? 6.926   14.565  51.751  1.00 18.08  ? 148 ILE A C   1 
ATOM   884  O  O   . ILE A 1 120 ? 6.858   13.355  51.454  1.00 19.18  ? 148 ILE A O   1 
ATOM   885  C  CB  . ILE A 1 120 ? 6.659   15.249  54.158  1.00 18.63  ? 148 ILE A CB  1 
ATOM   886  C  CG1 . ILE A 1 120 ? 7.096   13.890  54.707  1.00 19.58  ? 148 ILE A CG1 1 
ATOM   887  C  CG2 . ILE A 1 120 ? 5.720   15.974  55.092  1.00 19.34  ? 148 ILE A CG2 1 
ATOM   888  C  CD1 . ILE A 1 120 ? 7.914   13.989  56.010  1.00 19.56  ? 148 ILE A CD1 1 
ATOM   889  N  N   . THR A 1 121 ? 7.809   15.437  51.279  1.00 18.25  ? 149 THR A N   1 
ATOM   890  C  CA  . THR A 1 121 ? 8.954   15.188  50.388  1.00 19.23  ? 149 THR A CA  1 
ATOM   891  C  C   . THR A 1 121 ? 10.043  16.139  50.826  1.00 20.58  ? 149 THR A C   1 
ATOM   892  O  O   . THR A 1 121 ? 9.794   16.934  51.728  1.00 21.82  ? 149 THR A O   1 
ATOM   893  C  CB  . THR A 1 121 ? 8.576   15.460  48.915  1.00 19.56  ? 149 THR A CB  1 
ATOM   894  O  OG1 . THR A 1 121 ? 8.660   16.865  48.627  1.00 19.87  ? 149 THR A OG1 1 
ATOM   895  C  CG2 . THR A 1 121 ? 7.197   14.931  48.570  1.00 19.46  ? 149 THR A CG2 1 
ATOM   896  N  N   . THR A 1 122 ? 11.209  16.039  50.210  1.00 21.98  ? 150 THR A N   1 
ATOM   897  C  CA  . THR A 1 122 ? 12.225  17.092  50.230  1.00 22.69  ? 150 THR A CA  1 
ATOM   898  C  C   . THR A 1 122 ? 11.867  18.145  49.174  1.00 24.11  ? 150 THR A C   1 
ATOM   899  O  O   . THR A 1 122 ? 11.138  17.803  48.204  1.00 23.32  ? 150 THR A O   1 
ATOM   900  C  CB  . THR A 1 122 ? 13.605  16.465  50.018  1.00 24.55  ? 150 THR A CB  1 
ATOM   901  O  OG1 . THR A 1 122 ? 13.653  15.682  48.826  1.00 26.04  ? 150 THR A OG1 1 
ATOM   902  C  CG2 . THR A 1 122 ? 13.963  15.551  51.161  1.00 24.32  ? 150 THR A CG2 1 
ATOM   903  N  N   . SER A 1 123 ? 12.414  19.352  49.332  1.00 24.07  ? 151 SER A N   1 
ATOM   904  C  CA  . SER A 1 123 ? 12.193  20.511  48.443  1.00 24.81  ? 151 SER A CA  1 
ATOM   905  C  C   . SER A 1 123 ? 12.650  20.185  47.017  1.00 26.19  ? 151 SER A C   1 
ATOM   906  O  O   . SER A 1 123 ? 12.069  20.738  46.083  1.00 26.10  ? 151 SER A O   1 
ATOM   907  C  CB  . SER A 1 123 ? 12.865  21.738  48.995  1.00 24.96  ? 151 SER A CB  1 
ATOM   908  O  OG  . SER A 1 123 ? 14.273  21.560  49.052  1.00 26.51  ? 151 SER A OG  1 
ATOM   909  N  N   . ASP A 1 124 ? 13.660  19.333  46.855  1.00 27.69  ? 152 ASP A N   1 
ATOM   910  C  CA  . ASP A 1 124 ? 14.244  18.999  45.532  1.00 30.03  ? 152 ASP A CA  1 
ATOM   911  C  C   . ASP A 1 124 ? 13.488  17.831  44.864  1.00 30.09  ? 152 ASP A C   1 
ATOM   912  O  O   . ASP A 1 124 ? 13.890  17.443  43.743  1.00 30.94  ? 152 ASP A O   1 
ATOM   913  C  CB  . ASP A 1 124 ? 15.743  18.728  45.687  1.00 31.95  ? 152 ASP A CB  1 
ATOM   914  C  CG  . ASP A 1 124 ? 16.079  17.534  46.567  1.00 31.82  ? 152 ASP A CG  1 
ATOM   915  O  OD1 . ASP A 1 124 ? 15.154  16.907  47.107  1.00 30.32  ? 152 ASP A OD1 1 
ATOM   916  O  OD2 . ASP A 1 124 ? 17.272  17.215  46.676  1.00 34.05  ? 152 ASP A OD2 1 
ATOM   917  N  N   . ARG A 1 125 ? 12.475  17.264  45.526  1.00 29.05  ? 153 ARG A N   1 
ATOM   918  C  CA  . ARG A 1 125 ? 11.685  16.099  45.042  1.00 30.89  ? 153 ARG A CA  1 
ATOM   919  C  C   . ARG A 1 125 ? 12.622  14.981  44.558  1.00 32.78  ? 153 ARG A C   1 
ATOM   920  O  O   . ARG A 1 125 ? 12.298  14.289  43.571  1.00 32.58  ? 153 ARG A O   1 
ATOM   921  C  CB  . ARG A 1 125 ? 10.718  16.592  43.956  1.00 33.01  ? 153 ARG A CB  1 
ATOM   922  C  CG  . ARG A 1 125 ? 9.668   17.549  44.501  1.00 33.81  ? 153 ARG A CG  1 
ATOM   923  C  CD  . ARG A 1 125 ? 8.977   18.410  43.458  1.00 37.02  ? 153 ARG A CD  1 
ATOM   924  N  NE  . ARG A 1 125 ? 7.784   17.738  42.956  1.00 39.15  ? 153 ARG A NE  1 
ATOM   925  C  CZ  . ARG A 1 125 ? 6.812   18.358  42.251  1.00 41.12  ? 153 ARG A CZ  1 
ATOM   926  N  NH1 . ARG A 1 125 ? 5.757   17.655  41.852  1.00 39.66  ? 153 ARG A NH1 1 
ATOM   927  N  NH2 . ARG A 1 125 ? 6.913   19.665  41.962  1.00 40.12  ? 153 ARG A NH2 1 
ATOM   928  N  N   . ASP A 1 126 ? 13.729  14.769  45.263  1.00 33.55  ? 154 ASP A N   1 
ATOM   929  C  CA  . ASP A 1 126 ? 14.675  13.650  45.015  1.00 35.14  ? 154 ASP A CA  1 
ATOM   930  C  C   . ASP A 1 126 ? 14.150  12.415  45.743  1.00 33.24  ? 154 ASP A C   1 
ATOM   931  O  O   . ASP A 1 126 ? 14.374  12.283  46.956  1.00 31.17  ? 154 ASP A O   1 
ATOM   932  C  CB  . ASP A 1 126 ? 16.087  14.012  45.472  1.00 37.31  ? 154 ASP A CB  1 
ATOM   933  C  CG  . ASP A 1 126 ? 17.112  12.909  45.293  1.00 39.88  ? 154 ASP A CG  1 
ATOM   934  O  OD1 . ASP A 1 126 ? 16.772  11.845  44.706  1.00 40.83  ? 154 ASP A OD1 1 
ATOM   935  O  OD2 . ASP A 1 126 ? 18.245  13.120  45.753  1.00 41.48  ? 154 ASP A OD2 1 
ATOM   936  N  N   . ARG A 1 127 ? 13.524  11.501  45.003  1.00 32.74  ? 155 ARG A N   1 
ATOM   937  C  CA  . ARG A 1 127 ? 12.888  10.301  45.591  1.00 31.21  ? 155 ARG A CA  1 
ATOM   938  C  C   . ARG A 1 127 ? 13.915  9.483   46.377  1.00 32.18  ? 155 ARG A C   1 
ATOM   939  O  O   . ARG A 1 127 ? 13.468  8.786   47.292  1.00 31.21  ? 155 ARG A O   1 
ATOM   940  C  CB  . ARG A 1 127 ? 12.221  9.447   44.504  1.00 32.38  ? 155 ARG A CB  1 
ATOM   941  C  CG  . ARG A 1 127 ? 10.852  9.977   44.077  1.00 31.32  ? 155 ARG A CG  1 
ATOM   942  C  CD  . ARG A 1 127 ? 10.281  9.200   42.892  1.00 33.30  ? 155 ARG A CD  1 
ATOM   943  N  NE  . ARG A 1 127 ? 8.941   9.662   42.510  1.00 32.91  ? 155 ARG A NE  1 
ATOM   944  C  CZ  . ARG A 1 127 ? 8.108   8.998   41.698  1.00 34.31  ? 155 ARG A CZ  1 
ATOM   945  N  NH1 . ARG A 1 127 ? 8.501   7.864   41.161  1.00 34.85  ? 155 ARG A NH1 1 
ATOM   946  N  NH2 . ARG A 1 127 ? 6.908   9.494   41.393  1.00 34.44  ? 155 ARG A NH2 1 
ATOM   947  N  N   . SER A 1 128 ? 15.209  9.528   46.028  1.00 34.13  ? 156 SER A N   1 
ATOM   948  C  CA  . SER A 1 128 ? 16.260  8.734   46.717  1.00 35.46  ? 156 SER A CA  1 
ATOM   949  C  C   . SER A 1 128 ? 16.440  9.211   48.166  1.00 34.18  ? 156 SER A C   1 
ATOM   950  O  O   . SER A 1 128 ? 16.962  8.441   48.979  1.00 34.88  ? 156 SER A O   1 
ATOM   951  C  CB  . SER A 1 128 ? 17.561  8.735   45.967  1.00 38.88  ? 156 SER A CB  1 
ATOM   952  O  OG  . SER A 1 128 ? 18.138  10.029  45.943  1.00 40.21  ? 156 SER A OG  1 
ATOM   953  N  N   . LYS A 1 129 ? 15.952  10.395  48.512  1.00 32.23  ? 157 LYS A N   1 
ATOM   954  C  CA  . LYS A 1 129 ? 16.059  10.944  49.902  1.00 30.91  ? 157 LYS A CA  1 
ATOM   955  C  C   . LYS A 1 129 ? 14.887  10.506  50.787  1.00 28.59  ? 157 LYS A C   1 
ATOM   956  O  O   . LYS A 1 129 ? 14.979  10.693  52.015  1.00 29.47  ? 157 LYS A O   1 
ATOM   957  C  CB  . LYS A 1 129 ? 16.133  12.476  49.843  1.00 30.81  ? 157 LYS A CB  1 
ATOM   958  C  CG  . LYS A 1 129 ? 17.410  13.022  49.225  1.00 33.02  ? 157 LYS A CG  1 
ATOM   959  C  CD  . LYS A 1 129 ? 17.543  14.515  49.383  1.00 33.04  ? 157 LYS A CD  1 
ATOM   960  C  CE  . LYS A 1 129 ? 18.905  15.021  48.971  1.00 35.70  ? 157 LYS A CE  1 
ATOM   961  N  NZ  . LYS A 1 129 ? 18.960  15.270  47.513  1.00 36.67  ? 157 LYS A NZ  1 
ATOM   962  N  N   . TYR A 1 130 ? 13.811  9.946   50.230  1.00 27.46  ? 158 TYR A N   1 
ATOM   963  C  CA  . TYR A 1 130 ? 12.507  9.837   50.941  1.00 25.68  ? 158 TYR A CA  1 
ATOM   964  C  C   . TYR A 1 130 ? 12.595  8.827   52.097  1.00 25.79  ? 158 TYR A C   1 
ATOM   965  O  O   . TYR A 1 130 ? 12.002  9.094   53.152  1.00 25.62  ? 158 TYR A O   1 
ATOM   966  C  CB  . TYR A 1 130 ? 11.365  9.557   49.965  1.00 25.34  ? 158 TYR A CB  1 
ATOM   967  C  CG  . TYR A 1 130 ? 11.007  10.699  49.035  1.00 24.87  ? 158 TYR A CG  1 
ATOM   968  C  CD1 . TYR A 1 130 ? 11.785  11.845  48.929  1.00 25.44  ? 158 TYR A CD1 1 
ATOM   969  C  CD2 . TYR A 1 130 ? 9.904   10.605  48.201  1.00 24.90  ? 158 TYR A CD2 1 
ATOM   970  C  CE1 . TYR A 1 130 ? 11.429  12.902  48.114  1.00 25.30  ? 158 TYR A CE1 1 
ATOM   971  C  CE2 . TYR A 1 130 ? 9.571   11.626  47.326  1.00 24.88  ? 158 TYR A CE2 1 
ATOM   972  C  CZ  . TYR A 1 130 ? 10.340  12.770  47.270  1.00 24.93  ? 158 TYR A CZ  1 
ATOM   973  O  OH  . TYR A 1 130 ? 10.033  13.780  46.419  1.00 24.51  ? 158 TYR A OH  1 
ATOM   974  N  N   . GLY A 1 131 ? 13.317  7.719   51.934  1.00 27.28  ? 159 GLY A N   1 
ATOM   975  C  CA  . GLY A 1 131 ? 13.499  6.736   53.011  1.00 27.81  ? 159 GLY A CA  1 
ATOM   976  C  C   . GLY A 1 131 ? 14.106  7.388   54.246  1.00 27.97  ? 159 GLY A C   1 
ATOM   977  O  O   . GLY A 1 131 ? 13.591  7.149   55.362  1.00 27.53  ? 159 GLY A O   1 
ATOM   978  N  N   . MET A 1 132 ? 15.179  8.156   54.044  1.00 28.85  ? 160 MET A N   1 
ATOM   979  C  CA  . MET A 1 132 ? 15.879  8.900   55.127  1.00 29.77  ? 160 MET A CA  1 
ATOM   980  C  C   . MET A 1 132 ? 14.958  10.000  55.677  1.00 27.81  ? 160 MET A C   1 
ATOM   981  O  O   . MET A 1 132 ? 14.940  10.214  56.910  1.00 26.68  ? 160 MET A O   1 
ATOM   982  C  CB  . MET A 1 132 ? 17.177  9.496   54.590  1.00 32.20  ? 160 MET A CB  1 
ATOM   983  C  CG  . MET A 1 132 ? 17.957  10.231  55.666  1.00 34.42  ? 160 MET A CG  1 
ATOM   984  S  SD  . MET A 1 132 ? 18.438  9.084   56.969  1.00 38.44  ? 160 MET A SD  1 
ATOM   985  C  CE  . MET A 1 132 ? 19.891  8.364   56.207  1.00 41.58  ? 160 MET A CE  1 
ATOM   986  N  N   . LEU A 1 133 ? 14.212  10.693  54.799  1.00 25.77  ? 161 LEU A N   1 
ATOM   987  C  CA  . LEU A 1 133 ? 13.198  11.706  55.199  1.00 23.74  ? 161 LEU A CA  1 
ATOM   988  C  C   . LEU A 1 133 ? 12.222  11.060  56.176  1.00 23.76  ? 161 LEU A C   1 
ATOM   989  O  O   . LEU A 1 133 ? 11.954  11.685  57.255  1.00 23.96  ? 161 LEU A O   1 
ATOM   990  C  CB  . LEU A 1 133 ? 12.470  12.291  53.976  1.00 23.10  ? 161 LEU A CB  1 
ATOM   991  C  CG  . LEU A 1 133 ? 11.333  13.273  54.285  1.00 21.74  ? 161 LEU A CG  1 
ATOM   992  C  CD1 . LEU A 1 133 ? 11.829  14.508  55.038  1.00 22.42  ? 161 LEU A CD1 1 
ATOM   993  C  CD2 . LEU A 1 133 ? 10.642  13.717  53.000  1.00 21.57  ? 161 LEU A CD2 1 
ATOM   994  N  N   . ALA A 1 134 ? 11.764  9.838   55.893  1.00 23.41  ? 162 ALA A N   1 
ATOM   995  C  CA  . ALA A 1 134 ? 10.840  9.097   56.779  1.00 23.03  ? 162 ALA A CA  1 
ATOM   996  C  C   . ALA A 1 134 ? 11.504  8.846   58.140  1.00 24.73  ? 162 ALA A C   1 
ATOM   997  O  O   . ALA A 1 134 ? 10.812  8.936   59.157  1.00 24.67  ? 162 ALA A O   1 
ATOM   998  C  CB  . ALA A 1 134 ? 10.450  7.778   56.180  1.00 23.70  ? 162 ALA A CB  1 
ATOM   999  N  N   . ARG A 1 135 ? 12.770  8.442   58.131  1.00 26.55  ? 163 ARG A N   1 
ATOM   1000 C  CA  . ARG A 1 135 ? 13.515  8.127   59.385  1.00 28.10  ? 163 ARG A CA  1 
ATOM   1001 C  C   . ARG A 1 135 ? 13.618  9.427   60.192  1.00 28.17  ? 163 ARG A C   1 
ATOM   1002 O  O   . ARG A 1 135 ? 13.424  9.353   61.408  1.00 29.42  ? 163 ARG A O   1 
ATOM   1003 C  CB  . ARG A 1 135 ? 14.867  7.488   59.055  1.00 30.35  ? 163 ARG A CB  1 
ATOM   1004 C  CG  . ARG A 1 135 ? 15.875  7.499   60.192  1.00 34.03  ? 163 ARG A CG  1 
ATOM   1005 C  CD  . ARG A 1 135 ? 15.395  6.706   61.406  1.00 35.46  ? 163 ARG A CD  1 
ATOM   1006 N  NE  . ARG A 1 135 ? 14.978  5.354   61.124  1.00 36.84  ? 163 ARG A NE  1 
ATOM   1007 C  CZ  . ARG A 1 135 ? 14.267  4.594   61.950  1.00 38.69  ? 163 ARG A CZ  1 
ATOM   1008 N  NH1 . ARG A 1 135 ? 13.873  5.072   63.123  1.00 40.14  ? 163 ARG A NH1 1 
ATOM   1009 N  NH2 . ARG A 1 135 ? 13.953  3.366   61.598  1.00 39.09  ? 163 ARG A NH2 1 
ATOM   1010 N  N   . LEU A 1 136 ? 13.909  10.565  59.543  1.00 27.79  ? 164 LEU A N   1 
ATOM   1011 C  CA  . LEU A 1 136 ? 13.967  11.886  60.223  1.00 28.06  ? 164 LEU A CA  1 
ATOM   1012 C  C   . LEU A 1 136 ? 12.584  12.181  60.829  1.00 27.13  ? 164 LEU A C   1 
ATOM   1013 O  O   . LEU A 1 136 ? 12.529  12.662  61.973  1.00 27.21  ? 164 LEU A O   1 
ATOM   1014 C  CB  . LEU A 1 136 ? 14.484  12.979  59.280  1.00 27.85  ? 164 LEU A CB  1 
ATOM   1015 C  CG  . LEU A 1 136 ? 15.925  12.824  58.786  1.00 29.47  ? 164 LEU A CG  1 
ATOM   1016 C  CD1 . LEU A 1 136 ? 16.212  13.841  57.699  1.00 29.45  ? 164 LEU A CD1 1 
ATOM   1017 C  CD2 . LEU A 1 136 ? 16.952  12.943  59.917  1.00 31.77  ? 164 LEU A CD2 1 
ATOM   1018 N  N   . ALA A 1 137 ? 11.490  11.837  60.150  1.00 25.98  ? 165 ALA A N   1 
ATOM   1019 C  CA  . ALA A 1 137 ? 10.124  12.090  60.678  1.00 25.94  ? 165 ALA A CA  1 
ATOM   1020 C  C   . ALA A 1 137 ? 9.916   11.270  61.961  1.00 27.21  ? 165 ALA A C   1 
ATOM   1021 O  O   . ALA A 1 137 ? 9.317   11.820  62.936  1.00 28.38  ? 165 ALA A O   1 
ATOM   1022 C  CB  . ALA A 1 137 ? 9.052   11.801  59.663  1.00 25.59  ? 165 ALA A CB  1 
ATOM   1023 N  N   . VAL A 1 138 ? 10.421  10.035  61.996  1.00 27.24  ? 166 VAL A N   1 
ATOM   1024 C  CA  . VAL A 1 138 ? 10.322  9.184   63.227  1.00 29.34  ? 166 VAL A CA  1 
ATOM   1025 C  C   . VAL A 1 138 ? 11.080  9.902   64.364  1.00 30.62  ? 166 VAL A C   1 
ATOM   1026 O  O   . VAL A 1 138 ? 10.491  10.068  65.443  1.00 31.83  ? 166 VAL A O   1 
ATOM   1027 C  CB  . VAL A 1 138 ? 10.855  7.761   63.020  1.00 29.68  ? 166 VAL A CB  1 
ATOM   1028 C  CG1 . VAL A 1 138 ? 10.876  6.970   64.324  1.00 31.88  ? 166 VAL A CG1 1 
ATOM   1029 C  CG2 . VAL A 1 138 ? 10.091  6.994   61.928  1.00 28.54  ? 166 VAL A CG2 1 
ATOM   1030 N  N   . GLU A 1 139 ? 12.351  10.260  64.122  1.00 32.02  ? 167 GLU A N   1 
ATOM   1031 C  CA  . GLU A 1 139 ? 13.238  10.945  65.120  1.00 33.75  ? 167 GLU A CA  1 
ATOM   1032 C  C   . GLU A 1 139 ? 12.599  12.271  65.588  1.00 33.05  ? 167 GLU A C   1 
ATOM   1033 O  O   . GLU A 1 139 ? 12.759  12.642  66.783  1.00 32.99  ? 167 GLU A O   1 
ATOM   1034 C  CB  . GLU A 1 139 ? 14.647  11.127  64.533  1.00 35.77  ? 167 GLU A CB  1 
ATOM   1035 C  CG  . GLU A 1 139 ? 15.343  9.813   64.157  1.00 38.28  ? 167 GLU A CG  1 
ATOM   1036 C  CD  . GLU A 1 139 ? 15.350  8.734   65.240  1.00 43.25  ? 167 GLU A CD  1 
ATOM   1037 O  OE1 . GLU A 1 139 ? 15.790  9.073   66.351  1.00 45.40  ? 167 GLU A OE1 1 
ATOM   1038 O  OE2 . GLU A 1 139 ? 14.903  7.547   64.974  1.00 45.15  ? 167 GLU A OE2 1 
ATOM   1039 N  N   . ALA A 1 140 ? 11.917  13.010  64.705  1.00 30.23  ? 168 ALA A N   1 
ATOM   1040 C  CA  . ALA A 1 140 ? 11.227  14.298  65.008  1.00 30.33  ? 168 ALA A CA  1 
ATOM   1041 C  C   . ALA A 1 140 ? 9.974   14.103  65.880  1.00 30.95  ? 168 ALA A C   1 
ATOM   1042 O  O   . ALA A 1 140 ? 9.408   15.104  66.393  1.00 32.35  ? 168 ALA A O   1 
ATOM   1043 C  CB  . ALA A 1 140 ? 10.811  14.982  63.725  1.00 27.93  ? 168 ALA A CB  1 
ATOM   1044 N  N   . GLY A 1 141 ? 9.516   12.833  66.007  1.00 31.28  ? 169 GLY A N   1 
ATOM   1045 C  CA  . GLY A 1 141 ? 8.503   12.433  66.998  1.00 31.63  ? 169 GLY A CA  1 
ATOM   1046 C  C   . GLY A 1 141 ? 7.117   12.278  66.413  1.00 30.31  ? 169 GLY A C   1 
ATOM   1047 O  O   . GLY A 1 141 ? 6.148   12.209  67.171  1.00 29.90  ? 169 GLY A O   1 
ATOM   1048 N  N   . PHE A 1 142 ? 6.988   12.172  65.082  1.00 29.17  ? 170 PHE A N   1 
ATOM   1049 C  CA  . PHE A 1 142 ? 5.688   11.724  64.538  1.00 28.30  ? 170 PHE A CA  1 
ATOM   1050 C  C   . PHE A 1 142 ? 5.357   10.345  65.223  1.00 29.90  ? 170 PHE A C   1 
ATOM   1051 O  O   . PHE A 1 142 ? 6.261   9.468   65.428  1.00 31.79  ? 170 PHE A O   1 
ATOM   1052 C  CB  . PHE A 1 142 ? 5.735   11.720  63.007  1.00 26.08  ? 170 PHE A CB  1 
ATOM   1053 C  CG  . PHE A 1 142 ? 5.559   13.100  62.414  1.00 24.50  ? 170 PHE A CG  1 
ATOM   1054 C  CD1 . PHE A 1 142 ? 4.297   13.673  62.325  1.00 24.24  ? 170 PHE A CD1 1 
ATOM   1055 C  CD2 . PHE A 1 142 ? 6.652   13.830  61.972  1.00 24.14  ? 170 PHE A CD2 1 
ATOM   1056 C  CE1 . PHE A 1 142 ? 4.113   14.923  61.746  1.00 23.59  ? 170 PHE A CE1 1 
ATOM   1057 C  CE2 . PHE A 1 142 ? 6.469   15.086  61.407  1.00 24.22  ? 170 PHE A CE2 1 
ATOM   1058 C  CZ  . PHE A 1 142 ? 5.205   15.640  61.315  1.00 23.12  ? 170 PHE A CZ  1 
ATOM   1059 N  N   . ASP A 1 143 ? 4.060   10.206  65.554  1.00 29.48  ? 171 ASP A N   1 
ATOM   1060 C  CA  . ASP A 1 143 ? 3.418   8.999   66.183  1.00 31.51  ? 171 ASP A CA  1 
ATOM   1061 C  C   . ASP A 1 143 ? 3.307   7.838   65.170  1.00 30.93  ? 171 ASP A C   1 
ATOM   1062 O  O   . ASP A 1 143 ? 3.235   6.685   65.629  1.00 30.85  ? 171 ASP A O   1 
ATOM   1063 C  CB  . ASP A 1 143 ? 2.096   9.433   66.810  1.00 33.37  ? 171 ASP A CB  1 
ATOM   1064 C  CG  . ASP A 1 143 ? 2.364   10.523  67.862  1.00 34.55  ? 171 ASP A CG  1 
ATOM   1065 O  OD1 . ASP A 1 143 ? 3.225   10.259  68.741  1.00 34.72  ? 171 ASP A OD1 1 
ATOM   1066 O  OD2 . ASP A 1 143 ? 1.762   11.628  67.734  1.00 34.14  ? 171 ASP A OD2 1 
ATOM   1067 N  N   . TRP A 1 144 ? 3.267   8.118   63.860  1.00 28.93  ? 172 TRP A N   1 
ATOM   1068 C  CA  . TRP A 1 144 ? 3.170   7.057   62.825  1.00 29.30  ? 172 TRP A CA  1 
ATOM   1069 C  C   . TRP A 1 144 ? 3.785   7.593   61.545  1.00 26.94  ? 172 TRP A C   1 
ATOM   1070 O  O   . TRP A 1 144 ? 3.531   8.765   61.251  1.00 25.21  ? 172 TRP A O   1 
ATOM   1071 C  CB  . TRP A 1 144 ? 1.716   6.621   62.569  1.00 31.19  ? 172 TRP A CB  1 
ATOM   1072 C  CG  . TRP A 1 144 ? 1.593   5.254   61.954  1.00 31.49  ? 172 TRP A CG  1 
ATOM   1073 C  CD1 . TRP A 1 144 ? 1.907   4.046   62.527  1.00 33.00  ? 172 TRP A CD1 1 
ATOM   1074 C  CD2 . TRP A 1 144 ? 1.093   4.955   60.635  1.00 31.00  ? 172 TRP A CD2 1 
ATOM   1075 N  NE1 . TRP A 1 144 ? 1.649   3.032   61.641  1.00 33.80  ? 172 TRP A NE1 1 
ATOM   1076 C  CE2 . TRP A 1 144 ? 1.148   3.560   60.481  1.00 32.45  ? 172 TRP A CE2 1 
ATOM   1077 C  CE3 . TRP A 1 144 ? 0.677   5.745   59.555  1.00 30.43  ? 172 TRP A CE3 1 
ATOM   1078 C  CZ2 . TRP A 1 144 ? 0.730   2.921   59.311  1.00 32.31  ? 172 TRP A CZ2 1 
ATOM   1079 C  CZ3 . TRP A 1 144 ? 0.239   5.119   58.404  1.00 29.98  ? 172 TRP A CZ3 1 
ATOM   1080 C  CH2 . TRP A 1 144 ? 0.275   3.726   58.294  1.00 31.79  ? 172 TRP A CH2 1 
ATOM   1081 N  N   . VAL A 1 145 ? 4.679   6.814   60.938  1.00 27.36  ? 173 VAL A N   1 
ATOM   1082 C  CA  . VAL A 1 145 ? 5.389   7.206   59.688  1.00 25.26  ? 173 VAL A CA  1 
ATOM   1083 C  C   . VAL A 1 145 ? 5.341   6.028   58.732  1.00 25.19  ? 173 VAL A C   1 
ATOM   1084 O  O   . VAL A 1 145 ? 5.733   4.907   59.121  1.00 26.52  ? 173 VAL A O   1 
ATOM   1085 C  CB  . VAL A 1 145 ? 6.848   7.629   59.957  1.00 25.56  ? 173 VAL A CB  1 
ATOM   1086 C  CG1 . VAL A 1 145 ? 7.551   7.911   58.632  1.00 24.31  ? 173 VAL A CG1 1 
ATOM   1087 C  CG2 . VAL A 1 145 ? 6.897   8.856   60.870  1.00 25.42  ? 173 VAL A CG2 1 
ATOM   1088 N  N   . TYR A 1 146 ? 4.942   6.288   57.489  1.00 23.28  ? 174 TYR A N   1 
ATOM   1089 C  CA  . TYR A 1 146 ? 4.595   5.230   56.511  1.00 23.99  ? 174 TYR A CA  1 
ATOM   1090 C  C   . TYR A 1 146 ? 5.133   5.663   55.148  1.00 23.20  ? 174 TYR A C   1 
ATOM   1091 O  O   . TYR A 1 146 ? 4.744   6.753   54.762  1.00 22.93  ? 174 TYR A O   1 
ATOM   1092 C  CB  . TYR A 1 146 ? 3.076   5.037   56.516  1.00 24.17  ? 174 TYR A CB  1 
ATOM   1093 C  CG  . TYR A 1 146 ? 2.549   4.144   55.407  1.00 24.64  ? 174 TYR A CG  1 
ATOM   1094 C  CD1 . TYR A 1 146 ? 3.202   2.986   55.005  1.00 25.35  ? 174 TYR A CD1 1 
ATOM   1095 C  CD2 . TYR A 1 146 ? 1.327   4.415   54.825  1.00 24.81  ? 174 TYR A CD2 1 
ATOM   1096 C  CE1 . TYR A 1 146 ? 2.695   2.179   53.980  1.00 26.07  ? 174 TYR A CE1 1 
ATOM   1097 C  CE2 . TYR A 1 146 ? 0.806   3.613   53.809  1.00 25.89  ? 174 TYR A CE2 1 
ATOM   1098 C  CZ  . TYR A 1 146 ? 1.468   2.466   53.419  1.00 26.18  ? 174 TYR A CZ  1 
ATOM   1099 O  OH  . TYR A 1 146 ? 0.955   1.684   52.406  1.00 26.59  ? 174 TYR A OH  1 
ATOM   1100 N  N   . TYR A 1 147 ? 6.065   4.897   54.566  1.00 24.03  ? 175 TYR A N   1 
ATOM   1101 C  CA  . TYR A 1 147 ? 6.689   5.127   53.252  1.00 24.19  ? 175 TYR A CA  1 
ATOM   1102 C  C   . TYR A 1 147 ? 5.662   4.680   52.211  1.00 25.16  ? 175 TYR A C   1 
ATOM   1103 O  O   . TYR A 1 147 ? 5.761   3.574   51.654  1.00 26.51  ? 175 TYR A O   1 
ATOM   1104 C  CB  . TYR A 1 147 ? 8.056   4.446   53.151  1.00 25.23  ? 175 TYR A CB  1 
ATOM   1105 C  CG  . TYR A 1 147 ? 8.887   4.864   51.961  1.00 25.59  ? 175 TYR A CG  1 
ATOM   1106 C  CD1 . TYR A 1 147 ? 10.248  4.601   51.952  1.00 27.10  ? 175 TYR A CD1 1 
ATOM   1107 C  CD2 . TYR A 1 147 ? 8.349   5.527   50.852  1.00 25.09  ? 175 TYR A CD2 1 
ATOM   1108 C  CE1 . TYR A 1 147 ? 11.061  4.956   50.891  1.00 27.71  ? 175 TYR A CE1 1 
ATOM   1109 C  CE2 . TYR A 1 147 ? 9.156   5.894   49.787  1.00 25.75  ? 175 TYR A CE2 1 
ATOM   1110 C  CZ  . TYR A 1 147 ? 10.517  5.598   49.799  1.00 27.26  ? 175 TYR A CZ  1 
ATOM   1111 O  OH  . TYR A 1 147 ? 11.347  5.964   48.775  1.00 28.36  ? 175 TYR A OH  1 
ATOM   1112 N  N   . GLU A 1 148 ? 4.653   5.531   52.036  1.00 25.10  ? 176 GLU A N   1 
ATOM   1113 C  CA  . GLU A 1 148 ? 3.316   5.173   51.496  1.00 26.44  ? 176 GLU A CA  1 
ATOM   1114 C  C   . GLU A 1 148 ? 3.408   5.038   49.971  1.00 26.24  ? 176 GLU A C   1 
ATOM   1115 O  O   . GLU A 1 148 ? 2.719   4.209   49.436  1.00 26.60  ? 176 GLU A O   1 
ATOM   1116 C  CB  . GLU A 1 148 ? 2.296   6.256   51.849  1.00 27.00  ? 176 GLU A CB  1 
ATOM   1117 C  CG  . GLU A 1 148 ? 0.890   5.949   51.371  1.00 30.53  ? 176 GLU A CG  1 
ATOM   1118 C  CD  . GLU A 1 148 ? -0.228  6.717   52.067  1.00 31.19  ? 176 GLU A CD  1 
ATOM   1119 O  OE1 . GLU A 1 148 ? -0.087  7.938   52.259  1.00 34.84  ? 176 GLU A OE1 1 
ATOM   1120 O  OE2 . GLU A 1 148 ? -1.279  6.109   52.270  1.00 37.18  ? 176 GLU A OE2 1 
ATOM   1121 N  N   . SER A 1 149 ? 4.204   5.857   49.304  1.00 25.87  ? 177 SER A N   1 
ATOM   1122 C  CA  . SER A 1 149 ? 4.316   5.813   47.822  1.00 27.52  ? 177 SER A CA  1 
ATOM   1123 C  C   . SER A 1 149 ? 5.737   6.187   47.436  1.00 28.31  ? 177 SER A C   1 
ATOM   1124 O  O   . SER A 1 149 ? 6.457   6.757   48.279  1.00 26.75  ? 177 SER A O   1 
ATOM   1125 C  CB  . SER A 1 149 ? 3.283   6.683   47.113  1.00 27.77  ? 177 SER A CB  1 
ATOM   1126 O  OG  . SER A 1 149 ? 3.733   8.016   46.890  1.00 27.34  ? 177 SER A OG  1 
ATOM   1127 N  N   . LYS A 1 150 ? 6.075   5.969   46.167  1.00 29.82  ? 178 LYS A N   1 
ATOM   1128 C  CA  . LYS A 1 150 ? 7.352   6.458   45.582  1.00 31.39  ? 178 LYS A CA  1 
ATOM   1129 C  C   . LYS A 1 150 ? 7.429   7.981   45.715  1.00 28.16  ? 178 LYS A C   1 
ATOM   1130 O  O   . LYS A 1 150 ? 8.554   8.533   45.734  1.00 28.56  ? 178 LYS A O   1 
ATOM   1131 C  CB  . LYS A 1 150 ? 7.440   6.162   44.089  1.00 34.87  ? 178 LYS A CB  1 
ATOM   1132 C  CG  . LYS A 1 150 ? 7.147   4.742   43.705  1.00 38.36  ? 178 LYS A CG  1 
ATOM   1133 C  CD  . LYS A 1 150 ? 8.289   3.837   44.004  1.00 39.20  ? 178 LYS A CD  1 
ATOM   1134 C  CE  . LYS A 1 150 ? 7.929   2.447   43.543  1.00 41.82  ? 178 LYS A CE  1 
ATOM   1135 N  NZ  . LYS A 1 150 ? 7.875   2.348   42.076  1.00 43.71  ? 178 LYS A NZ  1 
ATOM   1136 N  N   . ALA A 1 151 ? 6.289   8.652   45.835  1.00 26.10  ? 179 ALA A N   1 
ATOM   1137 C  CA  . ALA A 1 151 ? 6.231   10.125  45.692  1.00 24.43  ? 179 ALA A CA  1 
ATOM   1138 C  C   . ALA A 1 151 ? 6.138   10.799  47.059  1.00 22.45  ? 179 ALA A C   1 
ATOM   1139 O  O   . ALA A 1 151 ? 6.294   12.006  47.087  1.00 22.05  ? 179 ALA A O   1 
ATOM   1140 C  CB  . ALA A 1 151 ? 5.102   10.537  44.780  1.00 25.76  ? 179 ALA A CB  1 
ATOM   1141 N  N   . HIS A 1 152 ? 5.853   10.092  48.159  1.00 21.59  ? 180 HIS A N   1 
ATOM   1142 C  CA  . HIS A 1 152 ? 5.699   10.788  49.461  1.00 20.48  ? 180 HIS A CA  1 
ATOM   1143 C  C   . HIS A 1 152 ? 5.809   9.855   50.670  1.00 20.54  ? 180 HIS A C   1 
ATOM   1144 O  O   . HIS A 1 152 ? 5.548   8.673   50.561  1.00 22.17  ? 180 HIS A O   1 
ATOM   1145 C  CB  . HIS A 1 152 ? 4.377   11.563  49.566  1.00 19.77  ? 180 HIS A CB  1 
ATOM   1146 C  CG  . HIS A 1 152 ? 3.180   10.705  49.794  1.00 21.48  ? 180 HIS A CG  1 
ATOM   1147 N  ND1 . HIS A 1 152 ? 2.597   9.939   48.773  1.00 22.98  ? 180 HIS A ND1 1 
ATOM   1148 C  CD2 . HIS A 1 152 ? 2.475   10.439  50.910  1.00 21.97  ? 180 HIS A CD2 1 
ATOM   1149 C  CE1 . HIS A 1 152 ? 1.589   9.254   49.291  1.00 23.66  ? 180 HIS A CE1 1 
ATOM   1150 N  NE2 . HIS A 1 152 ? 1.501   9.540   50.603  1.00 23.03  ? 180 HIS A NE2 1 
ATOM   1151 N  N   . ILE A 1 153 ? 6.021   10.485  51.821  1.00 19.88  ? 181 ILE A N   1 
ATOM   1152 C  CA  . ILE A 1 153 ? 5.984   9.869   53.175  1.00 19.98  ? 181 ILE A CA  1 
ATOM   1153 C  C   . ILE A 1 153 ? 4.757   10.427  53.888  1.00 19.82  ? 181 ILE A C   1 
ATOM   1154 O  O   . ILE A 1 153 ? 4.517   11.673  53.812  1.00 20.41  ? 181 ILE A O   1 
ATOM   1155 C  CB  . ILE A 1 153 ? 7.277   10.187  53.928  1.00 20.22  ? 181 ILE A CB  1 
ATOM   1156 C  CG1 . ILE A 1 153 ? 8.526   9.812   53.134  1.00 20.77  ? 181 ILE A CG1 1 
ATOM   1157 C  CG2 . ILE A 1 153 ? 7.275   9.556   55.312  1.00 21.17  ? 181 ILE A CG2 1 
ATOM   1158 C  CD1 . ILE A 1 153 ? 8.567   8.364   52.670  1.00 21.80  ? 181 ILE A CD1 1 
ATOM   1159 N  N   . HIS A 1 154 ? 3.939   9.556   54.469  1.00 19.81  ? 182 HIS A N   1 
ATOM   1160 C  CA  . HIS A 1 154 ? 2.745   9.946   55.246  1.00 19.87  ? 182 HIS A CA  1 
ATOM   1161 C  C   . HIS A 1 154 ? 3.159   9.950   56.718  1.00 20.37  ? 182 HIS A C   1 
ATOM   1162 O  O   . HIS A 1 154 ? 3.679   8.929   57.177  1.00 19.94  ? 182 HIS A O   1 
ATOM   1163 C  CB  . HIS A 1 154 ? 1.598   8.998   54.995  1.00 20.90  ? 182 HIS A CB  1 
ATOM   1164 C  CG  . HIS A 1 154 ? 0.441   9.109   55.936  1.00 22.32  ? 182 HIS A CG  1 
ATOM   1165 N  ND1 . HIS A 1 154 ? -0.666  9.889   55.650  1.00 22.71  ? 182 HIS A ND1 1 
ATOM   1166 C  CD2 . HIS A 1 154 ? 0.228   8.565   57.161  1.00 23.29  ? 182 HIS A CD2 1 
ATOM   1167 C  CE1 . HIS A 1 154 ? -1.542  9.767   56.635  1.00 24.99  ? 182 HIS A CE1 1 
ATOM   1168 N  NE2 . HIS A 1 154 ? -1.020  8.950   57.579  1.00 24.12  ? 182 HIS A NE2 1 
ATOM   1169 N  N   . CYS A 1 155 ? 2.842   11.005  57.425  1.00 20.36  ? 183 CYS A N   1 
ATOM   1170 C  CA  . CYS A 1 155 ? 3.251   11.148  58.854  1.00 21.56  ? 183 CYS A CA  1 
ATOM   1171 C  C   . CYS A 1 155 ? 2.013   11.554  59.633  1.00 22.81  ? 183 CYS A C   1 
ATOM   1172 O  O   . CYS A 1 155 ? 1.334   12.476  59.186  1.00 25.42  ? 183 CYS A O   1 
ATOM   1173 C  CB  . CYS A 1 155 ? 4.350   12.179  59.023  1.00 21.42  ? 183 CYS A CB  1 
ATOM   1174 S  SG  . CYS A 1 155 ? 5.863   11.865  58.079  1.00 23.73  ? 183 CYS A SG  1 
ATOM   1175 N  N   . SER A 1 156 ? 1.751   10.983  60.797  1.00 23.78  ? 184 SER A N   1 
ATOM   1176 C  CA  . SER A 1 156 ? 0.568   11.430  61.557  1.00 24.64  ? 184 SER A CA  1 
ATOM   1177 C  C   . SER A 1 156 ? 0.938   11.517  63.047  1.00 25.94  ? 184 SER A C   1 
ATOM   1178 O  O   . SER A 1 156 ? 2.048   11.055  63.410  1.00 24.39  ? 184 SER A O   1 
ATOM   1179 C  CB  . SER A 1 156 ? -0.645  10.561  61.296  1.00 25.70  ? 184 SER A CB  1 
ATOM   1180 O  OG  . SER A 1 156 ? -0.438  9.209   61.692  1.00 27.42  ? 184 SER A OG  1 
ATOM   1181 N  N   . VAL A 1 157 ? 0.013   12.094  63.800  1.00 27.58  ? 185 VAL A N   1 
ATOM   1182 C  CA  . VAL A 1 157 ? 0.146   12.348  65.268  1.00 30.29  ? 185 VAL A CA  1 
ATOM   1183 C  C   . VAL A 1 157 ? -1.136  11.953  65.984  1.00 33.41  ? 185 VAL A C   1 
ATOM   1184 O  O   . VAL A 1 157 ? -2.206  12.006  65.370  1.00 33.58  ? 185 VAL A O   1 
ATOM   1185 C  CB  . VAL A 1 157 ? 0.474   13.822  65.561  1.00 29.40  ? 185 VAL A CB  1 
ATOM   1186 C  CG1 . VAL A 1 157 ? 1.813   14.225  64.998  1.00 27.75  ? 185 VAL A CG1 1 
ATOM   1187 C  CG2 . VAL A 1 157 ? -0.624  14.778  65.114  1.00 29.35  ? 185 VAL A CG2 1 
ATOM   1188 N  N   . LYS A 1 158 ? -0.982  11.664  67.283  1.00 37.05  ? 186 LYS A N   1 
ATOM   1189 C  CA  A LYS A 1 158 ? -2.100  11.501  68.245  0.50 40.26  ? 186 LYS A CA  1 
ATOM   1190 C  CA  B LYS A 1 158 ? -2.095  11.503  68.251  0.50 40.47  ? 186 LYS A CA  1 
ATOM   1191 C  C   . LYS A 1 158 ? -2.906  12.803  68.275  1.00 41.37  ? 186 LYS A C   1 
ATOM   1192 O  O   . LYS A 1 158 ? -2.324  13.874  67.970  1.00 40.16  ? 186 LYS A O   1 
ATOM   1193 C  CB  A LYS A 1 158 ? -1.550  11.173  69.634  0.50 42.38  ? 186 LYS A CB  1 
ATOM   1194 C  CB  B LYS A 1 158 ? -1.541  11.185  69.643  0.50 42.90  ? 186 LYS A CB  1 
ATOM   1195 C  CG  A LYS A 1 158 ? -0.783  9.859   69.743  0.50 42.63  ? 186 LYS A CG  1 
ATOM   1196 C  CG  B LYS A 1 158 ? -0.473  10.095  69.699  0.50 42.91  ? 186 LYS A CG  1 
ATOM   1197 C  CD  A LYS A 1 158 ? -0.118  9.646   71.098  0.50 44.68  ? 186 LYS A CD  1 
ATOM   1198 C  CD  B LYS A 1 158 ? -0.101  9.655   71.111  0.50 45.87  ? 186 LYS A CD  1 
ATOM   1199 C  CE  A LYS A 1 158 ? 0.824   8.456   71.126  0.50 44.62  ? 186 LYS A CE  1 
ATOM   1200 C  CE  B LYS A 1 158 ? 0.804   8.435   71.144  0.50 46.26  ? 186 LYS A CE  1 
ATOM   1201 N  NZ  A LYS A 1 158 ? 0.121   7.168   70.904  0.50 45.18  ? 186 LYS A NZ  1 
ATOM   1202 N  NZ  B LYS A 1 158 ? 2.151   8.708   70.579  0.50 44.04  ? 186 LYS A NZ  1 
ATOM   1203 N  N   . ALA A 1 159 ? -4.184  12.709  68.637  1.00 44.43  ? 187 ALA A N   1 
ATOM   1204 C  CA  . ALA A 1 159 ? -5.058  13.880  68.862  1.00 47.27  ? 187 ALA A CA  1 
ATOM   1205 C  C   . ALA A 1 159 ? -4.584  14.622  70.134  1.00 49.63  ? 187 ALA A C   1 
ATOM   1206 O  O   . ALA A 1 159 ? -3.867  14.011  70.987  1.00 48.10  ? 187 ALA A O   1 
ATOM   1207 C  CB  . ALA A 1 159 ? -6.500  13.437  68.989  1.00 50.36  ? 187 ALA A CB  1 
ATOM   1208 N  N   . GLU A 1 160 ? -4.972  15.897  70.245  1.00 52.69  ? 188 GLU A N   1 
ATOM   1209 C  CA  . GLU A 1 160 ? -4.655  16.756  71.421  1.00 56.30  ? 188 GLU A CA  1 
ATOM   1210 C  C   . GLU A 1 160 ? -5.277  16.056  72.629  1.00 63.44  ? 188 GLU A C   1 
ATOM   1211 O  O   . GLU A 1 160 ? -4.556  15.858  73.627  1.00 65.46  ? 188 GLU A O   1 
ATOM   1212 C  CB  . GLU A 1 160 ? -5.165  18.187  71.217  1.00 55.81  ? 188 GLU A CB  1 
ATOM   1213 C  CG  . GLU A 1 160 ? -4.616  18.869  69.964  1.00 52.27  ? 188 GLU A CG  1 
ATOM   1214 C  CD  . GLU A 1 160 ? -3.098  18.956  69.886  1.00 49.39  ? 188 GLU A CD  1 
ATOM   1215 O  OE1 . GLU A 1 160 ? -2.460  19.292  70.926  1.00 52.00  ? 188 GLU A OE1 1 
ATOM   1216 O  OE2 . GLU A 1 160 ? -2.548  18.650  68.828  1.00 44.07  ? 188 GLU A OE2 1 
ATOM   1217 N  N   . ASN A 1 161 ? -6.554  15.665  72.486  1.00 69.40  ? 189 ASN A N   1 
ATOM   1218 C  CA  . ASN A 1 161 ? -7.330  14.786  73.408  1.00 75.35  ? 189 ASN A CA  1 
ATOM   1219 C  C   . ASN A 1 161 ? -7.687  13.494  72.655  1.00 75.84  ? 189 ASN A C   1 
ATOM   1220 O  O   . ASN A 1 161 ? -7.259  12.369  72.966  1.00 76.98  ? 189 ASN A O   1 
ATOM   1221 C  CB  . ASN A 1 161 ? -8.612  15.462  73.910  1.00 80.22  ? 189 ASN A CB  1 
ATOM   1222 C  CG  . ASN A 1 161 ? -8.377  16.525  74.964  1.00 82.65  ? 189 ASN A CG  1 
ATOM   1223 O  OD1 . ASN A 1 161 ? -7.805  17.576  74.679  1.00 81.99  ? 189 ASN A OD1 1 
ATOM   1224 N  ND2 . ASN A 1 161 ? -8.852  16.274  76.174  1.00 87.43  ? 189 ASN A ND2 1 
ATOM   1225 N  N   . GLN B 2 1   ? -11.700 21.564  35.210  1.00 53.08  ? 1   GLN H N   1 
ATOM   1226 C  CA  . GLN B 2 1   ? -10.790 22.758  35.321  1.00 50.62  ? 1   GLN H CA  1 
ATOM   1227 C  C   . GLN B 2 1   ? -9.330  22.365  35.015  1.00 44.55  ? 1   GLN H C   1 
ATOM   1228 O  O   . GLN B 2 1   ? -8.715  23.052  34.170  1.00 42.89  ? 1   GLN H O   1 
ATOM   1229 C  CB  . GLN B 2 1   ? -10.924 23.419  36.687  1.00 56.70  ? 1   GLN H CB  1 
ATOM   1230 C  CG  . GLN B 2 1   ? -10.483 24.875  36.681  1.00 61.14  ? 1   GLN H CG  1 
ATOM   1231 C  CD  . GLN B 2 1   ? -9.478  25.139  37.774  1.00 65.45  ? 1   GLN H CD  1 
ATOM   1232 O  OE1 . GLN B 2 1   ? -8.961  24.203  38.391  1.00 66.23  ? 1   GLN H OE1 1 
ATOM   1233 N  NE2 . GLN B 2 1   ? -9.189  26.411  38.013  1.00 67.26  ? 1   GLN H NE2 1 
ATOM   1234 N  N   . VAL B 2 2   ? -8.781  21.294  35.609  1.00 38.70  ? 2   VAL H N   1 
ATOM   1235 C  CA  . VAL B 2 2   ? -7.550  20.651  35.054  1.00 33.91  ? 2   VAL H CA  1 
ATOM   1236 C  C   . VAL B 2 2   ? -7.914  20.084  33.673  1.00 31.14  ? 2   VAL H C   1 
ATOM   1237 O  O   . VAL B 2 2   ? -8.881  19.294  33.605  1.00 30.48  ? 2   VAL H O   1 
ATOM   1238 C  CB  . VAL B 2 2   ? -6.976  19.542  35.955  1.00 32.43  ? 2   VAL H CB  1 
ATOM   1239 C  CG1 . VAL B 2 2   ? -5.798  18.855  35.299  1.00 30.40  ? 2   VAL H CG1 1 
ATOM   1240 C  CG2 . VAL B 2 2   ? -6.580  20.106  37.307  1.00 34.05  ? 2   VAL H CG2 1 
ATOM   1241 N  N   . GLN B 2 3   ? -7.181  20.471  32.626  1.00 30.24  ? 3   GLN H N   1 
ATOM   1242 C  CA  A GLN B 2 3   ? -7.337  19.889  31.263  0.50 28.90  ? 3   GLN H CA  1 
ATOM   1243 C  CA  B GLN B 2 3   ? -7.353  19.941  31.249  0.50 29.45  ? 3   GLN H CA  1 
ATOM   1244 C  C   . GLN B 2 3   ? -5.965  19.689  30.621  1.00 27.71  ? 3   GLN H C   1 
ATOM   1245 O  O   . GLN B 2 3   ? -5.053  20.524  30.811  1.00 28.14  ? 3   GLN H O   1 
ATOM   1246 C  CB  A GLN B 2 3   ? -8.154  20.729  30.277  0.50 29.47  ? 3   GLN H CB  1 
ATOM   1247 C  CB  B GLN B 2 3   ? -8.264  20.900  30.469  0.50 31.03  ? 3   GLN H CB  1 
ATOM   1248 C  CG  A GLN B 2 3   ? -8.166  20.122  28.873  0.50 28.55  ? 3   GLN H CG  1 
ATOM   1249 C  CG  B GLN B 2 3   ? -9.544  21.256  31.234  0.50 33.30  ? 3   GLN H CG  1 
ATOM   1250 C  CD  A GLN B 2 3   ? -9.016  20.887  27.887  0.50 29.92  ? 3   GLN H CD  1 
ATOM   1251 C  CD  B GLN B 2 3   ? -10.560 22.068  30.469  0.50 35.20  ? 3   GLN H CD  1 
ATOM   1252 O  OE1 A GLN B 2 3   ? -9.450  21.999  28.158  0.50 31.53  ? 3   GLN H OE1 1 
ATOM   1253 O  OE1 B GLN B 2 3   ? -10.362 22.410  29.306  0.50 35.24  ? 3   GLN H OE1 1 
ATOM   1254 N  NE2 A GLN B 2 3   ? -9.227  20.305  26.715  0.50 28.22  ? 3   GLN H NE2 1 
ATOM   1255 N  NE2 B GLN B 2 3   ? -11.662 22.398  31.133  0.50 37.62  ? 3   GLN H NE2 1 
ATOM   1256 N  N   . LEU B 2 4   ? -5.830  18.590  29.901  1.00 25.04  ? 4   LEU H N   1 
ATOM   1257 C  CA  . LEU B 2 4   ? -4.665  18.330  29.039  1.00 22.89  ? 4   LEU H CA  1 
ATOM   1258 C  C   . LEU B 2 4   ? -5.199  18.291  27.612  1.00 23.04  ? 4   LEU H C   1 
ATOM   1259 O  O   . LEU B 2 4   ? -6.082  17.437  27.352  1.00 22.42  ? 4   LEU H O   1 
ATOM   1260 C  CB  . LEU B 2 4   ? -4.025  17.005  29.428  1.00 22.84  ? 4   LEU H CB  1 
ATOM   1261 C  CG  . LEU B 2 4   ? -3.482  16.928  30.844  1.00 24.26  ? 4   LEU H CG  1 
ATOM   1262 C  CD1 . LEU B 2 4   ? -2.914  15.546  31.087  1.00 24.66  ? 4   LEU H CD1 1 
ATOM   1263 C  CD2 . LEU B 2 4   ? -2.430  17.968  31.079  1.00 26.20  ? 4   LEU H CD2 1 
ATOM   1264 N  N   . GLN B 2 5   ? -4.727  19.200  26.770  1.00 22.71  ? 5   GLN H N   1 
ATOM   1265 C  CA  . GLN B 2 5   ? -5.239  19.331  25.372  1.00 23.11  ? 5   GLN H CA  1 
ATOM   1266 C  C   . GLN B 2 5   ? -4.140  18.837  24.434  1.00 21.02  ? 5   GLN H C   1 
ATOM   1267 O  O   . GLN B 2 5   ? -3.065  19.459  24.369  1.00 21.82  ? 5   GLN H O   1 
ATOM   1268 C  CB  . GLN B 2 5   ? -5.701  20.770  25.112  1.00 26.78  ? 5   GLN H CB  1 
ATOM   1269 C  CG  . GLN B 2 5   ? -6.247  21.009  23.694  1.00 30.49  ? 5   GLN H CG  1 
ATOM   1270 C  CD  . GLN B 2 5   ? -7.455  20.158  23.368  1.00 31.20  ? 5   GLN H CD  1 
ATOM   1271 O  OE1 . GLN B 2 5   ? -8.182  19.710  24.258  1.00 37.12  ? 5   GLN H OE1 1 
ATOM   1272 N  NE2 . GLN B 2 5   ? -7.712  19.928  22.077  1.00 33.68  ? 5   GLN H NE2 1 
ATOM   1273 N  N   . GLN B 2 6   ? -4.417  17.760  23.691  1.00 19.88  ? 6   GLN H N   1 
ATOM   1274 C  CA  . GLN B 2 6   ? -3.439  17.156  22.765  1.00 19.48  ? 6   GLN H CA  1 
ATOM   1275 C  C   . GLN B 2 6   ? -3.684  17.642  21.337  1.00 19.24  ? 6   GLN H C   1 
ATOM   1276 O  O   . GLN B 2 6   ? -4.802  18.076  21.000  1.00 18.80  ? 6   GLN H O   1 
ATOM   1277 C  CB  . GLN B 2 6   ? -3.475  15.639  22.846  1.00 19.29  ? 6   GLN H CB  1 
ATOM   1278 C  CG  . GLN B 2 6   ? -3.029  15.138  24.238  1.00 19.61  ? 6   GLN H CG  1 
ATOM   1279 C  CD  . GLN B 2 6   ? -2.910  13.634  24.303  1.00 19.21  ? 6   GLN H CD  1 
ATOM   1280 O  OE1 . GLN B 2 6   ? -3.653  12.962  25.017  1.00 20.47  ? 6   GLN H OE1 1 
ATOM   1281 N  NE2 . GLN B 2 6   ? -1.979  13.075  23.536  1.00 19.98  ? 6   GLN H NE2 1 
ATOM   1282 N  N   . SER B 2 7   ? -2.630  17.569  20.559  1.00 19.30  ? 7   SER H N   1 
ATOM   1283 C  CA  . SER B 2 7   ? -2.596  17.973  19.142  1.00 18.89  ? 7   SER H CA  1 
ATOM   1284 C  C   . SER B 2 7   ? -3.378  16.957  18.314  1.00 18.97  ? 7   SER H C   1 
ATOM   1285 O  O   . SER B 2 7   ? -3.782  15.898  18.817  1.00 18.19  ? 7   SER H O   1 
ATOM   1286 C  CB  . SER B 2 7   ? -1.171  18.172  18.670  1.00 19.84  ? 7   SER H CB  1 
ATOM   1287 O  OG  . SER B 2 7   ? -0.372  17.045  18.959  1.00 19.43  ? 7   SER H OG  1 
ATOM   1288 N  N   . GLY B 2 8   ? -3.639  17.329  17.062  1.00 18.88  ? 8   GLY H N   1 
ATOM   1289 C  CA  . GLY B 2 8   ? -4.518  16.542  16.202  1.00 19.31  ? 8   GLY H CA  1 
ATOM   1290 C  C   . GLY B 2 8   ? -3.872  15.282  15.646  1.00 19.19  ? 8   GLY H C   1 
ATOM   1291 O  O   . GLY B 2 8   ? -2.688  14.988  15.818  1.00 18.74  ? 8   GLY H O   1 
ATOM   1292 N  N   . PRO B 2 9   ? -4.690  14.493  14.922  1.00 18.94  ? 9   PRO H N   1 
ATOM   1293 C  CA  . PRO B 2 9   ? -4.245  13.242  14.338  1.00 18.82  ? 9   PRO H CA  1 
ATOM   1294 C  C   . PRO B 2 9   ? -3.154  13.469  13.303  1.00 19.77  ? 9   PRO H C   1 
ATOM   1295 O  O   . PRO B 2 9   ? -3.144  14.525  12.652  1.00 21.03  ? 9   PRO H O   1 
ATOM   1296 C  CB  . PRO B 2 9   ? -5.527  12.673  13.726  1.00 18.46  ? 9   PRO H CB  1 
ATOM   1297 C  CG  . PRO B 2 9   ? -6.329  13.909  13.398  1.00 19.39  ? 9   PRO H CG  1 
ATOM   1298 C  CD  . PRO B 2 9   ? -6.103  14.771  14.632  1.00 19.11  ? 9   PRO H CD  1 
ATOM   1299 N  N   . GLU B 2 10  ? -2.307  12.465  13.112  1.00 19.81  ? 10  GLU H N   1 
ATOM   1300 C  CA  . GLU B 2 10  ? -1.091  12.531  12.262  1.00 21.60  ? 10  GLU H CA  1 
ATOM   1301 C  C   . GLU B 2 10  ? -1.094  11.323  11.330  1.00 20.48  ? 10  GLU H C   1 
ATOM   1302 O  O   . GLU B 2 10  ? -1.237  10.190  11.847  1.00 21.98  ? 10  GLU H O   1 
ATOM   1303 C  CB  . GLU B 2 10  ? 0.157   12.430  13.117  1.00 24.14  ? 10  GLU H CB  1 
ATOM   1304 C  CG  . GLU B 2 10  ? 0.326   13.570  14.086  1.00 26.40  ? 10  GLU H CG  1 
ATOM   1305 C  CD  . GLU B 2 10  ? 0.728   14.868  13.406  1.00 29.27  ? 10  GLU H CD  1 
ATOM   1306 O  OE1 . GLU B 2 10  ? 0.978   14.871  12.154  1.00 30.11  ? 10  GLU H OE1 1 
ATOM   1307 O  OE2 . GLU B 2 10  ? 0.777   15.887  14.116  1.00 31.67  ? 10  GLU H OE2 1 
ATOM   1308 N  N   . LEU B 2 11  ? -0.876  11.541  10.042  1.00 18.64  ? 11  LEU H N   1 
ATOM   1309 C  CA  . LEU B 2 11  ? -0.453  10.490  9.110   1.00 18.19  ? 11  LEU H CA  1 
ATOM   1310 C  C   . LEU B 2 11  ? 1.055   10.650  8.879   1.00 20.23  ? 11  LEU H C   1 
ATOM   1311 O  O   . LEU B 2 11  ? 1.511   11.737  8.522   1.00 21.18  ? 11  LEU H O   1 
ATOM   1312 C  CB  . LEU B 2 11  ? -1.197  10.683  7.785   1.00 17.72  ? 11  LEU H CB  1 
ATOM   1313 C  CG  . LEU B 2 11  ? -0.766  9.761   6.657   1.00 18.20  ? 11  LEU H CG  1 
ATOM   1314 C  CD1 . LEU B 2 11  ? -1.118  8.317   6.946   1.00 18.42  ? 11  LEU H CD1 1 
ATOM   1315 C  CD2 . LEU B 2 11  ? -1.362  10.178  5.312   1.00 18.55  ? 11  LEU H CD2 1 
ATOM   1316 N  N   . VAL B 2 12  ? 1.815   9.581   8.942   1.00 20.88  ? 12  VAL H N   1 
ATOM   1317 C  CA  . VAL B 2 12  ? 3.287   9.708   8.734   1.00 23.20  ? 12  VAL H CA  1 
ATOM   1318 C  C   . VAL B 2 12  ? 3.765   8.423   8.074   1.00 24.68  ? 12  VAL H C   1 
ATOM   1319 O  O   . VAL B 2 12  ? 3.278   7.344   8.459   1.00 24.93  ? 12  VAL H O   1 
ATOM   1320 C  CB  . VAL B 2 12  ? 3.976   10.030  10.077  1.00 23.55  ? 12  VAL H CB  1 
ATOM   1321 C  CG1 . VAL B 2 12  ? 3.466   9.183   11.187  1.00 23.22  ? 12  VAL H CG1 1 
ATOM   1322 C  CG2 . VAL B 2 12  ? 5.494   9.962   10.018  1.00 25.81  ? 12  VAL H CG2 1 
ATOM   1323 N  N   . ARG B 2 13  ? 4.636   8.545   7.086   1.00 26.93  ? 13  ARG H N   1 
ATOM   1324 C  CA  . ARG B 2 13  ? 5.320   7.385   6.466   1.00 28.21  ? 13  ARG H CA  1 
ATOM   1325 C  C   . ARG B 2 13  ? 6.223   6.678   7.462   1.00 29.18  ? 13  ARG H C   1 
ATOM   1326 O  O   . ARG B 2 13  ? 6.786   7.285   8.379   1.00 28.58  ? 13  ARG H O   1 
ATOM   1327 C  CB  . ARG B 2 13  ? 6.173   7.779   5.263   1.00 29.59  ? 13  ARG H CB  1 
ATOM   1328 C  CG  . ARG B 2 13  ? 5.450   7.549   3.950   1.00 28.90  ? 13  ARG H CG  1 
ATOM   1329 C  CD  . ARG B 2 13  ? 6.366   7.894   2.813   1.00 30.32  ? 13  ARG H CD  1 
ATOM   1330 N  NE  . ARG B 2 13  ? 5.750   7.743   1.516   1.00 29.75  ? 13  ARG H NE  1 
ATOM   1331 C  CZ  . ARG B 2 13  ? 5.727   6.616   0.843   1.00 30.51  ? 13  ARG H CZ  1 
ATOM   1332 N  NH1 . ARG B 2 13  ? 6.264   5.525   1.377   1.00 31.01  ? 13  ARG H NH1 1 
ATOM   1333 N  NH2 . ARG B 2 13  ? 5.106   6.559   -0.320  1.00 30.12  ? 13  ARG H NH2 1 
ATOM   1334 N  N   . PRO B 2 14  ? 6.388   5.358   7.279   1.00 30.97  ? 14  PRO H N   1 
ATOM   1335 C  CA  . PRO B 2 14  ? 7.380   4.610   8.025   1.00 33.31  ? 14  PRO H CA  1 
ATOM   1336 C  C   . PRO B 2 14  ? 8.751   5.263   7.767   1.00 35.24  ? 14  PRO H C   1 
ATOM   1337 O  O   . PRO B 2 14  ? 8.988   5.756   6.627   1.00 35.13  ? 14  PRO H O   1 
ATOM   1338 C  CB  . PRO B 2 14  ? 7.350   3.200   7.436   1.00 34.85  ? 14  PRO H CB  1 
ATOM   1339 C  CG  . PRO B 2 14  ? 6.041   3.114   6.725   1.00 33.93  ? 14  PRO H CG  1 
ATOM   1340 C  CD  . PRO B 2 14  ? 5.651   4.526   6.318   1.00 32.52  ? 14  PRO H CD  1 
ATOM   1341 N  N   . GLY B 2 15  ? 9.576   5.321   8.814   1.00 36.31  ? 15  GLY H N   1 
ATOM   1342 C  CA  . GLY B 2 15  ? 10.964  5.824   8.775   1.00 38.58  ? 15  GLY H CA  1 
ATOM   1343 C  C   . GLY B 2 15  ? 11.032  7.330   8.956   1.00 38.75  ? 15  GLY H C   1 
ATOM   1344 O  O   . GLY B 2 15  ? 12.130  7.844   9.031   1.00 41.97  ? 15  GLY H O   1 
ATOM   1345 N  N   . VAL B 2 16  ? 9.879   8.016   8.970   1.00 37.66  ? 16  VAL H N   1 
ATOM   1346 C  CA  . VAL B 2 16  ? 9.773   9.477   9.225   1.00 37.68  ? 16  VAL H CA  1 
ATOM   1347 C  C   . VAL B 2 16  ? 9.559   9.617   10.737  1.00 38.05  ? 16  VAL H C   1 
ATOM   1348 O  O   . VAL B 2 16  ? 9.519   8.556   11.469  1.00 39.59  ? 16  VAL H O   1 
ATOM   1349 C  CB  . VAL B 2 16  ? 8.675   10.074  8.325   1.00 38.74  ? 16  VAL H CB  1 
ATOM   1350 C  CG1 . VAL B 2 16  ? 8.275   11.503  8.642   1.00 38.97  ? 16  VAL H CG1 1 
ATOM   1351 C  CG2 . VAL B 2 16  ? 9.076   9.962   6.858   1.00 40.49  ? 16  VAL H CG2 1 
ATOM   1352 N  N   . SER B 2 17  ? 9.667   10.838  11.245  1.00 36.70  ? 17  SER H N   1 
ATOM   1353 C  CA  A SER B 2 17  ? 9.425   11.127  12.675  0.50 34.52  ? 17  SER H CA  1 
ATOM   1354 C  CA  B SER B 2 17  ? 9.443   11.160  12.673  0.50 34.61  ? 17  SER H CA  1 
ATOM   1355 C  C   . SER B 2 17  ? 8.154   11.968  12.784  1.00 33.00  ? 17  SER H C   1 
ATOM   1356 O  O   . SER B 2 17  ? 7.692   12.530  11.752  1.00 31.77  ? 17  SER H O   1 
ATOM   1357 C  CB  A SER B 2 17  ? 10.611  11.781  13.320  0.50 36.09  ? 17  SER H CB  1 
ATOM   1358 C  CB  B SER B 2 17  ? 10.579  11.932  13.246  0.50 36.25  ? 17  SER H CB  1 
ATOM   1359 O  OG  A SER B 2 17  ? 11.720  10.892  13.357  0.50 37.21  ? 17  SER H OG  1 
ATOM   1360 O  OG  B SER B 2 17  ? 10.350  13.321  13.060  0.50 36.01  ? 17  SER H OG  1 
ATOM   1361 N  N   . VAL B 2 18  ? 7.596   12.023  13.974  1.00 30.46  ? 18  VAL H N   1 
ATOM   1362 C  CA  . VAL B 2 18  ? 6.414   12.878  14.209  1.00 28.59  ? 18  VAL H CA  1 
ATOM   1363 C  C   . VAL B 2 18  ? 6.546   13.400  15.636  1.00 27.04  ? 18  VAL H C   1 
ATOM   1364 O  O   . VAL B 2 18  ? 7.048   12.698  16.482  1.00 26.48  ? 18  VAL H O   1 
ATOM   1365 C  CB  . VAL B 2 18  ? 5.100   12.107  13.977  1.00 27.69  ? 18  VAL H CB  1 
ATOM   1366 C  CG1 . VAL B 2 18  ? 4.843   11.076  15.071  1.00 27.53  ? 18  VAL H CG1 1 
ATOM   1367 C  CG2 . VAL B 2 18  ? 3.941   13.068  13.843  1.00 27.37  ? 18  VAL H CG2 1 
ATOM   1368 N  N   . LYS B 2 19  ? 6.107   14.621  15.857  1.00 27.18  ? 19  LYS H N   1 
ATOM   1369 C  CA  . LYS B 2 19  ? 6.189   15.255  17.189  1.00 26.73  ? 19  LYS H CA  1 
ATOM   1370 C  C   . LYS B 2 19  ? 4.787   15.716  17.556  1.00 25.40  ? 19  LYS H C   1 
ATOM   1371 O  O   . LYS B 2 19  ? 4.226   16.503  16.819  1.00 25.70  ? 19  LYS H O   1 
ATOM   1372 C  CB  . LYS B 2 19  ? 7.157   16.418  17.112  1.00 28.14  ? 19  LYS H CB  1 
ATOM   1373 C  CG  . LYS B 2 19  ? 7.486   17.014  18.459  1.00 28.38  ? 19  LYS H CG  1 
ATOM   1374 C  CD  . LYS B 2 19  ? 8.639   17.982  18.336  1.00 30.36  ? 19  LYS H CD  1 
ATOM   1375 C  CE  . LYS B 2 19  ? 9.098   18.498  19.669  1.00 31.29  ? 19  LYS H CE  1 
ATOM   1376 N  NZ  . LYS B 2 19  ? 10.281  19.379  19.477  1.00 33.48  ? 19  LYS H NZ  1 
ATOM   1377 N  N   . ILE B 2 20  ? 4.272   15.231  18.672  1.00 24.26  ? 20  ILE H N   1 
ATOM   1378 C  CA  . ILE B 2 20  ? 2.902   15.538  19.139  1.00 23.72  ? 20  ILE H CA  1 
ATOM   1379 C  C   . ILE B 2 20  ? 3.024   16.293  20.463  1.00 24.06  ? 20  ILE H C   1 
ATOM   1380 O  O   . ILE B 2 20  ? 4.089   16.195  21.116  1.00 24.17  ? 20  ILE H O   1 
ATOM   1381 C  CB  . ILE B 2 20  ? 2.072   14.244  19.238  1.00 22.99  ? 20  ILE H CB  1 
ATOM   1382 C  CG1 . ILE B 2 20  ? 2.600   13.263  20.277  1.00 23.91  ? 20  ILE H CG1 1 
ATOM   1383 C  CG2 . ILE B 2 20  ? 2.001   13.571  17.867  1.00 22.86  ? 20  ILE H CG2 1 
ATOM   1384 C  CD1 . ILE B 2 20  ? 1.741   11.993  20.360  1.00 23.91  ? 20  ILE H CD1 1 
ATOM   1385 N  N   . SER B 2 21  ? 1.968   17.015  20.822  1.00 22.84  ? 21  SER H N   1 
ATOM   1386 C  CA  . SER B 2 21  ? 1.960   17.987  21.941  1.00 22.78  ? 21  SER H CA  1 
ATOM   1387 C  C   . SER B 2 21  ? 0.795   17.758  22.896  1.00 21.50  ? 21  SER H C   1 
ATOM   1388 O  O   . SER B 2 21  ? -0.236  17.249  22.502  1.00 19.15  ? 21  SER H O   1 
ATOM   1389 C  CB  . SER B 2 21  ? 1.972   19.399  21.420  1.00 23.18  ? 21  SER H CB  1 
ATOM   1390 O  OG  . SER B 2 21  ? 0.721   19.836  20.932  1.00 22.68  ? 21  SER H OG  1 
ATOM   1391 N  N   . CYS B 2 22  ? 0.990   18.216  24.124  1.00 22.24  ? 22  CYS H N   1 
ATOM   1392 C  CA  . CYS B 2 22  ? 0.027   18.104  25.219  1.00 23.15  ? 22  CYS H CA  1 
ATOM   1393 C  C   . CYS B 2 22  ? 0.107   19.386  26.046  1.00 24.42  ? 22  CYS H C   1 
ATOM   1394 O  O   . CYS B 2 22  ? 1.144   19.585  26.705  1.00 25.93  ? 22  CYS H O   1 
ATOM   1395 C  CB  . CYS B 2 22  ? 0.374   16.865  26.042  1.00 23.27  ? 22  CYS H CB  1 
ATOM   1396 S  SG  . CYS B 2 22  ? -0.541  16.754  27.591  1.00 24.37  ? 22  CYS H SG  1 
ATOM   1397 N  N   . LYS B 2 23  ? -0.942  20.207  26.035  1.00 25.28  ? 23  LYS H N   1 
ATOM   1398 C  CA  . LYS B 2 23  ? -0.915  21.496  26.757  1.00 27.51  ? 23  LYS H CA  1 
ATOM   1399 C  C   . LYS B 2 23  ? -1.741  21.384  28.024  1.00 26.95  ? 23  LYS H C   1 
ATOM   1400 O  O   . LYS B 2 23  ? -2.904  21.011  27.959  1.00 25.53  ? 23  LYS H O   1 
ATOM   1401 C  CB  . LYS B 2 23  ? -1.423  22.610  25.836  1.00 30.56  ? 23  LYS H CB  1 
ATOM   1402 C  CG  . LYS B 2 23  ? -1.469  23.984  26.479  1.00 34.70  ? 23  LYS H CG  1 
ATOM   1403 C  CD  . LYS B 2 23  ? -1.337  25.066  25.429  1.00 37.81  ? 23  LYS H CD  1 
ATOM   1404 C  CE  . LYS B 2 23  ? -1.967  26.380  25.828  1.00 40.97  ? 23  LYS H CE  1 
ATOM   1405 N  NZ  . LYS B 2 23  ? -1.279  26.970  26.975  1.00 43.38  ? 23  LYS H NZ  1 
ATOM   1406 N  N   . GLY B 2 24  ? -1.148  21.716  29.165  1.00 28.09  ? 24  GLY H N   1 
ATOM   1407 C  CA  . GLY B 2 24  ? -1.853  21.646  30.447  1.00 28.94  ? 24  GLY H CA  1 
ATOM   1408 C  C   . GLY B 2 24  ? -2.445  22.980  30.839  1.00 29.95  ? 24  GLY H C   1 
ATOM   1409 O  O   . GLY B 2 24  ? -1.769  24.016  30.631  1.00 33.01  ? 24  GLY H O   1 
ATOM   1410 N  N   . SER B 2 25  ? -3.650  22.965  31.406  1.00 29.56  ? 25  SER H N   1 
ATOM   1411 C  CA  . SER B 2 25  ? -4.295  24.183  31.963  1.00 31.81  ? 25  SER H CA  1 
ATOM   1412 C  C   . SER B 2 25  ? -5.060  23.832  33.242  1.00 32.47  ? 25  SER H C   1 
ATOM   1413 O  O   . SER B 2 25  ? -5.344  22.632  33.478  1.00 31.78  ? 25  SER H O   1 
ATOM   1414 C  CB  . SER B 2 25  ? -5.180  24.874  30.924  1.00 31.86  ? 25  SER H CB  1 
ATOM   1415 O  OG  . SER B 2 25  ? -6.228  24.006  30.537  1.00 32.18  ? 25  SER H OG  1 
ATOM   1416 N  N   . GLY B 2 26  ? -5.338  24.855  34.052  1.00 33.69  ? 26  GLY H N   1 
ATOM   1417 C  CA  . GLY B 2 26  ? -6.172  24.735  35.259  1.00 34.89  ? 26  GLY H CA  1 
ATOM   1418 C  C   . GLY B 2 26  ? -5.368  24.197  36.436  1.00 35.53  ? 26  GLY H C   1 
ATOM   1419 O  O   . GLY B 2 26  ? -5.993  23.790  37.448  1.00 37.26  ? 26  GLY H O   1 
ATOM   1420 N  N   . TYR B 2 27  ? -4.038  24.243  36.301  1.00 34.55  ? 27  TYR H N   1 
ATOM   1421 C  CA  . TYR B 2 27  ? -3.056  23.928  37.371  1.00 35.21  ? 27  TYR H CA  1 
ATOM   1422 C  C   . TYR B 2 27  ? -1.713  24.557  36.993  1.00 36.26  ? 27  TYR H C   1 
ATOM   1423 O  O   . TYR B 2 27  ? -1.519  25.003  35.823  1.00 36.16  ? 27  TYR H O   1 
ATOM   1424 C  CB  . TYR B 2 27  ? -2.929  22.412  37.585  1.00 32.67  ? 27  TYR H CB  1 
ATOM   1425 C  CG  . TYR B 2 27  ? -2.166  21.675  36.525  1.00 30.82  ? 27  TYR H CG  1 
ATOM   1426 C  CD1 . TYR B 2 27  ? -0.851  21.311  36.706  1.00 30.56  ? 27  TYR H CD1 1 
ATOM   1427 C  CD2 . TYR B 2 27  ? -2.761  21.330  35.317  1.00 29.15  ? 27  TYR H CD2 1 
ATOM   1428 C  CE1 . TYR B 2 27  ? -0.158  20.584  35.757  1.00 29.03  ? 27  TYR H CE1 1 
ATOM   1429 C  CE2 . TYR B 2 27  ? -2.084  20.608  34.344  1.00 27.70  ? 27  TYR H CE2 1 
ATOM   1430 C  CZ  . TYR B 2 27  ? -0.765  20.243  34.554  1.00 28.34  ? 27  TYR H CZ  1 
ATOM   1431 O  OH  . TYR B 2 27  ? -0.062  19.565  33.607  1.00 26.10  ? 27  TYR H OH  1 
ATOM   1432 N  N   . THR B 2 28  ? -0.814  24.632  37.976  1.00 37.49  ? 28  THR H N   1 
ATOM   1433 C  CA  . THR B 2 28  ? 0.557   25.152  37.778  1.00 38.96  ? 28  THR H CA  1 
ATOM   1434 C  C   . THR B 2 28  ? 1.401   24.045  37.156  1.00 38.41  ? 28  THR H C   1 
ATOM   1435 O  O   . THR B 2 28  ? 1.612   22.996  37.827  1.00 40.11  ? 28  THR H O   1 
ATOM   1436 C  CB  . THR B 2 28  ? 1.143   25.666  39.088  1.00 40.76  ? 28  THR H CB  1 
ATOM   1437 O  OG1 . THR B 2 28  ? 0.122   26.552  39.593  1.00 42.24  ? 28  THR H OG1 1 
ATOM   1438 C  CG2 . THR B 2 28  ? 2.467   26.362  38.867  1.00 41.92  ? 28  THR H CG2 1 
ATOM   1439 N  N   . PHE B 2 29  ? 1.792   24.251  35.897  1.00 39.09  ? 29  PHE H N   1 
ATOM   1440 C  CA  . PHE B 2 29  ? 2.423   23.231  35.025  1.00 38.00  ? 29  PHE H CA  1 
ATOM   1441 C  C   . PHE B 2 29  ? 3.577   22.519  35.761  1.00 38.92  ? 29  PHE H C   1 
ATOM   1442 O  O   . PHE B 2 29  ? 3.649   21.302  35.645  1.00 38.30  ? 29  PHE H O   1 
ATOM   1443 C  CB  . PHE B 2 29  ? 2.829   23.905  33.714  1.00 38.85  ? 29  PHE H CB  1 
ATOM   1444 C  CG  . PHE B 2 29  ? 3.266   22.943  32.647  1.00 37.43  ? 29  PHE H CG  1 
ATOM   1445 C  CD1 . PHE B 2 29  ? 2.370   22.046  32.094  1.00 34.94  ? 29  PHE H CD1 1 
ATOM   1446 C  CD2 . PHE B 2 29  ? 4.588   22.903  32.232  1.00 38.28  ? 29  PHE H CD2 1 
ATOM   1447 C  CE1 . PHE B 2 29  ? 2.783   21.143  31.132  1.00 33.95  ? 29  PHE H CE1 1 
ATOM   1448 C  CE2 . PHE B 2 29  ? 4.990   22.000  31.261  1.00 37.76  ? 29  PHE H CE2 1 
ATOM   1449 C  CZ  . PHE B 2 29  ? 4.089   21.125  30.715  1.00 34.59  ? 29  PHE H CZ  1 
ATOM   1450 N  N   . ILE B 2 30  ? 4.465   23.205  36.493  1.00 40.04  ? 30  ILE H N   1 
ATOM   1451 C  CA  . ILE B 2 30  ? 5.674   22.549  37.109  1.00 41.33  ? 30  ILE H CA  1 
ATOM   1452 C  C   . ILE B 2 30  ? 5.287   21.794  38.408  1.00 41.52  ? 30  ILE H C   1 
ATOM   1453 O  O   . ILE B 2 30  ? 6.138   21.037  38.990  1.00 41.95  ? 30  ILE H O   1 
ATOM   1454 C  CB  . ILE B 2 30  ? 6.815   23.579  37.325  1.00 44.74  ? 30  ILE H CB  1 
ATOM   1455 C  CG1 . ILE B 2 30  ? 6.495   24.608  38.422  1.00 45.93  ? 30  ILE H CG1 1 
ATOM   1456 C  CG2 . ILE B 2 30  ? 7.182   24.248  36.003  1.00 45.31  ? 30  ILE H CG2 1 
ATOM   1457 C  CD1 . ILE B 2 30  ? 6.951   24.210  39.818  1.00 47.92  ? 30  ILE H CD1 1 
ATOM   1458 N  N   . ASP B 2 31  ? 4.044   21.953  38.879  1.00 41.12  ? 31  ASP H N   1 
ATOM   1459 C  CA  . ASP B 2 31  ? 3.536   21.220  40.076  1.00 40.59  ? 31  ASP H CA  1 
ATOM   1460 C  C   . ASP B 2 31  ? 3.408   19.719  39.813  1.00 38.36  ? 31  ASP H C   1 
ATOM   1461 O  O   . ASP B 2 31  ? 3.416   18.975  40.792  1.00 37.80  ? 31  ASP H O   1 
ATOM   1462 C  CB  . ASP B 2 31  ? 2.179   21.735  40.581  1.00 41.22  ? 31  ASP H CB  1 
ATOM   1463 C  CG  . ASP B 2 31  ? 2.329   22.916  41.551  1.00 43.49  ? 31  ASP H CG  1 
ATOM   1464 O  OD1 . ASP B 2 31  ? 3.493   23.224  41.878  1.00 44.06  ? 31  ASP H OD1 1 
ATOM   1465 O  OD2 . ASP B 2 31  ? 1.295   23.496  41.944  1.00 44.58  ? 31  ASP H OD2 1 
ATOM   1466 N  N   . GLU B 2 32  ? 3.214   19.269  38.568  1.00 34.63  ? 32  GLU H N   1 
ATOM   1467 C  CA  . GLU B 2 32  ? 2.999   17.812  38.366  1.00 33.47  ? 32  GLU H CA  1 
ATOM   1468 C  C   . GLU B 2 32  ? 3.839   17.288  37.199  1.00 32.10  ? 32  GLU H C   1 
ATOM   1469 O  O   . GLU B 2 32  ? 4.025   18.010  36.181  1.00 32.24  ? 32  GLU H O   1 
ATOM   1470 C  CB  . GLU B 2 32  ? 1.508   17.454  38.224  1.00 32.24  ? 32  GLU H CB  1 
ATOM   1471 C  CG  . GLU B 2 32  ? 0.556   18.192  39.180  1.00 33.07  ? 32  GLU H CG  1 
ATOM   1472 C  CD  . GLU B 2 32  ? 0.629   17.817  40.669  1.00 35.03  ? 32  GLU H CD  1 
ATOM   1473 O  OE1 . GLU B 2 32  ? 1.389   16.873  41.011  1.00 36.10  ? 32  GLU H OE1 1 
ATOM   1474 O  OE2 . GLU B 2 32  ? -0.075  18.479  41.484  1.00 36.98  ? 32  GLU H OE2 1 
ATOM   1475 N  N   . ALA B 2 33  ? 4.212   16.005  37.319  1.00 31.52  ? 33  ALA H N   1 
ATOM   1476 C  CA  . ALA B 2 33  ? 4.875   15.222  36.252  1.00 29.92  ? 33  ALA H CA  1 
ATOM   1477 C  C   . ALA B 2 33  ? 3.856   14.884  35.159  1.00 28.77  ? 33  ALA H C   1 
ATOM   1478 O  O   . ALA B 2 33  ? 2.652   14.748  35.454  1.00 28.76  ? 33  ALA H O   1 
ATOM   1479 C  CB  . ALA B 2 33  ? 5.518   13.991  36.846  1.00 30.77  ? 33  ALA H CB  1 
ATOM   1480 N  N   . LEU B 2 34  ? 4.342   14.703  33.952  1.00 27.18  ? 34  LEU H N   1 
ATOM   1481 C  CA  . LEU B 2 34  ? 3.505   14.342  32.769  1.00 26.45  ? 34  LEU H CA  1 
ATOM   1482 C  C   . LEU B 2 34  ? 4.047   13.039  32.198  1.00 24.58  ? 34  LEU H C   1 
ATOM   1483 O  O   . LEU B 2 34  ? 5.250   12.940  31.929  1.00 27.12  ? 34  LEU H O   1 
ATOM   1484 C  CB  . LEU B 2 34  ? 3.535   15.460  31.731  1.00 28.15  ? 34  LEU H CB  1 
ATOM   1485 C  CG  . LEU B 2 34  ? 2.529   16.576  31.985  1.00 30.92  ? 34  LEU H CG  1 
ATOM   1486 C  CD1 . LEU B 2 34  ? 2.784   17.735  31.014  1.00 32.06  ? 34  LEU H CD1 1 
ATOM   1487 C  CD2 . LEU B 2 34  ? 1.083   16.055  31.869  1.00 29.85  ? 34  LEU H CD2 1 
ATOM   1488 N  N   . HIS B 2 35  ? 3.116   12.078  31.979  1.00 22.54  ? 35  HIS H N   1 
ATOM   1489 C  CA  . HIS B 2 35  ? 3.454   10.733  31.465  1.00 21.26  ? 35  HIS H CA  1 
ATOM   1490 C  C   . HIS B 2 35  ? 2.872   10.597  30.074  1.00 20.32  ? 35  HIS H C   1 
ATOM   1491 O  O   . HIS B 2 35  ? 1.870   11.273  29.778  1.00 20.23  ? 35  HIS H O   1 
ATOM   1492 C  CB  . HIS B 2 35  ? 2.909   9.649   32.363  1.00 20.81  ? 35  HIS H CB  1 
ATOM   1493 C  CG  . HIS B 2 35  ? 3.399   9.775   33.776  1.00 21.02  ? 35  HIS H CG  1 
ATOM   1494 N  ND1 . HIS B 2 35  ? 4.198   8.839   34.343  1.00 21.49  ? 35  HIS H ND1 1 
ATOM   1495 C  CD2 . HIS B 2 35  ? 3.156   10.701  34.716  1.00 21.46  ? 35  HIS H CD2 1 
ATOM   1496 C  CE1 . HIS B 2 35  ? 4.419   9.151   35.613  1.00 22.51  ? 35  HIS H CE1 1 
ATOM   1497 N  NE2 . HIS B 2 35  ? 3.785   10.299  35.879  1.00 21.96  ? 35  HIS H NE2 1 
ATOM   1498 N  N   . TRP B 2 36  ? 3.495   9.761   29.283  1.00 20.20  ? 36  TRP H N   1 
ATOM   1499 C  CA  . TRP B 2 36  ? 2.977   9.383   27.951  1.00 19.69  ? 36  TRP H CA  1 
ATOM   1500 C  C   . TRP B 2 36  ? 2.600   7.901   27.960  1.00 19.64  ? 36  TRP H C   1 
ATOM   1501 O  O   . TRP B 2 36  ? 3.357   7.108   28.519  1.00 20.48  ? 36  TRP H O   1 
ATOM   1502 C  CB  . TRP B 2 36  ? 4.014   9.735   26.887  1.00 20.64  ? 36  TRP H CB  1 
ATOM   1503 C  CG  . TRP B 2 36  ? 4.188   11.208  26.728  1.00 21.24  ? 36  TRP H CG  1 
ATOM   1504 C  CD1 . TRP B 2 36  ? 5.111   11.994  27.359  1.00 22.53  ? 36  TRP H CD1 1 
ATOM   1505 C  CD2 . TRP B 2 36  ? 3.427   12.087  25.877  1.00 21.09  ? 36  TRP H CD2 1 
ATOM   1506 N  NE1 . TRP B 2 36  ? 4.935   13.295  26.988  1.00 22.78  ? 36  TRP H NE1 1 
ATOM   1507 C  CE2 . TRP B 2 36  ? 3.964   13.379  26.038  1.00 21.63  ? 36  TRP H CE2 1 
ATOM   1508 C  CE3 . TRP B 2 36  ? 2.368   11.911  24.979  1.00 20.45  ? 36  TRP H CE3 1 
ATOM   1509 C  CZ2 . TRP B 2 36  ? 3.462   14.495  25.362  1.00 21.90  ? 36  TRP H CZ2 1 
ATOM   1510 C  CZ3 . TRP B 2 36  ? 1.884   13.009  24.287  1.00 20.45  ? 36  TRP H CZ3 1 
ATOM   1511 C  CH2 . TRP B 2 36  ? 2.422   14.293  24.485  1.00 21.16  ? 36  TRP H CH2 1 
ATOM   1512 N  N   . VAL B 2 37  ? 1.444   7.557   27.403  1.00 18.73  ? 37  VAL H N   1 
ATOM   1513 C  CA  . VAL B 2 37  ? 0.878   6.182   27.392  1.00 18.93  ? 37  VAL H CA  1 
ATOM   1514 C  C   . VAL B 2 37  ? 0.399   5.861   25.965  1.00 19.54  ? 37  VAL H C   1 
ATOM   1515 O  O   . VAL B 2 37  ? -0.337  6.667   25.422  1.00 19.03  ? 37  VAL H O   1 
ATOM   1516 C  CB  . VAL B 2 37  ? -0.274  6.063   28.399  1.00 19.11  ? 37  VAL H CB  1 
ATOM   1517 C  CG1 . VAL B 2 37  ? -0.895  4.682   28.400  1.00 19.64  ? 37  VAL H CG1 1 
ATOM   1518 C  CG2 . VAL B 2 37  ? 0.169   6.402   29.836  1.00 19.86  ? 37  VAL H CG2 1 
ATOM   1519 N  N   . LYS B 2 38  ? 0.802   4.717   25.429  1.00 20.69  ? 38  LYS H N   1 
ATOM   1520 C  CA  . LYS B 2 38  ? 0.391   4.233   24.075  1.00 21.60  ? 38  LYS H CA  1 
ATOM   1521 C  C   . LYS B 2 38  ? -0.806  3.284   24.258  1.00 21.43  ? 38  LYS H C   1 
ATOM   1522 O  O   . LYS B 2 38  ? -0.790  2.456   25.210  1.00 21.86  ? 38  LYS H O   1 
ATOM   1523 C  CB  . LYS B 2 38  ? 1.592   3.521   23.456  1.00 23.23  ? 38  LYS H CB  1 
ATOM   1524 C  CG  . LYS B 2 38  ? 1.332   2.853   22.111  1.00 24.22  ? 38  LYS H CG  1 
ATOM   1525 C  CD  . LYS B 2 38  ? 2.538   2.153   21.593  1.00 25.87  ? 38  LYS H CD  1 
ATOM   1526 C  CE  . LYS B 2 38  ? 2.303   1.510   20.239  1.00 26.16  ? 38  LYS H CE  1 
ATOM   1527 N  NZ  . LYS B 2 38  ? 3.565   0.894   19.776  1.00 28.00  ? 38  LYS H NZ  1 
ATOM   1528 N  N   . GLN B 2 39  ? -1.805  3.374   23.395  1.00 21.58  ? 39  GLN H N   1 
ATOM   1529 C  CA  . GLN B 2 39  ? -2.920  2.397   23.360  1.00 22.59  ? 39  GLN H CA  1 
ATOM   1530 C  C   . GLN B 2 39  ? -3.013  1.861   21.938  1.00 24.21  ? 39  GLN H C   1 
ATOM   1531 O  O   . GLN B 2 39  ? -3.389  2.627   21.059  1.00 22.54  ? 39  GLN H O   1 
ATOM   1532 C  CB  . GLN B 2 39  ? -4.230  3.011   23.851  1.00 22.57  ? 39  GLN H CB  1 
ATOM   1533 C  CG  . GLN B 2 39  ? -5.330  1.962   24.040  1.00 24.62  ? 39  GLN H CG  1 
ATOM   1534 C  CD  . GLN B 2 39  ? -6.550  2.472   24.771  1.00 25.07  ? 39  GLN H CD  1 
ATOM   1535 O  OE1 . GLN B 2 39  ? -6.973  3.609   24.575  1.00 26.77  ? 39  GLN H OE1 1 
ATOM   1536 N  NE2 . GLN B 2 39  ? -7.149  1.620   25.596  1.00 26.19  ? 39  GLN H NE2 1 
ATOM   1537 N  N   . SER B 2 40  ? -2.715  0.580   21.743  1.00 28.78  ? 40  SER H N   1 
ATOM   1538 C  CA  . SER B 2 40  ? -2.857  -0.122  20.427  1.00 33.30  ? 40  SER H CA  1 
ATOM   1539 C  C   . SER B 2 40  ? -3.778  -1.338  20.597  1.00 39.46  ? 40  SER H C   1 
ATOM   1540 O  O   . SER B 2 40  ? -3.812  -1.920  21.732  1.00 41.04  ? 40  SER H O   1 
ATOM   1541 C  CB  . SER B 2 40  ? -1.510  -0.530  19.908  1.00 34.24  ? 40  SER H CB  1 
ATOM   1542 O  OG  . SER B 2 40  ? -0.873  -1.399  20.853  1.00 35.56  ? 40  SER H OG  1 
ATOM   1543 N  N   . HIS B 2 41  ? -4.434  -1.811  19.532  1.00 46.06  ? 41  HIS H N   1 
ATOM   1544 C  CA  . HIS B 2 41  ? -5.221  -3.076  19.623  1.00 50.44  ? 41  HIS H CA  1 
ATOM   1545 C  C   . HIS B 2 41  ? -4.330  -4.217  20.157  1.00 51.50  ? 41  HIS H C   1 
ATOM   1546 O  O   . HIS B 2 41  ? -4.766  -4.929  21.094  1.00 53.18  ? 41  HIS H O   1 
ATOM   1547 C  CB  . HIS B 2 41  ? -5.868  -3.453  18.284  1.00 59.74  ? 41  HIS H CB  1 
ATOM   1548 C  CG  . HIS B 2 41  ? -6.852  -4.569  18.438  1.00 69.10  ? 41  HIS H CG  1 
ATOM   1549 N  ND1 . HIS B 2 41  ? -6.616  -5.849  17.952  1.00 74.68  ? 41  HIS H ND1 1 
ATOM   1550 C  CD2 . HIS B 2 41  ? -8.035  -4.625  19.094  1.00 73.64  ? 41  HIS H CD2 1 
ATOM   1551 C  CE1 . HIS B 2 41  ? -7.630  -6.631  18.268  1.00 77.58  ? 41  HIS H CE1 1 
ATOM   1552 N  NE2 . HIS B 2 41  ? -8.513  -5.904  18.971  1.00 77.63  ? 41  HIS H NE2 1 
ATOM   1553 N  N   . ALA B 2 42  ? -3.116  -4.358  19.607  1.00 48.69  ? 42  ALA H N   1 
ATOM   1554 C  CA  . ALA B 2 42  ? -2.175  -5.481  19.834  1.00 49.52  ? 42  ALA H CA  1 
ATOM   1555 C  C   . ALA B 2 42  ? -1.682  -5.545  21.287  1.00 48.85  ? 42  ALA H C   1 
ATOM   1556 O  O   . ALA B 2 42  ? -1.413  -6.664  21.754  1.00 48.42  ? 42  ALA H O   1 
ATOM   1557 C  CB  . ALA B 2 42  ? -0.984  -5.362  18.904  1.00 50.59  ? 42  ALA H CB  1 
ATOM   1558 N  N   . GLU B 2 43  ? -1.463  -4.404  21.946  1.00 47.13  ? 43  GLU H N   1 
ATOM   1559 C  CA  . GLU B 2 43  ? -0.728  -4.374  23.238  1.00 47.39  ? 43  GLU H CA  1 
ATOM   1560 C  C   . GLU B 2 43  ? -1.495  -3.612  24.334  1.00 44.02  ? 43  GLU H C   1 
ATOM   1561 O  O   . GLU B 2 43  ? -0.884  -3.455  25.420  1.00 43.85  ? 43  GLU H O   1 
ATOM   1562 C  CB  . GLU B 2 43  ? 0.657   -3.752  23.036  1.00 51.36  ? 43  GLU H CB  1 
ATOM   1563 C  CG  . GLU B 2 43  ? 1.504   -4.420  21.968  1.00 55.32  ? 43  GLU H CG  1 
ATOM   1564 C  CD  . GLU B 2 43  ? 2.257   -5.673  22.386  1.00 59.98  ? 43  GLU H CD  1 
ATOM   1565 O  OE1 . GLU B 2 43  ? 2.244   -6.029  23.596  1.00 64.09  ? 43  GLU H OE1 1 
ATOM   1566 O  OE2 . GLU B 2 43  ? 2.865   -6.292  21.492  1.00 65.12  ? 43  GLU H OE2 1 
ATOM   1567 N  N   . SER B 2 44  ? -2.753  -3.191  24.101  1.00 39.44  ? 44  SER H N   1 
ATOM   1568 C  CA  . SER B 2 44  ? -3.588  -2.461  25.090  1.00 36.43  ? 44  SER H CA  1 
ATOM   1569 C  C   . SER B 2 44  ? -2.777  -1.226  25.558  1.00 32.48  ? 44  SER H C   1 
ATOM   1570 O  O   . SER B 2 44  ? -2.184  -0.549  24.660  1.00 32.10  ? 44  SER H O   1 
ATOM   1571 C  CB  . SER B 2 44  ? -4.016  -3.414  26.203  1.00 40.18  ? 44  SER H CB  1 
ATOM   1572 O  OG  . SER B 2 44  ? -4.357  -2.762  27.436  1.00 42.88  ? 44  SER H OG  1 
ATOM   1573 N  N   . LEU B 2 45  ? -2.689  -0.932  26.861  1.00 27.35  ? 45  LEU H N   1 
ATOM   1574 C  CA  . LEU B 2 45  ? -2.016  0.301   27.356  1.00 25.02  ? 45  LEU H CA  1 
ATOM   1575 C  C   . LEU B 2 45  ? -0.566  0.007   27.731  1.00 24.80  ? 45  LEU H C   1 
ATOM   1576 O  O   . LEU B 2 45  ? -0.285  -1.007  28.443  1.00 24.11  ? 45  LEU H O   1 
ATOM   1577 C  CB  . LEU B 2 45  ? -2.791  0.888   28.530  1.00 25.36  ? 45  LEU H CB  1 
ATOM   1578 C  CG  . LEU B 2 45  ? -4.159  1.469   28.183  1.00 24.66  ? 45  LEU H CG  1 
ATOM   1579 C  CD1 . LEU B 2 45  ? -5.038  1.529   29.404  1.00 26.20  ? 45  LEU H CD1 1 
ATOM   1580 C  CD2 . LEU B 2 45  ? -4.027  2.846   27.575  1.00 23.23  ? 45  LEU H CD2 1 
ATOM   1581 N  N   . GLU B 2 46  ? 0.339   0.868   27.306  1.00 23.32  ? 46  GLU H N   1 
ATOM   1582 C  CA  . GLU B 2 46  ? 1.785   0.718   27.600  1.00 25.03  ? 46  GLU H CA  1 
ATOM   1583 C  C   . GLU B 2 46  ? 2.324   2.071   28.055  1.00 23.29  ? 46  GLU H C   1 
ATOM   1584 O  O   . GLU B 2 46  ? 2.100   3.074   27.356  1.00 21.90  ? 46  GLU H O   1 
ATOM   1585 C  CB  . GLU B 2 46  ? 2.602   0.238   26.396  1.00 26.95  ? 46  GLU H CB  1 
ATOM   1586 C  CG  . GLU B 2 46  ? 2.279   -1.163  25.881  1.00 29.31  ? 46  GLU H CG  1 
ATOM   1587 C  CD  . GLU B 2 46  ? 3.148   -1.559  24.690  1.00 31.86  ? 46  GLU H CD  1 
ATOM   1588 O  OE1 . GLU B 2 46  ? 2.816   -1.117  23.583  1.00 32.93  ? 46  GLU H OE1 1 
ATOM   1589 O  OE2 . GLU B 2 46  ? 4.186   -2.247  24.885  1.00 34.63  ? 46  GLU H OE2 1 
ATOM   1590 N  N   . TRP B 2 47  ? 3.052   2.089   29.165  1.00 23.12  ? 47  TRP H N   1 
ATOM   1591 C  CA  . TRP B 2 47  ? 3.676   3.335   29.652  1.00 22.89  ? 47  TRP H CA  1 
ATOM   1592 C  C   . TRP B 2 47  ? 4.941   3.612   28.846  1.00 23.53  ? 47  TRP H C   1 
ATOM   1593 O  O   . TRP B 2 47  ? 5.816   2.723   28.795  1.00 24.50  ? 47  TRP H O   1 
ATOM   1594 C  CB  . TRP B 2 47  ? 3.948   3.205   31.138  1.00 23.26  ? 47  TRP H CB  1 
ATOM   1595 C  CG  . TRP B 2 47  ? 4.523   4.418   31.777  1.00 23.41  ? 47  TRP H CG  1 
ATOM   1596 C  CD1 . TRP B 2 47  ? 3.853   5.445   32.364  1.00 23.02  ? 47  TRP H CD1 1 
ATOM   1597 C  CD2 . TRP B 2 47  ? 5.921   4.619   32.068  1.00 24.50  ? 47  TRP H CD2 1 
ATOM   1598 N  NE1 . TRP B 2 47  ? 4.753   6.317   32.928  1.00 23.96  ? 47  TRP H NE1 1 
ATOM   1599 C  CE2 . TRP B 2 47  ? 6.024   5.817   32.795  1.00 24.78  ? 47  TRP H CE2 1 
ATOM   1600 C  CE3 . TRP B 2 47  ? 7.085   3.910   31.762  1.00 25.63  ? 47  TRP H CE3 1 
ATOM   1601 C  CZ2 . TRP B 2 47  ? 7.253   6.329   33.214  1.00 25.59  ? 47  TRP H CZ2 1 
ATOM   1602 C  CZ3 . TRP B 2 47  ? 8.303   4.384   32.232  1.00 27.12  ? 47  TRP H CZ3 1 
ATOM   1603 C  CH2 . TRP B 2 47  ? 8.378   5.574   32.956  1.00 26.46  ? 47  TRP H CH2 1 
ATOM   1604 N  N   . ILE B 2 48  ? 5.036   4.790   28.216  1.00 22.38  ? 48  ILE H N   1 
ATOM   1605 C  CA  . ILE B 2 48  ? 6.245   5.185   27.425  1.00 23.74  ? 48  ILE H CA  1 
ATOM   1606 C  C   . ILE B 2 48  ? 7.315   5.799   28.327  1.00 24.55  ? 48  ILE H C   1 
ATOM   1607 O  O   . ILE B 2 48  ? 8.531   5.478   28.134  1.00 26.59  ? 48  ILE H O   1 
ATOM   1608 C  CB  . ILE B 2 48  ? 5.852   6.130   26.279  1.00 23.06  ? 48  ILE H CB  1 
ATOM   1609 C  CG1 . ILE B 2 48  ? 4.916   5.386   25.333  1.00 23.26  ? 48  ILE H CG1 1 
ATOM   1610 C  CG2 . ILE B 2 48  ? 7.101   6.663   25.579  1.00 24.21  ? 48  ILE H CG2 1 
ATOM   1611 C  CD1 . ILE B 2 48  ? 4.198   6.243   24.291  1.00 21.72  ? 48  ILE H CD1 1 
ATOM   1612 N  N   . GLY B 2 49  ? 6.911   6.715   29.198  1.00 23.98  ? 49  GLY H N   1 
ATOM   1613 C  CA  . GLY B 2 49  ? 7.845   7.459   30.050  1.00 24.77  ? 49  GLY H CA  1 
ATOM   1614 C  C   . GLY B 2 49  ? 7.217   8.648   30.755  1.00 24.64  ? 49  GLY H C   1 
ATOM   1615 O  O   . GLY B 2 49  ? 5.985   8.914   30.640  1.00 22.92  ? 49  GLY H O   1 
ATOM   1616 N  N   . VAL B 2 50  ? 8.056   9.374   31.468  1.00 25.44  ? 50  VAL H N   1 
ATOM   1617 C  CA  . VAL B 2 50  ? 7.624   10.528  32.282  1.00 25.68  ? 50  VAL H CA  1 
ATOM   1618 C  C   . VAL B 2 50  ? 8.676   11.629  32.122  1.00 26.84  ? 50  VAL H C   1 
ATOM   1619 O  O   . VAL B 2 50  ? 9.929   11.321  32.064  1.00 28.34  ? 50  VAL H O   1 
ATOM   1620 C  CB  . VAL B 2 50  ? 7.418   10.141  33.760  1.00 25.90  ? 50  VAL H CB  1 
ATOM   1621 C  CG1 . VAL B 2 50  ? 8.661   9.542   34.383  1.00 27.51  ? 50  VAL H CG1 1 
ATOM   1622 C  CG2 . VAL B 2 50  ? 6.913   11.330  34.558  1.00 25.79  ? 50  VAL H CG2 1 
ATOM   1623 N  N   . ILE B 2 51  ? 8.162   12.861  32.145  1.00 27.12  ? 51  ILE H N   1 
ATOM   1624 C  CA  . ILE B 2 51  ? 9.001   14.081  32.219  1.00 29.27  ? 51  ILE H CA  1 
ATOM   1625 C  C   . ILE B 2 51  ? 8.533   14.915  33.427  1.00 30.45  ? 51  ILE H C   1 
ATOM   1626 O  O   . ILE B 2 51  ? 7.287   15.055  33.645  1.00 28.42  ? 51  ILE H O   1 
ATOM   1627 C  CB  . ILE B 2 51  ? 8.976   14.844  30.889  1.00 29.18  ? 51  ILE H CB  1 
ATOM   1628 C  CG1 . ILE B 2 51  ? 10.079  15.914  30.848  1.00 30.73  ? 51  ILE H CG1 1 
ATOM   1629 C  CG2 . ILE B 2 51  ? 7.575   15.396  30.617  1.00 27.78  ? 51  ILE H CG2 1 
ATOM   1630 C  CD1 . ILE B 2 51  ? 10.486  16.282  29.423  1.00 31.48  ? 51  ILE H CD1 1 
ATOM   1631 N  N   . ARG B 2 52  ? 9.509   15.402  34.214  1.00 32.54  ? 52  ARG H N   1 
ATOM   1632 C  CA  . ARG B 2 52  ? 9.211   16.246  35.388  1.00 35.06  ? 52  ARG H CA  1 
ATOM   1633 C  C   . ARG B 2 52  ? 9.576   17.666  34.958  1.00 36.42  ? 52  ARG H C   1 
ATOM   1634 O  O   . ARG B 2 52  ? 10.762  17.982  34.835  1.00 37.81  ? 52  ARG H O   1 
ATOM   1635 C  CB  . ARG B 2 52  ? 9.965   15.678  36.600  1.00 37.69  ? 52  ARG H CB  1 
ATOM   1636 C  CG  . ARG B 2 52  ? 9.848   14.164  36.741  1.00 39.16  ? 52  ARG H CG  1 
ATOM   1637 C  CD  . ARG B 2 52  ? 10.506  13.452  37.941  1.00 42.75  ? 52  ARG H CD  1 
ATOM   1638 N  NE  . ARG B 2 52  ? 10.236  12.003  37.858  1.00 45.72  ? 52  ARG H NE  1 
ATOM   1639 C  CZ  . ARG B 2 52  ? 9.045   11.418  38.114  1.00 47.12  ? 52  ARG H CZ  1 
ATOM   1640 N  NH1 . ARG B 2 52  ? 8.008   12.142  38.514  1.00 49.37  ? 52  ARG H NH1 1 
ATOM   1641 N  NH2 . ARG B 2 52  ? 8.884   10.105  37.991  1.00 47.51  ? 52  ARG H NH2 1 
ATOM   1642 N  N   . PRO B 2 53  ? 8.600   18.560  34.677  1.00 36.35  ? 53  PRO H N   1 
ATOM   1643 C  CA  . PRO B 2 53  ? 8.917   19.878  34.124  1.00 38.06  ? 53  PRO H CA  1 
ATOM   1644 C  C   . PRO B 2 53  ? 9.632   20.789  35.128  1.00 41.33  ? 53  PRO H C   1 
ATOM   1645 O  O   . PRO B 2 53  ? 10.263  21.720  34.702  1.00 43.07  ? 53  PRO H O   1 
ATOM   1646 C  CB  . PRO B 2 53  ? 7.545   20.478  33.733  1.00 36.86  ? 53  PRO H CB  1 
ATOM   1647 C  CG  . PRO B 2 53  ? 6.584   19.309  33.769  1.00 35.74  ? 53  PRO H CG  1 
ATOM   1648 C  CD  . PRO B 2 53  ? 7.142   18.368  34.820  1.00 35.29  ? 53  PRO H CD  1 
ATOM   1649 N  N   . TYR B 2 54  ? 9.519   20.493  36.422  1.00 41.81  ? 54  TYR H N   1 
ATOM   1650 C  CA  . TYR B 2 54  ? 10.188  21.262  37.497  1.00 44.69  ? 54  TYR H CA  1 
ATOM   1651 C  C   . TYR B 2 54  ? 11.715  21.135  37.416  1.00 46.63  ? 54  TYR H C   1 
ATOM   1652 O  O   . TYR B 2 54  ? 12.391  22.050  37.869  1.00 48.91  ? 54  TYR H O   1 
ATOM   1653 C  CB  . TYR B 2 54  ? 9.696   20.833  38.879  1.00 44.44  ? 54  TYR H CB  1 
ATOM   1654 C  CG  . TYR B 2 54  ? 9.506   19.363  39.163  1.00 44.45  ? 54  TYR H CG  1 
ATOM   1655 C  CD1 . TYR B 2 54  ? 10.479  18.623  39.823  1.00 45.51  ? 54  TYR H CD1 1 
ATOM   1656 C  CD2 . TYR B 2 54  ? 8.299   18.735  38.888  1.00 43.27  ? 54  TYR H CD2 1 
ATOM   1657 C  CE1 . TYR B 2 54  ? 10.277  17.288  40.153  1.00 45.57  ? 54  TYR H CE1 1 
ATOM   1658 C  CE2 . TYR B 2 54  ? 8.078   17.407  39.220  1.00 43.71  ? 54  TYR H CE2 1 
ATOM   1659 C  CZ  . TYR B 2 54  ? 9.058   16.688  39.888  1.00 44.22  ? 54  TYR H CZ  1 
ATOM   1660 O  OH  . TYR B 2 54  ? 8.834   15.380  40.216  1.00 45.01  ? 54  TYR H OH  1 
ATOM   1661 N  N   . SER B 2 55  ? 12.224  20.001  36.949  1.00 46.67  ? 55  SER H N   1 
ATOM   1662 C  CA  . SER B 2 55  ? 13.660  19.631  36.934  1.00 48.33  ? 55  SER H CA  1 
ATOM   1663 C  C   . SER B 2 55  ? 14.103  19.292  35.504  1.00 48.20  ? 55  SER H C   1 
ATOM   1664 O  O   . SER B 2 55  ? 15.312  19.109  35.311  1.00 53.21  ? 55  SER H O   1 
ATOM   1665 C  CB  . SER B 2 55  ? 13.881  18.464  37.828  1.00 48.25  ? 55  SER H CB  1 
ATOM   1666 O  OG  . SER B 2 55  ? 13.116  17.371  37.329  1.00 46.24  ? 55  SER H OG  1 
ATOM   1667 N  N   . GLY B 2 56  ? 13.165  19.109  34.578  1.00 44.62  ? 56  GLY H N   1 
ATOM   1668 C  CA  . GLY B 2 56  ? 13.419  18.645  33.199  1.00 43.11  ? 56  GLY H CA  1 
ATOM   1669 C  C   . GLY B 2 56  ? 13.884  17.191  33.119  1.00 41.67  ? 56  GLY H C   1 
ATOM   1670 O  O   . GLY B 2 56  ? 14.122  16.730  31.987  1.00 43.22  ? 56  GLY H O   1 
ATOM   1671 N  N   . GLU B 2 57  ? 13.965  16.458  34.229  1.00 39.62  ? 57  GLU H N   1 
ATOM   1672 C  CA  A GLU B 2 57  ? 14.380  15.027  34.254  0.50 39.64  ? 57  GLU H CA  1 
ATOM   1673 C  CA  B GLU B 2 57  ? 14.422  15.040  34.191  0.50 39.53  ? 57  GLU H CA  1 
ATOM   1674 C  C   . GLU B 2 57  ? 13.386  14.151  33.473  1.00 37.06  ? 57  GLU H C   1 
ATOM   1675 O  O   . GLU B 2 57  ? 12.168  14.416  33.550  1.00 34.60  ? 57  GLU H O   1 
ATOM   1676 C  CB  A GLU B 2 57  ? 14.480  14.552  35.702  0.50 40.88  ? 57  GLU H CB  1 
ATOM   1677 C  CB  B GLU B 2 57  ? 14.801  14.510  35.578  0.50 40.84  ? 57  GLU H CB  1 
ATOM   1678 C  CG  A GLU B 2 57  ? 14.255  13.067  35.905  0.50 41.04  ? 57  GLU H CG  1 
ATOM   1679 C  CG  B GLU B 2 57  ? 13.721  14.603  36.642  0.50 40.63  ? 57  GLU H CG  1 
ATOM   1680 C  CD  A GLU B 2 57  ? 14.156  12.694  37.375  0.50 42.12  ? 57  GLU H CD  1 
ATOM   1681 C  CD  B GLU B 2 57  ? 14.271  14.975  38.017  0.50 41.96  ? 57  GLU H CD  1 
ATOM   1682 O  OE1 A GLU B 2 57  ? 14.657  13.478  38.211  0.50 43.48  ? 57  GLU H OE1 1 
ATOM   1683 O  OE1 B GLU B 2 57  ? 13.593  15.725  38.765  0.50 41.48  ? 57  GLU H OE1 1 
ATOM   1684 O  OE2 A GLU B 2 57  ? 13.540  11.649  37.679  0.50 42.22  ? 57  GLU H OE2 1 
ATOM   1685 O  OE2 B GLU B 2 57  ? 15.397  14.535  38.327  0.50 43.43  ? 57  GLU H OE2 1 
ATOM   1686 N  N   . THR B 2 58  ? 13.886  13.118  32.808  1.00 35.91  ? 58  THR H N   1 
ATOM   1687 C  CA  . THR B 2 58  ? 13.073  12.139  32.053  1.00 34.52  ? 58  THR H CA  1 
ATOM   1688 C  C   . THR B 2 58  ? 13.419  10.731  32.533  1.00 35.20  ? 58  THR H C   1 
ATOM   1689 O  O   . THR B 2 58  ? 14.578  10.508  32.960  1.00 36.91  ? 58  THR H O   1 
ATOM   1690 C  CB  . THR B 2 58  ? 13.291  12.303  30.544  1.00 33.90  ? 58  THR H CB  1 
ATOM   1691 O  OG1 . THR B 2 58  ? 14.692  12.250  30.277  1.00 36.09  ? 58  THR H OG1 1 
ATOM   1692 C  CG2 . THR B 2 58  ? 12.705  13.594  30.043  1.00 33.20  ? 58  THR H CG2 1 
ATOM   1693 N  N   . ASN B 2 59  ? 12.447  9.821   32.481  1.00 34.20  ? 59  ASN H N   1 
ATOM   1694 C  CA  . ASN B 2 59  ? 12.642  8.364   32.689  1.00 35.42  ? 59  ASN H CA  1 
ATOM   1695 C  C   . ASN B 2 59  ? 11.907  7.669   31.552  1.00 33.58  ? 59  ASN H C   1 
ATOM   1696 O  O   . ASN B 2 59  ? 10.690  7.923   31.407  1.00 30.87  ? 59  ASN H O   1 
ATOM   1697 C  CB  . ASN B 2 59  ? 12.135  7.906   34.055  1.00 36.81  ? 59  ASN H CB  1 
ATOM   1698 C  CG  . ASN B 2 59  ? 12.801  8.624   35.212  1.00 40.74  ? 59  ASN H CG  1 
ATOM   1699 O  OD1 . ASN B 2 59  ? 13.907  8.264   35.609  1.00 45.60  ? 59  ASN H OD1 1 
ATOM   1700 N  ND2 . ASN B 2 59  ? 12.133  9.609   35.799  1.00 41.83  ? 59  ASN H ND2 1 
ATOM   1701 N  N   . TYR B 2 60  ? 12.597  6.866   30.752  1.00 34.09  ? 60  TYR H N   1 
ATOM   1702 C  CA  . TYR B 2 60  ? 11.954  6.162   29.613  1.00 33.42  ? 60  TYR H CA  1 
ATOM   1703 C  C   . TYR B 2 60  ? 11.800  4.692   29.963  1.00 34.01  ? 60  TYR H C   1 
ATOM   1704 O  O   . TYR B 2 60  ? 12.750  4.134   30.480  1.00 34.75  ? 60  TYR H O   1 
ATOM   1705 C  CB  . TYR B 2 60  ? 12.747  6.295   28.317  1.00 34.13  ? 60  TYR H CB  1 
ATOM   1706 C  CG  . TYR B 2 60  ? 12.845  7.699   27.782  1.00 33.78  ? 60  TYR H CG  1 
ATOM   1707 C  CD1 . TYR B 2 60  ? 13.826  8.562   28.242  1.00 35.16  ? 60  TYR H CD1 1 
ATOM   1708 C  CD2 . TYR B 2 60  ? 11.993  8.150   26.787  1.00 32.43  ? 60  TYR H CD2 1 
ATOM   1709 C  CE1 . TYR B 2 60  ? 13.933  9.850   27.737  1.00 34.91  ? 60  TYR H CE1 1 
ATOM   1710 C  CE2 . TYR B 2 60  ? 12.090  9.434   26.274  1.00 32.40  ? 60  TYR H CE2 1 
ATOM   1711 C  CZ  . TYR B 2 60  ? 13.087  10.280  26.731  1.00 33.56  ? 60  TYR H CZ  1 
ATOM   1712 O  OH  . TYR B 2 60  ? 13.180  11.584  26.277  1.00 33.68  ? 60  TYR H OH  1 
ATOM   1713 N  N   . ASN B 2 61  ? 10.655  4.105   29.630  1.00 32.85  ? 61  ASN H N   1 
ATOM   1714 C  CA  . ASN B 2 61  ? 10.503  2.638   29.449  1.00 34.20  ? 61  ASN H CA  1 
ATOM   1715 C  C   . ASN B 2 61  ? 11.569  2.173   28.449  1.00 36.34  ? 61  ASN H C   1 
ATOM   1716 O  O   . ASN B 2 61  ? 11.661  2.790   27.382  1.00 35.50  ? 61  ASN H O   1 
ATOM   1717 C  CB  . ASN B 2 61  ? 9.111   2.282   28.925  1.00 32.13  ? 61  ASN H CB  1 
ATOM   1718 C  CG  . ASN B 2 61  ? 8.819   0.775   28.898  1.00 32.48  ? 61  ASN H CG  1 
ATOM   1719 O  OD1 . ASN B 2 61  ? 9.742   -0.024  28.750  1.00 34.60  ? 61  ASN H OD1 1 
ATOM   1720 N  ND2 . ASN B 2 61  ? 7.544   0.403   29.041  1.00 31.20  ? 61  ASN H ND2 1 
ATOM   1721 N  N   . GLN B 2 62  ? 12.327  1.127   28.767  1.00 39.60  ? 62  GLN H N   1 
ATOM   1722 C  CA  . GLN B 2 62  ? 13.468  0.687   27.922  1.00 42.82  ? 62  GLN H CA  1 
ATOM   1723 C  C   . GLN B 2 62  ? 12.920  0.207   26.580  1.00 41.87  ? 62  GLN H C   1 
ATOM   1724 O  O   . GLN B 2 62  ? 13.662  0.313   25.620  1.00 41.83  ? 62  GLN H O   1 
ATOM   1725 C  CB  . GLN B 2 62  ? 14.311  -0.387  28.612  1.00 47.61  ? 62  GLN H CB  1 
ATOM   1726 C  CG  . GLN B 2 62  ? 15.221  0.172   29.703  1.00 52.95  ? 62  GLN H CG  1 
ATOM   1727 C  CD  . GLN B 2 62  ? 16.612  0.579   29.248  1.00 58.64  ? 62  GLN H CD  1 
ATOM   1728 O  OE1 . GLN B 2 62  ? 17.336  1.275   29.963  1.00 61.56  ? 62  GLN H OE1 1 
ATOM   1729 N  NE2 . GLN B 2 62  ? 17.010  0.144   28.054  1.00 62.46  ? 62  GLN H NE2 1 
ATOM   1730 N  N   . LYS B 2 63  ? 11.651  -0.211  26.496  1.00 39.98  ? 63  LYS H N   1 
ATOM   1731 C  CA  . LYS B 2 63  ? 11.051  -0.680  25.218  1.00 40.73  ? 63  LYS H CA  1 
ATOM   1732 C  C   . LYS B 2 63  ? 10.869  0.492   24.242  1.00 39.35  ? 63  LYS H C   1 
ATOM   1733 O  O   . LYS B 2 63  ? 10.589  0.204   23.064  1.00 38.62  ? 63  LYS H O   1 
ATOM   1734 C  CB  . LYS B 2 63  ? 9.701   -1.381  25.429  1.00 41.38  ? 63  LYS H CB  1 
ATOM   1735 C  CG  . LYS B 2 63  ? 9.778   -2.693  26.202  1.00 45.25  ? 63  LYS H CG  1 
ATOM   1736 C  CD  . LYS B 2 63  ? 8.462   -3.428  26.320  1.00 45.68  ? 63  LYS H CD  1 
ATOM   1737 C  CE  . LYS B 2 63  ? 8.545   -4.685  27.165  1.00 48.55  ? 63  LYS H CE  1 
ATOM   1738 N  NZ  . LYS B 2 63  ? 7.230   -5.374  27.172  1.00 48.91  ? 63  LYS H NZ  1 
ATOM   1739 N  N   . PHE B 2 64  ? 10.932  1.750   24.718  1.00 38.02  ? 64  PHE H N   1 
ATOM   1740 C  CA  . PHE B 2 64  ? 10.702  2.984   23.916  1.00 37.05  ? 64  PHE H CA  1 
ATOM   1741 C  C   . PHE B 2 64  ? 11.955  3.873   23.878  1.00 39.45  ? 64  PHE H C   1 
ATOM   1742 O  O   . PHE B 2 64  ? 11.891  4.925   23.236  1.00 39.96  ? 64  PHE H O   1 
ATOM   1743 C  CB  . PHE B 2 64  ? 9.509   3.756   24.483  1.00 34.52  ? 64  PHE H CB  1 
ATOM   1744 C  CG  . PHE B 2 64  ? 8.202   3.046   24.276  1.00 32.67  ? 64  PHE H CG  1 
ATOM   1745 C  CD1 . PHE B 2 64  ? 7.607   3.057   23.031  1.00 32.08  ? 64  PHE H CD1 1 
ATOM   1746 C  CD2 . PHE B 2 64  ? 7.590   2.320   25.284  1.00 32.07  ? 64  PHE H CD2 1 
ATOM   1747 C  CE1 . PHE B 2 64  ? 6.392   2.422   22.809  1.00 31.76  ? 64  PHE H CE1 1 
ATOM   1748 C  CE2 . PHE B 2 64  ? 6.401   1.630   25.055  1.00 30.94  ? 64  PHE H CE2 1 
ATOM   1749 C  CZ  . PHE B 2 64  ? 5.803   1.684   23.813  1.00 31.52  ? 64  PHE H CZ  1 
ATOM   1750 N  N   . LYS B 2 65  ? 13.058  3.477   24.505  1.00 43.68  ? 65  LYS H N   1 
ATOM   1751 C  CA  . LYS B 2 65  ? 14.252  4.355   24.673  1.00 49.07  ? 65  LYS H CA  1 
ATOM   1752 C  C   . LYS B 2 65  ? 14.771  4.853   23.307  1.00 50.92  ? 65  LYS H C   1 
ATOM   1753 O  O   . LYS B 2 65  ? 15.111  6.043   23.241  1.00 52.68  ? 65  LYS H O   1 
ATOM   1754 C  CB  . LYS B 2 65  ? 15.318  3.619   25.483  1.00 53.65  ? 65  LYS H CB  1 
ATOM   1755 C  CG  . LYS B 2 65  ? 16.587  4.405   25.778  1.00 57.92  ? 65  LYS H CG  1 
ATOM   1756 C  CD  . LYS B 2 65  ? 17.671  3.583   26.479  1.00 62.60  ? 65  LYS H CD  1 
ATOM   1757 C  CE  . LYS B 2 65  ? 17.866  2.178   25.934  1.00 65.64  ? 65  LYS H CE  1 
ATOM   1758 N  NZ  . LYS B 2 65  ? 18.004  2.146   24.456  1.00 68.26  ? 65  LYS H NZ  1 
ATOM   1759 N  N   . ASP B 2 66  ? 14.765  4.023   22.258  1.00 51.34  ? 66  ASP H N   1 
ATOM   1760 C  CA  . ASP B 2 66  ? 15.307  4.355   20.908  1.00 53.47  ? 66  ASP H CA  1 
ATOM   1761 C  C   . ASP B 2 66  ? 14.235  4.972   20.010  1.00 52.41  ? 66  ASP H C   1 
ATOM   1762 O  O   . ASP B 2 66  ? 14.552  5.392   18.872  1.00 58.34  ? 66  ASP H O   1 
ATOM   1763 C  CB  . ASP B 2 66  ? 15.901  3.109   20.245  1.00 56.59  ? 66  ASP H CB  1 
ATOM   1764 C  CG  . ASP B 2 66  ? 17.094  2.543   21.000  1.00 59.77  ? 66  ASP H CG  1 
ATOM   1765 O  OD1 . ASP B 2 66  ? 17.656  3.280   21.838  1.00 60.83  ? 66  ASP H OD1 1 
ATOM   1766 O  OD2 . ASP B 2 66  ? 17.449  1.366   20.756  1.00 62.57  ? 66  ASP H OD2 1 
ATOM   1767 N  N   . LYS B 2 67  ? 12.996  4.998   20.477  1.00 47.66  ? 67  LYS H N   1 
ATOM   1768 C  CA  . LYS B 2 67  ? 11.816  5.418   19.700  1.00 44.08  ? 67  LYS H CA  1 
ATOM   1769 C  C   . LYS B 2 67  ? 11.470  6.863   20.074  1.00 40.18  ? 67  LYS H C   1 
ATOM   1770 O  O   . LYS B 2 67  ? 11.169  7.659   19.166  1.00 39.15  ? 67  LYS H O   1 
ATOM   1771 C  CB  . LYS B 2 67  ? 10.689  4.438   20.055  1.00 45.26  ? 67  LYS H CB  1 
ATOM   1772 C  CG  . LYS B 2 67  ? 9.385   4.597   19.292  1.00 44.61  ? 67  LYS H CG  1 
ATOM   1773 C  CD  . LYS B 2 67  ? 9.538   4.381   17.795  1.00 47.40  ? 67  LYS H CD  1 
ATOM   1774 C  CE  . LYS B 2 67  ? 10.055  3.013   17.402  1.00 48.69  ? 67  LYS H CE  1 
ATOM   1775 N  NZ  . LYS B 2 67  ? 10.021  2.870   15.926  1.00 50.61  ? 67  LYS H NZ  1 
ATOM   1776 N  N   . ALA B 2 68  ? 11.471  7.175   21.377  1.00 35.86  ? 68  ALA H N   1 
ATOM   1777 C  CA  . ALA B 2 68  ? 10.717  8.310   21.941  1.00 33.07  ? 68  ALA H CA  1 
ATOM   1778 C  C   . ALA B 2 68  ? 11.672  9.334   22.551  1.00 32.23  ? 68  ALA H C   1 
ATOM   1779 O  O   . ALA B 2 68  ? 12.558  8.915   23.258  1.00 32.66  ? 68  ALA H O   1 
ATOM   1780 C  CB  . ALA B 2 68  ? 9.714   7.829   22.977  1.00 31.86  ? 68  ALA H CB  1 
ATOM   1781 N  N   . THR B 2 69  ? 11.414  10.622  22.308  1.00 30.67  ? 69  THR H N   1 
ATOM   1782 C  CA  . THR B 2 69  ? 12.020  11.767  23.022  1.00 31.83  ? 69  THR H CA  1 
ATOM   1783 C  C   . THR B 2 69  ? 10.926  12.652  23.634  1.00 29.42  ? 69  THR H C   1 
ATOM   1784 O  O   . THR B 2 69  ? 10.158  13.230  22.889  1.00 28.34  ? 69  THR H O   1 
ATOM   1785 C  CB  . THR B 2 69  ? 12.949  12.560  22.092  1.00 33.15  ? 69  THR H CB  1 
ATOM   1786 O  OG1 . THR B 2 69  ? 13.833  11.630  21.465  1.00 34.48  ? 69  THR H OG1 1 
ATOM   1787 C  CG2 . THR B 2 69  ? 13.779  13.576  22.833  1.00 34.34  ? 69  THR H CG2 1 
ATOM   1788 N  N   . MET B 2 70  ? 10.999  12.873  24.951  1.00 29.13  ? 70  MET H N   1 
ATOM   1789 C  CA  . MET B 2 70  ? 10.090  13.780  25.685  1.00 27.95  ? 70  MET H CA  1 
ATOM   1790 C  C   . MET B 2 70  ? 10.777  15.130  25.968  1.00 29.11  ? 70  MET H C   1 
ATOM   1791 O  O   . MET B 2 70  ? 11.905  15.105  26.503  1.00 30.81  ? 70  MET H O   1 
ATOM   1792 C  CB  . MET B 2 70  ? 9.708   13.105  27.001  1.00 28.06  ? 70  MET H CB  1 
ATOM   1793 C  CG  . MET B 2 70  ? 8.854   11.848  26.818  1.00 26.89  ? 70  MET H CG  1 
ATOM   1794 S  SD  . MET B 2 70  ? 8.498   11.106  28.441  1.00 27.51  ? 70  MET H SD  1 
ATOM   1795 C  CE  . MET B 2 70  ? 10.111  10.576  28.968  1.00 29.74  ? 70  MET H CE  1 
ATOM   1796 N  N   . THR B 2 71  ? 10.084  16.249  25.717  1.00 28.99  ? 71  THR H N   1 
ATOM   1797 C  CA  . THR B 2 71  ? 10.500  17.645  26.051  1.00 30.34  ? 71  THR H CA  1 
ATOM   1798 C  C   . THR B 2 71  ? 9.317   18.440  26.608  1.00 29.75  ? 71  THR H C   1 
ATOM   1799 O  O   . THR B 2 71  ? 8.191   17.968  26.505  1.00 27.07  ? 71  THR H O   1 
ATOM   1800 C  CB  . THR B 2 71  ? 11.074  18.348  24.824  1.00 31.40  ? 71  THR H CB  1 
ATOM   1801 O  OG1 . THR B 2 71  ? 10.142  18.212  23.749  1.00 30.13  ? 71  THR H OG1 1 
ATOM   1802 C  CG2 . THR B 2 71  ? 12.420  17.763  24.448  1.00 33.15  ? 71  THR H CG2 1 
ATOM   1803 N  N   . VAL B 2 72  ? 9.604   19.569  27.268  1.00 31.98  ? 72  VAL H N   1 
ATOM   1804 C  CA  . VAL B 2 72  ? 8.569   20.511  27.776  1.00 33.18  ? 72  VAL H CA  1 
ATOM   1805 C  C   . VAL B 2 72  ? 8.997   21.928  27.428  1.00 35.52  ? 72  VAL H C   1 
ATOM   1806 O  O   . VAL B 2 72  ? 10.212  22.171  27.421  1.00 37.37  ? 72  VAL H O   1 
ATOM   1807 C  CB  . VAL B 2 72  ? 8.311   20.406  29.289  1.00 33.68  ? 72  VAL H CB  1 
ATOM   1808 C  CG1 . VAL B 2 72  ? 7.806   19.030  29.654  1.00 33.83  ? 72  VAL H CG1 1 
ATOM   1809 C  CG2 . VAL B 2 72  ? 9.526   20.784  30.106  1.00 36.23  ? 72  VAL H CG2 1 
ATOM   1810 N  N   . ASP B 2 73  ? 8.000   22.785  27.216  1.00 36.36  ? 73  ASP H N   1 
ATOM   1811 C  CA  . ASP B 2 73  ? 8.092   24.265  27.193  1.00 40.44  ? 73  ASP H CA  1 
ATOM   1812 C  C   . ASP B 2 73  ? 7.251   24.845  28.343  1.00 40.43  ? 73  ASP H C   1 
ATOM   1813 O  O   . ASP B 2 73  ? 6.005   24.954  28.198  1.00 37.76  ? 73  ASP H O   1 
ATOM   1814 C  CB  . ASP B 2 73  ? 7.613   24.826  25.862  1.00 42.29  ? 73  ASP H CB  1 
ATOM   1815 C  CG  . ASP B 2 73  ? 7.882   26.314  25.783  1.00 47.25  ? 73  ASP H CG  1 
ATOM   1816 O  OD1 . ASP B 2 73  ? 6.911   27.103  25.677  1.00 49.74  ? 73  ASP H OD1 1 
ATOM   1817 O  OD2 . ASP B 2 73  ? 9.058   26.657  25.868  1.00 51.51  ? 73  ASP H OD2 1 
ATOM   1818 N  N   . ILE B 2 74  ? 7.903   25.278  29.430  1.00 42.21  ? 74  ILE H N   1 
ATOM   1819 C  CA  . ILE B 2 74  ? 7.147   25.671  30.652  1.00 43.93  ? 74  ILE H CA  1 
ATOM   1820 C  C   . ILE B 2 74  ? 6.292   26.903  30.355  1.00 45.11  ? 74  ILE H C   1 
ATOM   1821 O  O   . ILE B 2 74  ? 5.132   26.971  30.857  1.00 45.06  ? 74  ILE H O   1 
ATOM   1822 C  CB  . ILE B 2 74  ? 8.081   25.867  31.846  1.00 46.54  ? 74  ILE H CB  1 
ATOM   1823 C  CG1 . ILE B 2 74  ? 8.705   24.517  32.224  1.00 46.65  ? 74  ILE H CG1 1 
ATOM   1824 C  CG2 . ILE B 2 74  ? 7.341   26.524  33.007  1.00 47.33  ? 74  ILE H CG2 1 
ATOM   1825 C  CD1 . ILE B 2 74  ? 10.160  24.605  32.622  1.00 48.93  ? 74  ILE H CD1 1 
ATOM   1826 N  N   . SER B 2 75  ? 6.812   27.807  29.516  1.00 47.06  ? 75  SER H N   1 
ATOM   1827 C  CA  . SER B 2 75  ? 6.206   29.139  29.277  1.00 49.48  ? 75  SER H CA  1 
ATOM   1828 C  C   . SER B 2 75  ? 4.816   28.922  28.674  1.00 47.46  ? 75  SER H C   1 
ATOM   1829 O  O   . SER B 2 75  ? 3.859   29.612  29.076  1.00 48.85  ? 75  SER H O   1 
ATOM   1830 C  CB  . SER B 2 75  ? 7.109   30.027  28.426  1.00 52.20  ? 75  SER H CB  1 
ATOM   1831 O  OG  . SER B 2 75  ? 7.124   29.579  27.073  1.00 52.54  ? 75  SER H OG  1 
ATOM   1832 N  N   . SER B 2 76  ? 4.683   27.904  27.826  1.00 44.79  ? 76  SER H N   1 
ATOM   1833 C  CA  . SER B 2 76  ? 3.430   27.575  27.111  1.00 40.75  ? 76  SER H CA  1 
ATOM   1834 C  C   . SER B 2 76  ? 2.710   26.393  27.779  1.00 37.46  ? 76  SER H C   1 
ATOM   1835 O  O   . SER B 2 76  ? 1.755   25.894  27.177  1.00 35.42  ? 76  SER H O   1 
ATOM   1836 C  CB  . SER B 2 76  ? 3.742   27.287  25.663  1.00 40.65  ? 76  SER H CB  1 
ATOM   1837 O  OG  . SER B 2 76  ? 4.526   26.095  25.529  1.00 39.98  ? 76  SER H OG  1 
ATOM   1838 N  N   . SER B 2 77  ? 3.153   25.936  28.950  1.00 35.86  ? 77  SER H N   1 
ATOM   1839 C  CA  . SER B 2 77  ? 2.538   24.786  29.655  1.00 34.54  ? 77  SER H CA  1 
ATOM   1840 C  C   . SER B 2 77  ? 2.292   23.627  28.671  1.00 32.01  ? 77  SER H C   1 
ATOM   1841 O  O   . SER B 2 77  ? 1.232   23.006  28.769  1.00 31.01  ? 77  SER H O   1 
ATOM   1842 C  CB  . SER B 2 77  ? 1.276   25.222  30.348  1.00 34.66  ? 77  SER H CB  1 
ATOM   1843 O  OG  . SER B 2 77  ? 1.570   26.176  31.371  1.00 37.94  ? 77  SER H OG  1 
ATOM   1844 N  N   . THR B 2 78  ? 3.264   23.322  27.798  1.00 31.32  ? 78  THR H N   1 
ATOM   1845 C  CA  . THR B 2 78  ? 3.160   22.254  26.769  1.00 30.14  ? 78  THR H CA  1 
ATOM   1846 C  C   . THR B 2 78  ? 4.298   21.216  26.893  1.00 30.19  ? 78  THR H C   1 
ATOM   1847 O  O   . THR B 2 78  ? 5.483   21.606  26.996  1.00 31.35  ? 78  THR H O   1 
ATOM   1848 C  CB  . THR B 2 78  ? 3.082   22.878  25.371  1.00 30.79  ? 78  THR H CB  1 
ATOM   1849 O  OG1 . THR B 2 78  ? 2.000   23.827  25.357  1.00 30.65  ? 78  THR H OG1 1 
ATOM   1850 C  CG2 . THR B 2 78  ? 2.869   21.817  24.310  1.00 29.39  ? 78  THR H CG2 1 
ATOM   1851 N  N   . ALA B 2 79  ? 3.943   19.927  26.844  1.00 28.18  ? 79  ALA H N   1 
ATOM   1852 C  CA  . ALA B 2 79  ? 4.881   18.780  26.727  1.00 27.81  ? 79  ALA H CA  1 
ATOM   1853 C  C   . ALA B 2 79  ? 4.795   18.237  25.304  1.00 27.06  ? 79  ALA H C   1 
ATOM   1854 O  O   . ALA B 2 79  ? 3.645   18.258  24.730  1.00 26.49  ? 79  ALA H O   1 
ATOM   1855 C  CB  . ALA B 2 79  ? 4.520   17.699  27.724  1.00 27.13  ? 79  ALA H CB  1 
ATOM   1856 N  N   . TYR B 2 80  ? 5.922   17.736  24.791  1.00 27.07  ? 80  TYR H N   1 
ATOM   1857 C  CA  . TYR B 2 80  ? 6.071   17.174  23.429  1.00 27.47  ? 80  TYR H CA  1 
ATOM   1858 C  C   . TYR B 2 80  ? 6.603   15.746  23.520  1.00 26.64  ? 80  TYR H C   1 
ATOM   1859 O  O   . TYR B 2 80  ? 7.456   15.431  24.370  1.00 26.07  ? 80  TYR H O   1 
ATOM   1860 C  CB  . TYR B 2 80  ? 6.963   18.040  22.533  1.00 30.45  ? 80  TYR H CB  1 
ATOM   1861 C  CG  . TYR B 2 80  ? 6.491   19.469  22.391  1.00 32.57  ? 80  TYR H CG  1 
ATOM   1862 C  CD1 . TYR B 2 80  ? 5.670   19.871  21.343  1.00 32.44  ? 80  TYR H CD1 1 
ATOM   1863 C  CD2 . TYR B 2 80  ? 6.880   20.429  23.316  1.00 34.79  ? 80  TYR H CD2 1 
ATOM   1864 C  CE1 . TYR B 2 80  ? 5.212   21.176  21.239  1.00 34.31  ? 80  TYR H CE1 1 
ATOM   1865 C  CE2 . TYR B 2 80  ? 6.456   21.744  23.220  1.00 36.40  ? 80  TYR H CE2 1 
ATOM   1866 C  CZ  . TYR B 2 80  ? 5.603   22.111  22.194  1.00 37.61  ? 80  TYR H CZ  1 
ATOM   1867 O  OH  . TYR B 2 80  ? 5.194   23.406  22.133  1.00 40.51  ? 80  TYR H OH  1 
ATOM   1868 N  N   . LEU B 2 81  ? 6.061   14.892  22.648  1.00 24.58  ? 81  LEU H N   1 
ATOM   1869 C  CA  . LEU B 2 81  ? 6.574   13.540  22.404  1.00 25.21  ? 81  LEU H CA  1 
ATOM   1870 C  C   . LEU B 2 81  ? 6.989   13.441  20.938  1.00 26.45  ? 81  LEU H C   1 
ATOM   1871 O  O   . LEU B 2 81  ? 6.137   13.604  20.043  1.00 25.13  ? 81  LEU H O   1 
ATOM   1872 C  CB  . LEU B 2 81  ? 5.508   12.496  22.770  1.00 23.95  ? 81  LEU H CB  1 
ATOM   1873 C  CG  . LEU B 2 81  ? 5.934   11.028  22.614  1.00 24.40  ? 81  LEU H CG  1 
ATOM   1874 C  CD1 . LEU B 2 81  ? 6.975   10.648  23.627  1.00 26.73  ? 81  LEU H CD1 1 
ATOM   1875 C  CD2 . LEU B 2 81  ? 4.728   10.091  22.714  1.00 23.46  ? 81  LEU H CD2 1 
ATOM   1876 N  N   . GLU B 2 82  ? 8.252   13.111  20.710  1.00 28.25  ? 82  GLU H N   1 
ATOM   1877 C  CA  . GLU B 2 82  ? 8.804   12.921  19.350  1.00 30.62  ? 82  GLU H CA  1 
ATOM   1878 C  C   . GLU B 2 82  ? 9.042   11.420  19.200  1.00 30.37  ? 82  GLU H C   1 
ATOM   1879 O  O   . GLU B 2 82  ? 9.707   10.841  20.044  1.00 31.68  ? 82  GLU H O   1 
ATOM   1880 C  CB  . GLU B 2 82  ? 10.065  13.785  19.118  1.00 32.90  ? 82  GLU H CB  1 
ATOM   1881 C  CG  . GLU B 2 82  ? 10.587  13.641  17.693  1.00 35.25  ? 82  GLU H CG  1 
ATOM   1882 C  CD  . GLU B 2 82  ? 11.702  14.573  17.225  1.00 38.47  ? 82  GLU H CD  1 
ATOM   1883 O  OE1 . GLU B 2 82  ? 12.372  15.172  18.066  1.00 39.82  ? 82  GLU H OE1 1 
ATOM   1884 O  OE2 . GLU B 2 82  ? 11.822  14.746  15.994  1.00 41.64  ? 82  GLU H OE2 1 
ATOM   1885 N  N   . LEU B 2 83  ? 8.483   10.813  18.167  1.00 30.93  ? 83  LEU H N   1 
ATOM   1886 C  CA  . LEU B 2 83  ? 8.647   9.374   17.863  1.00 32.37  ? 83  LEU H CA  1 
ATOM   1887 C  C   . LEU B 2 83  ? 9.399   9.286   16.543  1.00 33.91  ? 83  LEU H C   1 
ATOM   1888 O  O   . LEU B 2 83  ? 8.982   9.988   15.588  1.00 32.40  ? 83  LEU H O   1 
ATOM   1889 C  CB  . LEU B 2 83  ? 7.269   8.715   17.733  1.00 32.26  ? 83  LEU H CB  1 
ATOM   1890 C  CG  . LEU B 2 83  ? 6.357   8.788   18.953  1.00 32.22  ? 83  LEU H CG  1 
ATOM   1891 C  CD1 . LEU B 2 83  ? 4.949   8.344   18.560  1.00 32.92  ? 83  LEU H CD1 1 
ATOM   1892 C  CD2 . LEU B 2 83  ? 6.871   7.948   20.098  1.00 33.45  ? 83  LEU H CD2 1 
ATOM   1893 N  N   . ALA B 2 84  ? 10.485  8.513   16.514  1.00 37.41  ? 84  ALA H N   1 
ATOM   1894 C  CA  . ALA B 2 84  ? 11.424  8.434   15.379  1.00 40.09  ? 84  ALA H CA  1 
ATOM   1895 C  C   . ALA B 2 84  ? 11.417  7.001   14.824  1.00 41.80  ? 84  ALA H C   1 
ATOM   1896 O  O   . ALA B 2 84  ? 11.007  6.049   15.581  1.00 41.80  ? 84  ALA H O   1 
ATOM   1897 C  CB  . ALA B 2 84  ? 12.816  8.832   15.812  1.00 43.21  ? 84  ALA H CB  1 
ATOM   1898 N  N   . ARG B 2 85  ? 11.832  6.917   13.537  1.00 43.91  ? 85  ARG H N   1 
ATOM   1899 C  CA  . ARG B 2 85  ? 12.035  5.671   12.761  1.00 47.40  ? 85  ARG H CA  1 
ATOM   1900 C  C   . ARG B 2 85  ? 10.791  4.788   12.928  1.00 45.39  ? 85  ARG H C   1 
ATOM   1901 O  O   . ARG B 2 85  ? 10.907  3.649   13.413  1.00 46.59  ? 85  ARG H O   1 
ATOM   1902 C  CB  . ARG B 2 85  ? 13.359  5.057   13.215  1.00 51.56  ? 85  ARG H CB  1 
ATOM   1903 C  CG  . ARG B 2 85  ? 14.520  6.040   13.095  1.00 55.12  ? 85  ARG H CG  1 
ATOM   1904 C  CD  . ARG B 2 85  ? 15.883  5.448   13.362  1.00 58.90  ? 85  ARG H CD  1 
ATOM   1905 N  NE  . ARG B 2 85  ? 15.942  4.771   14.651  1.00 60.72  ? 85  ARG H NE  1 
ATOM   1906 C  CZ  . ARG B 2 85  ? 16.009  5.361   15.844  1.00 61.13  ? 85  ARG H CZ  1 
ATOM   1907 N  NH1 . ARG B 2 85  ? 16.018  6.681   15.965  1.00 61.53  ? 85  ARG H NH1 1 
ATOM   1908 N  NH2 . ARG B 2 85  ? 16.090  4.609   16.926  1.00 62.86  ? 85  ARG H NH2 1 
ATOM   1909 N  N   . LEU B 2 86  ? 9.631   5.348   12.572  1.00 42.49  ? 86  LEU H N   1 
ATOM   1910 C  CA  . LEU B 2 86  ? 8.310   4.725   12.812  1.00 39.70  ? 86  LEU H CA  1 
ATOM   1911 C  C   . LEU B 2 86  ? 8.124   3.529   11.869  1.00 37.98  ? 86  LEU H C   1 
ATOM   1912 O  O   . LEU B 2 86  ? 8.585   3.592   10.723  1.00 38.60  ? 86  LEU H O   1 
ATOM   1913 C  CB  . LEU B 2 86  ? 7.215   5.767   12.575  1.00 39.50  ? 86  LEU H CB  1 
ATOM   1914 C  CG  . LEU B 2 86  ? 7.231   6.992   13.486  1.00 40.12  ? 86  LEU H CG  1 
ATOM   1915 C  CD1 . LEU B 2 86  ? 6.389   8.118   12.904  1.00 40.67  ? 86  LEU H CD1 1 
ATOM   1916 C  CD2 . LEU B 2 86  ? 6.783   6.632   14.888  1.00 40.02  ? 86  LEU H CD2 1 
ATOM   1917 N  N   . THR B 2 87  ? 7.415   2.512   12.356  1.00 35.63  ? 87  THR H N   1 
ATOM   1918 C  CA  . THR B 2 87  ? 6.826   1.402   11.573  1.00 35.29  ? 87  THR H CA  1 
ATOM   1919 C  C   . THR B 2 87  ? 5.337   1.370   11.895  1.00 33.56  ? 87  THR H C   1 
ATOM   1920 O  O   . THR B 2 87  ? 4.922   2.122   12.808  1.00 30.42  ? 87  THR H O   1 
ATOM   1921 C  CB  . THR B 2 87  ? 7.477   0.066   11.940  1.00 37.16  ? 87  THR H CB  1 
ATOM   1922 O  OG1 . THR B 2 87  ? 7.155   -0.194  13.306  1.00 34.98  ? 87  THR H OG1 1 
ATOM   1923 C  CG2 . THR B 2 87  ? 8.985   0.084   11.792  1.00 39.59  ? 87  THR H CG2 1 
ATOM   1924 N  N   . SER B 2 88  ? 4.586   0.500   11.223  1.00 35.30  ? 88  SER H N   1 
ATOM   1925 C  CA  . SER B 2 88  ? 3.134   0.290   11.459  1.00 36.36  ? 88  SER H CA  1 
ATOM   1926 C  C   . SER B 2 88  ? 2.874   -0.209  12.895  1.00 36.47  ? 88  SER H C   1 
ATOM   1927 O  O   . SER B 2 88  ? 1.784   0.083   13.424  1.00 37.53  ? 88  SER H O   1 
ATOM   1928 C  CB  . SER B 2 88  ? 2.552   -0.628  10.415  1.00 38.43  ? 88  SER H CB  1 
ATOM   1929 O  OG  . SER B 2 88  ? 2.994   -1.948  10.655  1.00 42.55  ? 88  SER H OG  1 
ATOM   1930 N  N   . GLU B 2 89  ? 3.841   -0.829  13.551  1.00 37.89  ? 89  GLU H N   1 
ATOM   1931 C  CA  . GLU B 2 89  ? 3.724   -1.207  14.995  1.00 40.14  ? 89  GLU H CA  1 
ATOM   1932 C  C   . GLU B 2 89  ? 3.523   0.067   15.838  1.00 34.51  ? 89  GLU H C   1 
ATOM   1933 O  O   . GLU B 2 89  ? 3.125   -0.039  17.018  1.00 35.23  ? 89  GLU H O   1 
ATOM   1934 C  CB  . GLU B 2 89  ? 4.940   -1.946  15.581  1.00 45.42  ? 89  GLU H CB  1 
ATOM   1935 C  CG  . GLU B 2 89  ? 5.719   -2.893  14.659  1.00 53.85  ? 89  GLU H CG  1 
ATOM   1936 C  CD  . GLU B 2 89  ? 5.004   -3.856  13.704  1.00 59.58  ? 89  GLU H CD  1 
ATOM   1937 O  OE1 . GLU B 2 89  ? 3.736   -3.836  13.624  1.00 63.16  ? 89  GLU H OE1 1 
ATOM   1938 O  OE2 . GLU B 2 89  ? 5.734   -4.644  13.019  1.00 64.04  ? 89  GLU H OE2 1 
ATOM   1939 N  N   . ASP B 2 90  ? 3.884   1.230   15.310  1.00 30.99  ? 90  ASP H N   1 
ATOM   1940 C  CA  . ASP B 2 90  ? 3.785   2.496   16.072  1.00 28.23  ? 90  ASP H CA  1 
ATOM   1941 C  C   . ASP B 2 90  ? 2.393   3.094   15.896  1.00 24.82  ? 90  ASP H C   1 
ATOM   1942 O  O   . ASP B 2 90  ? 2.127   4.061   16.609  1.00 23.03  ? 90  ASP H O   1 
ATOM   1943 C  CB  . ASP B 2 90  ? 4.944   3.450   15.766  1.00 28.49  ? 90  ASP H CB  1 
ATOM   1944 C  CG  . ASP B 2 90  ? 6.323   2.907   16.119  1.00 30.96  ? 90  ASP H CG  1 
ATOM   1945 O  OD1 . ASP B 2 90  ? 6.562   2.564   17.327  1.00 31.21  ? 90  ASP H OD1 1 
ATOM   1946 O  OD2 . ASP B 2 90  ? 7.165   2.829   15.209  1.00 31.82  ? 90  ASP H OD2 1 
ATOM   1947 N  N   . SER B 2 91  ? 1.558   2.630   14.945  1.00 24.49  ? 91  SER H N   1 
ATOM   1948 C  CA  . SER B 2 91  ? 0.170   3.151   14.814  1.00 23.54  ? 91  SER H CA  1 
ATOM   1949 C  C   . SER B 2 91  ? -0.568  2.909   16.143  1.00 23.76  ? 91  SER H C   1 
ATOM   1950 O  O   . SER B 2 91  ? -0.595  1.748   16.596  1.00 25.72  ? 91  SER H O   1 
ATOM   1951 C  CB  . SER B 2 91  ? -0.593  2.568   13.662  1.00 24.77  ? 91  SER H CB  1 
ATOM   1952 O  OG  . SER B 2 91  ? 0.091   2.811   12.446  1.00 24.42  ? 91  SER H OG  1 
ATOM   1953 N  N   . ALA B 2 92  ? -1.149  3.942   16.725  1.00 22.29  ? 92  ALA H N   1 
ATOM   1954 C  CA  . ALA B 2 92  ? -1.796  3.870   18.053  1.00 22.18  ? 92  ALA H CA  1 
ATOM   1955 C  C   . ALA B 2 92  ? -2.408  5.217   18.398  1.00 20.74  ? 92  ALA H C   1 
ATOM   1956 O  O   . ALA B 2 92  ? -2.128  6.246   17.694  1.00 19.89  ? 92  ALA H O   1 
ATOM   1957 C  CB  . ALA B 2 92  ? -0.791  3.457   19.082  1.00 22.71  ? 92  ALA H CB  1 
ATOM   1958 N  N   . ILE B 2 93  ? -3.209  5.211   19.457  1.00 20.06  ? 93  ILE H N   1 
ATOM   1959 C  CA  . ILE B 2 93  ? -3.574  6.424   20.221  1.00 20.32  ? 93  ILE H CA  1 
ATOM   1960 C  C   . ILE B 2 93  ? -2.462  6.691   21.251  1.00 19.25  ? 93  ILE H C   1 
ATOM   1961 O  O   . ILE B 2 93  ? -2.069  5.732   21.999  1.00 19.11  ? 93  ILE H O   1 
ATOM   1962 C  CB  . ILE B 2 93  ? -4.950  6.304   20.904  1.00 23.27  ? 93  ILE H CB  1 
ATOM   1963 C  CG1 . ILE B 2 93  ? -6.090  6.148   19.908  1.00 26.22  ? 93  ILE H CG1 1 
ATOM   1964 C  CG2 . ILE B 2 93  ? -5.175  7.535   21.746  1.00 24.03  ? 93  ILE H CG2 1 
ATOM   1965 C  CD1 . ILE B 2 93  ? -7.464  6.028   20.565  1.00 28.62  ? 93  ILE H CD1 1 
ATOM   1966 N  N   . TYR B 2 94  ? -1.942  7.908   21.256  1.00 17.84  ? 94  TYR H N   1 
ATOM   1967 C  CA  . TYR B 2 94  ? -0.955  8.334   22.266  1.00 18.48  ? 94  TYR H CA  1 
ATOM   1968 C  C   . TYR B 2 94  ? -1.655  9.280   23.223  1.00 17.63  ? 94  TYR H C   1 
ATOM   1969 O  O   . TYR B 2 94  ? -2.222  10.300  22.798  1.00 16.55  ? 94  TYR H O   1 
ATOM   1970 C  CB  . TYR B 2 94  ? 0.298   8.920   21.611  1.00 18.38  ? 94  TYR H CB  1 
ATOM   1971 C  CG  . TYR B 2 94  ? 1.042   7.898   20.837  1.00 19.26  ? 94  TYR H CG  1 
ATOM   1972 C  CD1 . TYR B 2 94  ? 0.659   7.529   19.563  1.00 19.09  ? 94  TYR H CD1 1 
ATOM   1973 C  CD2 . TYR B 2 94  ? 2.112   7.231   21.406  1.00 20.58  ? 94  TYR H CD2 1 
ATOM   1974 C  CE1 . TYR B 2 94  ? 1.349   6.539   18.871  1.00 20.00  ? 94  TYR H CE1 1 
ATOM   1975 C  CE2 . TYR B 2 94  ? 2.791   6.231   20.731  1.00 21.31  ? 94  TYR H CE2 1 
ATOM   1976 C  CZ  . TYR B 2 94  ? 2.415   5.882   19.448  1.00 20.81  ? 94  TYR H CZ  1 
ATOM   1977 O  OH  . TYR B 2 94  ? 3.153   4.920   18.798  1.00 21.51  ? 94  TYR H OH  1 
ATOM   1978 N  N   . TYR B 2 95  ? -1.575  8.984   24.512  1.00 17.45  ? 95  TYR H N   1 
ATOM   1979 C  CA  . TYR B 2 95  ? -2.133  9.883   25.534  1.00 17.85  ? 95  TYR H CA  1 
ATOM   1980 C  C   . TYR B 2 95  ? -0.990  10.521  26.339  1.00 18.09  ? 95  TYR H C   1 
ATOM   1981 O  O   . TYR B 2 95  ? 0.069   9.882   26.547  1.00 18.29  ? 95  TYR H O   1 
ATOM   1982 C  CB  . TYR B 2 95  ? -2.959  9.151   26.591  1.00 19.31  ? 95  TYR H CB  1 
ATOM   1983 C  CG  . TYR B 2 95  ? -4.211  8.481   26.090  1.00 19.07  ? 95  TYR H CG  1 
ATOM   1984 C  CD1 . TYR B 2 95  ? -5.356  9.209   25.824  1.00 19.41  ? 95  TYR H CD1 1 
ATOM   1985 C  CD2 . TYR B 2 95  ? -4.243  7.122   25.862  1.00 19.84  ? 95  TYR H CD2 1 
ATOM   1986 C  CE1 . TYR B 2 95  ? -6.509  8.595   25.370  1.00 19.69  ? 95  TYR H CE1 1 
ATOM   1987 C  CE2 . TYR B 2 95  ? -5.394  6.486   25.436  1.00 20.31  ? 95  TYR H CE2 1 
ATOM   1988 C  CZ  . TYR B 2 95  ? -6.528  7.233   25.161  1.00 20.10  ? 95  TYR H CZ  1 
ATOM   1989 O  OH  . TYR B 2 95  ? -7.661  6.594   24.683  1.00 21.49  ? 95  TYR H OH  1 
ATOM   1990 N  N   . CYS B 2 96  ? -1.206  11.754  26.763  1.00 17.63  ? 96  CYS H N   1 
ATOM   1991 C  CA  . CYS B 2 96  ? -0.473  12.325  27.918  1.00 19.02  ? 96  CYS H CA  1 
ATOM   1992 C  C   . CYS B 2 96  ? -1.361  12.165  29.136  1.00 18.58  ? 96  CYS H C   1 
ATOM   1993 O  O   . CYS B 2 96  ? -2.601  12.124  28.972  1.00 17.41  ? 96  CYS H O   1 
ATOM   1994 C  CB  . CYS B 2 96  ? -0.064  13.758  27.654  1.00 20.72  ? 96  CYS H CB  1 
ATOM   1995 S  SG  . CYS B 2 96  ? -1.456  14.884  27.431  1.00 22.63  ? 96  CYS H SG  1 
ATOM   1996 N  N   . ALA B 2 97  ? -0.764  12.088  30.339  1.00 19.06  ? 97  ALA H N   1 
ATOM   1997 C  CA  . ALA B 2 97  ? -1.540  11.882  31.559  1.00 19.80  ? 97  ALA H CA  1 
ATOM   1998 C  C   . ALA B 2 97  ? -0.738  12.459  32.719  1.00 19.97  ? 97  ALA H C   1 
ATOM   1999 O  O   . ALA B 2 97  ? 0.499   12.361  32.671  1.00 20.76  ? 97  ALA H O   1 
ATOM   2000 C  CB  . ALA B 2 97  ? -1.818  10.422  31.795  1.00 20.08  ? 97  ALA H CB  1 
ATOM   2001 N  N   . ARG B 2 98  ? -1.421  13.129  33.614  1.00 20.31  ? 98  ARG H N   1 
ATOM   2002 C  CA  . ARG B 2 98  ? -0.810  13.790  34.782  1.00 22.22  ? 98  ARG H CA  1 
ATOM   2003 C  C   . ARG B 2 98  ? -0.827  12.850  35.976  1.00 23.08  ? 98  ARG H C   1 
ATOM   2004 O  O   . ARG B 2 98  ? -1.844  12.207  36.196  1.00 22.74  ? 98  ARG H O   1 
ATOM   2005 C  CB  . ARG B 2 98  ? -1.664  15.008  35.101  1.00 23.67  ? 98  ARG H CB  1 
ATOM   2006 C  CG  . ARG B 2 98  ? -0.940  16.127  35.809  1.00 26.65  ? 98  ARG H CG  1 
ATOM   2007 C  CD  . ARG B 2 98  ? -1.978  17.158  36.230  1.00 28.22  ? 98  ARG H CD  1 
ATOM   2008 N  NE  . ARG B 2 98  ? -2.779  16.686  37.356  1.00 29.96  ? 98  ARG H NE  1 
ATOM   2009 C  CZ  . ARG B 2 98  ? -3.265  17.479  38.306  1.00 32.70  ? 98  ARG H CZ  1 
ATOM   2010 N  NH1 . ARG B 2 98  ? -3.038  18.780  38.253  1.00 33.31  ? 98  ARG H NH1 1 
ATOM   2011 N  NH2 . ARG B 2 98  ? -3.932  16.972  39.334  1.00 34.22  ? 98  ARG H NH2 1 
ATOM   2012 N  N   . ASP B 2 99  ? 0.221   12.861  36.799  1.00 23.41  ? 99  ASP H N   1 
ATOM   2013 C  CA  . ASP B 2 99  ? 0.124   12.252  38.149  1.00 25.31  ? 99  ASP H CA  1 
ATOM   2014 C  C   . ASP B 2 99  ? -0.151  13.389  39.133  1.00 25.91  ? 99  ASP H C   1 
ATOM   2015 O  O   . ASP B 2 99  ? -0.273  14.571  38.725  1.00 25.92  ? 99  ASP H O   1 
ATOM   2016 C  CB  . ASP B 2 99  ? 1.310   11.329  38.460  1.00 26.37  ? 99  ASP H CB  1 
ATOM   2017 C  CG  . ASP B 2 99  ? 2.610   12.004  38.851  1.00 28.63  ? 99  ASP H CG  1 
ATOM   2018 O  OD1 . ASP B 2 99  ? 2.602   12.715  39.890  1.00 30.73  ? 99  ASP H OD1 1 
ATOM   2019 O  OD2 . ASP B 2 99  ? 3.622   11.699  38.235  1.00 30.15  ? 99  ASP H OD2 1 
ATOM   2020 N  N   . TRP B 2 100 ? -0.369  13.032  40.388  1.00 25.77  ? 100 TRP H N   1 
ATOM   2021 C  CA  . TRP B 2 100 ? -0.751  14.024  41.405  1.00 27.44  ? 100 TRP H CA  1 
ATOM   2022 C  C   . TRP B 2 100 ? 0.099   13.787  42.659  1.00 27.07  ? 100 TRP H C   1 
ATOM   2023 O  O   . TRP B 2 100 ? -0.335  14.136  43.755  1.00 27.94  ? 100 TRP H O   1 
ATOM   2024 C  CB  . TRP B 2 100 ? -2.273  13.990  41.619  1.00 29.16  ? 100 TRP H CB  1 
ATOM   2025 C  CG  . TRP B 2 100 ? -2.919  12.639  41.785  1.00 31.23  ? 100 TRP H CG  1 
ATOM   2026 C  CD1 . TRP B 2 100 ? -2.983  11.584  40.906  1.00 31.26  ? 100 TRP H CD1 1 
ATOM   2027 C  CD2 . TRP B 2 100 ? -3.740  12.267  42.895  1.00 33.37  ? 100 TRP H CD2 1 
ATOM   2028 N  NE1 . TRP B 2 100 ? -3.740  10.566  41.425  1.00 32.62  ? 100 TRP H NE1 1 
ATOM   2029 C  CE2 . TRP B 2 100 ? -4.197  10.953  42.660  1.00 33.58  ? 100 TRP H CE2 1 
ATOM   2030 C  CE3 . TRP B 2 100 ? -4.058  12.893  44.105  1.00 34.87  ? 100 TRP H CE3 1 
ATOM   2031 C  CZ2 . TRP B 2 100 ? -5.023  10.292  43.563  1.00 34.45  ? 100 TRP H CZ2 1 
ATOM   2032 C  CZ3 . TRP B 2 100 ? -4.890  12.240  44.984  1.00 37.00  ? 100 TRP H CZ3 1 
ATOM   2033 C  CH2 . TRP B 2 100 ? -5.344  10.943  44.727  1.00 36.90  ? 100 TRP H CH2 1 
ATOM   2034 N  N   . GLU B 2 101 ? 1.311   13.286  42.435  1.00 26.20  ? 101 GLU H N   1 
ATOM   2035 C  CA  . GLU B 2 101 ? 2.370   13.155  43.447  1.00 28.22  ? 101 GLU H CA  1 
ATOM   2036 C  C   . GLU B 2 101 ? 1.901   12.164  44.516  1.00 28.95  ? 101 GLU H C   1 
ATOM   2037 O  O   . GLU B 2 101 ? 2.216   12.340  45.707  1.00 29.51  ? 101 GLU H O   1 
ATOM   2038 C  CB  . GLU B 2 101 ? 2.753   14.543  43.982  1.00 29.26  ? 101 GLU H CB  1 
ATOM   2039 C  CG  . GLU B 2 101 ? 4.194   14.577  44.364  1.00 30.51  ? 101 GLU H CG  1 
ATOM   2040 C  CD  . GLU B 2 101 ? 4.782   15.968  44.609  1.00 31.52  ? 101 GLU H CD  1 
ATOM   2041 O  OE1 . GLU B 2 101 ? 6.092   15.851  45.084  1.00 32.27  ? 101 GLU H OE1 1 
ATOM   2042 O  OE2 . GLU B 2 101 ? 4.098   17.027  44.316  1.00 32.31  ? 101 GLU H OE2 1 
ATOM   2043 N  N   . ARG B 2 102 ? 1.184   11.124  44.085  1.00 29.17  ? 102 ARG H N   1 
ATOM   2044 C  CA  . ARG B 2 102 ? 0.737   10.003  44.953  1.00 31.60  ? 102 ARG H CA  1 
ATOM   2045 C  C   . ARG B 2 102 ? 1.404   8.676   44.547  1.00 30.96  ? 102 ARG H C   1 
ATOM   2046 O  O   . ARG B 2 102 ? 1.097   7.655   45.146  1.00 33.25  ? 102 ARG H O   1 
ATOM   2047 C  CB  . ARG B 2 102 ? -0.764  9.733   44.808  1.00 32.78  ? 102 ARG H CB  1 
ATOM   2048 C  CG  . ARG B 2 102 ? -1.654  10.899  45.170  1.00 34.36  ? 102 ARG H CG  1 
ATOM   2049 C  CD  . ARG B 2 102 ? -1.290  11.537  46.499  1.00 35.91  ? 102 ARG H CD  1 
ATOM   2050 N  NE  . ARG B 2 102 ? -1.603  10.773  47.682  1.00 38.13  ? 102 ARG H NE  1 
ATOM   2051 C  CZ  . ARG B 2 102 ? -1.334  11.178  48.941  1.00 39.69  ? 102 ARG H CZ  1 
ATOM   2052 N  NH1 . ARG B 2 102 ? -0.727  12.343  49.170  1.00 38.80  ? 102 ARG H NH1 1 
ATOM   2053 N  NH2 . ARG B 2 102 ? -1.696  10.399  49.951  1.00 39.80  ? 102 ARG H NH2 1 
ATOM   2054 N  N   . GLY B 2 103 ? 2.186   8.702   43.447  1.00 28.95  ? 103 GLY H N   1 
ATOM   2055 C  CA  . GLY B 2 103 ? 2.650   7.487   42.757  1.00 28.68  ? 103 GLY H CA  1 
ATOM   2056 C  C   . GLY B 2 103 ? 2.455   7.625   41.255  1.00 27.16  ? 103 GLY H C   1 
ATOM   2057 O  O   . GLY B 2 103 ? 1.926   8.655   40.837  1.00 26.17  ? 103 GLY H O   1 
ATOM   2058 N  N   . ASP B 2 104 ? 2.955   6.682   40.465  1.00 27.37  ? 104 ASP H N   1 
ATOM   2059 C  CA  . ASP B 2 104 ? 2.988   6.800   38.988  1.00 26.95  ? 104 ASP H CA  1 
ATOM   2060 C  C   . ASP B 2 104 ? 1.671   6.234   38.407  1.00 26.53  ? 104 ASP H C   1 
ATOM   2061 O  O   . ASP B 2 104 ? 1.677   5.205   37.714  1.00 26.11  ? 104 ASP H O   1 
ATOM   2062 C  CB  . ASP B 2 104 ? 4.283   6.197   38.435  1.00 28.99  ? 104 ASP H CB  1 
ATOM   2063 C  CG  . ASP B 2 104 ? 5.516   6.923   38.965  1.00 31.11  ? 104 ASP H CG  1 
ATOM   2064 O  OD1 . ASP B 2 104 ? 5.696   8.094   38.614  1.00 33.46  ? 104 ASP H OD1 1 
ATOM   2065 O  OD2 . ASP B 2 104 ? 6.242   6.355   39.757  1.00 32.76  ? 104 ASP H OD2 1 
ATOM   2066 N  N   . PHE B 2 105 ? 0.578   6.913   38.768  1.00 25.30  ? 105 PHE H N   1 
ATOM   2067 C  CA  . PHE B 2 105 ? -0.780  6.662   38.217  1.00 23.96  ? 105 PHE H CA  1 
ATOM   2068 C  C   . PHE B 2 105 ? -1.486  8.027   38.095  1.00 23.75  ? 105 PHE H C   1 
ATOM   2069 O  O   . PHE B 2 105 ? -1.069  9.017   38.765  1.00 23.67  ? 105 PHE H O   1 
ATOM   2070 C  CB  . PHE B 2 105 ? -1.506  5.642   39.093  1.00 24.31  ? 105 PHE H CB  1 
ATOM   2071 C  CG  . PHE B 2 105 ? -1.646  6.066   40.531  1.00 25.51  ? 105 PHE H CG  1 
ATOM   2072 C  CD1 . PHE B 2 105 ? -2.729  6.822   40.938  1.00 25.64  ? 105 PHE H CD1 1 
ATOM   2073 C  CD2 . PHE B 2 105 ? -0.714  5.695   41.498  1.00 26.36  ? 105 PHE H CD2 1 
ATOM   2074 C  CE1 . PHE B 2 105 ? -2.864  7.203   42.259  1.00 26.94  ? 105 PHE H CE1 1 
ATOM   2075 C  CE2 . PHE B 2 105 ? -0.852  6.080   42.828  1.00 27.99  ? 105 PHE H CE2 1 
ATOM   2076 C  CZ  . PHE B 2 105 ? -1.945  6.824   43.214  1.00 28.03  ? 105 PHE H CZ  1 
ATOM   2077 N  N   . PHE B 2 106 ? -2.557  8.076   37.317  1.00 23.44  ? 106 PHE H N   1 
ATOM   2078 C  CA  . PHE B 2 106 ? -2.931  9.305   36.554  1.00 23.81  ? 106 PHE H CA  1 
ATOM   2079 C  C   . PHE B 2 106 ? -4.403  9.708   36.760  1.00 25.17  ? 106 PHE H C   1 
ATOM   2080 O  O   . PHE B 2 106 ? -5.308  8.981   36.284  1.00 26.56  ? 106 PHE H O   1 
ATOM   2081 C  CB  . PHE B 2 106 ? -2.612  9.054   35.093  1.00 21.87  ? 106 PHE H CB  1 
ATOM   2082 C  CG  . PHE B 2 106 ? -1.309  8.323   34.893  1.00 22.70  ? 106 PHE H CG  1 
ATOM   2083 C  CD1 . PHE B 2 106 ? -1.274  7.106   34.222  1.00 22.54  ? 106 PHE H CD1 1 
ATOM   2084 C  CD2 . PHE B 2 106 ? -0.124  8.821   35.449  1.00 23.45  ? 106 PHE H CD2 1 
ATOM   2085 C  CE1 . PHE B 2 106 ? -0.071  6.422   34.096  1.00 23.79  ? 106 PHE H CE1 1 
ATOM   2086 C  CE2 . PHE B 2 106 ? 1.081   8.151   35.302  1.00 23.95  ? 106 PHE H CE2 1 
ATOM   2087 C  CZ  . PHE B 2 106 ? 1.100   6.931   34.673  1.00 24.73  ? 106 PHE H CZ  1 
ATOM   2088 N  N   . ASP B 2 107 ? -4.619  10.913  37.292  1.00 25.72  ? 107 ASP H N   1 
ATOM   2089 C  CA  . ASP B 2 107 ? -5.966  11.457  37.602  1.00 27.22  ? 107 ASP H CA  1 
ATOM   2090 C  C   . ASP B 2 107 ? -6.491  12.217  36.385  1.00 26.66  ? 107 ASP H C   1 
ATOM   2091 O  O   . ASP B 2 107 ? -7.679  12.330  36.283  1.00 29.65  ? 107 ASP H O   1 
ATOM   2092 C  CB  . ASP B 2 107 ? -5.949  12.308  38.870  1.00 29.37  ? 107 ASP H CB  1 
ATOM   2093 C  CG  . ASP B 2 107 ? -4.988  13.487  38.875  1.00 29.66  ? 107 ASP H CG  1 
ATOM   2094 O  OD1 . ASP B 2 107 ? -4.178  13.614  37.930  1.00 29.49  ? 107 ASP H OD1 1 
ATOM   2095 O  OD2 . ASP B 2 107 ? -5.088  14.302  39.792  1.00 32.01  ? 107 ASP H OD2 1 
ATOM   2096 N  N   . TYR B 2 108 ? -5.644  12.734  35.512  1.00 24.79  ? 108 TYR H N   1 
ATOM   2097 C  CA  . TYR B 2 108 ? -6.111  13.537  34.366  1.00 23.93  ? 108 TYR H CA  1 
ATOM   2098 C  C   . TYR B 2 108 ? -5.402  13.035  33.127  1.00 22.21  ? 108 TYR H C   1 
ATOM   2099 O  O   . TYR B 2 108 ? -4.180  12.896  33.157  1.00 21.84  ? 108 TYR H O   1 
ATOM   2100 C  CB  . TYR B 2 108 ? -5.935  15.041  34.582  1.00 25.26  ? 108 TYR H CB  1 
ATOM   2101 C  CG  . TYR B 2 108 ? -6.896  15.612  35.587  1.00 27.47  ? 108 TYR H CG  1 
ATOM   2102 C  CD1 . TYR B 2 108 ? -8.230  15.838  35.252  1.00 28.32  ? 108 TYR H CD1 1 
ATOM   2103 C  CD2 . TYR B 2 108 ? -6.522  15.752  36.915  1.00 28.83  ? 108 TYR H CD2 1 
ATOM   2104 C  CE1 . TYR B 2 108 ? -9.143  16.275  36.196  1.00 29.91  ? 108 TYR H CE1 1 
ATOM   2105 C  CE2 . TYR B 2 108 ? -7.410  16.235  37.852  1.00 30.82  ? 108 TYR H CE2 1 
ATOM   2106 C  CZ  . TYR B 2 108 ? -8.725  16.479  37.497  1.00 31.16  ? 108 TYR H CZ  1 
ATOM   2107 O  OH  . TYR B 2 108 ? -9.601  16.912  38.439  1.00 34.36  ? 108 TYR H OH  1 
ATOM   2108 N  N   . TRP B 2 109 ? -6.162  12.834  32.041  1.00 20.36  ? 109 TRP H N   1 
ATOM   2109 C  CA  . TRP B 2 109 ? -5.676  12.249  30.778  1.00 18.99  ? 109 TRP H CA  1 
ATOM   2110 C  C   . TRP B 2 109 ? -6.043  13.225  29.649  1.00 19.14  ? 109 TRP H C   1 
ATOM   2111 O  O   . TRP B 2 109 ? -7.160  13.818  29.725  1.00 19.00  ? 109 TRP H O   1 
ATOM   2112 C  CB  . TRP B 2 109 ? -6.310  10.869  30.508  1.00 18.74  ? 109 TRP H CB  1 
ATOM   2113 C  CG  . TRP B 2 109 ? -5.964  9.731   31.410  1.00 18.66  ? 109 TRP H CG  1 
ATOM   2114 C  CD1 . TRP B 2 109 ? -6.264  9.616   32.743  1.00 19.58  ? 109 TRP H CD1 1 
ATOM   2115 C  CD2 . TRP B 2 109 ? -5.272  8.533   31.044  1.00 18.54  ? 109 TRP H CD2 1 
ATOM   2116 N  NE1 . TRP B 2 109 ? -5.795  8.436   33.235  1.00 19.88  ? 109 TRP H NE1 1 
ATOM   2117 C  CE2 . TRP B 2 109 ? -5.142  7.765   32.223  1.00 20.10  ? 109 TRP H CE2 1 
ATOM   2118 C  CE3 . TRP B 2 109 ? -4.684  8.084   29.861  1.00 18.29  ? 109 TRP H CE3 1 
ATOM   2119 C  CZ2 . TRP B 2 109 ? -4.517  6.520   32.221  1.00 19.88  ? 109 TRP H CZ2 1 
ATOM   2120 C  CZ3 . TRP B 2 109 ? -4.057  6.864   29.860  1.00 18.76  ? 109 TRP H CZ3 1 
ATOM   2121 C  CH2 . TRP B 2 109 ? -3.968  6.099   31.024  1.00 19.80  ? 109 TRP H CH2 1 
ATOM   2122 N  N   . GLY B 2 110 ? -5.123  13.463  28.726  1.00 18.01  ? 110 GLY H N   1 
ATOM   2123 C  CA  . GLY B 2 110 ? -5.449  14.077  27.413  1.00 18.05  ? 110 GLY H CA  1 
ATOM   2124 C  C   . GLY B 2 110 ? -6.501  13.260  26.683  1.00 17.83  ? 110 GLY H C   1 
ATOM   2125 O  O   . GLY B 2 110 ? -6.718  12.089  27.045  1.00 17.72  ? 110 GLY H O   1 
ATOM   2126 N  N   . GLN B 2 111 ? -7.078  13.835  25.638  1.00 17.90  ? 111 GLN H N   1 
ATOM   2127 C  CA  . GLN B 2 111 ? -8.123  13.178  24.800  1.00 18.64  ? 111 GLN H CA  1 
ATOM   2128 C  C   . GLN B 2 111 ? -7.480  12.174  23.861  1.00 17.89  ? 111 GLN H C   1 
ATOM   2129 O  O   . GLN B 2 111 ? -8.204  11.380  23.224  1.00 17.77  ? 111 GLN H O   1 
ATOM   2130 C  CB  . GLN B 2 111 ? -8.948  14.256  24.087  1.00 19.19  ? 111 GLN H CB  1 
ATOM   2131 C  CG  . GLN B 2 111 ? -8.408  14.774  22.771  1.00 20.20  ? 111 GLN H CG  1 
ATOM   2132 C  CD  . GLN B 2 111 ? -7.406  15.901  22.858  1.00 21.67  ? 111 GLN H CD  1 
ATOM   2133 O  OE1 . GLN B 2 111 ? -6.779  16.157  23.905  1.00 21.33  ? 111 GLN H OE1 1 
ATOM   2134 N  NE2 . GLN B 2 111 ? -7.206  16.566  21.719  1.00 21.36  ? 111 GLN H NE2 1 
ATOM   2135 N  N   . GLY B 2 112 ? -6.164  12.208  23.690  1.00 17.16  ? 112 GLY H N   1 
ATOM   2136 C  CA  . GLY B 2 112 ? -5.490  11.222  22.850  1.00 17.56  ? 112 GLY H CA  1 
ATOM   2137 C  C   . GLY B 2 112 ? -5.245  11.735  21.444  1.00 17.46  ? 112 GLY H C   1 
ATOM   2138 O  O   . GLY B 2 112 ? -6.058  12.579  20.977  1.00 16.98  ? 112 GLY H O   1 
ATOM   2139 N  N   . THR B 2 113 ? -4.065  11.401  20.895  1.00 16.88  ? 113 THR H N   1 
ATOM   2140 C  CA  . THR B 2 113 ? -3.680  11.723  19.499  1.00 17.15  ? 113 THR H CA  1 
ATOM   2141 C  C   . THR B 2 113 ? -3.577  10.408  18.724  1.00 16.67  ? 113 THR H C   1 
ATOM   2142 O  O   . THR B 2 113 ? -2.725  9.551   19.062  1.00 17.39  ? 113 THR H O   1 
ATOM   2143 C  CB  . THR B 2 113 ? -2.346  12.520  19.432  1.00 17.40  ? 113 THR H CB  1 
ATOM   2144 O  OG1 . THR B 2 113 ? -2.515  13.760  20.120  1.00 18.02  ? 113 THR H OG1 1 
ATOM   2145 C  CG2 . THR B 2 113 ? -1.906  12.773  18.009  1.00 17.78  ? 113 THR H CG2 1 
ATOM   2146 N  N   . LEU B 2 114 ? -4.332  10.270  17.634  1.00 17.04  ? 114 LEU H N   1 
ATOM   2147 C  CA  . LEU B 2 114 ? -4.267  9.063   16.796  1.00 17.37  ? 114 LEU H CA  1 
ATOM   2148 C  C   . LEU B 2 114 ? -3.140  9.268   15.793  1.00 17.81  ? 114 LEU H C   1 
ATOM   2149 O  O   . LEU B 2 114 ? -3.265  10.179  14.942  1.00 18.68  ? 114 LEU H O   1 
ATOM   2150 C  CB  . LEU B 2 114 ? -5.585  8.821   16.065  1.00 18.00  ? 114 LEU H CB  1 
ATOM   2151 C  CG  . LEU B 2 114 ? -5.588  7.534   15.244  1.00 18.39  ? 114 LEU H CG  1 
ATOM   2152 C  CD1 . LEU B 2 114 ? -5.482  6.332   16.178  1.00 19.13  ? 114 LEU H CD1 1 
ATOM   2153 C  CD2 . LEU B 2 114 ? -6.865  7.417   14.421  1.00 20.08  ? 114 LEU H CD2 1 
ATOM   2154 N  N   . VAL B 2 115 ? -2.148  8.405   15.833  1.00 17.72  ? 115 VAL H N   1 
ATOM   2155 C  CA  . VAL B 2 115 ? -1.023  8.383   14.879  1.00 19.02  ? 115 VAL H CA  1 
ATOM   2156 C  C   . VAL B 2 115 ? -1.167  7.153   13.982  1.00 19.63  ? 115 VAL H C   1 
ATOM   2157 O  O   . VAL B 2 115 ? -1.190  6.018   14.482  1.00 20.07  ? 115 VAL H O   1 
ATOM   2158 C  CB  . VAL B 2 115 ? 0.344   8.411   15.551  1.00 19.99  ? 115 VAL H CB  1 
ATOM   2159 C  CG1 . VAL B 2 115 ? 1.420   8.369   14.505  1.00 21.23  ? 115 VAL H CG1 1 
ATOM   2160 C  CG2 . VAL B 2 115 ? 0.487   9.572   16.517  1.00 20.11  ? 115 VAL H CG2 1 
ATOM   2161 N  N   . THR B 2 116 ? -1.328  7.399   12.683  1.00 18.53  ? 116 THR H N   1 
ATOM   2162 C  CA  . THR B 2 116 ? -1.371  6.338   11.648  1.00 19.32  ? 116 THR H CA  1 
ATOM   2163 C  C   . THR B 2 116 ? -0.035  6.339   10.883  1.00 20.68  ? 116 THR H C   1 
ATOM   2164 O  O   . THR B 2 116 ? 0.261   7.325   10.162  1.00 21.18  ? 116 THR H O   1 
ATOM   2165 C  CB  . THR B 2 116 ? -2.595  6.517   10.738  1.00 19.05  ? 116 THR H CB  1 
ATOM   2166 O  OG1 . THR B 2 116 ? -3.784  6.570   11.538  1.00 17.74  ? 116 THR H OG1 1 
ATOM   2167 C  CG2 . THR B 2 116 ? -2.771  5.394   9.741   1.00 20.46  ? 116 THR H CG2 1 
ATOM   2168 N  N   . VAL B 2 117 ? 0.723   5.253   10.990  1.00 20.45  ? 117 VAL H N   1 
ATOM   2169 C  CA  . VAL B 2 117 ? 1.995   5.075   10.259  1.00 22.54  ? 117 VAL H CA  1 
ATOM   2170 C  C   . VAL B 2 117 ? 1.707   4.251   9.021   1.00 23.02  ? 117 VAL H C   1 
ATOM   2171 O  O   . VAL B 2 117 ? 1.322   3.079   9.153   1.00 24.31  ? 117 VAL H O   1 
ATOM   2172 C  CB  . VAL B 2 117 ? 3.057   4.424   11.141  1.00 23.57  ? 117 VAL H CB  1 
ATOM   2173 C  CG1 . VAL B 2 117 ? 4.364   4.272   10.364  1.00 25.90  ? 117 VAL H CG1 1 
ATOM   2174 C  CG2 . VAL B 2 117 ? 3.243   5.250   12.403  1.00 23.20  ? 117 VAL H CG2 1 
ATOM   2175 N  N   . SER B 2 118 ? 1.822   4.862   7.847   1.00 22.29  ? 118 SER H N   1 
ATOM   2176 C  CA  . SER B 2 118 ? 1.368   4.215   6.608   1.00 22.55  ? 118 SER H CA  1 
ATOM   2177 C  C   . SER B 2 118 ? 1.998   4.928   5.432   1.00 24.18  ? 118 SER H C   1 
ATOM   2178 O  O   . SER B 2 118 ? 2.248   6.155   5.530   1.00 23.66  ? 118 SER H O   1 
ATOM   2179 C  CB  . SER B 2 118 ? -0.171  4.292   6.535   1.00 20.97  ? 118 SER H CB  1 
ATOM   2180 O  OG  . SER B 2 118 ? -0.677  4.017   5.225   1.00 21.38  ? 118 SER H OG  1 
ATOM   2181 N  N   . SER B 2 119 ? 2.101   4.200   4.338   1.00 25.34  ? 119 SER H N   1 
ATOM   2182 C  CA  . SER B 2 119 ? 2.650   4.739   3.086   1.00 27.23  ? 119 SER H CA  1 
ATOM   2183 C  C   . SER B 2 119 ? 1.527   5.325   2.236   1.00 25.18  ? 119 SER H C   1 
ATOM   2184 O  O   . SER B 2 119 ? 1.832   5.972   1.213   1.00 25.79  ? 119 SER H O   1 
ATOM   2185 C  CB  . SER B 2 119 ? 3.494   3.691   2.433   1.00 30.80  ? 119 SER H CB  1 
ATOM   2186 O  OG  . SER B 2 119 ? 2.661   2.694   1.898   1.00 33.05  ? 119 SER H OG  1 
ATOM   2187 N  N   . ALA B 2 120 ? 0.265   5.167   2.652   1.00 22.94  ? 120 ALA H N   1 
ATOM   2188 C  CA  . ALA B 2 120 ? -0.899  5.614   1.871   1.00 22.58  ? 120 ALA H CA  1 
ATOM   2189 C  C   . ALA B 2 120 ? -1.066  7.152   1.956   1.00 21.50  ? 120 ALA H C   1 
ATOM   2190 O  O   . ALA B 2 120 ? -0.772  7.757   3.009   1.00 20.07  ? 120 ALA H O   1 
ATOM   2191 C  CB  . ALA B 2 120 ? -2.159  4.893   2.346   1.00 21.81  ? 120 ALA H CB  1 
ATOM   2192 N  N   . SER B 2 121 ? -1.574  7.752   0.870   1.00 21.62  ? 121 SER H N   1 
ATOM   2193 C  CA  . SER B 2 121 ? -1.873  9.206   0.772   1.00 21.41  ? 121 SER H CA  1 
ATOM   2194 C  C   . SER B 2 121 ? -3.132  9.582   1.559   1.00 19.89  ? 121 SER H C   1 
ATOM   2195 O  O   . SER B 2 121 ? -4.150  8.858   1.547   1.00 18.81  ? 121 SER H O   1 
ATOM   2196 C  CB  . SER B 2 121 ? -2.002  9.630   -0.673  1.00 22.17  ? 121 SER H CB  1 
ATOM   2197 O  OG  . SER B 2 121 ? -3.045  8.907   -1.330  1.00 22.16  ? 121 SER H OG  1 
ATOM   2198 N  N   . THR B 2 122 ? -3.139  10.776  2.137   1.00 19.63  ? 122 THR H N   1 
ATOM   2199 C  CA  . THR B 2 122 ? -4.367  11.347  2.722   1.00 19.62  ? 122 THR H CA  1 
ATOM   2200 C  C   . THR B 2 122 ? -5.373  11.633  1.618   1.00 19.47  ? 122 THR H C   1 
ATOM   2201 O  O   . THR B 2 122 ? -4.976  11.931  0.488   1.00 19.14  ? 122 THR H O   1 
ATOM   2202 C  CB  . THR B 2 122 ? -4.046  12.564  3.607   1.00 22.02  ? 122 THR H CB  1 
ATOM   2203 O  OG1 . THR B 2 122 ? -5.155  12.753  4.496   1.00 25.20  ? 122 THR H OG1 1 
ATOM   2204 C  CG2 . THR B 2 122 ? -3.854  13.836  2.829   1.00 22.96  ? 122 THR H CG2 1 
ATOM   2205 N  N   . LYS B 2 123 ? -6.646  11.501  1.973   1.00 19.27  ? 123 LYS H N   1 
ATOM   2206 C  CA  . LYS B 2 123 ? -7.772  11.832  1.097   1.00 19.97  ? 123 LYS H CA  1 
ATOM   2207 C  C   . LYS B 2 123 ? -8.921  12.285  1.980   1.00 18.66  ? 123 LYS H C   1 
ATOM   2208 O  O   . LYS B 2 123 ? -9.230  11.614  2.956   1.00 17.80  ? 123 LYS H O   1 
ATOM   2209 C  CB  . LYS B 2 123 ? -8.253  10.666  0.240   1.00 20.77  ? 123 LYS H CB  1 
ATOM   2210 C  CG  . LYS B 2 123 ? -9.253  11.118  -0.814  1.00 22.03  ? 123 LYS H CG  1 
ATOM   2211 C  CD  . LYS B 2 123 ? -9.809  10.015  -1.675  1.00 24.24  ? 123 LYS H CD  1 
ATOM   2212 C  CE  . LYS B 2 123 ? -10.988 10.504  -2.521  1.00 26.05  ? 123 LYS H CE  1 
ATOM   2213 N  NZ  . LYS B 2 123 ? -12.151 10.857  -1.640  1.00 25.91  ? 123 LYS H NZ  1 
ATOM   2214 N  N   . GLY B 2 124 ? -9.445  13.460  1.685   1.00 18.67  ? 124 GLY H N   1 
ATOM   2215 C  CA  . GLY B 2 124 ? -10.581 14.002  2.442   1.00 18.48  ? 124 GLY H CA  1 
ATOM   2216 C  C   . GLY B 2 124 ? -11.857 13.342  1.973   1.00 19.11  ? 124 GLY H C   1 
ATOM   2217 O  O   . GLY B 2 124 ? -11.943 12.925  0.805   1.00 19.53  ? 124 GLY H O   1 
ATOM   2218 N  N   . PRO B 2 125 ? -12.881 13.303  2.836   1.00 18.68  ? 125 PRO H N   1 
ATOM   2219 C  CA  . PRO B 2 125 ? -14.156 12.707  2.456   1.00 19.44  ? 125 PRO H CA  1 
ATOM   2220 C  C   . PRO B 2 125 ? -14.990 13.556  1.510   1.00 19.76  ? 125 PRO H C   1 
ATOM   2221 O  O   . PRO B 2 125 ? -14.800 14.724  1.520   1.00 20.55  ? 125 PRO H O   1 
ATOM   2222 C  CB  . PRO B 2 125 ? -14.898 12.641  3.783   1.00 18.84  ? 125 PRO H CB  1 
ATOM   2223 C  CG  . PRO B 2 125 ? -14.370 13.815  4.574   1.00 18.51  ? 125 PRO H CG  1 
ATOM   2224 C  CD  . PRO B 2 125 ? -12.891 13.842  4.206   1.00 18.47  ? 125 PRO H CD  1 
ATOM   2225 N  N   . SER B 2 126 ? -15.894 12.924  0.761   1.00 20.28  ? 126 SER H N   1 
ATOM   2226 C  CA  . SER B 2 126 ? -17.101 13.550  0.177   1.00 21.48  ? 126 SER H CA  1 
ATOM   2227 C  C   . SER B 2 126 ? -18.204 13.421  1.212   1.00 21.12  ? 126 SER H C   1 
ATOM   2228 O  O   . SER B 2 126 ? -18.255 12.353  1.892   1.00 22.14  ? 126 SER H O   1 
ATOM   2229 C  CB  . SER B 2 126 ? -17.511 12.867  -1.127  1.00 23.48  ? 126 SER H CB  1 
ATOM   2230 O  OG  . SER B 2 126 ? -16.542 13.082  -2.140  1.00 25.54  ? 126 SER H OG  1 
ATOM   2231 N  N   . VAL B 2 127 ? -19.072 14.421  1.344   1.00 20.17  ? 127 VAL H N   1 
ATOM   2232 C  CA  . VAL B 2 127 ? -20.168 14.400  2.349   1.00 20.12  ? 127 VAL H CA  1 
ATOM   2233 C  C   . VAL B 2 127 ? -21.484 14.515  1.617   1.00 20.66  ? 127 VAL H C   1 
ATOM   2234 O  O   . VAL B 2 127 ? -21.657 15.524  0.881   1.00 20.77  ? 127 VAL H O   1 
ATOM   2235 C  CB  . VAL B 2 127 ? -20.008 15.492  3.412   1.00 19.87  ? 127 VAL H CB  1 
ATOM   2236 C  CG1 . VAL B 2 127 ? -21.152 15.501  4.404   1.00 20.40  ? 127 VAL H CG1 1 
ATOM   2237 C  CG2 . VAL B 2 127 ? -18.682 15.376  4.099   1.00 19.93  ? 127 VAL H CG2 1 
ATOM   2238 N  N   . PHE B 2 128 ? -22.350 13.514  1.766   1.00 20.28  ? 128 PHE H N   1 
ATOM   2239 C  CA  . PHE B 2 128 ? -23.638 13.475  1.028   1.00 21.37  ? 128 PHE H CA  1 
ATOM   2240 C  C   . PHE B 2 128 ? -24.774 13.431  2.020   1.00 21.07  ? 128 PHE H C   1 
ATOM   2241 O  O   . PHE B 2 128 ? -24.631 12.815  3.082   1.00 20.40  ? 128 PHE H O   1 
ATOM   2242 C  CB  . PHE B 2 128 ? -23.700 12.274  0.092   1.00 22.27  ? 128 PHE H CB  1 
ATOM   2243 C  CG  . PHE B 2 128 ? -22.564 12.204  -0.891  1.00 23.05  ? 128 PHE H CG  1 
ATOM   2244 C  CD1 . PHE B 2 128 ? -22.421 13.167  -1.890  1.00 24.14  ? 128 PHE H CD1 1 
ATOM   2245 C  CD2 . PHE B 2 128 ? -21.664 11.163  -0.846  1.00 23.17  ? 128 PHE H CD2 1 
ATOM   2246 C  CE1 . PHE B 2 128 ? -21.380 13.079  -2.801  1.00 24.58  ? 128 PHE H CE1 1 
ATOM   2247 C  CE2 . PHE B 2 128 ? -20.665 11.043  -1.803  1.00 24.30  ? 128 PHE H CE2 1 
ATOM   2248 C  CZ  . PHE B 2 128 ? -20.524 12.002  -2.776  1.00 24.38  ? 128 PHE H CZ  1 
ATOM   2249 N  N   . PRO B 2 129 ? -25.908 14.086  1.691   1.00 21.38  ? 129 PRO H N   1 
ATOM   2250 C  CA  . PRO B 2 129 ? -27.094 14.075  2.540   1.00 22.03  ? 129 PRO H CA  1 
ATOM   2251 C  C   . PRO B 2 129 ? -27.762 12.689  2.597   1.00 22.57  ? 129 PRO H C   1 
ATOM   2252 O  O   . PRO B 2 129 ? -27.885 12.061  1.537   1.00 22.72  ? 129 PRO H O   1 
ATOM   2253 C  CB  . PRO B 2 129 ? -28.015 15.089  1.858   1.00 23.48  ? 129 PRO H CB  1 
ATOM   2254 C  CG  . PRO B 2 129 ? -27.621 15.072  0.427   1.00 23.22  ? 129 PRO H CG  1 
ATOM   2255 C  CD  . PRO B 2 129 ? -26.123 14.854  0.452   1.00 22.17  ? 129 PRO H CD  1 
ATOM   2256 N  N   . LEU B 2 130 ? -28.180 12.266  3.803   1.00 22.52  ? 130 LEU H N   1 
ATOM   2257 C  CA  . LEU B 2 130 ? -29.223 11.217  3.989   1.00 24.12  ? 130 LEU H CA  1 
ATOM   2258 C  C   . LEU B 2 130 ? -30.561 11.905  4.317   1.00 25.73  ? 130 LEU H C   1 
ATOM   2259 O  O   . LEU B 2 130 ? -30.815 12.216  5.477   1.00 24.84  ? 130 LEU H O   1 
ATOM   2260 C  CB  . LEU B 2 130 ? -28.781 10.229  5.070   1.00 24.10  ? 130 LEU H CB  1 
ATOM   2261 C  CG  . LEU B 2 130 ? -27.413 9.569   4.840   1.00 22.73  ? 130 LEU H CG  1 
ATOM   2262 C  CD1 . LEU B 2 130 ? -26.923 8.933   6.127   1.00 22.54  ? 130 LEU H CD1 1 
ATOM   2263 C  CD2 . LEU B 2 130 ? -27.458 8.522   3.724   1.00 23.53  ? 130 LEU H CD2 1 
ATOM   2264 N  N   . ALA B 2 131 ? -31.361 12.160  3.283   1.00 27.69  ? 131 ALA H N   1 
ATOM   2265 C  CA  . ALA B 2 131 ? -32.503 13.104  3.337   1.00 31.04  ? 131 ALA H CA  1 
ATOM   2266 C  C   . ALA B 2 131 ? -33.621 12.455  4.133   1.00 33.32  ? 131 ALA H C   1 
ATOM   2267 O  O   . ALA B 2 131 ? -33.874 11.295  3.900   1.00 34.13  ? 131 ALA H O   1 
ATOM   2268 C  CB  . ALA B 2 131 ? -32.975 13.414  1.944   1.00 32.17  ? 131 ALA H CB  1 
ATOM   2269 N  N   . PRO B 2 132 ? -34.340 13.146  5.044   1.00 36.60  ? 132 PRO H N   1 
ATOM   2270 C  CA  . PRO B 2 132 ? -35.521 12.550  5.677   1.00 40.31  ? 132 PRO H CA  1 
ATOM   2271 C  C   . PRO B 2 132 ? -36.640 12.203  4.688   1.00 43.84  ? 132 PRO H C   1 
ATOM   2272 O  O   . PRO B 2 132 ? -36.806 12.936  3.685   1.00 44.06  ? 132 PRO H O   1 
ATOM   2273 C  CB  . PRO B 2 132 ? -36.053 13.649  6.607   1.00 41.60  ? 132 PRO H CB  1 
ATOM   2274 C  CG  . PRO B 2 132 ? -35.446 14.942  6.052   1.00 40.30  ? 132 PRO H CG  1 
ATOM   2275 C  CD  . PRO B 2 132 ? -34.108 14.528  5.477   1.00 37.58  ? 132 PRO H CD  1 
ATOM   2276 N  N   . SER B 2 133 ? -37.392 11.134  4.986   1.00 48.16  ? 133 SER H N   1 
ATOM   2277 C  CA  . SER B 2 133 ? -38.835 10.951  4.607   1.00 51.93  ? 133 SER H CA  1 
ATOM   2278 C  C   . SER B 2 133 ? -39.029 11.007  3.091   1.00 52.68  ? 133 SER H C   1 
ATOM   2279 O  O   . SER B 2 133 ? -40.176 11.311  2.703   1.00 54.76  ? 133 SER H O   1 
ATOM   2280 C  CB  . SER B 2 133 ? -39.732 11.996  5.263   1.00 53.33  ? 133 SER H CB  1 
ATOM   2281 O  OG  . SER B 2 133 ? -39.850 11.783  6.680   1.00 55.84  ? 133 SER H OG  1 
ATOM   2282 N  N   . GLY B 2 139 ? -47.060 13.196  12.552  1.00 70.48  ? 139 GLY H N   1 
ATOM   2283 C  CA  . GLY B 2 139 ? -46.348 13.324  13.835  1.00 68.71  ? 139 GLY H CA  1 
ATOM   2284 C  C   . GLY B 2 139 ? -45.122 12.428  13.856  1.00 66.70  ? 139 GLY H C   1 
ATOM   2285 O  O   . GLY B 2 139 ? -44.575 12.114  12.753  1.00 67.10  ? 139 GLY H O   1 
ATOM   2286 N  N   . GLY B 2 140 ? -44.689 12.040  15.057  1.00 63.97  ? 140 GLY H N   1 
ATOM   2287 C  CA  . GLY B 2 140 ? -43.700 10.974  15.264  1.00 59.38  ? 140 GLY H CA  1 
ATOM   2288 C  C   . GLY B 2 140 ? -42.304 11.412  14.855  1.00 54.55  ? 140 GLY H C   1 
ATOM   2289 O  O   . GLY B 2 140 ? -42.003 12.620  14.858  1.00 53.48  ? 140 GLY H O   1 
ATOM   2290 N  N   . THR B 2 141 ? -41.490 10.443  14.476  1.00 50.58  ? 141 THR H N   1 
ATOM   2291 C  CA  . THR B 2 141 ? -40.022 10.578  14.412  1.00 46.38  ? 141 THR H CA  1 
ATOM   2292 C  C   . THR B 2 141 ? -39.562 10.490  12.967  1.00 42.81  ? 141 THR H C   1 
ATOM   2293 O  O   . THR B 2 141 ? -40.051 9.594   12.263  1.00 43.74  ? 141 THR H O   1 
ATOM   2294 C  CB  . THR B 2 141 ? -39.389 9.480   15.260  1.00 46.61  ? 141 THR H CB  1 
ATOM   2295 O  OG1 . THR B 2 141 ? -39.858 9.662   16.597  1.00 50.06  ? 141 THR H OG1 1 
ATOM   2296 C  CG2 . THR B 2 141 ? -37.884 9.507   15.227  1.00 43.32  ? 141 THR H CG2 1 
ATOM   2297 N  N   . ALA B 2 142 ? -38.598 11.337  12.575  1.00 39.61  ? 142 ALA H N   1 
ATOM   2298 C  CA  . ALA B 2 142 ? -37.949 11.247  11.252  1.00 36.46  ? 142 ALA H CA  1 
ATOM   2299 C  C   . ALA B 2 142 ? -36.455 11.125  11.480  1.00 32.90  ? 142 ALA H C   1 
ATOM   2300 O  O   . ALA B 2 142 ? -35.968 11.755  12.425  1.00 32.10  ? 142 ALA H O   1 
ATOM   2301 C  CB  . ALA B 2 142 ? -38.245 12.439  10.393  1.00 36.73  ? 142 ALA H CB  1 
ATOM   2302 N  N   . ALA B 2 143 ? -35.791 10.333  10.652  1.00 30.54  ? 143 ALA H N   1 
ATOM   2303 C  CA  . ALA B 2 143 ? -34.319 10.200  10.687  1.00 27.84  ? 143 ALA H CA  1 
ATOM   2304 C  C   . ALA B 2 143 ? -33.727 10.893  9.470   1.00 26.64  ? 143 ALA H C   1 
ATOM   2305 O  O   . ALA B 2 143 ? -34.295 10.817  8.394   1.00 26.83  ? 143 ALA H O   1 
ATOM   2306 C  CB  . ALA B 2 143 ? -33.912 8.753   10.759  1.00 27.33  ? 143 ALA H CB  1 
ATOM   2307 N  N   . LEU B 2 144 ? -32.529 11.449  9.652   1.00 25.85  ? 144 LEU H N   1 
ATOM   2308 C  CA  . LEU B 2 144 ? -31.766 12.112  8.584   1.00 25.03  ? 144 LEU H CA  1 
ATOM   2309 C  C   . LEU B 2 144 ? -30.309 11.991  8.967   1.00 22.89  ? 144 LEU H C   1 
ATOM   2310 O  O   . LEU B 2 144 ? -30.008 11.523  10.076  1.00 22.32  ? 144 LEU H O   1 
ATOM   2311 C  CB  . LEU B 2 144 ? -32.251 13.549  8.428   1.00 26.71  ? 144 LEU H CB  1 
ATOM   2312 C  CG  . LEU B 2 144 ? -32.137 14.448  9.664   1.00 27.53  ? 144 LEU H CG  1 
ATOM   2313 C  CD1 . LEU B 2 144 ? -30.834 15.200  9.677   1.00 26.71  ? 144 LEU H CD1 1 
ATOM   2314 C  CD2 . LEU B 2 144 ? -33.299 15.431  9.701   1.00 29.62  ? 144 LEU H CD2 1 
ATOM   2315 N  N   . GLY B 2 145 ? -29.441 12.298  8.036   1.00 22.36  ? 145 GLY H N   1 
ATOM   2316 C  CA  . GLY B 2 145 ? -28.017 12.057  8.288   1.00 20.77  ? 145 GLY H CA  1 
ATOM   2317 C  C   . GLY B 2 145 ? -27.120 12.588  7.218   1.00 20.75  ? 145 GLY H C   1 
ATOM   2318 O  O   . GLY B 2 145 ? -27.587 13.308  6.347   1.00 21.47  ? 145 GLY H O   1 
ATOM   2319 N  N   . CYS B 2 146 ? -25.838 12.245  7.352   1.00 20.46  ? 146 CYS H N   1 
ATOM   2320 C  CA  . CYS B 2 146 ? -24.752 12.559  6.405   1.00 20.85  ? 146 CYS H CA  1 
ATOM   2321 C  C   . CYS B 2 146 ? -23.890 11.328  6.243   1.00 19.36  ? 146 CYS H C   1 
ATOM   2322 O  O   . CYS B 2 146 ? -23.624 10.646  7.270   1.00 18.84  ? 146 CYS H O   1 
ATOM   2323 C  CB  . CYS B 2 146 ? -23.849 13.685  6.902   1.00 22.30  ? 146 CYS H CB  1 
ATOM   2324 S  SG  . CYS B 2 146 ? -24.659 15.271  6.693   1.00 26.72  ? 146 CYS H SG  1 
ATOM   2325 N  N   . LEU B 2 147 ? -23.614 11.011  4.984   1.00 18.53  ? 147 LEU H N   1 
ATOM   2326 C  CA  . LEU B 2 147 ? -22.695 9.960   4.564   1.00 18.02  ? 147 LEU H CA  1 
ATOM   2327 C  C   . LEU B 2 147 ? -21.338 10.625  4.313   1.00 17.37  ? 147 LEU H C   1 
ATOM   2328 O  O   . LEU B 2 147 ? -21.264 11.539  3.491   1.00 18.36  ? 147 LEU H O   1 
ATOM   2329 C  CB  . LEU B 2 147 ? -23.243 9.288   3.305   1.00 18.30  ? 147 LEU H CB  1 
ATOM   2330 C  CG  . LEU B 2 147 ? -22.344 8.260   2.663   1.00 18.14  ? 147 LEU H CG  1 
ATOM   2331 C  CD1 . LEU B 2 147 ? -22.070 7.090   3.598   1.00 18.75  ? 147 LEU H CD1 1 
ATOM   2332 C  CD2 . LEU B 2 147 ? -22.950 7.769   1.359   1.00 19.27  ? 147 LEU H CD2 1 
ATOM   2333 N  N   . VAL B 2 148 ? -20.328 10.157  5.024   1.00 16.88  ? 148 VAL H N   1 
ATOM   2334 C  CA  . VAL B 2 148 ? -18.941 10.700  4.978   1.00 16.82  ? 148 VAL H CA  1 
ATOM   2335 C  C   . VAL B 2 148 ? -18.084 9.639   4.312   1.00 16.65  ? 148 VAL H C   1 
ATOM   2336 O  O   . VAL B 2 148 ? -17.748 8.652   4.956   1.00 16.89  ? 148 VAL H O   1 
ATOM   2337 C  CB  . VAL B 2 148 ? -18.443 11.025  6.387   1.00 16.01  ? 148 VAL H CB  1 
ATOM   2338 C  CG1 . VAL B 2 148 ? -17.092 11.721  6.326   1.00 15.36  ? 148 VAL H CG1 1 
ATOM   2339 C  CG2 . VAL B 2 148 ? -19.447 11.866  7.085   1.00 16.77  ? 148 VAL H CG2 1 
ATOM   2340 N  N   . LYS B 2 149 ? -17.923 9.750   3.007   1.00 17.86  ? 149 LYS H N   1 
ATOM   2341 C  CA  A LYS B 2 149 ? -17.390 8.638   2.184   0.50 19.02  ? 149 LYS H CA  1 
ATOM   2342 C  CA  B LYS B 2 149 ? -17.410 8.665   2.138   0.50 18.46  ? 149 LYS H CA  1 
ATOM   2343 C  C   . LYS B 2 149 ? -15.960 8.930   1.675   1.00 18.63  ? 149 LYS H C   1 
ATOM   2344 O  O   . LYS B 2 149 ? -15.673 10.068  1.196   1.00 19.55  ? 149 LYS H O   1 
ATOM   2345 C  CB  A LYS B 2 149 ? -18.330 8.318   1.020   0.50 20.40  ? 149 LYS H CB  1 
ATOM   2346 C  CB  B LYS B 2 149 ? -18.314 8.549   0.912   0.50 19.04  ? 149 LYS H CB  1 
ATOM   2347 C  CG  A LYS B 2 149 ? -18.304 6.849   0.625   0.50 21.48  ? 149 LYS H CG  1 
ATOM   2348 C  CG  B LYS B 2 149 ? -17.888 7.485   -0.082  0.50 19.45  ? 149 LYS H CG  1 
ATOM   2349 C  CD  A LYS B 2 149 ? -19.075 6.514   -0.605  0.50 23.45  ? 149 LYS H CD  1 
ATOM   2350 C  CD  B LYS B 2 149 ? -19.038 6.716   -0.639  0.50 20.36  ? 149 LYS H CD  1 
ATOM   2351 C  CE  A LYS B 2 149 ? -18.574 5.249   -1.270  0.50 24.48  ? 149 LYS H CE  1 
ATOM   2352 C  CE  B LYS B 2 149 ? -18.629 5.774   -1.753  0.50 20.72  ? 149 LYS H CE  1 
ATOM   2353 N  NZ  A LYS B 2 149 ? -17.683 5.546   -2.413  0.50 25.73  ? 149 LYS H NZ  1 
ATOM   2354 N  NZ  B LYS B 2 149 ? -17.966 4.548   -1.237  0.50 20.44  ? 149 LYS H NZ  1 
ATOM   2355 N  N   . ASP B 2 150 ? -15.127 7.902   1.717   1.00 18.59  ? 150 ASP H N   1 
ATOM   2356 C  CA  . ASP B 2 150 ? -13.876 7.754   0.918   1.00 18.98  ? 150 ASP H CA  1 
ATOM   2357 C  C   . ASP B 2 150 ? -12.772 8.632   1.482   1.00 18.79  ? 150 ASP H C   1 
ATOM   2358 O  O   . ASP B 2 150 ? -12.254 9.521   0.767   1.00 18.50  ? 150 ASP H O   1 
ATOM   2359 C  CB  . ASP B 2 150 ? -14.152 8.064   -0.559  1.00 20.22  ? 150 ASP H CB  1 
ATOM   2360 C  CG  . ASP B 2 150 ? -14.829 6.911   -1.263  1.00 21.64  ? 150 ASP H CG  1 
ATOM   2361 O  OD1 . ASP B 2 150 ? -14.851 5.802   -0.686  1.00 22.59  ? 150 ASP H OD1 1 
ATOM   2362 O  OD2 . ASP B 2 150 ? -15.274 7.113   -2.382  1.00 22.26  ? 150 ASP H OD2 1 
ATOM   2363 N  N   . TYR B 2 151 ? -12.412 8.430   2.756   1.00 17.27  ? 151 TYR H N   1 
ATOM   2364 C  CA  . TYR B 2 151 ? -11.341 9.246   3.356   1.00 18.25  ? 151 TYR H CA  1 
ATOM   2365 C  C   . TYR B 2 151 ? -10.222 8.348   3.910   1.00 18.18  ? 151 TYR H C   1 
ATOM   2366 O  O   . TYR B 2 151 ? -10.410 7.140   4.210   1.00 17.48  ? 151 TYR H O   1 
ATOM   2367 C  CB  . TYR B 2 151 ? -11.874 10.152  4.464   1.00 17.17  ? 151 TYR H CB  1 
ATOM   2368 C  CG  . TYR B 2 151 ? -12.460 9.458   5.656   1.00 17.28  ? 151 TYR H CG  1 
ATOM   2369 C  CD1 . TYR B 2 151 ? -13.809 9.090   5.687   1.00 16.79  ? 151 TYR H CD1 1 
ATOM   2370 C  CD2 . TYR B 2 151 ? -11.699 9.229   6.791   1.00 16.76  ? 151 TYR H CD2 1 
ATOM   2371 C  CE1 . TYR B 2 151 ? -14.342 8.439   6.775   1.00 17.30  ? 151 TYR H CE1 1 
ATOM   2372 C  CE2 . TYR B 2 151 ? -12.222 8.573   7.900   1.00 17.08  ? 151 TYR H CE2 1 
ATOM   2373 C  CZ  . TYR B 2 151 ? -13.566 8.219   7.905   1.00 17.01  ? 151 TYR H CZ  1 
ATOM   2374 O  OH  . TYR B 2 151 ? -14.078 7.582   8.984   1.00 17.74  ? 151 TYR H OH  1 
ATOM   2375 N  N   . PHE B 2 152 ? -9.075  8.959   4.132   1.00 17.86  ? 152 PHE H N   1 
ATOM   2376 C  CA  . PHE B 2 152 ? -7.924  8.279   4.774   1.00 18.04  ? 152 PHE H CA  1 
ATOM   2377 C  C   . PHE B 2 152 ? -6.962  9.327   5.325   1.00 18.17  ? 152 PHE H C   1 
ATOM   2378 O  O   . PHE B 2 152 ? -6.726  10.342  4.673   1.00 17.23  ? 152 PHE H O   1 
ATOM   2379 C  CB  . PHE B 2 152 ? -7.226  7.417   3.729   1.00 19.42  ? 152 PHE H CB  1 
ATOM   2380 C  CG  . PHE B 2 152 ? -6.149  6.568   4.358   1.00 20.33  ? 152 PHE H CG  1 
ATOM   2381 C  CD1 . PHE B 2 152 ? -6.476  5.371   4.964   1.00 20.43  ? 152 PHE H CD1 1 
ATOM   2382 C  CD2 . PHE B 2 152 ? -4.833  7.008   4.429   1.00 21.19  ? 152 PHE H CD2 1 
ATOM   2383 C  CE1 . PHE B 2 152 ? -5.513  4.588   5.571   1.00 21.81  ? 152 PHE H CE1 1 
ATOM   2384 C  CE2 . PHE B 2 152 ? -3.882  6.249   5.097   1.00 21.74  ? 152 PHE H CE2 1 
ATOM   2385 C  CZ  . PHE B 2 152 ? -4.211  5.032   5.632   1.00 21.65  ? 152 PHE H CZ  1 
ATOM   2386 N  N   . PRO B 2 153 ? -6.362  9.150   6.528   1.00 18.11  ? 153 PRO H N   1 
ATOM   2387 C  CA  . PRO B 2 153 ? -6.660  8.051   7.434   1.00 18.21  ? 153 PRO H CA  1 
ATOM   2388 C  C   . PRO B 2 153 ? -7.866  8.367   8.337   1.00 17.63  ? 153 PRO H C   1 
ATOM   2389 O  O   . PRO B 2 153 ? -8.495  9.375   8.135   1.00 17.06  ? 153 PRO H O   1 
ATOM   2390 C  CB  . PRO B 2 153 ? -5.420  8.027   8.308   1.00 17.93  ? 153 PRO H CB  1 
ATOM   2391 C  CG  . PRO B 2 153 ? -5.068  9.503   8.455   1.00 18.22  ? 153 PRO H CG  1 
ATOM   2392 C  CD  . PRO B 2 153 ? -5.359  10.073  7.080   1.00 18.31  ? 153 PRO H CD  1 
ATOM   2393 N  N   . GLU B 2 154 ? -8.082  7.550   9.373   1.00 17.07  ? 154 GLU H N   1 
ATOM   2394 C  CA  . GLU B 2 154 ? -8.937  7.916   10.514  1.00 18.43  ? 154 GLU H CA  1 
ATOM   2395 C  C   . GLU B 2 154 ? -8.206  9.033   11.244  1.00 16.60  ? 154 GLU H C   1 
ATOM   2396 O  O   . GLU B 2 154 ? -6.979  9.156   11.067  1.00 17.40  ? 154 GLU H O   1 
ATOM   2397 C  CB  . GLU B 2 154 ? -9.166  6.695   11.428  1.00 20.34  ? 154 GLU H CB  1 
ATOM   2398 C  CG  . GLU B 2 154 ? -10.178 5.729   10.888  1.00 22.60  ? 154 GLU H CG  1 
ATOM   2399 C  CD  . GLU B 2 154 ? -11.600 6.051   11.374  1.00 26.44  ? 154 GLU H CD  1 
ATOM   2400 O  OE1 . GLU B 2 154 ? -12.075 5.203   12.142  1.00 26.94  ? 154 GLU H OE1 1 
ATOM   2401 O  OE2 . GLU B 2 154 ? -12.240 7.197   11.035  1.00 23.45  ? 154 GLU H OE2 1 
ATOM   2402 N  N   . PRO B 2 155 ? -8.861  9.849   12.073  1.00 16.03  ? 155 PRO H N   1 
ATOM   2403 C  CA  . PRO B 2 155 ? -10.322 9.889   12.249  1.00 16.66  ? 155 PRO H CA  1 
ATOM   2404 C  C   . PRO B 2 155 ? -11.008 11.031  11.521  1.00 17.89  ? 155 PRO H C   1 
ATOM   2405 O  O   . PRO B 2 155 ? -10.369 11.851  10.939  1.00 19.22  ? 155 PRO H O   1 
ATOM   2406 C  CB  . PRO B 2 155 ? -10.438 10.215  13.753  1.00 17.13  ? 155 PRO H CB  1 
ATOM   2407 C  CG  . PRO B 2 155 ? -9.286  11.207  13.990  1.00 17.00  ? 155 PRO H CG  1 
ATOM   2408 C  CD  . PRO B 2 155 ? -8.212  10.821  12.983  1.00 17.26  ? 155 PRO H CD  1 
ATOM   2409 N  N   . VAL B 2 156 ? -12.331 11.069  11.668  1.00 19.34  ? 156 VAL H N   1 
ATOM   2410 C  CA  A VAL B 2 156 ? -13.177 12.221  11.255  0.60 20.04  ? 156 VAL H CA  1 
ATOM   2411 C  CA  B VAL B 2 156 ? -13.214 12.193  11.237  0.40 19.62  ? 156 VAL H CA  1 
ATOM   2412 C  C   . VAL B 2 156 ? -14.132 12.520  12.410  1.00 19.80  ? 156 VAL H C   1 
ATOM   2413 O  O   . VAL B 2 156 ? -14.444 11.555  13.210  1.00 20.77  ? 156 VAL H O   1 
ATOM   2414 C  CB  A VAL B 2 156 ? -13.912 11.899  9.935   0.60 21.18  ? 156 VAL H CB  1 
ATOM   2415 C  CB  B VAL B 2 156 ? -14.035 11.816  9.986   0.40 20.03  ? 156 VAL H CB  1 
ATOM   2416 C  CG1 A VAL B 2 156 ? -15.030 10.895  10.150  0.60 21.93  ? 156 VAL H CG1 1 
ATOM   2417 C  CG1 B VAL B 2 156 ? -13.241 12.007  8.704   0.40 20.04  ? 156 VAL H CG1 1 
ATOM   2418 C  CG2 A VAL B 2 156 ? -14.421 13.146  9.241   0.60 21.30  ? 156 VAL H CG2 1 
ATOM   2419 C  CG2 B VAL B 2 156 ? -14.560 10.391  10.088  0.40 20.06  ? 156 VAL H CG2 1 
ATOM   2420 N  N   . THR B 2 157 ? -14.474 13.789  12.576  1.00 19.76  ? 157 THR H N   1 
ATOM   2421 C  CA  . THR B 2 157 ? -15.479 14.192  13.580  1.00 20.81  ? 157 THR H CA  1 
ATOM   2422 C  C   . THR B 2 157 ? -16.728 14.660  12.868  1.00 19.68  ? 157 THR H C   1 
ATOM   2423 O  O   . THR B 2 157 ? -16.627 15.278  11.819  1.00 19.29  ? 157 THR H O   1 
ATOM   2424 C  CB  . THR B 2 157 ? -14.946 15.218  14.581  1.00 22.57  ? 157 THR H CB  1 
ATOM   2425 O  OG1 . THR B 2 157 ? -14.578 16.345  13.816  1.00 22.78  ? 157 THR H OG1 1 
ATOM   2426 C  CG2 . THR B 2 157 ? -13.815 14.669  15.425  1.00 23.68  ? 157 THR H CG2 1 
ATOM   2427 N  N   . VAL B 2 158 ? -17.867 14.379  13.465  1.00 19.99  ? 158 VAL H N   1 
ATOM   2428 C  CA  . VAL B 2 158 ? -19.155 14.897  12.963  1.00 21.27  ? 158 VAL H CA  1 
ATOM   2429 C  C   . VAL B 2 158 ? -19.914 15.496  14.135  1.00 23.05  ? 158 VAL H C   1 
ATOM   2430 O  O   . VAL B 2 158 ? -20.027 14.826  15.193  1.00 24.87  ? 158 VAL H O   1 
ATOM   2431 C  CB  . VAL B 2 158 ? -19.996 13.832  12.252  1.00 21.61  ? 158 VAL H CB  1 
ATOM   2432 C  CG1 . VAL B 2 158 ? -21.247 14.472  11.701  1.00 22.59  ? 158 VAL H CG1 1 
ATOM   2433 C  CG2 . VAL B 2 158 ? -19.214 13.113  11.173  1.00 21.64  ? 158 VAL H CG2 1 
ATOM   2434 N  N   . SER B 2 159 ? -20.343 16.736  13.962  1.00 23.17  ? 159 SER H N   1 
ATOM   2435 C  CA  . SER B 2 159 ? -21.297 17.383  14.883  1.00 25.17  ? 159 SER H CA  1 
ATOM   2436 C  C   . SER B 2 159 ? -22.523 17.775  14.088  1.00 24.43  ? 159 SER H C   1 
ATOM   2437 O  O   . SER B 2 159 ? -22.495 17.756  12.833  1.00 24.61  ? 159 SER H O   1 
ATOM   2438 C  CB  . SER B 2 159 ? -20.643 18.566  15.635  1.00 25.57  ? 159 SER H CB  1 
ATOM   2439 O  OG  . SER B 2 159 ? -20.324 19.582  14.700  1.00 27.28  ? 159 SER H OG  1 
ATOM   2440 N  N   . TRP B 2 160 ? -23.575 18.140  14.801  1.00 25.14  ? 160 TRP H N   1 
ATOM   2441 C  CA  . TRP B 2 160 ? -24.824 18.626  14.175  1.00 25.62  ? 160 TRP H CA  1 
ATOM   2442 C  C   . TRP B 2 160 ? -25.153 20.052  14.647  1.00 25.98  ? 160 TRP H C   1 
ATOM   2443 O  O   . TRP B 2 160 ? -25.149 20.304  15.858  1.00 26.51  ? 160 TRP H O   1 
ATOM   2444 C  CB  . TRP B 2 160 ? -25.957 17.611  14.427  1.00 25.86  ? 160 TRP H CB  1 
ATOM   2445 C  CG  . TRP B 2 160 ? -25.793 16.380  13.593  1.00 23.92  ? 160 TRP H CG  1 
ATOM   2446 C  CD1 . TRP B 2 160 ? -25.094 15.251  13.911  1.00 22.49  ? 160 TRP H CD1 1 
ATOM   2447 C  CD2 . TRP B 2 160 ? -26.308 16.176  12.268  1.00 23.50  ? 160 TRP H CD2 1 
ATOM   2448 N  NE1 . TRP B 2 160 ? -25.146 14.350  12.881  1.00 21.91  ? 160 TRP H NE1 1 
ATOM   2449 C  CE2 . TRP B 2 160 ? -25.874 14.893  11.856  1.00 22.56  ? 160 TRP H CE2 1 
ATOM   2450 C  CE3 . TRP B 2 160 ? -27.058 16.958  11.389  1.00 23.86  ? 160 TRP H CE3 1 
ATOM   2451 C  CZ2 . TRP B 2 160 ? -26.214 14.365  10.614  1.00 22.12  ? 160 TRP H CZ2 1 
ATOM   2452 C  CZ3 . TRP B 2 160 ? -27.374 16.443  10.152  1.00 23.63  ? 160 TRP H CZ3 1 
ATOM   2453 C  CH2 . TRP B 2 160 ? -26.938 15.173  9.764   1.00 22.88  ? 160 TRP H CH2 1 
ATOM   2454 N  N   . ASN B 2 161 ? -25.428 20.944  13.700  1.00 26.51  ? 161 ASN H N   1 
ATOM   2455 C  CA  . ASN B 2 161 ? -25.800 22.354  13.985  1.00 29.06  ? 161 ASN H CA  1 
ATOM   2456 C  C   . ASN B 2 161 ? -24.753 22.969  14.920  1.00 29.53  ? 161 ASN H C   1 
ATOM   2457 O  O   . ASN B 2 161 ? -25.121 23.617  15.926  1.00 30.85  ? 161 ASN H O   1 
ATOM   2458 C  CB  . ASN B 2 161 ? -27.230 22.447  14.530  1.00 30.46  ? 161 ASN H CB  1 
ATOM   2459 C  CG  . ASN B 2 161 ? -28.243 22.040  13.488  1.00 31.20  ? 161 ASN H CG  1 
ATOM   2460 O  OD1 . ASN B 2 161 ? -27.916 21.941  12.298  1.00 30.92  ? 161 ASN H OD1 1 
ATOM   2461 N  ND2 . ASN B 2 161 ? -29.495 21.863  13.904  1.00 31.56  ? 161 ASN H ND2 1 
ATOM   2462 N  N   . SER B 2 162 ? -23.485 22.708  14.619  1.00 29.08  ? 162 SER H N   1 
ATOM   2463 C  CA  . SER B 2 162 ? -22.288 23.253  15.312  1.00 29.65  ? 162 SER H CA  1 
ATOM   2464 C  C   . SER B 2 162 ? -22.320 22.892  16.794  1.00 30.80  ? 162 SER H C   1 
ATOM   2465 O  O   . SER B 2 162 ? -21.838 23.701  17.580  1.00 30.46  ? 162 SER H O   1 
ATOM   2466 C  CB  . SER B 2 162 ? -22.165 24.730  15.145  1.00 30.58  ? 162 SER H CB  1 
ATOM   2467 O  OG  . SER B 2 162 ? -22.245 25.106  13.785  1.00 31.71  ? 162 SER H OG  1 
ATOM   2468 N  N   . GLY B 2 163 ? -22.878 21.733  17.150  1.00 30.22  ? 163 GLY H N   1 
ATOM   2469 C  CA  . GLY B 2 163 ? -22.848 21.193  18.519  1.00 30.33  ? 163 GLY H CA  1 
ATOM   2470 C  C   . GLY B 2 163 ? -24.139 21.445  19.274  1.00 32.23  ? 163 GLY H C   1 
ATOM   2471 O  O   . GLY B 2 163 ? -24.245 20.942  20.382  1.00 34.36  ? 163 GLY H O   1 
ATOM   2472 N  N   . ALA B 2 164 ? -25.075 22.196  18.707  1.00 32.70  ? 164 ALA H N   1 
ATOM   2473 C  CA  . ALA B 2 164 ? -26.375 22.517  19.332  1.00 35.37  ? 164 ALA H CA  1 
ATOM   2474 C  C   . ALA B 2 164 ? -27.301 21.292  19.328  1.00 36.36  ? 164 ALA H C   1 
ATOM   2475 O  O   . ALA B 2 164 ? -28.291 21.313  20.081  1.00 39.06  ? 164 ALA H O   1 
ATOM   2476 C  CB  . ALA B 2 164 ? -27.029 23.651  18.600  1.00 36.28  ? 164 ALA H CB  1 
ATOM   2477 N  N   . LEU B 2 165 ? -27.068 20.308  18.453  1.00 34.53  ? 165 LEU H N   1 
ATOM   2478 C  CA  . LEU B 2 165 ? -27.946 19.116  18.355  1.00 33.53  ? 165 LEU H CA  1 
ATOM   2479 C  C   . LEU B 2 165 ? -27.120 17.885  18.731  1.00 32.23  ? 165 LEU H C   1 
ATOM   2480 O  O   . LEU B 2 165 ? -26.174 17.547  17.988  1.00 30.87  ? 165 LEU H O   1 
ATOM   2481 C  CB  . LEU B 2 165 ? -28.502 19.035  16.935  1.00 33.53  ? 165 LEU H CB  1 
ATOM   2482 C  CG  . LEU B 2 165 ? -29.347 17.802  16.623  1.00 33.33  ? 165 LEU H CG  1 
ATOM   2483 C  CD1 . LEU B 2 165 ? -30.533 17.698  17.564  1.00 35.98  ? 165 LEU H CD1 1 
ATOM   2484 C  CD2 . LEU B 2 165 ? -29.818 17.853  15.183  1.00 33.57  ? 165 LEU H CD2 1 
ATOM   2485 N  N   . THR B 2 166 ? -27.426 17.281  19.883  1.00 31.86  ? 166 THR H N   1 
ATOM   2486 C  CA  . THR B 2 166 ? -26.695 16.122  20.434  1.00 30.78  ? 166 THR H CA  1 
ATOM   2487 C  C   . THR B 2 166 ? -27.663 14.974  20.719  1.00 31.35  ? 166 THR H C   1 
ATOM   2488 O  O   . THR B 2 166 ? -27.216 13.837  20.585  1.00 31.79  ? 166 THR H O   1 
ATOM   2489 C  CB  . THR B 2 166 ? -25.910 16.539  21.684  1.00 31.53  ? 166 THR H CB  1 
ATOM   2490 O  OG1 . THR B 2 166 ? -26.848 17.211  22.516  1.00 32.97  ? 166 THR H OG1 1 
ATOM   2491 C  CG2 . THR B 2 166 ? -24.753 17.464  21.372  1.00 30.86  ? 166 THR H CG2 1 
ATOM   2492 N  N   . SER B 2 167 ? -28.908 15.260  21.121  1.00 33.16  ? 167 SER H N   1 
ATOM   2493 C  CA  A SER B 2 167 ? -29.929 14.241  21.480  0.50 34.21  ? 167 SER H CA  1 
ATOM   2494 C  CA  B SER B 2 167 ? -29.897 14.215  21.485  0.50 33.98  ? 167 SER H CA  1 
ATOM   2495 C  C   . SER B 2 167 ? -30.256 13.407  20.238  1.00 33.40  ? 167 SER H C   1 
ATOM   2496 O  O   . SER B 2 167 ? -30.533 14.016  19.198  1.00 33.03  ? 167 SER H O   1 
ATOM   2497 C  CB  A SER B 2 167 ? -31.155 14.891  22.045  0.50 36.60  ? 167 SER H CB  1 
ATOM   2498 C  CB  B SER B 2 167 ? -31.091 14.800  22.149  0.50 36.13  ? 167 SER H CB  1 
ATOM   2499 O  OG  A SER B 2 167 ? -32.061 13.924  22.558  0.50 38.45  ? 167 SER H OG  1 
ATOM   2500 O  OG  B SER B 2 167 ? -30.777 15.116  23.493  0.50 36.64  ? 167 SER H OG  1 
ATOM   2501 N  N   . GLY B 2 168 ? -30.164 12.081  20.342  1.00 33.42  ? 168 GLY H N   1 
ATOM   2502 C  CA  . GLY B 2 168 ? -30.568 11.170  19.251  1.00 33.32  ? 168 GLY H CA  1 
ATOM   2503 C  C   . GLY B 2 168 ? -29.527 11.038  18.146  1.00 30.79  ? 168 GLY H C   1 
ATOM   2504 O  O   . GLY B 2 168 ? -29.815 10.391  17.113  1.00 30.84  ? 168 GLY H O   1 
ATOM   2505 N  N   . VAL B 2 169 ? -28.339 11.590  18.308  1.00 28.52  ? 169 VAL H N   1 
ATOM   2506 C  CA  . VAL B 2 169 ? -27.287 11.452  17.273  1.00 26.24  ? 169 VAL H CA  1 
ATOM   2507 C  C   . VAL B 2 169 ? -26.620 10.085  17.412  1.00 25.50  ? 169 VAL H C   1 
ATOM   2508 O  O   . VAL B 2 169 ? -26.294 9.681   18.531  1.00 26.09  ? 169 VAL H O   1 
ATOM   2509 C  CB  . VAL B 2 169 ? -26.264 12.595  17.386  1.00 25.68  ? 169 VAL H CB  1 
ATOM   2510 C  CG1 . VAL B 2 169 ? -25.012 12.355  16.532  1.00 24.14  ? 169 VAL H CG1 1 
ATOM   2511 C  CG2 . VAL B 2 169 ? -26.899 13.932  17.071  1.00 26.05  ? 169 VAL H CG2 1 
ATOM   2512 N  N   . HIS B 2 170 ? -26.400 9.389   16.295  1.00 24.37  ? 170 HIS H N   1 
ATOM   2513 C  CA  . HIS B 2 170 ? -25.533 8.189   16.250  1.00 23.01  ? 170 HIS H CA  1 
ATOM   2514 C  C   . HIS B 2 170 ? -24.546 8.391   15.121  1.00 21.94  ? 170 HIS H C   1 
ATOM   2515 O  O   . HIS B 2 170 ? -24.997 8.454   13.941  1.00 21.19  ? 170 HIS H O   1 
ATOM   2516 C  CB  . HIS B 2 170 ? -26.322 6.884   16.045  1.00 23.86  ? 170 HIS H CB  1 
ATOM   2517 C  CG  . HIS B 2 170 ? -27.233 6.510   17.146  1.00 25.27  ? 170 HIS H CG  1 
ATOM   2518 N  ND1 . HIS B 2 170 ? -26.764 6.123   18.392  1.00 25.20  ? 170 HIS H ND1 1 
ATOM   2519 C  CD2 . HIS B 2 170 ? -28.584 6.401   17.176  1.00 26.30  ? 170 HIS H CD2 1 
ATOM   2520 C  CE1 . HIS B 2 170 ? -27.802 5.804   19.153  1.00 27.01  ? 170 HIS H CE1 1 
ATOM   2521 N  NE2 . HIS B 2 170 ? -28.922 5.973   18.432  1.00 27.46  ? 170 HIS H NE2 1 
ATOM   2522 N  N   . THR B 2 171 ? -23.266 8.478   15.463  1.00 21.10  ? 171 THR H N   1 
ATOM   2523 C  CA  . THR B 2 171 ? -22.166 8.512   14.480  1.00 20.00  ? 171 THR H CA  1 
ATOM   2524 C  C   . THR B 2 171 ? -21.528 7.139   14.489  1.00 19.47  ? 171 THR H C   1 
ATOM   2525 O  O   . THR B 2 171 ? -21.060 6.695   15.541  1.00 19.66  ? 171 THR H O   1 
ATOM   2526 C  CB  . THR B 2 171 ? -21.224 9.673   14.781  1.00 20.09  ? 171 THR H CB  1 
ATOM   2527 O  OG1 . THR B 2 171 ? -22.016 10.842  14.657  1.00 21.54  ? 171 THR H OG1 1 
ATOM   2528 C  CG2 . THR B 2 171 ? -20.029 9.698   13.861  1.00 19.77  ? 171 THR H CG2 1 
ATOM   2529 N  N   . PHE B 2 172 ? -21.608 6.426   13.379  1.00 18.30  ? 172 PHE H N   1 
ATOM   2530 C  CA  . PHE B 2 172 ? -21.220 5.004   13.296  1.00 18.83  ? 172 PHE H CA  1 
ATOM   2531 C  C   . PHE B 2 172 ? -19.701 4.927   13.218  1.00 19.16  ? 172 PHE H C   1 
ATOM   2532 O  O   . PHE B 2 172 ? -19.061 5.842   12.695  1.00 18.41  ? 172 PHE H O   1 
ATOM   2533 C  CB  . PHE B 2 172 ? -21.900 4.330   12.087  1.00 18.74  ? 172 PHE H CB  1 
ATOM   2534 C  CG  . PHE B 2 172 ? -23.359 4.048   12.317  1.00 20.17  ? 172 PHE H CG  1 
ATOM   2535 C  CD1 . PHE B 2 172 ? -23.755 2.915   13.005  1.00 21.07  ? 172 PHE H CD1 1 
ATOM   2536 C  CD2 . PHE B 2 172 ? -24.326 4.963   11.952  1.00 20.46  ? 172 PHE H CD2 1 
ATOM   2537 C  CE1 . PHE B 2 172 ? -25.099 2.665   13.273  1.00 22.57  ? 172 PHE H CE1 1 
ATOM   2538 C  CE2 . PHE B 2 172 ? -25.667 4.726   12.227  1.00 21.55  ? 172 PHE H CE2 1 
ATOM   2539 C  CZ  . PHE B 2 172 ? -26.054 3.580   12.883  1.00 22.72  ? 172 PHE H CZ  1 
ATOM   2540 N  N   . PRO B 2 173 ? -19.109 3.842   13.751  1.00 20.76  ? 173 PRO H N   1 
ATOM   2541 C  CA  . PRO B 2 173 ? -17.717 3.514   13.495  1.00 21.80  ? 173 PRO H CA  1 
ATOM   2542 C  C   . PRO B 2 173 ? -17.480 3.406   11.980  1.00 22.27  ? 173 PRO H C   1 
ATOM   2543 O  O   . PRO B 2 173 ? -18.331 2.900   11.225  1.00 22.08  ? 173 PRO H O   1 
ATOM   2544 C  CB  . PRO B 2 173 ? -17.498 2.167   14.227  1.00 22.58  ? 173 PRO H CB  1 
ATOM   2545 C  CG  . PRO B 2 173 ? -18.566 2.131   15.270  1.00 23.29  ? 173 PRO H CG  1 
ATOM   2546 C  CD  . PRO B 2 173 ? -19.734 2.874   14.654  1.00 22.72  ? 173 PRO H CD  1 
ATOM   2547 N  N   . ALA B 2 174 ? -16.327 3.908   11.558  1.00 22.15  ? 174 ALA H N   1 
ATOM   2548 C  CA  . ALA B 2 174 ? -15.904 3.809   10.156  1.00 24.01  ? 174 ALA H CA  1 
ATOM   2549 C  C   . ALA B 2 174 ? -15.754 2.331   9.790   1.00 25.32  ? 174 ALA H C   1 
ATOM   2550 O  O   . ALA B 2 174 ? -15.390 1.516   10.674  1.00 25.17  ? 174 ALA H O   1 
ATOM   2551 C  CB  . ALA B 2 174 ? -14.616 4.578   9.946   1.00 23.57  ? 174 ALA H CB  1 
ATOM   2552 N  N   . VAL B 2 175 ? -16.044 2.015   8.538   1.00 25.55  ? 175 VAL H N   1 
ATOM   2553 C  CA  . VAL B 2 175 ? -15.750 0.716   7.884   1.00 27.90  ? 175 VAL H CA  1 
ATOM   2554 C  C   . VAL B 2 175 ? -14.716 0.982   6.800   1.00 25.54  ? 175 VAL H C   1 
ATOM   2555 O  O   . VAL B 2 175 ? -14.847 1.996   6.063   1.00 24.26  ? 175 VAL H O   1 
ATOM   2556 C  CB  . VAL B 2 175 ? -17.000 0.026   7.299   1.00 31.83  ? 175 VAL H CB  1 
ATOM   2557 C  CG1 . VAL B 2 175 ? -18.078 -0.105  8.359   1.00 33.08  ? 175 VAL H CG1 1 
ATOM   2558 C  CG2 . VAL B 2 175 ? -17.532 0.726   6.045   1.00 34.24  ? 175 VAL H CG2 1 
ATOM   2559 N  N   . LEU B 2 176 ? -13.707 0.126   6.759   1.00 25.40  ? 176 LEU H N   1 
ATOM   2560 C  CA  . LEU B 2 176 ? -12.690 0.130   5.696   1.00 26.17  ? 176 LEU H CA  1 
ATOM   2561 C  C   . LEU B 2 176 ? -13.294 -0.511  4.456   1.00 26.40  ? 176 LEU H C   1 
ATOM   2562 O  O   . LEU B 2 176 ? -13.691 -1.685  4.500   1.00 26.16  ? 176 LEU H O   1 
ATOM   2563 C  CB  . LEU B 2 176 ? -11.440 -0.594  6.185   1.00 27.52  ? 176 LEU H CB  1 
ATOM   2564 C  CG  . LEU B 2 176 ? -10.258 -0.595  5.218   1.00 29.89  ? 176 LEU H CG  1 
ATOM   2565 C  CD1 . LEU B 2 176 ? -9.790  0.824   4.904   1.00 28.89  ? 176 LEU H CD1 1 
ATOM   2566 C  CD2 . LEU B 2 176 ? -9.095  -1.379  5.814   1.00 31.57  ? 176 LEU H CD2 1 
ATOM   2567 N  N   . GLN B 2 177 ? -13.349 0.233   3.364   1.00 25.81  ? 177 GLN H N   1 
ATOM   2568 C  CA  . GLN B 2 177 ? -13.796 -0.278  2.050   1.00 26.80  ? 177 GLN H CA  1 
ATOM   2569 C  C   . GLN B 2 177 ? -12.700 -1.096  1.354   1.00 28.43  ? 177 GLN H C   1 
ATOM   2570 O  O   . GLN B 2 177 ? -11.487 -0.946  1.677   1.00 26.90  ? 177 GLN H O   1 
ATOM   2571 C  CB  . GLN B 2 177 ? -14.241 0.892   1.175   1.00 27.29  ? 177 GLN H CB  1 
ATOM   2572 C  CG  . GLN B 2 177 ? -15.437 1.629   1.771   1.00 27.68  ? 177 GLN H CG  1 
ATOM   2573 C  CD  . GLN B 2 177 ? -15.720 2.962   1.112   1.00 28.69  ? 177 GLN H CD  1 
ATOM   2574 O  OE1 . GLN B 2 177 ? -16.820 3.192   0.593   1.00 31.38  ? 177 GLN H OE1 1 
ATOM   2575 N  NE2 . GLN B 2 177 ? -14.773 3.886   1.209   1.00 25.96  ? 177 GLN H NE2 1 
ATOM   2576 N  N   . SER B 2 178 ? -13.098 -1.880  0.352   1.00 30.19  ? 178 SER H N   1 
ATOM   2577 C  CA  . SER B 2 178 ? -12.159 -2.675  -0.482  1.00 32.81  ? 178 SER H CA  1 
ATOM   2578 C  C   . SER B 2 178 ? -11.114 -1.750  -1.129  1.00 32.84  ? 178 SER H C   1 
ATOM   2579 O  O   . SER B 2 178 ? -9.972  -2.193  -1.365  1.00 32.84  ? 178 SER H O   1 
ATOM   2580 C  CB  . SER B 2 178 ? -12.893 -3.526  -1.507  1.00 33.82  ? 178 SER H CB  1 
ATOM   2581 O  OG  . SER B 2 178 ? -13.300 -2.739  -2.625  1.00 34.48  ? 178 SER H OG  1 
ATOM   2582 N  N   . SER B 2 179 ? -11.469 -0.487  -1.361  1.00 31.78  ? 179 SER H N   1 
ATOM   2583 C  CA  . SER B 2 179 ? -10.558 0.555   -1.905  1.00 31.11  ? 179 SER H CA  1 
ATOM   2584 C  C   . SER B 2 179 ? -9.440  0.924   -0.912  1.00 29.67  ? 179 SER H C   1 
ATOM   2585 O  O   . SER B 2 179 ? -8.554  1.634   -1.333  1.00 30.83  ? 179 SER H O   1 
ATOM   2586 C  CB  . SER B 2 179 ? -11.347 1.764   -2.270  1.00 30.12  ? 179 SER H CB  1 
ATOM   2587 O  OG  . SER B 2 179 ? -11.946 2.292   -1.103  1.00 28.62  ? 179 SER H OG  1 
ATOM   2588 N  N   . GLY B 2 180 ? -9.492  0.533   0.362   1.00 27.60  ? 180 GLY H N   1 
ATOM   2589 C  CA  . GLY B 2 180 ? -8.571  1.021   1.402   1.00 25.81  ? 180 GLY H CA  1 
ATOM   2590 C  C   . GLY B 2 180 ? -8.893  2.440   1.878   1.00 24.75  ? 180 GLY H C   1 
ATOM   2591 O  O   . GLY B 2 180 ? -8.073  3.037   2.620   1.00 24.66  ? 180 GLY H O   1 
ATOM   2592 N  N   . LEU B 2 181 ? -10.070 2.957   1.551   1.00 23.03  ? 181 LEU H N   1 
ATOM   2593 C  CA  . LEU B 2 181 ? -10.622 4.216   2.103   1.00 21.07  ? 181 LEU H CA  1 
ATOM   2594 C  C   . LEU B 2 181 ? -11.755 3.896   3.084   1.00 20.48  ? 181 LEU H C   1 
ATOM   2595 O  O   . LEU B 2 181 ? -12.514 2.902   2.870   1.00 21.29  ? 181 LEU H O   1 
ATOM   2596 C  CB  . LEU B 2 181 ? -11.149 5.077   0.949   1.00 20.68  ? 181 LEU H CB  1 
ATOM   2597 C  CG  . LEU B 2 181 ? -10.102 5.455   -0.095  1.00 21.70  ? 181 LEU H CG  1 
ATOM   2598 C  CD1 . LEU B 2 181 ? -10.746 6.060   -1.341  1.00 22.08  ? 181 LEU H CD1 1 
ATOM   2599 C  CD2 . LEU B 2 181 ? -9.114  6.445   0.510   1.00 21.70  ? 181 LEU H CD2 1 
ATOM   2600 N  N   . TYR B 2 182 ? -11.879 4.725   4.105   1.00 18.96  ? 182 TYR H N   1 
ATOM   2601 C  CA  . TYR B 2 182 ? -12.928 4.624   5.136   1.00 18.60  ? 182 TYR H CA  1 
ATOM   2602 C  C   . TYR B 2 182 ? -14.190 5.341   4.678   1.00 18.13  ? 182 TYR H C   1 
ATOM   2603 O  O   . TYR B 2 182 ? -14.178 6.234   3.821   1.00 18.56  ? 182 TYR H O   1 
ATOM   2604 C  CB  . TYR B 2 182 ? -12.472 5.240   6.471   1.00 18.26  ? 182 TYR H CB  1 
ATOM   2605 C  CG  . TYR B 2 182 ? -11.381 4.444   7.105   1.00 20.67  ? 182 TYR H CG  1 
ATOM   2606 C  CD1 . TYR B 2 182 ? -11.663 3.306   7.847   1.00 22.07  ? 182 TYR H CD1 1 
ATOM   2607 C  CD2 . TYR B 2 182 ? -10.044 4.777   6.889   1.00 20.71  ? 182 TYR H CD2 1 
ATOM   2608 C  CE1 . TYR B 2 182 ? -10.643 2.573   8.431   1.00 23.27  ? 182 TYR H CE1 1 
ATOM   2609 C  CE2 . TYR B 2 182 ? -9.019  4.027   7.433   1.00 22.15  ? 182 TYR H CE2 1 
ATOM   2610 C  CZ  . TYR B 2 182 ? -9.321  2.913   8.196   1.00 23.19  ? 182 TYR H CZ  1 
ATOM   2611 O  OH  . TYR B 2 182 ? -8.311  2.206   8.765   1.00 24.91  ? 182 TYR H OH  1 
ATOM   2612 N  N   . SER B 2 183 ? -15.282 4.922   5.287   1.00 18.56  ? 183 SER H N   1 
ATOM   2613 C  CA  A SER B 2 183 ? -16.621 5.530   5.089   0.50 18.60  ? 183 SER H CA  1 
ATOM   2614 C  CA  B SER B 2 183 ? -16.629 5.512   5.094   0.50 19.48  ? 183 SER H CA  1 
ATOM   2615 C  C   . SER B 2 183 ? -17.400 5.402   6.400   1.00 18.96  ? 183 SER H C   1 
ATOM   2616 O  O   . SER B 2 183 ? -17.252 4.351   7.086   1.00 18.52  ? 183 SER H O   1 
ATOM   2617 C  CB  A SER B 2 183 ? -17.347 4.875   3.915   0.50 19.08  ? 183 SER H CB  1 
ATOM   2618 C  CB  B SER B 2 183 ? -17.379 4.813   3.995   0.50 20.95  ? 183 SER H CB  1 
ATOM   2619 O  OG  A SER B 2 183 ? -18.569 5.538   3.618   0.50 18.21  ? 183 SER H OG  1 
ATOM   2620 O  OG  B SER B 2 183 ? -17.076 5.415   2.765   0.50 22.44  ? 183 SER H OG  1 
ATOM   2621 N  N   . LEU B 2 184 ? -18.181 6.421   6.737   1.00 19.31  ? 184 LEU H N   1 
ATOM   2622 C  CA  . LEU B 2 184 ? -19.175 6.263   7.835   1.00 20.45  ? 184 LEU H CA  1 
ATOM   2623 C  C   . LEU B 2 184 ? -20.391 7.131   7.569   1.00 19.87  ? 184 LEU H C   1 
ATOM   2624 O  O   . LEU B 2 184 ? -20.294 8.054   6.778   1.00 19.40  ? 184 LEU H O   1 
ATOM   2625 C  CB  . LEU B 2 184 ? -18.525 6.591   9.184   1.00 20.62  ? 184 LEU H CB  1 
ATOM   2626 C  CG  . LEU B 2 184 ? -18.045 8.017   9.463   1.00 20.60  ? 184 LEU H CG  1 
ATOM   2627 C  CD1 . LEU B 2 184 ? -19.181 9.011   9.757   1.00 20.94  ? 184 LEU H CD1 1 
ATOM   2628 C  CD2 . LEU B 2 184 ? -17.109 7.983   10.655  1.00 22.05  ? 184 LEU H CD2 1 
ATOM   2629 N  N   . SER B 2 185 ? -21.483 6.824   8.243   1.00 20.70  ? 185 SER H N   1 
ATOM   2630 C  CA  . SER B 2 185 ? -22.659 7.687   8.330   1.00 20.04  ? 185 SER H CA  1 
ATOM   2631 C  C   . SER B 2 185 ? -22.754 8.244   9.746   1.00 19.24  ? 185 SER H C   1 
ATOM   2632 O  O   . SER B 2 185 ? -22.367 7.543   10.712  1.00 19.41  ? 185 SER H O   1 
ATOM   2633 C  CB  . SER B 2 185 ? -23.897 6.938   7.945   1.00 23.42  ? 185 SER H CB  1 
ATOM   2634 O  OG  . SER B 2 185 ? -24.015 6.972   6.523   1.00 26.03  ? 185 SER H OG  1 
ATOM   2635 N  N   . SER B 2 186 ? -23.361 9.417   9.835   1.00 18.27  ? 186 SER H N   1 
ATOM   2636 C  CA  . SER B 2 186 ? -23.891 10.022  11.064  1.00 18.08  ? 186 SER H CA  1 
ATOM   2637 C  C   . SER B 2 186 ? -25.373 10.272  10.858  1.00 18.90  ? 186 SER H C   1 
ATOM   2638 O  O   . SER B 2 186 ? -25.737 10.964  9.866   1.00 19.10  ? 186 SER H O   1 
ATOM   2639 C  CB  . SER B 2 186 ? -23.196 11.314  11.392  1.00 17.99  ? 186 SER H CB  1 
ATOM   2640 O  OG  . SER B 2 186 ? -23.498 11.742  12.716  1.00 18.00  ? 186 SER H OG  1 
ATOM   2641 N  N   . VAL B 2 187 ? -26.176 9.790   11.768  1.00 19.39  ? 187 VAL H N   1 
ATOM   2642 C  CA  . VAL B 2 187 ? -27.643 10.006  11.687  1.00 20.27  ? 187 VAL H CA  1 
ATOM   2643 C  C   . VAL B 2 187 ? -28.176 10.730  12.915  1.00 21.33  ? 187 VAL H C   1 
ATOM   2644 O  O   . VAL B 2 187 ? -27.578 10.662  14.024  1.00 22.07  ? 187 VAL H O   1 
ATOM   2645 C  CB  . VAL B 2 187 ? -28.348 8.656   11.458  1.00 21.22  ? 187 VAL H CB  1 
ATOM   2646 C  CG1 . VAL B 2 187 ? -27.865 8.032   10.165  1.00 20.49  ? 187 VAL H CG1 1 
ATOM   2647 C  CG2 . VAL B 2 187 ? -28.147 7.709   12.641  1.00 21.29  ? 187 VAL H CG2 1 
ATOM   2648 N  N   . VAL B 2 188 ? -29.427 11.198  12.805  1.00 22.78  ? 188 VAL H N   1 
ATOM   2649 C  CA  . VAL B 2 188 ? -30.102 11.782  13.986  1.00 23.39  ? 188 VAL H CA  1 
ATOM   2650 C  C   . VAL B 2 188 ? -31.598 11.606  13.742  1.00 24.92  ? 188 VAL H C   1 
ATOM   2651 O  O   . VAL B 2 188 ? -32.029 11.649  12.583  1.00 24.64  ? 188 VAL H O   1 
ATOM   2652 C  CB  . VAL B 2 188 ? -29.684 13.249  14.200  1.00 22.89  ? 188 VAL H CB  1 
ATOM   2653 C  CG1 . VAL B 2 188 ? -30.005 14.131  13.002  1.00 22.99  ? 188 VAL H CG1 1 
ATOM   2654 C  CG2 . VAL B 2 188 ? -30.268 13.828  15.467  1.00 24.64  ? 188 VAL H CG2 1 
ATOM   2655 N  N   . THR B 2 189 ? -32.320 11.368  14.806  1.00 26.84  ? 189 THR H N   1 
ATOM   2656 C  CA  . THR B 2 189 ? -33.808 11.326  14.746  1.00 29.39  ? 189 THR H CA  1 
ATOM   2657 C  C   . THR B 2 189 ? -34.334 12.601  15.383  1.00 31.34  ? 189 THR H C   1 
ATOM   2658 O  O   . THR B 2 189 ? -33.814 12.986  16.439  1.00 31.71  ? 189 THR H O   1 
ATOM   2659 C  CB  . THR B 2 189 ? -34.380 10.065  15.398  1.00 30.74  ? 189 THR H CB  1 
ATOM   2660 O  OG1 . THR B 2 189 ? -33.847 9.948   16.719  1.00 30.20  ? 189 THR H OG1 1 
ATOM   2661 C  CG2 . THR B 2 189 ? -34.101 8.813   14.593  1.00 30.08  ? 189 THR H CG2 1 
ATOM   2662 N  N   . VAL B 2 190 ? -35.364 13.177  14.769  1.00 33.70  ? 190 VAL H N   1 
ATOM   2663 C  CA  . VAL B 2 190 ? -35.927 14.499  15.128  1.00 35.50  ? 190 VAL H CA  1 
ATOM   2664 C  C   . VAL B 2 190 ? -37.436 14.389  14.949  1.00 38.41  ? 190 VAL H C   1 
ATOM   2665 O  O   . VAL B 2 190 ? -37.905 13.482  14.263  1.00 38.62  ? 190 VAL H O   1 
ATOM   2666 C  CB  . VAL B 2 190 ? -35.321 15.613  14.260  1.00 34.39  ? 190 VAL H CB  1 
ATOM   2667 C  CG1 . VAL B 2 190 ? -33.807 15.700  14.437  1.00 32.37  ? 190 VAL H CG1 1 
ATOM   2668 C  CG2 . VAL B 2 190 ? -35.667 15.454  12.792  1.00 34.32  ? 190 VAL H CG2 1 
ATOM   2669 N  N   . PRO B 2 191 ? -38.225 15.297  15.543  1.00 41.26  ? 191 PRO H N   1 
ATOM   2670 C  CA  . PRO B 2 191 ? -39.660 15.354  15.255  1.00 44.69  ? 191 PRO H CA  1 
ATOM   2671 C  C   . PRO B 2 191 ? -39.953 15.653  13.770  1.00 45.69  ? 191 PRO H C   1 
ATOM   2672 O  O   . PRO B 2 191 ? -39.371 16.564  13.192  1.00 44.98  ? 191 PRO H O   1 
ATOM   2673 C  CB  . PRO B 2 191 ? -40.152 16.495  16.147  1.00 46.34  ? 191 PRO H CB  1 
ATOM   2674 C  CG  . PRO B 2 191 ? -39.113 16.597  17.227  1.00 45.04  ? 191 PRO H CG  1 
ATOM   2675 C  CD  . PRO B 2 191 ? -37.795 16.301  16.529  1.00 41.94  ? 191 PRO H CD  1 
ATOM   2676 N  N   . SER B 2 192 ? -40.878 14.890  13.163  1.00 48.16  ? 192 SER H N   1 
ATOM   2677 C  CA  . SER B 2 192 ? -41.261 15.065  11.732  1.00 49.50  ? 192 SER H CA  1 
ATOM   2678 C  C   . SER B 2 192 ? -41.797 16.503  11.500  1.00 51.43  ? 192 SER H C   1 
ATOM   2679 O  O   . SER B 2 192 ? -41.638 17.032  10.360  1.00 50.65  ? 192 SER H O   1 
ATOM   2680 C  CB  . SER B 2 192 ? -42.272 14.011  11.277  1.00 51.82  ? 192 SER H CB  1 
ATOM   2681 O  OG  . SER B 2 192 ? -41.905 12.694  11.695  1.00 51.33  ? 192 SER H OG  1 
ATOM   2682 N  N   . SER B 2 193 ? -42.436 17.084  12.536  1.00 54.98  ? 193 SER H N   1 
ATOM   2683 C  CA  . SER B 2 193 ? -42.975 18.477  12.582  1.00 57.59  ? 193 SER H CA  1 
ATOM   2684 C  C   . SER B 2 193 ? -41.861 19.523  12.388  1.00 56.68  ? 193 SER H C   1 
ATOM   2685 O  O   . SER B 2 193 ? -42.169 20.616  11.881  1.00 58.36  ? 193 SER H O   1 
ATOM   2686 C  CB  . SER B 2 193 ? -43.677 18.721  13.891  1.00 60.22  ? 193 SER H CB  1 
ATOM   2687 O  OG  . SER B 2 193 ? -42.738 18.694  14.958  1.00 59.25  ? 193 SER H OG  1 
ATOM   2688 N  N   . SER B 2 194 ? -40.627 19.214  12.801  1.00 54.68  ? 194 SER H N   1 
ATOM   2689 C  CA  . SER B 2 194 ? -39.461 20.136  12.766  1.00 54.07  ? 194 SER H CA  1 
ATOM   2690 C  C   . SER B 2 194 ? -38.887 20.268  11.343  1.00 53.35  ? 194 SER H C   1 
ATOM   2691 O  O   . SER B 2 194 ? -38.011 21.134  11.151  1.00 53.23  ? 194 SER H O   1 
ATOM   2692 C  CB  . SER B 2 194 ? -38.388 19.698  13.750  1.00 51.93  ? 194 SER H CB  1 
ATOM   2693 O  OG  . SER B 2 194 ? -37.560 18.671  13.207  1.00 49.24  ? 194 SER H OG  1 
ATOM   2694 N  N   . LEU B 2 195 ? -39.316 19.436  10.388  1.00 53.16  ? 195 LEU H N   1 
ATOM   2695 C  CA  . LEU B 2 195 ? -38.656 19.312  9.059   1.00 52.14  ? 195 LEU H CA  1 
ATOM   2696 C  C   . LEU B 2 195 ? -38.909 20.564  8.204   1.00 54.59  ? 195 LEU H C   1 
ATOM   2697 O  O   . LEU B 2 195 ? -38.007 20.962  7.467   1.00 53.23  ? 195 LEU H O   1 
ATOM   2698 C  CB  . LEU B 2 195 ? -39.145 18.036  8.361   1.00 51.39  ? 195 LEU H CB  1 
ATOM   2699 C  CG  . LEU B 2 195 ? -38.696 16.710  8.991   1.00 50.05  ? 195 LEU H CG  1 
ATOM   2700 C  CD1 . LEU B 2 195 ? -39.021 15.545  8.059   1.00 50.05  ? 195 LEU H CD1 1 
ATOM   2701 C  CD2 . LEU B 2 195 ? -37.208 16.711  9.332   1.00 46.15  ? 195 LEU H CD2 1 
ATOM   2702 N  N   . GLY B 2 196 ? -40.098 21.158  8.267   1.00 60.07  ? 196 GLY H N   1 
ATOM   2703 C  CA  . GLY B 2 196 ? -40.410 22.414  7.546   1.00 63.46  ? 196 GLY H CA  1 
ATOM   2704 C  C   . GLY B 2 196 ? -39.540 23.571  8.036   1.00 64.79  ? 196 GLY H C   1 
ATOM   2705 O  O   . GLY B 2 196 ? -39.077 24.385  7.196   1.00 64.71  ? 196 GLY H O   1 
ATOM   2706 N  N   . THR B 2 197 ? -39.287 23.605  9.349   1.00 64.63  ? 197 THR H N   1 
ATOM   2707 C  CA  . THR B 2 197 ? -38.883 24.805  10.127  1.00 64.46  ? 197 THR H CA  1 
ATOM   2708 C  C   . THR B 2 197 ? -37.373 24.737  10.418  1.00 59.48  ? 197 THR H C   1 
ATOM   2709 O  O   . THR B 2 197 ? -36.658 25.659  10.005  1.00 60.00  ? 197 THR H O   1 
ATOM   2710 C  CB  . THR B 2 197 ? -39.798 24.937  11.358  1.00 67.43  ? 197 THR H CB  1 
ATOM   2711 O  OG1 . THR B 2 197 ? -39.638 26.241  11.914  1.00 71.74  ? 197 THR H OG1 1 
ATOM   2712 C  CG2 . THR B 2 197 ? -39.538 23.921  12.451  1.00 66.19  ? 197 THR H CG2 1 
ATOM   2713 N  N   . GLN B 2 198 ? -36.900 23.655  11.039  1.00 54.68  ? 198 GLN H N   1 
ATOM   2714 C  CA  . GLN B 2 198 ? -35.558 23.570  11.666  1.00 50.55  ? 198 GLN H CA  1 
ATOM   2715 C  C   . GLN B 2 198 ? -34.505 23.216  10.609  1.00 46.40  ? 198 GLN H C   1 
ATOM   2716 O  O   . GLN B 2 198 ? -34.697 22.243  9.846   1.00 46.60  ? 198 GLN H O   1 
ATOM   2717 C  CB  . GLN B 2 198 ? -35.600 22.557  12.808  1.00 50.14  ? 198 GLN H CB  1 
ATOM   2718 C  CG  . GLN B 2 198 ? -34.269 22.374  13.510  1.00 48.69  ? 198 GLN H CG  1 
ATOM   2719 C  CD  . GLN B 2 198 ? -33.820 23.639  14.199  1.00 49.50  ? 198 GLN H CD  1 
ATOM   2720 O  OE1 . GLN B 2 198 ? -34.578 24.260  14.941  1.00 50.85  ? 198 GLN H OE1 1 
ATOM   2721 N  NE2 . GLN B 2 198 ? -32.580 24.028  13.939  1.00 46.43  ? 198 GLN H NE2 1 
ATOM   2722 N  N   . THR B 2 199 ? -33.425 23.991  10.553  1.00 43.33  ? 199 THR H N   1 
ATOM   2723 C  CA  . THR B 2 199 ? -32.267 23.720  9.671   1.00 39.92  ? 199 THR H CA  1 
ATOM   2724 C  C   . THR B 2 199 ? -31.435 22.617  10.325  1.00 36.48  ? 199 THR H C   1 
ATOM   2725 O  O   . THR B 2 199 ? -31.214 22.671  11.574  1.00 35.40  ? 199 THR H O   1 
ATOM   2726 C  CB  . THR B 2 199 ? -31.484 24.995  9.337   1.00 39.77  ? 199 THR H CB  1 
ATOM   2727 O  OG1 . THR B 2 199 ? -32.323 25.715  8.439   1.00 41.36  ? 199 THR H OG1 1 
ATOM   2728 C  CG2 . THR B 2 199 ? -30.167 24.718  8.649   1.00 38.71  ? 199 THR H CG2 1 
ATOM   2729 N  N   . TYR B 2 200 ? -31.037 21.625  9.533   1.00 33.89  ? 200 TYR H N   1 
ATOM   2730 C  CA  . TYR B 2 200 ? -30.152 20.521  9.998   1.00 31.96  ? 200 TYR H CA  1 
ATOM   2731 C  C   . TYR B 2 200 ? -28.884 20.490  9.137   1.00 29.64  ? 200 TYR H C   1 
ATOM   2732 O  O   . TYR B 2 200 ? -28.945 20.271  7.902   1.00 28.91  ? 200 TYR H O   1 
ATOM   2733 C  CB  . TYR B 2 200 ? -30.936 19.202  9.991   1.00 31.75  ? 200 TYR H CB  1 
ATOM   2734 C  CG  . TYR B 2 200 ? -32.069 19.157  10.983  1.00 32.91  ? 200 TYR H CG  1 
ATOM   2735 C  CD1 . TYR B 2 200 ? -31.795 19.066  12.336  1.00 33.13  ? 200 TYR H CD1 1 
ATOM   2736 C  CD2 . TYR B 2 200 ? -33.403 19.220  10.594  1.00 34.08  ? 200 TYR H CD2 1 
ATOM   2737 C  CE1 . TYR B 2 200 ? -32.821 19.014  13.268  1.00 34.29  ? 200 TYR H CE1 1 
ATOM   2738 C  CE2 . TYR B 2 200 ? -34.435 19.168  11.519  1.00 35.29  ? 200 TYR H CE2 1 
ATOM   2739 C  CZ  . TYR B 2 200 ? -34.139 19.068  12.869  1.00 35.81  ? 200 TYR H CZ  1 
ATOM   2740 O  OH  . TYR B 2 200 ? -35.105 19.024  13.846  1.00 37.39  ? 200 TYR H OH  1 
ATOM   2741 N  N   . ILE B 2 201 ? -27.753 20.754  9.773   1.00 29.12  ? 201 ILE H N   1 
ATOM   2742 C  CA  . ILE B 2 201 ? -26.403 20.789  9.126   1.00 28.21  ? 201 ILE H CA  1 
ATOM   2743 C  C   . ILE B 2 201 ? -25.451 19.862  9.877   1.00 26.46  ? 201 ILE H C   1 
ATOM   2744 O  O   . ILE B 2 201 ? -25.299 19.994  11.107  1.00 26.56  ? 201 ILE H O   1 
ATOM   2745 C  CB  . ILE B 2 201 ? -25.869 22.234  9.050   1.00 29.91  ? 201 ILE H CB  1 
ATOM   2746 C  CG1 . ILE B 2 201 ? -26.763 23.094  8.155   1.00 31.60  ? 201 ILE H CG1 1 
ATOM   2747 C  CG2 . ILE B 2 201 ? -24.417 22.254  8.585   1.00 28.69  ? 201 ILE H CG2 1 
ATOM   2748 C  CD1 . ILE B 2 201 ? -26.459 24.560  8.188   1.00 33.38  ? 201 ILE H CD1 1 
ATOM   2749 N  N   . CYS B 2 202 ? -24.813 18.942  9.153   1.00 25.54  ? 202 CYS H N   1 
ATOM   2750 C  CA  . CYS B 2 202 ? -23.719 18.108  9.704   1.00 24.32  ? 202 CYS H CA  1 
ATOM   2751 C  C   . CYS B 2 202 ? -22.383 18.814  9.426   1.00 24.09  ? 202 CYS H C   1 
ATOM   2752 O  O   . CYS B 2 202 ? -22.156 19.260  8.266   1.00 24.23  ? 202 CYS H O   1 
ATOM   2753 C  CB  . CYS B 2 202 ? -23.700 16.675  9.192   1.00 24.43  ? 202 CYS H CB  1 
ATOM   2754 S  SG  . CYS B 2 202 ? -23.261 16.536  7.452   1.00 24.69  ? 202 CYS H SG  1 
ATOM   2755 N  N   . ASN B 2 203 ? -21.597 18.969  10.483  1.00 22.31  ? 203 ASN H N   1 
ATOM   2756 C  CA  . ASN B 2 203 ? -20.263 19.646  10.443  1.00 22.56  ? 203 ASN H CA  1 
ATOM   2757 C  C   . ASN B 2 203 ? -19.190 18.571  10.487  1.00 20.53  ? 203 ASN H C   1 
ATOM   2758 O  O   . ASN B 2 203 ? -19.011 17.898  11.544  1.00 20.80  ? 203 ASN H O   1 
ATOM   2759 C  CB  . ASN B 2 203 ? -20.085 20.676  11.565  1.00 23.04  ? 203 ASN H CB  1 
ATOM   2760 C  CG  . ASN B 2 203 ? -21.361 21.426  11.883  1.00 23.68  ? 203 ASN H CG  1 
ATOM   2761 O  OD1 . ASN B 2 203 ? -21.936 21.172  12.924  1.00 25.11  ? 203 ASN H OD1 1 
ATOM   2762 N  ND2 . ASN B 2 203 ? -21.812 22.289  10.985  1.00 23.86  ? 203 ASN H ND2 1 
ATOM   2763 N  N   . VAL B 2 204 ? -18.554 18.346  9.356   1.00 19.41  ? 204 VAL H N   1 
ATOM   2764 C  CA  . VAL B 2 204 ? -17.603 17.221  9.195   1.00 18.80  ? 204 VAL H CA  1 
ATOM   2765 C  C   . VAL B 2 204 ? -16.190 17.813  9.179   1.00 18.73  ? 204 VAL H C   1 
ATOM   2766 O  O   . VAL B 2 204 ? -15.934 18.772  8.435   1.00 18.00  ? 204 VAL H O   1 
ATOM   2767 C  CB  . VAL B 2 204 ? -17.900 16.399  7.919   1.00 19.55  ? 204 VAL H CB  1 
ATOM   2768 C  CG1 . VAL B 2 204 ? -16.842 15.322  7.692   1.00 19.03  ? 204 VAL H CG1 1 
ATOM   2769 C  CG2 . VAL B 2 204 ? -19.285 15.755  7.953   1.00 20.05  ? 204 VAL H CG2 1 
ATOM   2770 N  N   . ASN B 2 205 ? -15.299 17.233  9.974   1.00 17.97  ? 205 ASN H N   1 
ATOM   2771 C  CA  . ASN B 2 205 ? -13.881 17.659  9.957   1.00 19.60  ? 205 ASN H CA  1 
ATOM   2772 C  C   . ASN B 2 205 ? -13.004 16.439  9.776   1.00 18.78  ? 205 ASN H C   1 
ATOM   2773 O  O   . ASN B 2 205 ? -13.026 15.570  10.686  1.00 21.11  ? 205 ASN H O   1 
ATOM   2774 C  CB  . ASN B 2 205 ? -13.542 18.466  11.205  1.00 20.29  ? 205 ASN H CB  1 
ATOM   2775 C  CG  . ASN B 2 205 ? -12.184 19.142  11.144  1.00 22.60  ? 205 ASN H CG  1 
ATOM   2776 O  OD1 . ASN B 2 205 ? -11.479 19.096  10.131  1.00 22.39  ? 205 ASN H OD1 1 
ATOM   2777 N  ND2 . ASN B 2 205 ? -11.828 19.819  12.227  1.00 24.00  ? 205 ASN H ND2 1 
ATOM   2778 N  N   . HIS B 2 206 ? -12.192 16.450  8.728   1.00 17.92  ? 206 HIS H N   1 
ATOM   2779 C  CA  . HIS B 2 206 ? -11.098 15.473  8.504   1.00 16.70  ? 206 HIS H CA  1 
ATOM   2780 C  C   . HIS B 2 206 ? -9.771  16.218  8.601   1.00 16.78  ? 206 HIS H C   1 
ATOM   2781 O  O   . HIS B 2 206 ? -9.280  16.759  7.620   1.00 16.54  ? 206 HIS H O   1 
ATOM   2782 C  CB  . HIS B 2 206 ? -11.281 14.684  7.213   1.00 16.09  ? 206 HIS H CB  1 
ATOM   2783 C  CG  . HIS B 2 206 ? -10.265 13.615  7.014   1.00 15.83  ? 206 HIS H CG  1 
ATOM   2784 N  ND1 . HIS B 2 206 ? -9.377  13.636  5.971   1.00 16.23  ? 206 HIS H ND1 1 
ATOM   2785 C  CD2 . HIS B 2 206 ? -9.974  12.512  7.745   1.00 16.34  ? 206 HIS H CD2 1 
ATOM   2786 C  CE1 . HIS B 2 206 ? -8.593  12.581  6.049   1.00 16.84  ? 206 HIS H CE1 1 
ATOM   2787 N  NE2 . HIS B 2 206 ? -8.956  11.839  7.103   1.00 16.60  ? 206 HIS H NE2 1 
ATOM   2788 N  N   . LYS B 2 207 ? -9.192  16.246  9.804   1.00 17.26  ? 207 LYS H N   1 
ATOM   2789 C  CA  . LYS B 2 207 ? -8.014  17.108  10.026  1.00 19.26  ? 207 LYS H CA  1 
ATOM   2790 C  C   . LYS B 2 207 ? -6.816  16.678  9.176   1.00 19.02  ? 207 LYS H C   1 
ATOM   2791 O  O   . LYS B 2 207 ? -6.091  17.536  8.730   1.00 20.26  ? 207 LYS H O   1 
ATOM   2792 C  CB  . LYS B 2 207 ? -7.691  17.140  11.525  1.00 21.18  ? 207 LYS H CB  1 
ATOM   2793 C  CG  . LYS B 2 207 ? -8.688  17.983  12.302  1.00 23.94  ? 207 LYS H CG  1 
ATOM   2794 C  CD  . LYS B 2 207 ? -8.449  17.986  13.810  1.00 27.93  ? 207 LYS H CD  1 
ATOM   2795 C  CE  . LYS B 2 207 ? -9.522  18.714  14.588  1.00 31.47  ? 207 LYS H CE  1 
ATOM   2796 N  NZ  . LYS B 2 207 ? -9.060  18.941  15.988  1.00 35.46  ? 207 LYS H NZ  1 
ATOM   2797 N  N   . PRO B 2 208 ? -6.482  15.391  8.932   1.00 19.03  ? 208 PRO H N   1 
ATOM   2798 C  CA  . PRO B 2 208 ? -5.266  15.078  8.156   1.00 20.10  ? 208 PRO H CA  1 
ATOM   2799 C  C   . PRO B 2 208 ? -5.267  15.599  6.713   1.00 19.93  ? 208 PRO H C   1 
ATOM   2800 O  O   . PRO B 2 208 ? -4.179  15.792  6.137   1.00 19.72  ? 208 PRO H O   1 
ATOM   2801 C  CB  . PRO B 2 208 ? -5.264  13.545  8.142   1.00 20.17  ? 208 PRO H CB  1 
ATOM   2802 C  CG  . PRO B 2 208 ? -5.951  13.232  9.428   1.00 20.40  ? 208 PRO H CG  1 
ATOM   2803 C  CD  . PRO B 2 208 ? -7.126  14.180  9.438   1.00 19.38  ? 208 PRO H CD  1 
ATOM   2804 N  N   . SER B 2 209 ? -6.440  15.879  6.166   1.00 18.15  ? 209 SER H N   1 
ATOM   2805 C  CA  . SER B 2 209 ? -6.554  16.453  4.793   1.00 18.73  ? 209 SER H CA  1 
ATOM   2806 C  C   . SER B 2 209 ? -6.947  17.939  4.798   1.00 19.85  ? 209 SER H C   1 
ATOM   2807 O  O   . SER B 2 209 ? -7.149  18.506  3.693   1.00 20.29  ? 209 SER H O   1 
ATOM   2808 C  CB  . SER B 2 209 ? -7.485  15.657  3.934   1.00 18.07  ? 209 SER H CB  1 
ATOM   2809 O  OG  . SER B 2 209 ? -8.838  15.798  4.403   1.00 16.40  ? 209 SER H OG  1 
ATOM   2810 N  N   . ASN B 2 210 ? -7.094  18.548  5.969   1.00 20.85  ? 210 ASN H N   1 
ATOM   2811 C  CA  . ASN B 2 210 ? -7.645  19.917  6.126   1.00 24.06  ? 210 ASN H CA  1 
ATOM   2812 C  C   . ASN B 2 210 ? -8.988  20.017  5.390   1.00 24.05  ? 210 ASN H C   1 
ATOM   2813 O  O   . ASN B 2 210 ? -9.176  20.978  4.656   1.00 25.23  ? 210 ASN H O   1 
ATOM   2814 C  CB  . ASN B 2 210 ? -6.637  20.965  5.683   1.00 28.29  ? 210 ASN H CB  1 
ATOM   2815 C  CG  . ASN B 2 210 ? -5.373  20.870  6.507   1.00 31.83  ? 210 ASN H CG  1 
ATOM   2816 O  OD1 . ASN B 2 210 ? -4.310  20.610  5.952   1.00 40.57  ? 210 ASN H OD1 1 
ATOM   2817 N  ND2 . ASN B 2 210 ? -5.470  21.005  7.824   1.00 32.51  ? 210 ASN H ND2 1 
ATOM   2818 N  N   . THR B 2 211 ? -9.842  19.007  5.520   1.00 23.64  ? 211 THR H N   1 
ATOM   2819 C  CA  . THR B 2 211 ? -11.187 18.959  4.900   1.00 23.49  ? 211 THR H CA  1 
ATOM   2820 C  C   . THR B 2 211 ? -12.249 19.218  5.968   1.00 23.46  ? 211 THR H C   1 
ATOM   2821 O  O   . THR B 2 211 ? -12.471 18.326  6.847   1.00 22.77  ? 211 THR H O   1 
ATOM   2822 C  CB  . THR B 2 211 ? -11.475 17.637  4.183   1.00 22.94  ? 211 THR H CB  1 
ATOM   2823 O  OG1 . THR B 2 211 ? -10.461 17.422  3.202   1.00 22.30  ? 211 THR H OG1 1 
ATOM   2824 C  CG2 . THR B 2 211 ? -12.844 17.651  3.522   1.00 24.44  ? 211 THR H CG2 1 
ATOM   2825 N  N   . LYS B 2 212 ? -12.931 20.364  5.849   1.00 23.74  ? 212 LYS H N   1 
ATOM   2826 C  CA  . LYS B 2 212 ? -14.106 20.689  6.696   1.00 24.64  ? 212 LYS H CA  1 
ATOM   2827 C  C   . LYS B 2 212 ? -15.283 20.992  5.796   1.00 23.96  ? 212 LYS H C   1 
ATOM   2828 O  O   . LYS B 2 212 ? -15.120 21.794  4.828   1.00 23.34  ? 212 LYS H O   1 
ATOM   2829 C  CB  . LYS B 2 212 ? -13.895 21.902  7.607   1.00 27.59  ? 212 LYS H CB  1 
ATOM   2830 C  CG  . LYS B 2 212 ? -12.811 21.750  8.643   1.00 30.97  ? 212 LYS H CG  1 
ATOM   2831 C  CD  . LYS B 2 212 ? -12.900 22.788  9.729   1.00 34.05  ? 212 LYS H CD  1 
ATOM   2832 C  CE  . LYS B 2 212 ? -12.556 24.146  9.202   1.00 37.16  ? 212 LYS H CE  1 
ATOM   2833 N  NZ  . LYS B 2 212 ? -12.199 25.088  10.289  1.00 41.47  ? 212 LYS H NZ  1 
ATOM   2834 N  N   . VAL B 2 213 ? -16.398 20.349  6.118   1.00 23.72  ? 213 VAL H N   1 
ATOM   2835 C  CA  . VAL B 2 213 ? -17.627 20.449  5.296   1.00 25.07  ? 213 VAL H CA  1 
ATOM   2836 C  C   . VAL B 2 213 ? -18.827 20.615  6.214   1.00 25.40  ? 213 VAL H C   1 
ATOM   2837 O  O   . VAL B 2 213 ? -18.929 19.873  7.174   1.00 23.44  ? 213 VAL H O   1 
ATOM   2838 C  CB  . VAL B 2 213 ? -17.780 19.243  4.356   1.00 25.37  ? 213 VAL H CB  1 
ATOM   2839 C  CG1 . VAL B 2 213 ? -19.031 19.377  3.515   1.00 25.86  ? 213 VAL H CG1 1 
ATOM   2840 C  CG2 . VAL B 2 213 ? -16.556 19.089  3.460   1.00 25.46  ? 213 VAL H CG2 1 
ATOM   2841 N  N   . ASP B 2 214 ? -19.633 21.642  5.945   1.00 28.42  ? 214 ASP H N   1 
ATOM   2842 C  CA  . ASP B 2 214 ? -21.002 21.812  6.492   1.00 32.68  ? 214 ASP H CA  1 
ATOM   2843 C  C   . ASP B 2 214 ? -21.931 21.268  5.398   1.00 35.02  ? 214 ASP H C   1 
ATOM   2844 O  O   . ASP B 2 214 ? -21.780 21.655  4.183   1.00 42.29  ? 214 ASP H O   1 
ATOM   2845 C  CB  . ASP B 2 214 ? -21.256 23.265  6.925   1.00 36.96  ? 214 ASP H CB  1 
ATOM   2846 C  CG  . ASP B 2 214 ? -20.347 23.793  8.014   1.00 37.86  ? 214 ASP H CG  1 
ATOM   2847 O  OD1 . ASP B 2 214 ? -19.867 23.007  8.862   1.00 36.34  ? 214 ASP H OD1 1 
ATOM   2848 O  OD2 . ASP B 2 214 ? -20.130 25.008  8.038   1.00 45.18  ? 214 ASP H OD2 1 
ATOM   2849 N  N   . LYS B 2 215 ? -22.738 20.259  5.698   1.00 30.25  ? 215 LYS H N   1 
ATOM   2850 C  CA  . LYS B 2 215 ? -23.695 19.802  4.673   1.00 28.90  ? 215 LYS H CA  1 
ATOM   2851 C  C   . LYS B 2 215 ? -25.104 20.027  5.225   1.00 27.40  ? 215 LYS H C   1 
ATOM   2852 O  O   . LYS B 2 215 ? -25.403 19.482  6.295   1.00 25.32  ? 215 LYS H O   1 
ATOM   2853 C  CB  . LYS B 2 215 ? -23.418 18.353  4.292   1.00 29.17  ? 215 LYS H CB  1 
ATOM   2854 C  CG  . LYS B 2 215 ? -24.388 17.723  3.319   1.00 30.58  ? 215 LYS H CG  1 
ATOM   2855 C  CD  . LYS B 2 215 ? -24.592 18.448  2.026   1.00 33.20  ? 215 LYS H CD  1 
ATOM   2856 C  CE  . LYS B 2 215 ? -23.407 18.400  1.106   1.00 33.13  ? 215 LYS H CE  1 
ATOM   2857 N  NZ  . LYS B 2 215 ? -23.817 18.845  -0.244  1.00 35.77  ? 215 LYS H NZ  1 
ATOM   2858 N  N   . LYS B 2 216 ? -25.871 20.870  4.552   1.00 26.76  ? 216 LYS H N   1 
ATOM   2859 C  CA  . LYS B 2 216 ? -27.303 21.080  4.880   1.00 28.24  ? 216 LYS H CA  1 
ATOM   2860 C  C   . LYS B 2 216 ? -28.079 19.879  4.365   1.00 28.22  ? 216 LYS H C   1 
ATOM   2861 O  O   . LYS B 2 216 ? -27.877 19.506  3.206   1.00 28.28  ? 216 LYS H O   1 
ATOM   2862 C  CB  . LYS B 2 216 ? -27.844 22.395  4.330   1.00 29.54  ? 216 LYS H CB  1 
ATOM   2863 C  CG  . LYS B 2 216 ? -29.293 22.683  4.722   1.00 30.79  ? 216 LYS H CG  1 
ATOM   2864 C  CD  . LYS B 2 216 ? -29.779 24.033  4.283   1.00 32.72  ? 216 LYS H CD  1 
ATOM   2865 C  CE  . LYS B 2 216 ? -31.262 24.218  4.552   1.00 34.66  ? 216 LYS H CE  1 
ATOM   2866 N  NZ  . LYS B 2 216 ? -31.712 25.563  4.153   1.00 36.88  ? 216 LYS H NZ  1 
ATOM   2867 N  N   . VAL B 2 217 ? -28.899 19.284  5.232   1.00 28.70  ? 217 VAL H N   1 
ATOM   2868 C  CA  . VAL B 2 217 ? -29.712 18.076  4.931   1.00 28.85  ? 217 VAL H CA  1 
ATOM   2869 C  C   . VAL B 2 217 ? -31.177 18.503  4.957   1.00 31.80  ? 217 VAL H C   1 
ATOM   2870 O  O   . VAL B 2 217 ? -31.642 18.859  6.041   1.00 31.62  ? 217 VAL H O   1 
ATOM   2871 C  CB  . VAL B 2 217 ? -29.416 16.960  5.956   1.00 27.81  ? 217 VAL H CB  1 
ATOM   2872 C  CG1 . VAL B 2 217 ? -30.108 15.655  5.574   1.00 27.92  ? 217 VAL H CG1 1 
ATOM   2873 C  CG2 . VAL B 2 217 ? -27.914 16.739  6.121   1.00 26.30  ? 217 VAL H CG2 1 
ATOM   2874 N  N   . GLU B 2 218 ? -31.847 18.495  3.811   1.00 34.28  ? 218 GLU H N   1 
ATOM   2875 C  CA  . GLU B 2 218 ? -33.282 18.879  3.736   1.00 39.76  ? 218 GLU H CA  1 
ATOM   2876 C  C   . GLU B 2 218 ? -34.107 17.827  2.991   1.00 40.03  ? 218 GLU H C   1 
ATOM   2877 O  O   . GLU B 2 218 ? -33.590 17.058  2.198   1.00 38.29  ? 218 GLU H O   1 
ATOM   2878 C  CB  . GLU B 2 218 ? -33.399 20.256  3.086   1.00 43.75  ? 218 GLU H CB  1 
ATOM   2879 C  CG  . GLU B 2 218 ? -32.637 20.403  1.783   1.00 45.70  ? 218 GLU H CG  1 
ATOM   2880 C  CD  . GLU B 2 218 ? -32.466 21.861  1.384   1.00 48.89  ? 218 GLU H CD  1 
ATOM   2881 O  OE1 . GLU B 2 218 ? -31.417 22.188  0.807   1.00 51.80  ? 218 GLU H OE1 1 
ATOM   2882 O  OE2 . GLU B 2 218 ? -33.375 22.662  1.681   1.00 52.05  ? 218 GLU H OE2 1 
ATOM   2883 N  N   . PRO B 2 219 ? -35.443 17.772  3.216   1.00 44.20  ? 219 PRO H N   1 
ATOM   2884 C  CA  . PRO B 2 219 ? -36.324 16.876  2.455   1.00 45.51  ? 219 PRO H CA  1 
ATOM   2885 C  C   . PRO B 2 219 ? -36.099 16.890  0.919   1.00 46.05  ? 219 PRO H C   1 
ATOM   2886 O  O   . PRO B 2 219 ? -35.764 17.988  0.442   1.00 48.13  ? 219 PRO H O   1 
ATOM   2887 C  CB  . PRO B 2 219 ? -37.724 17.407  2.798   1.00 48.17  ? 219 PRO H CB  1 
ATOM   2888 C  CG  . PRO B 2 219 ? -37.559 17.956  4.212   1.00 48.57  ? 219 PRO H CG  1 
ATOM   2889 C  CD  . PRO B 2 219 ? -36.166 18.564  4.227   1.00 46.08  ? 219 PRO H CD  1 
ATOM   2890 N  N   . GLY C 3 1   ? 13.247  -8.448  34.217  1.00 57.87  ? 0   GLY L N   1 
ATOM   2891 C  CA  . GLY C 3 1   ? 11.853  -8.861  33.918  1.00 54.74  ? 0   GLY L CA  1 
ATOM   2892 C  C   . GLY C 3 1   ? 10.866  -7.799  34.378  1.00 51.67  ? 0   GLY L C   1 
ATOM   2893 O  O   . GLY C 3 1   ? 10.728  -7.585  35.608  1.00 54.12  ? 0   GLY L O   1 
ATOM   2894 N  N   . ASP C 3 2   ? 10.238  -7.124  33.424  1.00 48.53  ? 1   ASP L N   1 
ATOM   2895 C  CA  . ASP C 3 2   ? 9.079   -6.231  33.664  1.00 45.19  ? 1   ASP L CA  1 
ATOM   2896 C  C   . ASP C 3 2   ? 7.955   -7.047  34.298  1.00 42.36  ? 1   ASP L C   1 
ATOM   2897 O  O   . ASP C 3 2   ? 7.943   -8.263  34.084  1.00 45.38  ? 1   ASP L O   1 
ATOM   2898 C  CB  . ASP C 3 2   ? 8.617   -5.594  32.358  1.00 44.48  ? 1   ASP L CB  1 
ATOM   2899 C  CG  . ASP C 3 2   ? 9.648   -4.622  31.802  1.00 45.52  ? 1   ASP L CG  1 
ATOM   2900 O  OD1 . ASP C 3 2   ? 10.776  -4.536  32.394  1.00 46.08  ? 1   ASP L OD1 1 
ATOM   2901 O  OD2 . ASP C 3 2   ? 9.326   -3.957  30.792  1.00 45.14  ? 1   ASP L OD2 1 
ATOM   2902 N  N   . ILE C 3 3   ? 7.046   -6.402  35.032  1.00 36.68  ? 2   ILE L N   1 
ATOM   2903 C  CA  . ILE C 3 3   ? 5.931   -7.088  35.731  1.00 33.61  ? 2   ILE L CA  1 
ATOM   2904 C  C   . ILE C 3 3   ? 4.785   -7.228  34.747  1.00 32.29  ? 2   ILE L C   1 
ATOM   2905 O  O   . ILE C 3 3   ? 4.459   -6.274  34.001  1.00 31.38  ? 2   ILE L O   1 
ATOM   2906 C  CB  . ILE C 3 3   ? 5.560   -6.363  37.042  1.00 32.21  ? 2   ILE L CB  1 
ATOM   2907 C  CG1 . ILE C 3 3   ? 6.749   -6.305  37.994  1.00 32.07  ? 2   ILE L CG1 1 
ATOM   2908 C  CG2 . ILE C 3 3   ? 4.349   -7.003  37.709  1.00 31.73  ? 2   ILE L CG2 1 
ATOM   2909 C  CD1 . ILE C 3 3   ? 6.445   -5.652  39.317  1.00 31.41  ? 2   ILE L CD1 1 
ATOM   2910 N  N   . VAL C 3 4   ? 4.208   -8.415  34.699  1.00 31.56  ? 3   VAL L N   1 
ATOM   2911 C  CA  . VAL C 3 4   ? 3.076   -8.714  33.798  1.00 29.74  ? 3   VAL L CA  1 
ATOM   2912 C  C   . VAL C 3 4   ? 1.800   -8.772  34.630  1.00 28.41  ? 3   VAL L C   1 
ATOM   2913 O  O   . VAL C 3 4   ? 1.768   -9.476  35.659  1.00 29.00  ? 3   VAL L O   1 
ATOM   2914 C  CB  . VAL C 3 4   ? 3.326   -10.016 33.030  1.00 31.37  ? 3   VAL L CB  1 
ATOM   2915 C  CG1 . VAL C 3 4   ? 2.106   -10.372 32.226  1.00 30.90  ? 3   VAL L CG1 1 
ATOM   2916 C  CG2 . VAL C 3 4   ? 4.584   -9.937  32.176  1.00 32.13  ? 3   VAL L CG2 1 
ATOM   2917 N  N   . MET C 3 5   ? 0.802   -8.009  34.225  1.00 26.90  ? 4   MET L N   1 
ATOM   2918 C  CA  . MET C 3 5   ? -0.536  -8.020  34.856  1.00 26.87  ? 4   MET L CA  1 
ATOM   2919 C  C   . MET C 3 5   ? -1.449  -8.852  33.970  1.00 27.23  ? 4   MET L C   1 
ATOM   2920 O  O   . MET C 3 5   ? -1.562  -8.500  32.764  1.00 27.63  ? 4   MET L O   1 
ATOM   2921 C  CB  . MET C 3 5   ? -1.084  -6.600  34.970  1.00 26.36  ? 4   MET L CB  1 
ATOM   2922 C  CG  . MET C 3 5   ? -0.091  -5.645  35.665  1.00 25.92  ? 4   MET L CG  1 
ATOM   2923 S  SD  . MET C 3 5   ? 0.309   -6.222  37.329  1.00 27.20  ? 4   MET L SD  1 
ATOM   2924 C  CE  . MET C 3 5   ? -1.355  -6.329  37.987  1.00 25.75  ? 4   MET L CE  1 
ATOM   2925 N  N   . THR C 3 6   ? -2.031  -9.931  34.509  1.00 28.22  ? 5   THR L N   1 
ATOM   2926 C  CA  . THR C 3 6   ? -3.001  -10.779 33.776  1.00 28.93  ? 5   THR L CA  1 
ATOM   2927 C  C   . THR C 3 6   ? -4.393  -10.476 34.311  1.00 29.01  ? 5   THR L C   1 
ATOM   2928 O  O   . THR C 3 6   ? -4.662  -10.740 35.490  1.00 29.37  ? 5   THR L O   1 
ATOM   2929 C  CB  . THR C 3 6   ? -2.676  -12.273 33.860  1.00 30.26  ? 5   THR L CB  1 
ATOM   2930 O  OG1 . THR C 3 6   ? -1.303  -12.407 33.466  1.00 31.30  ? 5   THR L OG1 1 
ATOM   2931 C  CG2 . THR C 3 6   ? -3.587  -13.113 32.993  1.00 31.70  ? 5   THR L CG2 1 
ATOM   2932 N  N   . GLN C 3 7   ? -5.252  -9.938  33.455  1.00 27.30  ? 6   GLN L N   1 
ATOM   2933 C  CA  . GLN C 3 7   ? -6.619  -9.543  33.855  1.00 28.07  ? 6   GLN L CA  1 
ATOM   2934 C  C   . GLN C 3 7   ? -7.605  -10.561 33.327  1.00 30.84  ? 6   GLN L C   1 
ATOM   2935 O  O   . GLN C 3 7   ? -7.560  -10.880 32.086  1.00 31.23  ? 6   GLN L O   1 
ATOM   2936 C  CB  . GLN C 3 7   ? -6.825  -8.122  33.356  1.00 28.45  ? 6   GLN L CB  1 
ATOM   2937 C  CG  . GLN C 3 7   ? -8.070  -7.448  33.882  1.00 28.96  ? 6   GLN L CG  1 
ATOM   2938 C  CD  . GLN C 3 7   ? -8.161  -5.972  33.564  1.00 26.36  ? 6   GLN L CD  1 
ATOM   2939 O  OE1 . GLN C 3 7   ? -7.169  -5.282  33.269  1.00 26.21  ? 6   GLN L OE1 1 
ATOM   2940 N  NE2 . GLN C 3 7   ? -9.381  -5.481  33.634  1.00 24.54  ? 6   GLN L NE2 1 
ATOM   2941 N  N   . THR C 3 8   ? -8.549  -10.957 34.173  1.00 31.86  ? 7   THR L N   1 
ATOM   2942 C  CA  . THR C 3 8   ? -9.658  -11.872 33.803  1.00 33.85  ? 7   THR L CA  1 
ATOM   2943 C  C   . THR C 3 8   ? -10.963 -11.410 34.445  1.00 33.76  ? 7   THR L C   1 
ATOM   2944 O  O   . THR C 3 8   ? -10.945 -10.798 35.503  1.00 32.98  ? 7   THR L O   1 
ATOM   2945 C  CB  . THR C 3 8   ? -9.348  -13.313 34.240  1.00 35.50  ? 7   THR L CB  1 
ATOM   2946 O  OG1 . THR C 3 8   ? -9.041  -13.344 35.636  1.00 34.72  ? 7   THR L OG1 1 
ATOM   2947 C  CG2 . THR C 3 8   ? -8.197  -13.928 33.468  1.00 36.00  ? 7   THR L CG2 1 
ATOM   2948 N  N   . PRO C 3 9   ? -12.128 -11.686 33.836  1.00 34.44  ? 8   PRO L N   1 
ATOM   2949 C  CA  . PRO C 3 9   ? -12.200 -12.299 32.493  1.00 35.52  ? 8   PRO L CA  1 
ATOM   2950 C  C   . PRO C 3 9   ? -11.867 -11.252 31.422  1.00 36.48  ? 8   PRO L C   1 
ATOM   2951 O  O   . PRO C 3 9   ? -11.634 -10.156 31.814  1.00 37.58  ? 8   PRO L O   1 
ATOM   2952 C  CB  . PRO C 3 9   ? -13.671 -12.740 32.398  1.00 34.82  ? 8   PRO L CB  1 
ATOM   2953 C  CG  . PRO C 3 9   ? -14.431 -11.760 33.269  1.00 34.71  ? 8   PRO L CG  1 
ATOM   2954 C  CD  . PRO C 3 9   ? -13.467 -11.422 34.401  1.00 34.04  ? 8   PRO L CD  1 
ATOM   2955 N  N   . LYS C 3 10  ? -11.894 -11.570 30.122  1.00 36.47  ? 9   LYS L N   1 
ATOM   2956 C  CA  . LYS C 3 10  ? -11.726 -10.547 29.046  1.00 36.27  ? 9   LYS L CA  1 
ATOM   2957 C  C   . LYS C 3 10  ? -13.042 -9.782  28.805  1.00 33.57  ? 9   LYS L C   1 
ATOM   2958 O  O   . LYS C 3 10  ? -12.974 -8.618  28.360  1.00 31.11  ? 9   LYS L O   1 
ATOM   2959 C  CB  . LYS C 3 10  ? -11.307 -11.143 27.698  1.00 40.39  ? 9   LYS L CB  1 
ATOM   2960 C  CG  . LYS C 3 10  ? -10.058 -12.011 27.682  1.00 45.87  ? 9   LYS L CG  1 
ATOM   2961 C  CD  . LYS C 3 10  ? -8.768  -11.277 27.924  1.00 48.61  ? 9   LYS L CD  1 
ATOM   2962 C  CE  . LYS C 3 10  ? -8.326  -10.374 26.790  1.00 51.22  ? 9   LYS L CE  1 
ATOM   2963 N  NZ  . LYS C 3 10  ? -7.154  -9.546  27.199  1.00 49.95  ? 9   LYS L NZ  1 
ATOM   2964 N  N   . PHE C 3 11  ? -14.194 -10.404 29.040  1.00 34.23  ? 10  PHE L N   1 
ATOM   2965 C  CA  . PHE C 3 11  ? -15.540 -9.853  28.709  1.00 36.25  ? 10  PHE L CA  1 
ATOM   2966 C  C   . PHE C 3 11  ? -16.488 -10.297 29.809  1.00 33.39  ? 10  PHE L C   1 
ATOM   2967 O  O   . PHE C 3 11  ? -16.285 -11.399 30.320  1.00 33.93  ? 10  PHE L O   1 
ATOM   2968 C  CB  . PHE C 3 11  ? -16.156 -10.391 27.401  1.00 41.51  ? 10  PHE L CB  1 
ATOM   2969 C  CG  . PHE C 3 11  ? -15.461 -9.963  26.135  1.00 49.38  ? 10  PHE L CG  1 
ATOM   2970 C  CD1 . PHE C 3 11  ? -15.996 -8.972  25.313  1.00 53.76  ? 10  PHE L CD1 1 
ATOM   2971 C  CD2 . PHE C 3 11  ? -14.252 -10.543 25.758  1.00 56.92  ? 10  PHE L CD2 1 
ATOM   2972 C  CE1 . PHE C 3 11  ? -15.344 -8.579  24.147  1.00 53.95  ? 10  PHE L CE1 1 
ATOM   2973 C  CE2 . PHE C 3 11  ? -13.590 -10.141 24.599  1.00 57.20  ? 10  PHE L CE2 1 
ATOM   2974 C  CZ  . PHE C 3 11  ? -14.141 -9.161  23.795  1.00 56.62  ? 10  PHE L CZ  1 
ATOM   2975 N  N   . LEU C 3 12  ? -17.506 -9.486  30.079  1.00 31.35  ? 11  LEU L N   1 
ATOM   2976 C  CA  . LEU C 3 12  ? -18.594 -9.805  31.036  1.00 32.96  ? 11  LEU L CA  1 
ATOM   2977 C  C   . LEU C 3 12  ? -19.858 -9.225  30.446  1.00 31.98  ? 11  LEU L C   1 
ATOM   2978 O  O   . LEU C 3 12  ? -19.845 -8.057  30.073  1.00 31.55  ? 11  LEU L O   1 
ATOM   2979 C  CB  . LEU C 3 12  ? -18.381 -9.133  32.398  1.00 34.50  ? 11  LEU L CB  1 
ATOM   2980 C  CG  . LEU C 3 12  ? -17.539 -9.871  33.430  1.00 36.23  ? 11  LEU L CG  1 
ATOM   2981 C  CD1 . LEU C 3 12  ? -17.409 -9.008  34.665  1.00 36.00  ? 11  LEU L CD1 1 
ATOM   2982 C  CD2 . LEU C 3 12  ? -18.143 -11.208 33.802  1.00 38.21  ? 11  LEU L CD2 1 
ATOM   2983 N  N   . LEU C 3 13  ? -20.897 -10.030 30.372  1.00 31.85  ? 12  LEU L N   1 
ATOM   2984 C  CA  . LEU C 3 13  ? -22.248 -9.550  30.057  1.00 32.39  ? 12  LEU L CA  1 
ATOM   2985 C  C   . LEU C 3 13  ? -23.061 -9.580  31.347  1.00 33.03  ? 12  LEU L C   1 
ATOM   2986 O  O   . LEU C 3 13  ? -23.171 -10.674 31.975  1.00 33.52  ? 12  LEU L O   1 
ATOM   2987 C  CB  . LEU C 3 13  ? -22.838 -10.451 28.968  1.00 33.92  ? 12  LEU L CB  1 
ATOM   2988 C  CG  . LEU C 3 13  ? -24.218 -10.043 28.497  1.00 35.25  ? 12  LEU L CG  1 
ATOM   2989 C  CD1 . LEU C 3 13  ? -24.142 -8.682  27.825  1.00 34.27  ? 12  LEU L CD1 1 
ATOM   2990 C  CD2 . LEU C 3 13  ? -24.803 -11.100 27.542  1.00 35.93  ? 12  LEU L CD2 1 
ATOM   2991 N  N   . VAL C 3 14  ? -23.615 -8.435  31.738  1.00 31.93  ? 13  VAL L N   1 
ATOM   2992 C  CA  . VAL C 3 14  ? -24.260 -8.295  33.068  1.00 32.77  ? 13  VAL L CA  1 
ATOM   2993 C  C   . VAL C 3 14  ? -25.507 -7.408  32.952  1.00 32.24  ? 13  VAL L C   1 
ATOM   2994 O  O   . VAL C 3 14  ? -25.507 -6.448  32.169  1.00 30.79  ? 13  VAL L O   1 
ATOM   2995 C  CB  . VAL C 3 14  ? -23.218 -7.770  34.075  1.00 32.58  ? 13  VAL L CB  1 
ATOM   2996 C  CG1 . VAL C 3 14  ? -22.685 -6.382  33.696  1.00 31.17  ? 13  VAL L CG1 1 
ATOM   2997 C  CG2 . VAL C 3 14  ? -23.792 -7.790  35.454  1.00 34.78  ? 13  VAL L CG2 1 
ATOM   2998 N  N   . SER C 3 15  ? -26.562 -7.754  33.691  1.00 33.50  ? 14  SER L N   1 
ATOM   2999 C  CA  . SER C 3 15  ? -27.828 -6.986  33.761  1.00 35.24  ? 14  SER L CA  1 
ATOM   3000 C  C   . SER C 3 15  ? -27.667 -5.928  34.838  1.00 36.76  ? 14  SER L C   1 
ATOM   3001 O  O   . SER C 3 15  ? -26.925 -6.198  35.811  1.00 37.37  ? 14  SER L O   1 
ATOM   3002 C  CB  . SER C 3 15  ? -29.019 -7.865  34.074  1.00 38.22  ? 14  SER L CB  1 
ATOM   3003 O  OG  . SER C 3 15  ? -29.134 -8.931  33.125  1.00 38.06  ? 14  SER L OG  1 
ATOM   3004 N  N   . ALA C 3 16  ? -28.367 -4.804  34.714  1.00 36.94  ? 15  ALA L N   1 
ATOM   3005 C  CA  . ALA C 3 16  ? -28.314 -3.732  35.726  1.00 37.01  ? 15  ALA L CA  1 
ATOM   3006 C  C   . ALA C 3 16  ? -28.706 -4.366  37.060  1.00 38.83  ? 15  ALA L C   1 
ATOM   3007 O  O   . ALA C 3 16  ? -29.521 -5.291  37.026  1.00 40.66  ? 15  ALA L O   1 
ATOM   3008 C  CB  . ALA C 3 16  ? -29.224 -2.587  35.334  1.00 37.84  ? 15  ALA L CB  1 
ATOM   3009 N  N   . GLY C 3 17  ? -28.113 -3.936  38.177  1.00 37.79  ? 16  GLY L N   1 
ATOM   3010 C  CA  . GLY C 3 17  ? -28.419 -4.480  39.509  1.00 40.18  ? 16  GLY L CA  1 
ATOM   3011 C  C   . GLY C 3 17  ? -27.495 -5.620  39.896  1.00 40.55  ? 16  GLY L C   1 
ATOM   3012 O  O   . GLY C 3 17  ? -27.377 -5.868  41.097  1.00 41.97  ? 16  GLY L O   1 
ATOM   3013 N  N   . ASP C 3 18  ? -26.859 -6.291  38.934  1.00 39.89  ? 17  ASP L N   1 
ATOM   3014 C  CA  . ASP C 3 18  ? -25.981 -7.460  39.206  1.00 41.01  ? 17  ASP L CA  1 
ATOM   3015 C  C   . ASP C 3 18  ? -24.538 -7.042  39.543  1.00 38.77  ? 17  ASP L C   1 
ATOM   3016 O  O   . ASP C 3 18  ? -24.118 -5.934  39.222  1.00 36.51  ? 17  ASP L O   1 
ATOM   3017 C  CB  . ASP C 3 18  ? -25.974 -8.414  38.012  1.00 42.49  ? 17  ASP L CB  1 
ATOM   3018 C  CG  . ASP C 3 18  ? -27.282 -9.159  37.850  1.00 45.36  ? 17  ASP L CG  1 
ATOM   3019 O  OD1 . ASP C 3 18  ? -28.051 -9.182  38.827  1.00 48.78  ? 17  ASP L OD1 1 
ATOM   3020 O  OD2 . ASP C 3 18  ? -27.517 -9.667  36.744  1.00 48.37  ? 17  ASP L OD2 1 
ATOM   3021 N  N   . LYS C 3 19  ? -23.788 -7.972  40.120  1.00 38.98  ? 18  LYS L N   1 
ATOM   3022 C  CA  . LYS C 3 19  ? -22.380 -7.785  40.554  1.00 38.09  ? 18  LYS L CA  1 
ATOM   3023 C  C   . LYS C 3 19  ? -21.431 -8.028  39.383  1.00 35.51  ? 18  LYS L C   1 
ATOM   3024 O  O   . LYS C 3 19  ? -21.708 -8.950  38.577  1.00 34.50  ? 18  LYS L O   1 
ATOM   3025 C  CB  . LYS C 3 19  ? -22.052 -8.803  41.640  1.00 40.65  ? 18  LYS L CB  1 
ATOM   3026 C  CG  . LYS C 3 19  ? -20.829 -8.509  42.480  1.00 42.03  ? 18  LYS L CG  1 
ATOM   3027 C  CD  . LYS C 3 19  ? -21.128 -8.986  43.874  1.00 44.21  ? 18  LYS L CD  1 
ATOM   3028 C  CE  . LYS C 3 19  ? -19.993 -8.904  44.854  1.00 46.81  ? 18  LYS L CE  1 
ATOM   3029 N  NZ  . LYS C 3 19  ? -20.262 -9.837  45.974  1.00 48.56  ? 18  LYS L NZ  1 
ATOM   3030 N  N   . VAL C 3 20  ? -20.353 -7.243  39.310  1.00 32.39  ? 19  VAL L N   1 
ATOM   3031 C  CA  . VAL C 3 20  ? -19.200 -7.453  38.398  1.00 30.82  ? 19  VAL L CA  1 
ATOM   3032 C  C   . VAL C 3 20  ? -17.983 -7.768  39.263  1.00 30.78  ? 19  VAL L C   1 
ATOM   3033 O  O   . VAL C 3 20  ? -17.669 -6.960  40.186  1.00 29.57  ? 19  VAL L O   1 
ATOM   3034 C  CB  . VAL C 3 20  ? -18.952 -6.205  37.538  1.00 29.88  ? 19  VAL L CB  1 
ATOM   3035 C  CG1 . VAL C 3 20  ? -17.586 -6.227  36.858  1.00 28.43  ? 19  VAL L CG1 1 
ATOM   3036 C  CG2 . VAL C 3 20  ? -20.072 -6.001  36.526  1.00 29.45  ? 19  VAL L CG2 1 
ATOM   3037 N  N   . THR C 3 21  ? -17.271 -8.848  38.962  1.00 30.74  ? 20  THR L N   1 
ATOM   3038 C  CA  . THR C 3 21  ? -15.997 -9.161  39.664  1.00 31.23  ? 20  THR L CA  1 
ATOM   3039 C  C   . THR C 3 21  ? -14.886 -9.342  38.630  1.00 29.71  ? 20  THR L C   1 
ATOM   3040 O  O   . THR C 3 21  ? -15.019 -10.272 37.785  1.00 30.56  ? 20  THR L O   1 
ATOM   3041 C  CB  . THR C 3 21  ? -16.135 -10.380 40.585  1.00 33.07  ? 20  THR L CB  1 
ATOM   3042 O  OG1 . THR C 3 21  ? -17.185 -10.167 41.535  1.00 33.08  ? 20  THR L OG1 1 
ATOM   3043 C  CG2 . THR C 3 21  ? -14.845 -10.660 41.317  1.00 34.08  ? 20  THR L CG2 1 
ATOM   3044 N  N   . ILE C 3 22  ? -13.834 -8.537  38.730  1.00 27.71  ? 21  ILE L N   1 
ATOM   3045 C  CA  . ILE C 3 22  ? -12.696 -8.525  37.793  1.00 28.05  ? 21  ILE L CA  1 
ATOM   3046 C  C   . ILE C 3 22  ? -11.437 -8.843  38.572  1.00 28.99  ? 21  ILE L C   1 
ATOM   3047 O  O   . ILE C 3 22  ? -11.236 -8.296  39.679  1.00 29.19  ? 21  ILE L O   1 
ATOM   3048 C  CB  . ILE C 3 22  ? -12.615 -7.172  37.040  1.00 29.17  ? 21  ILE L CB  1 
ATOM   3049 C  CG1 . ILE C 3 22  ? -13.907 -6.928  36.255  1.00 29.01  ? 21  ILE L CG1 1 
ATOM   3050 C  CG2 . ILE C 3 22  ? -11.388 -7.074  36.119  1.00 28.16  ? 21  ILE L CG2 1 
ATOM   3051 C  CD1 . ILE C 3 22  ? -13.986 -5.592  35.572  1.00 28.66  ? 21  ILE L CD1 1 
ATOM   3052 N  N   . THR C 3 23  ? -10.580 -9.648  37.986  1.00 28.78  ? 22  THR L N   1 
ATOM   3053 C  CA  . THR C 3 23  ? -9.361  -10.107 38.685  1.00 29.68  ? 22  THR L CA  1 
ATOM   3054 C  C   . THR C 3 23  ? -8.140  -9.611  37.921  1.00 29.00  ? 22  THR L C   1 
ATOM   3055 O  O   . THR C 3 23  ? -8.075  -9.729  36.677  1.00 27.28  ? 22  THR L O   1 
ATOM   3056 C  CB  . THR C 3 23  ? -9.389  -11.618 38.930  1.00 30.39  ? 22  THR L CB  1 
ATOM   3057 O  OG1 . THR C 3 23  ? -10.525 -11.817 39.777  1.00 31.00  ? 22  THR L OG1 1 
ATOM   3058 C  CG2 . THR C 3 23  ? -8.114  -12.122 39.577  1.00 31.34  ? 22  THR L CG2 1 
ATOM   3059 N  N   . CYS C 3 24  ? -7.185  -9.104  38.675  1.00 28.13  ? 23  CYS L N   1 
ATOM   3060 C  CA  A CYS C 3 24  ? -5.853  -8.735  38.179  0.50 28.09  ? 23  CYS L CA  1 
ATOM   3061 C  CA  B CYS C 3 24  ? -5.839  -8.795  38.138  0.50 27.86  ? 23  CYS L CA  1 
ATOM   3062 C  C   . CYS C 3 24  ? -4.801  -9.559  38.953  1.00 29.39  ? 23  CYS L C   1 
ATOM   3063 O  O   . CYS C 3 24  ? -4.807  -9.470  40.218  1.00 29.36  ? 23  CYS L O   1 
ATOM   3064 C  CB  A CYS C 3 24  ? -5.783  -7.219  38.348  0.50 27.73  ? 23  CYS L CB  1 
ATOM   3065 C  CB  B CYS C 3 24  ? -5.551  -7.295  38.086  0.50 27.33  ? 23  CYS L CB  1 
ATOM   3066 S  SG  A CYS C 3 24  ? -4.245  -6.502  37.762  0.50 28.57  ? 23  CYS L SG  1 
ATOM   3067 S  SG  B CYS C 3 24  ? -5.905  -6.648  36.429  0.50 27.04  ? 23  CYS L SG  1 
ATOM   3068 N  N   . LYS C 3 25  ? -3.940  -10.292 38.255  1.00 29.49  ? 24  LYS L N   1 
ATOM   3069 C  CA  . LYS C 3 25  ? -2.853  -11.074 38.889  1.00 32.69  ? 24  LYS L CA  1 
ATOM   3070 C  C   . LYS C 3 25  ? -1.518  -10.596 38.331  1.00 31.93  ? 24  LYS L C   1 
ATOM   3071 O  O   . LYS C 3 25  ? -1.350  -10.581 37.082  1.00 31.70  ? 24  LYS L O   1 
ATOM   3072 C  CB  . LYS C 3 25  ? -3.057  -12.573 38.679  1.00 35.95  ? 24  LYS L CB  1 
ATOM   3073 C  CG  . LYS C 3 25  ? -4.047  -13.180 39.654  1.00 39.48  ? 24  LYS L CG  1 
ATOM   3074 C  CD  . LYS C 3 25  ? -4.262  -14.678 39.524  1.00 42.38  ? 24  LYS L CD  1 
ATOM   3075 C  CE  . LYS C 3 25  ? -5.334  -15.128 40.493  1.00 45.34  ? 24  LYS L CE  1 
ATOM   3076 N  NZ  . LYS C 3 25  ? -5.744  -16.532 40.253  1.00 48.09  ? 24  LYS L NZ  1 
ATOM   3077 N  N   . ALA C 3 26  ? -0.645  -10.134 39.217  1.00 29.23  ? 25  ALA L N   1 
ATOM   3078 C  CA  . ALA C 3 26  ? 0.730   -9.721  38.854  1.00 29.50  ? 25  ALA L CA  1 
ATOM   3079 C  C   . ALA C 3 26  ? 1.664   -10.935 38.815  1.00 31.48  ? 25  ALA L C   1 
ATOM   3080 O  O   . ALA C 3 26  ? 1.589   -11.807 39.735  1.00 32.22  ? 25  ALA L O   1 
ATOM   3081 C  CB  . ALA C 3 26  ? 1.243   -8.656  39.813  1.00 28.83  ? 25  ALA L CB  1 
ATOM   3082 N  N   . SER C 3 27  ? 2.643   -10.889 37.914  1.00 31.82  ? 26  SER L N   1 
ATOM   3083 C  CA  . SER C 3 27  ? 3.710   -11.919 37.775  1.00 34.33  ? 26  SER L CA  1 
ATOM   3084 C  C   . SER C 3 27  ? 4.602   -11.955 39.035  1.00 34.06  ? 26  SER L C   1 
ATOM   3085 O  O   . SER C 3 27  ? 5.277   -12.952 39.256  1.00 33.95  ? 26  SER L O   1 
ATOM   3086 C  CB  . SER C 3 27  ? 4.512   -11.652 36.539  1.00 34.73  ? 26  SER L CB  1 
ATOM   3087 O  OG  . SER C 3 27  ? 5.177   -10.405 36.674  1.00 35.09  ? 26  SER L OG  1 
ATOM   3088 N  N   . GLN C 3 28  ? 4.619   -10.882 39.828  1.00 33.12  ? 27  GLN L N   1 
ATOM   3089 C  CA  . GLN C 3 28  ? 5.282   -10.867 41.145  1.00 33.85  ? 27  GLN L CA  1 
ATOM   3090 C  C   . GLN C 3 28  ? 4.611   -9.828  42.018  1.00 32.10  ? 27  GLN L C   1 
ATOM   3091 O  O   . GLN C 3 28  ? 3.860   -9.017  41.510  1.00 30.43  ? 27  GLN L O   1 
ATOM   3092 C  CB  . GLN C 3 28  ? 6.757   -10.552 41.003  1.00 35.36  ? 27  GLN L CB  1 
ATOM   3093 C  CG  . GLN C 3 28  ? 7.014   -9.111  40.624  1.00 36.33  ? 27  GLN L CG  1 
ATOM   3094 C  CD  . GLN C 3 28  ? 8.385   -9.043  40.012  1.00 39.16  ? 27  GLN L CD  1 
ATOM   3095 O  OE1 . GLN C 3 28  ? 8.607   -9.591  38.927  1.00 43.74  ? 27  GLN L OE1 1 
ATOM   3096 N  NE2 . GLN C 3 28  ? 9.304   -8.410  40.724  1.00 39.51  ? 27  GLN L NE2 1 
ATOM   3097 N  N   . SER C 3 29  ? 4.885   -9.829  43.318  1.00 30.23  ? 28  SER L N   1 
ATOM   3098 C  CA  A SER C 3 29  ? 4.116   -8.972  44.251  0.50 29.47  ? 28  SER L CA  1 
ATOM   3099 C  CA  B SER C 3 29  ? 4.160   -8.950  44.266  0.50 30.13  ? 28  SER L CA  1 
ATOM   3100 C  C   . SER C 3 29  ? 4.374   -7.481  43.903  1.00 29.18  ? 28  SER L C   1 
ATOM   3101 O  O   . SER C 3 29  ? 5.560   -7.080  43.569  1.00 30.17  ? 28  SER L O   1 
ATOM   3102 C  CB  A SER C 3 29  ? 4.394   -9.345  45.738  0.50 29.67  ? 28  SER L CB  1 
ATOM   3103 C  CB  B SER C 3 29  ? 4.594   -9.103  45.693  0.50 30.73  ? 28  SER L CB  1 
ATOM   3104 O  OG  A SER C 3 29  ? 3.752   -10.587 46.145  0.50 29.19  ? 28  SER L OG  1 
ATOM   3105 O  OG  B SER C 3 29  ? 4.379   -7.847  46.319  0.50 30.41  ? 28  SER L OG  1 
ATOM   3106 N  N   . VAL C 3 30  ? 3.299   -6.712  43.967  1.00 27.92  ? 29  VAL L N   1 
ATOM   3107 C  CA  . VAL C 3 30  ? 3.313   -5.232  43.722  1.00 27.34  ? 29  VAL L CA  1 
ATOM   3108 C  C   . VAL C 3 30  ? 2.751   -4.508  44.951  1.00 26.80  ? 29  VAL L C   1 
ATOM   3109 O  O   . VAL C 3 30  ? 2.178   -3.425  44.802  1.00 23.67  ? 29  VAL L O   1 
ATOM   3110 C  CB  . VAL C 3 30  ? 2.561   -4.922  42.416  1.00 26.63  ? 29  VAL L CB  1 
ATOM   3111 C  CG1 . VAL C 3 30  ? 3.308   -5.514  41.243  1.00 27.18  ? 29  VAL L CG1 1 
ATOM   3112 C  CG2 . VAL C 3 30  ? 1.129   -5.379  42.440  1.00 26.38  ? 29  VAL L CG2 1 
ATOM   3113 N  N   . SER C 3 31  ? 2.914   -5.107  46.145  1.00 26.72  ? 30  SER L N   1 
ATOM   3114 C  CA  . SER C 3 31  ? 2.444   -4.491  47.408  1.00 28.09  ? 30  SER L CA  1 
ATOM   3115 C  C   . SER C 3 31  ? 0.970   -4.071  47.214  1.00 26.30  ? 30  SER L C   1 
ATOM   3116 O  O   . SER C 3 31  ? 0.186   -4.936  46.772  1.00 25.46  ? 30  SER L O   1 
ATOM   3117 C  CB  . SER C 3 31  ? 3.381   -3.385  47.813  1.00 28.19  ? 30  SER L CB  1 
ATOM   3118 O  OG  . SER C 3 31  ? 2.856   -2.641  48.920  1.00 30.14  ? 30  SER L OG  1 
ATOM   3119 N  N   . ASN C 3 32  ? 0.617   -2.796  47.436  1.00 24.87  ? 31  ASN L N   1 
ATOM   3120 C  CA  . ASN C 3 32  ? -0.736  -2.266  47.128  1.00 25.53  ? 31  ASN L CA  1 
ATOM   3121 C  C   . ASN C 3 32  ? -0.704  -1.214  46.002  1.00 25.08  ? 31  ASN L C   1 
ATOM   3122 O  O   . ASN C 3 32  ? -1.693  -0.476  45.901  1.00 25.10  ? 31  ASN L O   1 
ATOM   3123 C  CB  . ASN C 3 32  ? -1.437  -1.707  48.356  1.00 26.74  ? 31  ASN L CB  1 
ATOM   3124 C  CG  . ASN C 3 32  ? -0.693  -0.507  48.965  1.00 27.28  ? 31  ASN L CG  1 
ATOM   3125 O  OD1 . ASN C 3 32  ? 0.495   -0.266  48.666  1.00 27.22  ? 31  ASN L OD1 1 
ATOM   3126 N  ND2 . ASN C 3 32  ? -1.436  0.259   49.743  1.00 28.48  ? 31  ASN L ND2 1 
ATOM   3127 N  N   . ASP C 3 33  ? 0.373   -1.138  45.207  1.00 24.65  ? 32  ASP L N   1 
ATOM   3128 C  CA  . ASP C 3 33  ? 0.573   -0.126  44.129  1.00 23.66  ? 32  ASP L CA  1 
ATOM   3129 C  C   . ASP C 3 33  ? -0.196  -0.574  42.876  1.00 23.27  ? 32  ASP L C   1 
ATOM   3130 O  O   . ASP C 3 33  ? 0.442   -0.861  41.861  1.00 22.92  ? 32  ASP L O   1 
ATOM   3131 C  CB  . ASP C 3 33  ? 2.069   0.054   43.861  1.00 24.88  ? 32  ASP L CB  1 
ATOM   3132 C  CG  . ASP C 3 33  ? 2.801   0.877   44.918  1.00 25.88  ? 32  ASP L CG  1 
ATOM   3133 O  OD1 . ASP C 3 33  ? 2.161   1.705   45.538  1.00 26.40  ? 32  ASP L OD1 1 
ATOM   3134 O  OD2 . ASP C 3 33  ? 4.025   0.711   45.048  1.00 29.66  ? 32  ASP L OD2 1 
ATOM   3135 N  N   . LEU C 3 34  ? -1.510  -0.646  43.002  1.00 22.47  ? 33  LEU L N   1 
ATOM   3136 C  CA  . LEU C 3 34  ? -2.434  -1.208  42.006  1.00 22.72  ? 33  LEU L CA  1 
ATOM   3137 C  C   . LEU C 3 34  ? -3.579  -0.203  41.845  1.00 21.84  ? 33  LEU L C   1 
ATOM   3138 O  O   . LEU C 3 34  ? -4.229  0.140   42.813  1.00 21.79  ? 33  LEU L O   1 
ATOM   3139 C  CB  . LEU C 3 34  ? -2.896  -2.600  42.469  1.00 23.60  ? 33  LEU L CB  1 
ATOM   3140 C  CG  . LEU C 3 34  ? -3.498  -3.536  41.419  1.00 24.06  ? 33  LEU L CG  1 
ATOM   3141 C  CD1 . LEU C 3 34  ? -4.925  -3.170  41.065  1.00 24.27  ? 33  LEU L CD1 1 
ATOM   3142 C  CD2 . LEU C 3 34  ? -2.627  -3.607  40.184  1.00 23.33  ? 33  LEU L CD2 1 
ATOM   3143 N  N   . THR C 3 35  ? -3.789  0.260   40.606  1.00 20.32  ? 34  THR L N   1 
ATOM   3144 C  CA  . THR C 3 35  ? -4.756  1.309   40.226  1.00 21.00  ? 34  THR L CA  1 
ATOM   3145 C  C   . THR C 3 35  ? -5.761  0.701   39.231  1.00 20.67  ? 34  THR L C   1 
ATOM   3146 O  O   . THR C 3 35  ? -5.354  -0.152  38.441  1.00 20.94  ? 34  THR L O   1 
ATOM   3147 C  CB  . THR C 3 35  ? -3.996  2.485   39.597  1.00 21.34  ? 34  THR L CB  1 
ATOM   3148 O  OG1 . THR C 3 35  ? -3.019  2.978   40.523  1.00 20.90  ? 34  THR L OG1 1 
ATOM   3149 C  CG2 . THR C 3 35  ? -4.896  3.612   39.139  1.00 20.84  ? 34  THR L CG2 1 
ATOM   3150 N  N   . TRP C 3 36  ? -7.042  1.024   39.387  1.00 20.58  ? 35  TRP L N   1 
ATOM   3151 C  CA  . TRP C 3 36  ? -8.135  0.588   38.486  1.00 20.43  ? 35  TRP L CA  1 
ATOM   3152 C  C   . TRP C 3 36  ? -8.678  1.805   37.737  1.00 19.94  ? 35  TRP L C   1 
ATOM   3153 O  O   . TRP C 3 36  ? -9.043  2.809   38.357  1.00 19.46  ? 35  TRP L O   1 
ATOM   3154 C  CB  . TRP C 3 36  ? -9.233  -0.084  39.301  1.00 21.20  ? 35  TRP L CB  1 
ATOM   3155 C  CG  . TRP C 3 36  ? -8.833  -1.405  39.863  1.00 21.57  ? 35  TRP L CG  1 
ATOM   3156 C  CD1 . TRP C 3 36  ? -8.466  -1.704  41.159  1.00 22.29  ? 35  TRP L CD1 1 
ATOM   3157 C  CD2 . TRP C 3 36  ? -8.836  -2.643  39.145  1.00 21.71  ? 35  TRP L CD2 1 
ATOM   3158 N  NE1 . TRP C 3 36  ? -8.212  -3.047  41.281  1.00 22.18  ? 35  TRP L NE1 1 
ATOM   3159 C  CE2 . TRP C 3 36  ? -8.450  -3.650  40.056  1.00 22.79  ? 35  TRP L CE2 1 
ATOM   3160 C  CE3 . TRP C 3 36  ? -9.150  -2.991  37.818  1.00 21.76  ? 35  TRP L CE3 1 
ATOM   3161 C  CZ2 . TRP C 3 36  ? -8.315  -4.977  39.671  1.00 23.57  ? 35  TRP L CZ2 1 
ATOM   3162 C  CZ3 . TRP C 3 36  ? -9.041  -4.307  37.460  1.00 22.37  ? 35  TRP L CZ3 1 
ATOM   3163 C  CH2 . TRP C 3 36  ? -8.637  -5.285  38.369  1.00 24.25  ? 35  TRP L CH2 1 
ATOM   3164 N  N   . TYR C 3 37  ? -8.751  1.724   36.418  1.00 19.55  ? 36  TYR L N   1 
ATOM   3165 C  CA  . TYR C 3 37  ? -9.320  2.778   35.561  1.00 19.84  ? 36  TYR L CA  1 
ATOM   3166 C  C   . TYR C 3 37  ? -10.558 2.248   34.821  1.00 20.61  ? 36  TYR L C   1 
ATOM   3167 O  O   . TYR C 3 37  ? -10.667 1.019   34.542  1.00 19.53  ? 36  TYR L O   1 
ATOM   3168 C  CB  . TYR C 3 37  ? -8.323  3.182   34.476  1.00 19.94  ? 36  TYR L CB  1 
ATOM   3169 C  CG  . TYR C 3 37  ? -7.003  3.730   34.971  1.00 19.53  ? 36  TYR L CG  1 
ATOM   3170 C  CD1 . TYR C 3 37  ? -5.885  2.936   35.089  1.00 20.32  ? 36  TYR L CD1 1 
ATOM   3171 C  CD2 . TYR C 3 37  ? -6.873  5.073   35.300  1.00 20.03  ? 36  TYR L CD2 1 
ATOM   3172 C  CE1 . TYR C 3 37  ? -4.674  3.450   35.546  1.00 20.44  ? 36  TYR L CE1 1 
ATOM   3173 C  CE2 . TYR C 3 37  ? -5.670  5.617   35.710  1.00 19.77  ? 36  TYR L CE2 1 
ATOM   3174 C  CZ  . TYR C 3 37  ? -4.571  4.794   35.859  1.00 20.08  ? 36  TYR L CZ  1 
ATOM   3175 O  OH  . TYR C 3 37  ? -3.394  5.350   36.248  1.00 20.84  ? 36  TYR L OH  1 
ATOM   3176 N  N   . GLN C 3 38  ? -11.445 3.176   34.488  1.00 21.06  ? 37  GLN L N   1 
ATOM   3177 C  CA  . GLN C 3 38  ? -12.661 2.941   33.690  1.00 21.22  ? 37  GLN L CA  1 
ATOM   3178 C  C   . GLN C 3 38  ? -12.502 3.699   32.372  1.00 20.19  ? 37  GLN L C   1 
ATOM   3179 O  O   . GLN C 3 38  ? -12.363 4.922   32.438  1.00 20.30  ? 37  GLN L O   1 
ATOM   3180 C  CB  . GLN C 3 38  ? -13.837 3.464   34.497  1.00 22.31  ? 37  GLN L CB  1 
ATOM   3181 C  CG  . GLN C 3 38  ? -15.160 3.394   33.769  1.00 23.42  ? 37  GLN L CG  1 
ATOM   3182 C  CD  . GLN C 3 38  ? -16.232 4.134   34.506  1.00 24.64  ? 37  GLN L CD  1 
ATOM   3183 O  OE1 . GLN C 3 38  ? -16.174 5.351   34.671  1.00 26.33  ? 37  GLN L OE1 1 
ATOM   3184 N  NE2 . GLN C 3 38  ? -17.245 3.397   34.943  1.00 25.68  ? 37  GLN L NE2 1 
ATOM   3185 N  N   . GLN C 3 39  ? -12.606 3.024   31.228  1.00 21.17  ? 38  GLN L N   1 
ATOM   3186 C  CA  . GLN C 3 39  ? -12.565 3.714   29.911  1.00 21.12  ? 38  GLN L CA  1 
ATOM   3187 C  C   . GLN C 3 39  ? -13.887 3.538   29.162  1.00 20.98  ? 38  GLN L C   1 
ATOM   3188 O  O   . GLN C 3 39  ? -14.104 2.443   28.636  1.00 22.15  ? 38  GLN L O   1 
ATOM   3189 C  CB  . GLN C 3 39  ? -11.451 3.155   29.029  1.00 21.77  ? 38  GLN L CB  1 
ATOM   3190 C  CG  . GLN C 3 39  ? -11.298 3.970   27.734  1.00 22.30  ? 38  GLN L CG  1 
ATOM   3191 C  CD  . GLN C 3 39  ? -9.994  3.659   27.036  1.00 23.00  ? 38  GLN L CD  1 
ATOM   3192 O  OE1 . GLN C 3 39  ? -9.557  2.508   26.967  1.00 25.28  ? 38  GLN L OE1 1 
ATOM   3193 N  NE2 . GLN C 3 39  ? -9.426  4.679   26.413  1.00 23.60  ? 38  GLN L NE2 1 
ATOM   3194 N  N   . LYS C 3 40  ? -14.740 4.558   29.156  1.00 22.10  ? 39  LYS L N   1 
ATOM   3195 C  CA  . LYS C 3 40  ? -16.051 4.505   28.491  1.00 23.76  ? 39  LYS L CA  1 
ATOM   3196 C  C   . LYS C 3 40  ? -15.807 4.705   26.997  1.00 24.75  ? 39  LYS L C   1 
ATOM   3197 O  O   . LYS C 3 40  ? -14.777 5.227   26.581  1.00 22.32  ? 39  LYS L O   1 
ATOM   3198 C  CB  . LYS C 3 40  ? -17.001 5.546   29.071  1.00 24.25  ? 39  LYS L CB  1 
ATOM   3199 C  CG  . LYS C 3 40  ? -17.402 5.239   30.497  1.00 25.64  ? 39  LYS L CG  1 
ATOM   3200 C  CD  . LYS C 3 40  ? -18.372 6.215   31.092  1.00 26.84  ? 39  LYS L CD  1 
ATOM   3201 C  CE  . LYS C 3 40  ? -18.642 5.880   32.547  1.00 28.15  ? 39  LYS L CE  1 
ATOM   3202 N  NZ  . LYS C 3 40  ? -19.836 6.600   33.037  1.00 29.75  ? 39  LYS L NZ  1 
ATOM   3203 N  N   . PRO C 3 41  ? -16.737 4.257   26.140  1.00 27.08  ? 40  PRO L N   1 
ATOM   3204 C  CA  . PRO C 3 41  ? -16.519 4.373   24.698  1.00 28.71  ? 40  PRO L CA  1 
ATOM   3205 C  C   . PRO C 3 41  ? -16.213 5.804   24.226  1.00 28.06  ? 40  PRO L C   1 
ATOM   3206 O  O   . PRO C 3 41  ? -16.881 6.774   24.610  1.00 28.88  ? 40  PRO L O   1 
ATOM   3207 C  CB  . PRO C 3 41  ? -17.818 3.838   24.058  1.00 28.82  ? 40  PRO L CB  1 
ATOM   3208 C  CG  . PRO C 3 41  ? -18.618 3.195   25.190  1.00 28.03  ? 40  PRO L CG  1 
ATOM   3209 C  CD  . PRO C 3 41  ? -18.014 3.624   26.513  1.00 27.95  ? 40  PRO L CD  1 
ATOM   3210 N  N   . GLY C 3 42  ? -15.172 5.914   23.401  1.00 28.09  ? 41  GLY L N   1 
ATOM   3211 C  CA  . GLY C 3 42  ? -14.674 7.178   22.826  1.00 29.46  ? 41  GLY L CA  1 
ATOM   3212 C  C   . GLY C 3 42  ? -14.018 8.109   23.834  1.00 29.70  ? 41  GLY L C   1 
ATOM   3213 O  O   . GLY C 3 42  ? -13.728 9.235   23.454  1.00 29.34  ? 41  GLY L O   1 
ATOM   3214 N  N   . GLN C 3 43  ? -13.811 7.693   25.088  1.00 28.72  ? 42  GLN L N   1 
ATOM   3215 C  CA  . GLN C 3 43  ? -13.207 8.584   26.122  1.00 29.22  ? 42  GLN L CA  1 
ATOM   3216 C  C   . GLN C 3 43  ? -11.818 8.094   26.535  1.00 26.48  ? 42  GLN L C   1 
ATOM   3217 O  O   . GLN C 3 43  ? -11.391 6.965   26.227  1.00 24.32  ? 42  GLN L O   1 
ATOM   3218 C  CB  . GLN C 3 43  ? -14.057 8.662   27.390  1.00 32.21  ? 42  GLN L CB  1 
ATOM   3219 C  CG  . GLN C 3 43  ? -15.504 9.072   27.149  1.00 33.89  ? 42  GLN L CG  1 
ATOM   3220 C  CD  . GLN C 3 43  ? -16.201 9.382   28.453  1.00 38.50  ? 42  GLN L CD  1 
ATOM   3221 O  OE1 . GLN C 3 43  ? -15.699 9.108   29.553  1.00 42.09  ? 42  GLN L OE1 1 
ATOM   3222 N  NE2 . GLN C 3 43  ? -17.400 9.936   28.360  1.00 40.24  ? 42  GLN L NE2 1 
ATOM   3223 N  N   . SER C 3 44  ? -11.129 8.950   27.271  1.00 25.65  ? 43  SER L N   1 
ATOM   3224 C  CA  . SER C 3 44  ? -9.856  8.620   27.919  1.00 24.17  ? 43  SER L CA  1 
ATOM   3225 C  C   . SER C 3 44  ? -10.169 7.856   29.201  1.00 23.21  ? 43  SER L C   1 
ATOM   3226 O  O   . SER C 3 44  ? -11.272 7.954   29.753  1.00 22.21  ? 43  SER L O   1 
ATOM   3227 C  CB  . SER C 3 44  ? -9.063  9.900   28.134  1.00 24.17  ? 43  SER L CB  1 
ATOM   3228 O  OG  . SER C 3 44  ? -8.933  10.577  26.884  1.00 26.64  ? 43  SER L OG  1 
ATOM   3229 N  N   . PRO C 3 45  ? -9.230  7.031   29.682  1.00 21.61  ? 44  PRO L N   1 
ATOM   3230 C  CA  . PRO C 3 45  ? -9.404  6.343   30.951  1.00 22.33  ? 44  PRO L CA  1 
ATOM   3231 C  C   . PRO C 3 45  ? -9.621  7.340   32.078  1.00 22.38  ? 44  PRO L C   1 
ATOM   3232 O  O   . PRO C 3 45  ? -9.108  8.483   32.002  1.00 23.85  ? 44  PRO L O   1 
ATOM   3233 C  CB  . PRO C 3 45  ? -8.096  5.572   31.147  1.00 22.05  ? 44  PRO L CB  1 
ATOM   3234 C  CG  . PRO C 3 45  ? -7.527  5.432   29.768  1.00 22.48  ? 44  PRO L CG  1 
ATOM   3235 C  CD  . PRO C 3 45  ? -7.956  6.692   29.060  1.00 22.48  ? 44  PRO L CD  1 
ATOM   3236 N  N   . LYS C 3 46  ? -10.379 6.891   33.076  1.00 22.78  ? 45  LYS L N   1 
ATOM   3237 C  CA  . LYS C 3 46  ? -10.749 7.675   34.269  1.00 23.35  ? 45  LYS L CA  1 
ATOM   3238 C  C   . LYS C 3 46  ? -10.345 6.874   35.521  1.00 20.84  ? 45  LYS L C   1 
ATOM   3239 O  O   . LYS C 3 46  ? -10.678 5.685   35.620  1.00 19.57  ? 45  LYS L O   1 
ATOM   3240 C  CB  . LYS C 3 46  ? -12.251 7.960   34.265  1.00 26.75  ? 45  LYS L CB  1 
ATOM   3241 C  CG  . LYS C 3 46  ? -12.722 8.843   35.405  1.00 30.71  ? 45  LYS L CG  1 
ATOM   3242 C  CD  . LYS C 3 46  ? -14.240 9.102   35.453  1.00 34.75  ? 45  LYS L CD  1 
ATOM   3243 C  CE  . LYS C 3 46  ? -14.778 9.112   36.876  1.00 38.83  ? 45  LYS L CE  1 
ATOM   3244 N  NZ  . LYS C 3 46  ? -16.259 9.151   36.935  1.00 42.06  ? 45  LYS L NZ  1 
ATOM   3245 N  N   . LEU C 3 47  ? -9.687  7.520   36.469  1.00 19.75  ? 46  LEU L N   1 
ATOM   3246 C  CA  A LEU C 3 47  ? -9.168  6.840   37.680  0.50 20.01  ? 46  LEU L CA  1 
ATOM   3247 C  CA  B LEU C 3 47  ? -9.181  6.779   37.646  0.50 20.05  ? 46  LEU L CA  1 
ATOM   3248 C  C   . LEU C 3 47  ? -10.348 6.555   38.618  1.00 20.80  ? 46  LEU L C   1 
ATOM   3249 O  O   . LEU C 3 47  ? -11.030 7.547   38.976  1.00 21.67  ? 46  LEU L O   1 
ATOM   3250 C  CB  A LEU C 3 47  ? -8.145  7.767   38.339  0.50 19.67  ? 46  LEU L CB  1 
ATOM   3251 C  CB  B LEU C 3 47  ? -8.019  7.525   38.302  0.50 19.75  ? 46  LEU L CB  1 
ATOM   3252 C  CG  A LEU C 3 47  ? -7.650  7.365   39.726  0.50 19.57  ? 46  LEU L CG  1 
ATOM   3253 C  CG  B LEU C 3 47  ? -7.212  6.671   39.277  0.50 19.59  ? 46  LEU L CG  1 
ATOM   3254 C  CD1 A LEU C 3 47  ? -6.775  6.132   39.647  0.50 19.08  ? 46  LEU L CD1 1 
ATOM   3255 C  CD1 B LEU C 3 47  ? -5.787  7.164   39.398  0.50 19.54  ? 46  LEU L CD1 1 
ATOM   3256 C  CD2 A LEU C 3 47  ? -6.863  8.503   40.348  0.50 19.77  ? 46  LEU L CD2 1 
ATOM   3257 C  CD2 B LEU C 3 47  ? -7.882  6.629   40.637  0.50 20.04  ? 46  LEU L CD2 1 
ATOM   3258 N  N   . LEU C 3 48  ? -10.540 5.299   39.041  1.00 20.77  ? 47  LEU L N   1 
ATOM   3259 C  CA  . LEU C 3 48  ? -11.568 4.982   40.057  1.00 21.16  ? 47  LEU L CA  1 
ATOM   3260 C  C   . LEU C 3 48  ? -10.895 4.631   41.394  1.00 20.50  ? 47  LEU L C   1 
ATOM   3261 O  O   . LEU C 3 48  ? -11.375 5.065   42.353  1.00 22.40  ? 47  LEU L O   1 
ATOM   3262 C  CB  . LEU C 3 48  ? -12.462 3.821   39.619  1.00 21.21  ? 47  LEU L CB  1 
ATOM   3263 C  CG  . LEU C 3 48  ? -13.252 4.012   38.328  1.00 21.86  ? 47  LEU L CG  1 
ATOM   3264 C  CD1 . LEU C 3 48  ? -14.199 2.841   38.112  1.00 22.64  ? 47  LEU L CD1 1 
ATOM   3265 C  CD2 . LEU C 3 48  ? -14.049 5.287   38.347  1.00 22.68  ? 47  LEU L CD2 1 
ATOM   3266 N  N   . ILE C 3 49  ? -9.869  3.797   41.411  1.00 21.04  ? 48  ILE L N   1 
ATOM   3267 C  CA  . ILE C 3 49  ? -9.349  3.164   42.666  1.00 21.40  ? 48  ILE L CA  1 
ATOM   3268 C  C   . ILE C 3 49  ? -7.826  3.231   42.601  1.00 21.31  ? 48  ILE L C   1 
ATOM   3269 O  O   . ILE C 3 49  ? -7.239  2.903   41.549  1.00 20.14  ? 48  ILE L O   1 
ATOM   3270 C  CB  . ILE C 3 49  ? -9.793  1.698   42.871  1.00 22.36  ? 48  ILE L CB  1 
ATOM   3271 C  CG1 . ILE C 3 49  ? -11.307 1.465   42.797  1.00 24.07  ? 48  ILE L CG1 1 
ATOM   3272 C  CG2 . ILE C 3 49  ? -9.207  1.100   44.164  1.00 22.67  ? 48  ILE L CG2 1 
ATOM   3273 C  CD1 . ILE C 3 49  ? -12.106 2.062   43.880  1.00 25.19  ? 48  ILE L CD1 1 
ATOM   3274 N  N   . TYR C 3 50  ? -7.164  3.561   43.716  1.00 20.21  ? 49  TYR L N   1 
ATOM   3275 C  CA  . TYR C 3 50  ? -5.682  3.560   43.768  1.00 19.67  ? 49  TYR L CA  1 
ATOM   3276 C  C   . TYR C 3 50  ? -5.290  2.987   45.136  1.00 19.89  ? 49  TYR L C   1 
ATOM   3277 O  O   . TYR C 3 50  ? -6.195  2.816   45.975  1.00 19.67  ? 49  TYR L O   1 
ATOM   3278 C  CB  . TYR C 3 50  ? -5.128  4.957   43.498  1.00 20.37  ? 49  TYR L CB  1 
ATOM   3279 C  CG  . TYR C 3 50  ? -5.472  5.954   44.571  1.00 21.56  ? 49  TYR L CG  1 
ATOM   3280 C  CD1 . TYR C 3 50  ? -6.691  6.619   44.559  1.00 22.12  ? 49  TYR L CD1 1 
ATOM   3281 C  CD2 . TYR C 3 50  ? -4.626  6.165   45.659  1.00 22.37  ? 49  TYR L CD2 1 
ATOM   3282 C  CE1 . TYR C 3 50  ? -7.056  7.491   45.573  1.00 23.76  ? 49  TYR L CE1 1 
ATOM   3283 C  CE2 . TYR C 3 50  ? -4.973  7.050   46.667  1.00 23.76  ? 49  TYR L CE2 1 
ATOM   3284 C  CZ  . TYR C 3 50  ? -6.195  7.710   46.633  1.00 24.97  ? 49  TYR L CZ  1 
ATOM   3285 O  OH  . TYR C 3 50  ? -6.546  8.603   47.628  1.00 26.67  ? 49  TYR L OH  1 
ATOM   3286 N  N   . TYR C 3 51  ? -4.034  2.590   45.280  1.00 19.93  ? 50  TYR L N   1 
ATOM   3287 C  CA  . TYR C 3 51  ? -3.525  1.845   46.465  1.00 20.87  ? 50  TYR L CA  1 
ATOM   3288 C  C   . TYR C 3 51  ? -4.415  0.611   46.730  1.00 21.77  ? 50  TYR L C   1 
ATOM   3289 O  O   . TYR C 3 51  ? -4.726  0.297   47.912  1.00 21.80  ? 50  TYR L O   1 
ATOM   3290 C  CB  . TYR C 3 51  ? -3.456  2.797   47.675  1.00 21.68  ? 50  TYR L CB  1 
ATOM   3291 C  CG  . TYR C 3 51  ? -2.552  4.000   47.558  1.00 22.26  ? 50  TYR L CG  1 
ATOM   3292 C  CD1 . TYR C 3 51  ? -1.528  4.081   46.623  1.00 22.26  ? 50  TYR L CD1 1 
ATOM   3293 C  CD2 . TYR C 3 51  ? -2.640  5.019   48.505  1.00 22.95  ? 50  TYR L CD2 1 
ATOM   3294 C  CE1 . TYR C 3 51  ? -0.690  5.184   46.531  1.00 22.95  ? 50  TYR L CE1 1 
ATOM   3295 C  CE2 . TYR C 3 51  ? -1.848  6.142   48.395  1.00 23.72  ? 50  TYR L CE2 1 
ATOM   3296 C  CZ  . TYR C 3 51  ? -0.817  6.194   47.474  1.00 23.46  ? 50  TYR L CZ  1 
ATOM   3297 O  OH  . TYR C 3 51  ? -0.058  7.330   47.400  1.00 24.50  ? 50  TYR L OH  1 
ATOM   3298 N  N   . ALA C 3 52  ? -4.860  -0.049  45.642  1.00 22.28  ? 51  ALA L N   1 
ATOM   3299 C  CA  . ALA C 3 52  ? -5.699  -1.264  45.599  1.00 23.08  ? 51  ALA L CA  1 
ATOM   3300 C  C   . ALA C 3 52  ? -7.132  -1.034  46.103  1.00 23.94  ? 51  ALA L C   1 
ATOM   3301 O  O   . ALA C 3 52  ? -8.019  -1.780  45.619  1.00 24.06  ? 51  ALA L O   1 
ATOM   3302 C  CB  . ALA C 3 52  ? -5.029  -2.386  46.379  1.00 24.34  ? 51  ALA L CB  1 
ATOM   3303 N  N   . SER C 3 53  ? -7.387  -0.164  47.088  1.00 24.24  ? 52  SER L N   1 
ATOM   3304 C  CA  . SER C 3 53  ? -8.723  -0.095  47.734  1.00 25.44  ? 52  SER L CA  1 
ATOM   3305 C  C   . SER C 3 53  ? -9.269  1.324   47.924  1.00 26.35  ? 52  SER L C   1 
ATOM   3306 O  O   . SER C 3 53  ? -10.460 1.440   48.306  1.00 27.53  ? 52  SER L O   1 
ATOM   3307 C  CB  . SER C 3 53  ? -8.703  -0.859  49.048  1.00 26.39  ? 52  SER L CB  1 
ATOM   3308 O  OG  . SER C 3 53  ? -7.905  -0.186  49.978  1.00 26.53  ? 52  SER L OG  1 
ATOM   3309 N  N   . ASN C 3 54  ? -8.456  2.372   47.698  1.00 27.50  ? 53  ASN L N   1 
ATOM   3310 C  CA  . ASN C 3 54  ? -8.891  3.769   47.950  1.00 27.98  ? 53  ASN L CA  1 
ATOM   3311 C  C   . ASN C 3 54  ? -9.692  4.240   46.741  1.00 27.10  ? 53  ASN L C   1 
ATOM   3312 O  O   . ASN C 3 54  ? -9.108  4.325   45.662  1.00 25.40  ? 53  ASN L O   1 
ATOM   3313 C  CB  . ASN C 3 54  ? -7.720  4.734   48.193  1.00 28.73  ? 53  ASN L CB  1 
ATOM   3314 C  CG  . ASN C 3 54  ? -7.040  4.645   49.554  1.00 31.68  ? 53  ASN L CG  1 
ATOM   3315 O  OD1 . ASN C 3 54  ? -7.496  3.979   50.478  1.00 36.80  ? 53  ASN L OD1 1 
ATOM   3316 N  ND2 . ASN C 3 54  ? -5.945  5.368   49.709  1.00 33.00  ? 53  ASN L ND2 1 
ATOM   3317 N  N   . ARG C 3 55  ? -10.945 4.627   46.935  1.00 27.57  ? 54  ARG L N   1 
ATOM   3318 C  CA  . ARG C 3 55  ? -11.713 5.336   45.871  1.00 28.34  ? 54  ARG L CA  1 
ATOM   3319 C  C   . ARG C 3 55  ? -11.157 6.739   45.688  1.00 26.55  ? 54  ARG L C   1 
ATOM   3320 O  O   . ARG C 3 55  ? -10.877 7.424   46.693  1.00 25.31  ? 54  ARG L O   1 
ATOM   3321 C  CB  . ARG C 3 55  ? -13.196 5.493   46.203  1.00 30.65  ? 54  ARG L CB  1 
ATOM   3322 C  CG  . ARG C 3 55  ? -14.040 4.238   46.051  1.00 33.79  ? 54  ARG L CG  1 
ATOM   3323 C  CD  . ARG C 3 55  ? -15.416 4.497   46.663  1.00 37.66  ? 54  ARG L CD  1 
ATOM   3324 N  NE  . ARG C 3 55  ? -16.070 3.271   47.096  1.00 40.92  ? 54  ARG L NE  1 
ATOM   3325 C  CZ  . ARG C 3 55  ? -16.267 2.868   48.337  1.00 42.87  ? 54  ARG L CZ  1 
ATOM   3326 N  NH1 . ARG C 3 55  ? -15.883 3.593   49.381  1.00 42.21  ? 54  ARG L NH1 1 
ATOM   3327 N  NH2 . ARG C 3 55  ? -16.913 1.729   48.527  1.00 44.81  ? 54  ARG L NH2 1 
ATOM   3328 N  N   . TYR C 3 56  ? -10.967 7.154   44.453  1.00 26.23  ? 55  TYR L N   1 
ATOM   3329 C  CA  . TYR C 3 56  ? -10.700 8.560   44.071  1.00 26.63  ? 55  TYR L CA  1 
ATOM   3330 C  C   . TYR C 3 56  ? -11.934 9.397   44.450  1.00 27.80  ? 55  TYR L C   1 
ATOM   3331 O  O   . TYR C 3 56  ? -13.034 8.868   44.509  1.00 27.42  ? 55  TYR L O   1 
ATOM   3332 C  CB  . TYR C 3 56  ? -10.353 8.645   42.582  1.00 27.05  ? 55  TYR L CB  1 
ATOM   3333 C  CG  . TYR C 3 56  ? -9.854  9.998   42.141  1.00 28.43  ? 55  TYR L CG  1 
ATOM   3334 C  CD1 . TYR C 3 56  ? -8.581  10.405  42.499  1.00 30.16  ? 55  TYR L CD1 1 
ATOM   3335 C  CD2 . TYR C 3 56  ? -10.623 10.869  41.379  1.00 30.02  ? 55  TYR L CD2 1 
ATOM   3336 C  CE1 . TYR C 3 56  ? -8.086  11.649  42.133  1.00 32.20  ? 55  TYR L CE1 1 
ATOM   3337 C  CE2 . TYR C 3 56  ? -10.140 12.116  40.998  1.00 31.23  ? 55  TYR L CE2 1 
ATOM   3338 C  CZ  . TYR C 3 56  ? -8.865  12.505  41.376  1.00 32.32  ? 55  TYR L CZ  1 
ATOM   3339 O  OH  . TYR C 3 56  ? -8.312  13.709  41.064  1.00 35.22  ? 55  TYR L OH  1 
ATOM   3340 N  N   . ALA C 3 57  ? -11.731 10.680  44.751  1.00 29.54  ? 56  ALA L N   1 
ATOM   3341 C  CA  . ALA C 3 57  ? -12.801 11.650  45.086  1.00 31.94  ? 56  ALA L CA  1 
ATOM   3342 C  C   . ALA C 3 57  ? -13.907 11.619  44.023  1.00 32.76  ? 56  ALA L C   1 
ATOM   3343 O  O   . ALA C 3 57  ? -13.598 11.710  42.812  1.00 32.34  ? 56  ALA L O   1 
ATOM   3344 C  CB  . ALA C 3 57  ? -12.223 13.044  45.241  1.00 32.15  ? 56  ALA L CB  1 
ATOM   3345 N  N   . GLY C 3 58  ? -15.156 11.485  44.491  1.00 33.83  ? 57  GLY L N   1 
ATOM   3346 C  CA  . GLY C 3 58  ? -16.388 11.525  43.683  1.00 35.19  ? 57  GLY L CA  1 
ATOM   3347 C  C   . GLY C 3 58  ? -16.792 10.170  43.103  1.00 34.78  ? 57  GLY L C   1 
ATOM   3348 O  O   . GLY C 3 58  ? -17.834 10.122  42.473  1.00 37.56  ? 57  GLY L O   1 
ATOM   3349 N  N   . VAL C 3 59  ? -15.969 9.128   43.243  1.00 32.76  ? 58  VAL L N   1 
ATOM   3350 C  CA  . VAL C 3 59  ? -16.243 7.754   42.729  1.00 31.16  ? 58  VAL L CA  1 
ATOM   3351 C  C   . VAL C 3 59  ? -17.291 7.123   43.634  1.00 32.20  ? 58  VAL L C   1 
ATOM   3352 O  O   . VAL C 3 59  ? -17.077 7.023   44.850  1.00 31.54  ? 58  VAL L O   1 
ATOM   3353 C  CB  . VAL C 3 59  ? -14.984 6.869   42.683  1.00 30.51  ? 58  VAL L CB  1 
ATOM   3354 C  CG1 . VAL C 3 59  ? -15.326 5.403   42.400  1.00 30.38  ? 58  VAL L CG1 1 
ATOM   3355 C  CG2 . VAL C 3 59  ? -13.964 7.388   41.691  1.00 29.49  ? 58  VAL L CG2 1 
ATOM   3356 N  N   . PRO C 3 60  ? -18.429 6.671   43.057  1.00 32.71  ? 59  PRO L N   1 
ATOM   3357 C  CA  . PRO C 3 60  ? -19.524 6.064   43.816  1.00 33.76  ? 59  PRO L CA  1 
ATOM   3358 C  C   . PRO C 3 60  ? -19.144 4.815   44.631  1.00 33.90  ? 59  PRO L C   1 
ATOM   3359 O  O   . PRO C 3 60  ? -18.168 4.159   44.288  1.00 30.45  ? 59  PRO L O   1 
ATOM   3360 C  CB  . PRO C 3 60  ? -20.522 5.629   42.738  1.00 34.35  ? 59  PRO L CB  1 
ATOM   3361 C  CG  . PRO C 3 60  ? -20.208 6.470   41.537  1.00 33.79  ? 59  PRO L CG  1 
ATOM   3362 C  CD  . PRO C 3 60  ? -18.718 6.727   41.617  1.00 32.88  ? 59  PRO L CD  1 
ATOM   3363 N  N   . ASP C 3 61  ? -19.972 4.514   45.643  1.00 36.99  ? 60  ASP L N   1 
ATOM   3364 C  CA  . ASP C 3 61  ? -19.811 3.431   46.656  1.00 39.25  ? 60  ASP L CA  1 
ATOM   3365 C  C   . ASP C 3 61  ? -19.772 2.056   45.999  1.00 36.86  ? 60  ASP L C   1 
ATOM   3366 O  O   . ASP C 3 61  ? -19.126 1.172   46.569  1.00 37.09  ? 60  ASP L O   1 
ATOM   3367 C  CB  . ASP C 3 61  ? -20.954 3.436   47.688  1.00 44.43  ? 60  ASP L CB  1 
ATOM   3368 C  CG  . ASP C 3 61  ? -20.755 4.427   48.824  1.00 48.44  ? 60  ASP L CG  1 
ATOM   3369 O  OD1 . ASP C 3 61  ? -19.926 5.349   48.647  1.00 49.99  ? 60  ASP L OD1 1 
ATOM   3370 O  OD2 . ASP C 3 61  ? -21.418 4.274   49.900  1.00 54.44  ? 60  ASP L OD2 1 
ATOM   3371 N  N   . ARG C 3 62  ? -20.432 1.874   44.847  1.00 36.52  ? 61  ARG L N   1 
ATOM   3372 C  CA  . ARG C 3 62  ? -20.606 0.534   44.229  1.00 34.98  ? 61  ARG L CA  1 
ATOM   3373 C  C   . ARG C 3 62  ? -19.259 0.014   43.721  1.00 33.09  ? 61  ARG L C   1 
ATOM   3374 O  O   . ARG C 3 62  ? -19.192 -1.200  43.426  1.00 34.14  ? 61  ARG L O   1 
ATOM   3375 C  CB  . ARG C 3 62  ? -21.651 0.560   43.115  1.00 34.85  ? 61  ARG L CB  1 
ATOM   3376 C  CG  . ARG C 3 62  ? -21.336 1.464   41.929  1.00 33.92  ? 61  ARG L CG  1 
ATOM   3377 C  CD  . ARG C 3 62  ? -22.407 1.284   40.884  1.00 33.81  ? 61  ARG L CD  1 
ATOM   3378 N  NE  . ARG C 3 62  ? -22.314 2.150   39.709  1.00 32.54  ? 61  ARG L NE  1 
ATOM   3379 C  CZ  . ARG C 3 62  ? -22.543 3.463   39.718  1.00 32.79  ? 61  ARG L CZ  1 
ATOM   3380 N  NH1 . ARG C 3 62  ? -22.820 4.083   40.855  1.00 34.02  ? 61  ARG L NH1 1 
ATOM   3381 N  NH2 . ARG C 3 62  ? -22.446 4.168   38.603  1.00 31.89  ? 61  ARG L NH2 1 
ATOM   3382 N  N   . PHE C 3 63  ? -18.256 0.892   43.563  1.00 30.36  ? 62  PHE L N   1 
ATOM   3383 C  CA  . PHE C 3 63  ? -16.887 0.525   43.111  1.00 29.28  ? 62  PHE L CA  1 
ATOM   3384 C  C   . PHE C 3 63  ? -15.971 0.289   44.306  1.00 29.25  ? 62  PHE L C   1 
ATOM   3385 O  O   . PHE C 3 63  ? -15.788 1.203   45.129  1.00 29.11  ? 62  PHE L O   1 
ATOM   3386 C  CB  . PHE C 3 63  ? -16.275 1.600   42.219  1.00 28.18  ? 62  PHE L CB  1 
ATOM   3387 C  CG  . PHE C 3 63  ? -17.095 1.874   40.981  1.00 27.87  ? 62  PHE L CG  1 
ATOM   3388 C  CD1 . PHE C 3 63  ? -17.074 0.988   39.912  1.00 27.54  ? 62  PHE L CD1 1 
ATOM   3389 C  CD2 . PHE C 3 63  ? -17.916 2.990   40.914  1.00 28.10  ? 62  PHE L CD2 1 
ATOM   3390 C  CE1 . PHE C 3 63  ? -17.814 1.261   38.770  1.00 27.17  ? 62  PHE L CE1 1 
ATOM   3391 C  CE2 . PHE C 3 63  ? -18.660 3.252   39.779  1.00 27.98  ? 62  PHE L CE2 1 
ATOM   3392 C  CZ  . PHE C 3 63  ? -18.624 2.377   38.712  1.00 27.79  ? 62  PHE L CZ  1 
ATOM   3393 N  N   . THR C 3 64  ? -15.399 -0.907  44.380  1.00 29.76  ? 63  THR L N   1 
ATOM   3394 C  CA  . THR C 3 64  ? -14.413 -1.265  45.430  1.00 30.75  ? 63  THR L CA  1 
ATOM   3395 C  C   . THR C 3 64  ? -13.267 -2.054  44.807  1.00 29.05  ? 63  THR L C   1 
ATOM   3396 O  O   . THR C 3 64  ? -13.375 -2.535  43.674  1.00 26.72  ? 63  THR L O   1 
ATOM   3397 C  CB  . THR C 3 64  ? -15.061 -2.022  46.597  1.00 33.31  ? 63  THR L CB  1 
ATOM   3398 O  OG1 . THR C 3 64  ? -15.492 -3.341  46.178  1.00 34.66  ? 63  THR L OG1 1 
ATOM   3399 C  CG2 . THR C 3 64  ? -16.228 -1.259  47.198  1.00 34.84  ? 63  THR L CG2 1 
ATOM   3400 N  N   . GLY C 3 65  ? -12.204 -2.192  45.575  1.00 28.96  ? 64  GLY L N   1 
ATOM   3401 C  CA  . GLY C 3 65  ? -11.002 -2.940  45.180  1.00 27.56  ? 64  GLY L CA  1 
ATOM   3402 C  C   . GLY C 3 65  ? -10.399 -3.555  46.408  1.00 28.02  ? 64  GLY L C   1 
ATOM   3403 O  O   . GLY C 3 65  ? -10.565 -2.952  47.511  1.00 27.54  ? 64  GLY L O   1 
ATOM   3404 N  N   . SER C 3 66  ? -9.702  -4.676  46.260  1.00 27.18  ? 65  SER L N   1 
ATOM   3405 C  CA  . SER C 3 66  ? -8.988  -5.294  47.403  1.00 27.68  ? 65  SER L CA  1 
ATOM   3406 C  C   . SER C 3 66  ? -7.754  -6.012  46.872  1.00 27.54  ? 65  SER L C   1 
ATOM   3407 O  O   . SER C 3 66  ? -7.637  -6.223  45.613  1.00 27.14  ? 65  SER L O   1 
ATOM   3408 C  CB  . SER C 3 66  ? -9.929  -6.187  48.177  1.00 29.16  ? 65  SER L CB  1 
ATOM   3409 O  OG  . SER C 3 66  ? -10.284 -7.289  47.376  1.00 30.22  ? 65  SER L OG  1 
ATOM   3410 N  N   . GLY C 3 67  ? -6.872  -6.380  47.788  1.00 28.35  ? 66  GLY L N   1 
ATOM   3411 C  CA  . GLY C 3 67  ? -5.697  -7.196  47.481  1.00 28.49  ? 66  GLY L CA  1 
ATOM   3412 C  C   . GLY C 3 67  ? -4.405  -6.530  47.889  1.00 28.00  ? 66  GLY L C   1 
ATOM   3413 O  O   . GLY C 3 67  ? -4.366  -5.298  48.133  1.00 27.45  ? 66  GLY L O   1 
ATOM   3414 N  N   . TYR C 3 68  ? -3.382  -7.372  47.984  1.00 28.18  ? 67  TYR L N   1 
ATOM   3415 C  CA  . TYR C 3 68  ? -2.001  -7.025  48.358  1.00 28.50  ? 67  TYR L CA  1 
ATOM   3416 C  C   . TYR C 3 68  ? -1.140  -8.173  47.786  1.00 29.11  ? 67  TYR L C   1 
ATOM   3417 O  O   . TYR C 3 68  ? -1.436  -9.359  48.117  1.00 32.45  ? 67  TYR L O   1 
ATOM   3418 C  CB  . TYR C 3 68  ? -1.851  -6.876  49.889  1.00 28.62  ? 67  TYR L CB  1 
ATOM   3419 C  CG  . TYR C 3 68  ? -0.554  -6.204  50.268  1.00 29.48  ? 67  TYR L CG  1 
ATOM   3420 C  CD1 . TYR C 3 68  ? -0.515  -4.836  50.548  1.00 28.66  ? 67  TYR L CD1 1 
ATOM   3421 C  CD2 . TYR C 3 68  ? 0.644   -6.915  50.332  1.00 30.00  ? 67  TYR L CD2 1 
ATOM   3422 C  CE1 . TYR C 3 68  ? 0.676   -4.193  50.844  1.00 29.08  ? 67  TYR L CE1 1 
ATOM   3423 C  CE2 . TYR C 3 68  ? 1.851   -6.283  50.599  1.00 29.28  ? 67  TYR L CE2 1 
ATOM   3424 C  CZ  . TYR C 3 68  ? 1.873   -4.898  50.835  1.00 29.37  ? 67  TYR L CZ  1 
ATOM   3425 O  OH  . TYR C 3 68  ? 3.005   -4.172  51.106  1.00 31.70  ? 67  TYR L OH  1 
ATOM   3426 N  N   . GLY C 3 69  ? -0.057  -7.826  47.098  1.00 27.67  ? 68  GLY L N   1 
ATOM   3427 C  CA  . GLY C 3 69  ? 0.902   -8.827  46.590  1.00 28.36  ? 68  GLY L CA  1 
ATOM   3428 C  C   . GLY C 3 69  ? 0.658   -9.041  45.114  1.00 27.20  ? 68  GLY L C   1 
ATOM   3429 O  O   . GLY C 3 69  ? 0.917   -8.089  44.366  1.00 26.54  ? 68  GLY L O   1 
ATOM   3430 N  N   . THR C 3 70  ? 0.174   -10.210 44.718  1.00 28.41  ? 69  THR L N   1 
ATOM   3431 C  CA  . THR C 3 70  ? -0.095  -10.508 43.280  1.00 29.12  ? 69  THR L CA  1 
ATOM   3432 C  C   . THR C 3 70  ? -1.588  -10.439 42.928  1.00 29.08  ? 69  THR L C   1 
ATOM   3433 O  O   . THR C 3 70  ? -1.891  -10.288 41.730  1.00 29.48  ? 69  THR L O   1 
ATOM   3434 C  CB  . THR C 3 70  ? 0.458   -11.877 42.887  1.00 30.25  ? 69  THR L CB  1 
ATOM   3435 O  OG1 . THR C 3 70  ? -0.198  -12.886 43.667  1.00 32.09  ? 69  THR L OG1 1 
ATOM   3436 C  CG2 . THR C 3 70  ? 1.958   -11.940 43.057  1.00 31.20  ? 69  THR L CG2 1 
ATOM   3437 N  N   . ASP C 3 71  ? -2.500  -10.676 43.866  1.00 30.10  ? 70  ASP L N   1 
ATOM   3438 C  CA  . ASP C 3 71  ? -3.902  -11.052 43.522  1.00 30.79  ? 70  ASP L CA  1 
ATOM   3439 C  C   . ASP C 3 71  ? -4.855  -9.909  43.893  1.00 29.52  ? 70  ASP L C   1 
ATOM   3440 O  O   . ASP C 3 71  ? -5.005  -9.597  45.082  1.00 29.11  ? 70  ASP L O   1 
ATOM   3441 C  CB  . ASP C 3 71  ? -4.268  -12.384 44.191  1.00 34.43  ? 70  ASP L CB  1 
ATOM   3442 C  CG  . ASP C 3 71  ? -3.432  -13.587 43.750  1.00 37.26  ? 70  ASP L CG  1 
ATOM   3443 O  OD1 . ASP C 3 71  ? -2.652  -13.453 42.782  1.00 37.67  ? 70  ASP L OD1 1 
ATOM   3444 O  OD2 . ASP C 3 71  ? -3.549  -14.659 44.412  1.00 41.43  ? 70  ASP L OD2 1 
ATOM   3445 N  N   . PHE C 3 72  ? -5.452  -9.248  42.897  1.00 27.37  ? 71  PHE L N   1 
ATOM   3446 C  CA  . PHE C 3 72  ? -6.293  -8.048  43.133  1.00 27.24  ? 71  PHE L CA  1 
ATOM   3447 C  C   . PHE C 3 72  ? -7.665  -8.257  42.544  1.00 27.57  ? 71  PHE L C   1 
ATOM   3448 O  O   . PHE C 3 72  ? -7.788  -8.819  41.404  1.00 28.87  ? 71  PHE L O   1 
ATOM   3449 C  CB  . PHE C 3 72  ? -5.636  -6.767  42.617  1.00 25.22  ? 71  PHE L CB  1 
ATOM   3450 C  CG  . PHE C 3 72  ? -4.265  -6.534  43.193  1.00 25.41  ? 71  PHE L CG  1 
ATOM   3451 C  CD1 . PHE C 3 72  ? -4.100  -5.743  44.328  1.00 25.22  ? 71  PHE L CD1 1 
ATOM   3452 C  CD2 . PHE C 3 72  ? -3.146  -7.115  42.609  1.00 24.98  ? 71  PHE L CD2 1 
ATOM   3453 C  CE1 . PHE C 3 72  ? -2.846  -5.561  44.874  1.00 25.23  ? 71  PHE L CE1 1 
ATOM   3454 C  CE2 . PHE C 3 72  ? -1.883  -6.881  43.122  1.00 25.81  ? 71  PHE L CE2 1 
ATOM   3455 C  CZ  . PHE C 3 72  ? -1.732  -6.124  44.276  1.00 25.52  ? 71  PHE L CZ  1 
ATOM   3456 N  N   . THR C 3 73  ? -8.649  -7.718  43.242  1.00 27.17  ? 72  THR L N   1 
ATOM   3457 C  CA  . THR C 3 73  ? -10.079 -7.902  42.915  1.00 27.88  ? 72  THR L CA  1 
ATOM   3458 C  C   . THR C 3 73  ? -10.747 -6.540  42.818  1.00 27.77  ? 72  THR L C   1 
ATOM   3459 O  O   . THR C 3 73  ? -10.611 -5.742  43.763  1.00 27.58  ? 72  THR L O   1 
ATOM   3460 C  CB  . THR C 3 73  ? -10.776 -8.756  43.981  1.00 29.97  ? 72  THR L CB  1 
ATOM   3461 O  OG1 . THR C 3 73  ? -10.033 -9.992  44.097  1.00 31.41  ? 72  THR L OG1 1 
ATOM   3462 C  CG2 . THR C 3 73  ? -12.239 -8.976  43.683  1.00 29.80  ? 72  THR L CG2 1 
ATOM   3463 N  N   . PHE C 3 74  ? -11.414 -6.271  41.694  1.00 27.02  ? 73  PHE L N   1 
ATOM   3464 C  CA  . PHE C 3 74  ? -12.259 -5.066  41.475  1.00 26.44  ? 73  PHE L CA  1 
ATOM   3465 C  C   . PHE C 3 74  ? -13.711 -5.499  41.376  1.00 27.22  ? 73  PHE L C   1 
ATOM   3466 O  O   . PHE C 3 74  ? -14.023 -6.408  40.540  1.00 27.64  ? 73  PHE L O   1 
ATOM   3467 C  CB  . PHE C 3 74  ? -11.818 -4.331  40.210  1.00 26.52  ? 73  PHE L CB  1 
ATOM   3468 C  CG  . PHE C 3 74  ? -12.688 -3.179  39.776  1.00 26.51  ? 73  PHE L CG  1 
ATOM   3469 C  CD1 . PHE C 3 74  ? -12.464 -1.906  40.268  1.00 26.33  ? 73  PHE L CD1 1 
ATOM   3470 C  CD2 . PHE C 3 74  ? -13.679 -3.338  38.821  1.00 26.95  ? 73  PHE L CD2 1 
ATOM   3471 C  CE1 . PHE C 3 74  ? -13.247 -0.835  39.863  1.00 26.57  ? 73  PHE L CE1 1 
ATOM   3472 C  CE2 . PHE C 3 74  ? -14.453 -2.262  38.403  1.00 26.54  ? 73  PHE L CE2 1 
ATOM   3473 C  CZ  . PHE C 3 74  ? -14.237 -1.012  38.925  1.00 26.51  ? 73  PHE L CZ  1 
ATOM   3474 N  N   . THR C 3 75  ? -14.591 -4.804  42.084  1.00 27.81  ? 74  THR L N   1 
ATOM   3475 C  CA  . THR C 3 75  ? -16.027 -5.179  42.216  1.00 29.22  ? 74  THR L CA  1 
ATOM   3476 C  C   . THR C 3 75  ? -16.924 -3.967  41.950  1.00 28.66  ? 74  THR L C   1 
ATOM   3477 O  O   . THR C 3 75  ? -16.641 -2.902  42.473  1.00 28.52  ? 74  THR L O   1 
ATOM   3478 C  CB  . THR C 3 75  ? -16.310 -5.771  43.601  1.00 30.52  ? 74  THR L CB  1 
ATOM   3479 O  OG1 . THR C 3 75  ? -15.352 -6.819  43.795  1.00 30.83  ? 74  THR L OG1 1 
ATOM   3480 C  CG2 . THR C 3 75  ? -17.722 -6.294  43.746  1.00 32.87  ? 74  THR L CG2 1 
ATOM   3481 N  N   . ILE C 3 76  ? -17.945 -4.125  41.102  1.00 28.46  ? 75  ILE L N   1 
ATOM   3482 C  CA  . ILE C 3 76  ? -19.111 -3.192  41.034  1.00 28.65  ? 75  ILE L CA  1 
ATOM   3483 C  C   . ILE C 3 76  ? -20.256 -3.969  41.670  1.00 30.69  ? 75  ILE L C   1 
ATOM   3484 O  O   . ILE C 3 76  ? -20.637 -5.003  41.104  1.00 31.55  ? 75  ILE L O   1 
ATOM   3485 C  CB  . ILE C 3 76  ? -19.482 -2.790  39.587  1.00 27.70  ? 75  ILE L CB  1 
ATOM   3486 C  CG1 . ILE C 3 76  ? -18.241 -2.582  38.723  1.00 26.23  ? 75  ILE L CG1 1 
ATOM   3487 C  CG2 . ILE C 3 76  ? -20.432 -1.602  39.612  1.00 27.89  ? 75  ILE L CG2 1 
ATOM   3488 C  CD1 . ILE C 3 76  ? -18.532 -2.176  37.279  1.00 26.80  ? 75  ILE L CD1 1 
ATOM   3489 N  N   . SER C 3 77  ? -20.712 -3.549  42.837  1.00 33.22  ? 76  SER L N   1 
ATOM   3490 C  CA  . SER C 3 77  ? -21.640 -4.320  43.698  1.00 36.54  ? 76  SER L CA  1 
ATOM   3491 C  C   . SER C 3 77  ? -22.957 -4.481  42.945  1.00 38.27  ? 76  SER L C   1 
ATOM   3492 O  O   . SER C 3 77  ? -23.439 -5.634  42.807  1.00 39.29  ? 76  SER L O   1 
ATOM   3493 C  CB  . SER C 3 77  ? -21.804 -3.651  45.044  1.00 37.85  ? 76  SER L CB  1 
ATOM   3494 O  OG  . SER C 3 77  ? -22.307 -2.335  44.869  1.00 38.47  ? 76  SER L OG  1 
ATOM   3495 N  N   . THR C 3 78  ? -23.456 -3.379  42.387  1.00 38.70  ? 77  THR L N   1 
ATOM   3496 C  CA  . THR C 3 78  ? -24.709 -3.341  41.591  1.00 39.69  ? 77  THR L CA  1 
ATOM   3497 C  C   . THR C 3 78  ? -24.474 -2.476  40.343  1.00 37.57  ? 77  THR L C   1 
ATOM   3498 O  O   . THR C 3 78  ? -24.671 -1.244  40.380  1.00 36.83  ? 77  THR L O   1 
ATOM   3499 C  CB  . THR C 3 78  ? -25.867 -2.893  42.483  1.00 41.11  ? 77  THR L CB  1 
ATOM   3500 O  OG1 . THR C 3 78  ? -25.682 -1.515  42.782  1.00 42.84  ? 77  THR L OG1 1 
ATOM   3501 C  CG2 . THR C 3 78  ? -25.917 -3.673  43.778  1.00 43.69  ? 77  THR L CG2 1 
ATOM   3502 N  N   . VAL C 3 79  ? -24.082 -3.118  39.256  1.00 35.36  ? 78  VAL L N   1 
ATOM   3503 C  CA  . VAL C 3 79  ? -23.676 -2.398  38.024  1.00 33.99  ? 78  VAL L CA  1 
ATOM   3504 C  C   . VAL C 3 79  ? -24.865 -1.570  37.525  1.00 34.53  ? 78  VAL L C   1 
ATOM   3505 O  O   . VAL C 3 79  ? -26.024 -2.010  37.669  1.00 35.23  ? 78  VAL L O   1 
ATOM   3506 C  CB  . VAL C 3 79  ? -23.148 -3.385  36.981  1.00 33.24  ? 78  VAL L CB  1 
ATOM   3507 C  CG1 . VAL C 3 79  ? -24.257 -4.262  36.463  1.00 34.17  ? 78  VAL L CG1 1 
ATOM   3508 C  CG2 . VAL C 3 79  ? -22.416 -2.657  35.855  1.00 32.75  ? 78  VAL L CG2 1 
ATOM   3509 N  N   . GLN C 3 80  ? -24.585 -0.377  37.000  1.00 34.07  ? 79  GLN L N   1 
ATOM   3510 C  CA  . GLN C 3 80  ? -25.610 0.506   36.392  1.00 34.78  ? 79  GLN L CA  1 
ATOM   3511 C  C   . GLN C 3 80  ? -25.354 0.585   34.884  1.00 32.32  ? 79  GLN L C   1 
ATOM   3512 O  O   . GLN C 3 80  ? -24.226 0.249   34.434  1.00 29.95  ? 79  GLN L O   1 
ATOM   3513 C  CB  . GLN C 3 80  ? -25.608 1.855   37.101  1.00 36.13  ? 79  GLN L CB  1 
ATOM   3514 C  CG  . GLN C 3 80  ? -25.961 1.690   38.570  1.00 39.61  ? 79  GLN L CG  1 
ATOM   3515 C  CD  . GLN C 3 80  ? -25.883 2.946   39.403  1.00 41.85  ? 79  GLN L CD  1 
ATOM   3516 O  OE1 . GLN C 3 80  ? -26.075 2.902   40.623  1.00 44.89  ? 79  GLN L OE1 1 
ATOM   3517 N  NE2 . GLN C 3 80  ? -25.634 4.076   38.757  1.00 42.47  ? 79  GLN L NE2 1 
ATOM   3518 N  N   . ALA C 3 81  ? -26.368 1.013   34.134  1.00 32.34  ? 80  ALA L N   1 
ATOM   3519 C  CA  . ALA C 3 81  ? -26.347 1.093   32.648  1.00 31.34  ? 80  ALA L CA  1 
ATOM   3520 C  C   . ALA C 3 81  ? -25.119 1.891   32.194  1.00 29.87  ? 80  ALA L C   1 
ATOM   3521 O  O   . ALA C 3 81  ? -24.517 1.525   31.179  1.00 28.59  ? 80  ALA L O   1 
ATOM   3522 C  CB  . ALA C 3 81  ? -27.638 1.731   32.161  1.00 31.99  ? 80  ALA L CB  1 
ATOM   3523 N  N   . GLU C 3 82  ? -24.766 2.958   32.917  1.00 29.81  ? 81  GLU L N   1 
ATOM   3524 C  CA  . GLU C 3 82  ? -23.711 3.925   32.512  1.00 29.37  ? 81  GLU L CA  1 
ATOM   3525 C  C   . GLU C 3 82  ? -22.320 3.363   32.822  1.00 28.43  ? 81  GLU L C   1 
ATOM   3526 O  O   . GLU C 3 82  ? -21.324 4.010   32.424  1.00 27.64  ? 81  GLU L O   1 
ATOM   3527 C  CB  . GLU C 3 82  ? -23.948 5.280   33.179  1.00 31.96  ? 81  GLU L CB  1 
ATOM   3528 C  CG  . GLU C 3 82  ? -23.913 5.222   34.689  1.00 33.51  ? 81  GLU L CG  1 
ATOM   3529 C  CD  . GLU C 3 82  ? -25.268 5.024   35.350  1.00 37.92  ? 81  GLU L CD  1 
ATOM   3530 O  OE1 . GLU C 3 82  ? -26.244 4.545   34.678  1.00 37.98  ? 81  GLU L OE1 1 
ATOM   3531 O  OE2 . GLU C 3 82  ? -25.350 5.349   36.553  1.00 41.04  ? 81  GLU L OE2 1 
ATOM   3532 N  N   . ASP C 3 83  ? -22.249 2.194   33.461  1.00 27.31  ? 82  ASP L N   1 
ATOM   3533 C  CA  . ASP C 3 83  ? -20.974 1.556   33.840  1.00 26.47  ? 82  ASP L CA  1 
ATOM   3534 C  C   . ASP C 3 83  ? -20.402 0.764   32.683  1.00 25.67  ? 82  ASP L C   1 
ATOM   3535 O  O   . ASP C 3 83  ? -19.277 0.224   32.812  1.00 25.56  ? 82  ASP L O   1 
ATOM   3536 C  CB  . ASP C 3 83  ? -21.144 0.712   35.094  1.00 27.90  ? 82  ASP L CB  1 
ATOM   3537 C  CG  . ASP C 3 83  ? -21.535 1.515   36.317  1.00 28.42  ? 82  ASP L CG  1 
ATOM   3538 O  OD1 . ASP C 3 83  ? -21.335 2.739   36.307  1.00 27.80  ? 82  ASP L OD1 1 
ATOM   3539 O  OD2 . ASP C 3 83  ? -22.047 0.899   37.268  1.00 29.03  ? 82  ASP L OD2 1 
ATOM   3540 N  N   . LEU C 3 84  ? -21.086 0.694   31.540  1.00 25.82  ? 83  LEU L N   1 
ATOM   3541 C  CA  . LEU C 3 84  ? -20.434 0.009   30.402  1.00 25.35  ? 83  LEU L CA  1 
ATOM   3542 C  C   . LEU C 3 84  ? -19.109 0.717   30.059  1.00 22.36  ? 83  LEU L C   1 
ATOM   3543 O  O   . LEU C 3 84  ? -19.096 1.940   29.924  1.00 21.78  ? 83  LEU L O   1 
ATOM   3544 C  CB  . LEU C 3 84  ? -21.427 -0.122  29.250  1.00 27.25  ? 83  LEU L CB  1 
ATOM   3545 C  CG  . LEU C 3 84  ? -21.681 1.076   28.351  1.00 29.34  ? 83  LEU L CG  1 
ATOM   3546 C  CD1 . LEU C 3 84  ? -20.747 1.084   27.164  1.00 29.57  ? 83  LEU L CD1 1 
ATOM   3547 C  CD2 . LEU C 3 84  ? -23.099 1.034   27.839  1.00 32.25  ? 83  LEU L CD2 1 
ATOM   3548 N  N   . ALA C 3 85  ? -18.027 -0.051  29.943  1.00 21.59  ? 84  ALA L N   1 
ATOM   3549 C  CA  . ALA C 3 85  ? -16.656 0.478   29.785  1.00 20.53  ? 84  ALA L CA  1 
ATOM   3550 C  C   . ALA C 3 85  ? -15.706 -0.688  29.660  1.00 20.21  ? 84  ALA L C   1 
ATOM   3551 O  O   . ALA C 3 85  ? -16.150 -1.822  29.967  1.00 20.80  ? 84  ALA L O   1 
ATOM   3552 C  CB  . ALA C 3 85  ? -16.289 1.331   30.999  1.00 21.15  ? 84  ALA L CB  1 
ATOM   3553 N  N   . VAL C 3 86  ? -14.444 -0.418  29.297  1.00 19.41  ? 85  VAL L N   1 
ATOM   3554 C  CA  . VAL C 3 86  ? -13.325 -1.341  29.536  1.00 20.47  ? 85  VAL L CA  1 
ATOM   3555 C  C   . VAL C 3 86  ? -12.691 -0.907  30.866  1.00 21.29  ? 85  VAL L C   1 
ATOM   3556 O  O   . VAL C 3 86  ? -12.413 0.268   31.008  1.00 21.81  ? 85  VAL L O   1 
ATOM   3557 C  CB  . VAL C 3 86  ? -12.334 -1.353  28.379  1.00 21.06  ? 85  VAL L CB  1 
ATOM   3558 C  CG1 . VAL C 3 86  ? -11.262 -2.393  28.579  1.00 21.44  ? 85  VAL L CG1 1 
ATOM   3559 C  CG2 . VAL C 3 86  ? -13.071 -1.560  27.044  1.00 21.85  ? 85  VAL L CG2 1 
ATOM   3560 N  N   . TYR C 3 87  ? -12.506 -1.831  31.800  1.00 22.22  ? 86  TYR L N   1 
ATOM   3561 C  CA  . TYR C 3 87  ? -11.835 -1.575  33.106  1.00 21.73  ? 86  TYR L CA  1 
ATOM   3562 C  C   . TYR C 3 87  ? -10.430 -2.176  33.023  1.00 23.09  ? 86  TYR L C   1 
ATOM   3563 O  O   . TYR C 3 87  ? -10.258 -3.276  32.392  1.00 23.94  ? 86  TYR L O   1 
ATOM   3564 C  CB  . TYR C 3 87  ? -12.666 -2.152  34.238  1.00 21.89  ? 86  TYR L CB  1 
ATOM   3565 C  CG  . TYR C 3 87  ? -13.989 -1.463  34.403  1.00 22.75  ? 86  TYR L CG  1 
ATOM   3566 C  CD1 . TYR C 3 87  ? -15.096 -1.838  33.657  1.00 22.67  ? 86  TYR L CD1 1 
ATOM   3567 C  CD2 . TYR C 3 87  ? -14.171 -0.453  35.335  1.00 22.38  ? 86  TYR L CD2 1 
ATOM   3568 C  CE1 . TYR C 3 87  ? -16.318 -1.198  33.798  1.00 22.71  ? 86  TYR L CE1 1 
ATOM   3569 C  CE2 . TYR C 3 87  ? -15.386 0.196   35.473  1.00 22.75  ? 86  TYR L CE2 1 
ATOM   3570 C  CZ  . TYR C 3 87  ? -16.479 -0.175  34.700  1.00 22.79  ? 86  TYR L CZ  1 
ATOM   3571 O  OH  . TYR C 3 87  ? -17.693 0.445   34.866  1.00 22.84  ? 86  TYR L OH  1 
ATOM   3572 N  N   . PHE C 3 88  ? -9.413  -1.429  33.463  1.00 21.34  ? 87  PHE L N   1 
ATOM   3573 C  CA  . PHE C 3 88  ? -7.987  -1.842  33.367  1.00 21.44  ? 87  PHE L CA  1 
ATOM   3574 C  C   . PHE C 3 88  ? -7.343  -1.642  34.739  1.00 21.37  ? 87  PHE L C   1 
ATOM   3575 O  O   . PHE C 3 88  ? -7.698  -0.655  35.390  1.00 21.05  ? 87  PHE L O   1 
ATOM   3576 C  CB  . PHE C 3 88  ? -7.153  -0.978  32.431  1.00 23.18  ? 87  PHE L CB  1 
ATOM   3577 C  CG  . PHE C 3 88  ? -7.542  -0.949  30.980  1.00 23.98  ? 87  PHE L CG  1 
ATOM   3578 C  CD1 . PHE C 3 88  ? -6.904  -1.771  30.059  1.00 25.51  ? 87  PHE L CD1 1 
ATOM   3579 C  CD2 . PHE C 3 88  ? -8.460  -0.010  30.535  1.00 24.38  ? 87  PHE L CD2 1 
ATOM   3580 C  CE1 . PHE C 3 88  ? -7.227  -1.718  28.704  1.00 26.18  ? 87  PHE L CE1 1 
ATOM   3581 C  CE2 . PHE C 3 88  ? -8.793  0.035   29.180  1.00 23.94  ? 87  PHE L CE2 1 
ATOM   3582 C  CZ  . PHE C 3 88  ? -8.187  -0.829  28.281  1.00 24.85  ? 87  PHE L CZ  1 
ATOM   3583 N  N   . CYS C 3 89  ? -6.454  -2.554  35.132  1.00 21.66  ? 88  CYS L N   1 
ATOM   3584 C  CA  . CYS C 3 89  ? -5.584  -2.425  36.308  1.00 22.27  ? 88  CYS L CA  1 
ATOM   3585 C  C   . CYS C 3 89  ? -4.228  -1.952  35.802  1.00 21.64  ? 88  CYS L C   1 
ATOM   3586 O  O   . CYS C 3 89  ? -3.910  -2.109  34.599  1.00 21.20  ? 88  CYS L O   1 
ATOM   3587 C  CB  . CYS C 3 89  ? -5.492  -3.726  37.089  1.00 24.05  ? 88  CYS L CB  1 
ATOM   3588 S  SG  . CYS C 3 89  ? -4.690  -5.075  36.184  1.00 26.48  ? 88  CYS L SG  1 
ATOM   3589 N  N   . GLN C 3 90  ? -3.491  -1.291  36.669  1.00 21.01  ? 89  GLN L N   1 
ATOM   3590 C  CA  . GLN C 3 90  ? -2.120  -0.823  36.413  1.00 20.65  ? 89  GLN L CA  1 
ATOM   3591 C  C   . GLN C 3 90  ? -1.357  -0.997  37.728  1.00 21.13  ? 89  GLN L C   1 
ATOM   3592 O  O   . GLN C 3 90  ? -1.857  -0.512  38.729  1.00 21.41  ? 89  GLN L O   1 
ATOM   3593 C  CB  . GLN C 3 90  ? -2.134  0.638   36.006  1.00 20.50  ? 89  GLN L CB  1 
ATOM   3594 C  CG  . GLN C 3 90  ? -0.758  1.155   35.696  1.00 21.27  ? 89  GLN L CG  1 
ATOM   3595 C  CD  . GLN C 3 90  ? -0.578  2.570   36.165  1.00 22.58  ? 89  GLN L CD  1 
ATOM   3596 O  OE1 . GLN C 3 90  ? -1.454  3.432   36.017  1.00 22.70  ? 89  GLN L OE1 1 
ATOM   3597 N  NE2 . GLN C 3 90  ? 0.574   2.813   36.758  1.00 24.35  ? 89  GLN L NE2 1 
ATOM   3598 N  N   . GLN C 3 91  ? -0.160  -1.563  37.647  1.00 21.87  ? 90  GLN L N   1 
ATOM   3599 C  CA  . GLN C 3 91  ? 0.780   -1.650  38.788  1.00 21.86  ? 90  GLN L CA  1 
ATOM   3600 C  C   . GLN C 3 91  ? 1.812   -0.534  38.587  1.00 22.07  ? 90  GLN L C   1 
ATOM   3601 O  O   . GLN C 3 91  ? 2.193   -0.261  37.421  1.00 20.78  ? 90  GLN L O   1 
ATOM   3602 C  CB  . GLN C 3 91  ? 1.425   -3.046  38.841  1.00 21.88  ? 90  GLN L CB  1 
ATOM   3603 C  CG  . GLN C 3 91  ? 2.455   -3.352  37.755  1.00 21.68  ? 90  GLN L CG  1 
ATOM   3604 C  CD  . GLN C 3 91  ? 3.838   -2.811  38.030  1.00 22.26  ? 90  GLN L CD  1 
ATOM   3605 O  OE1 . GLN C 3 91  ? 4.220   -2.531  39.180  1.00 23.17  ? 90  GLN L OE1 1 
ATOM   3606 N  NE2 . GLN C 3 91  ? 4.611   -2.651  36.974  1.00 21.81  ? 90  GLN L NE2 1 
ATOM   3607 N  N   . ASP C 3 92  ? 2.261   0.119   39.670  1.00 20.77  ? 91  ASP L N   1 
ATOM   3608 C  CA  . ASP C 3 92  ? 3.454   0.991   39.588  1.00 21.66  ? 91  ASP L CA  1 
ATOM   3609 C  C   . ASP C 3 92  ? 4.389   0.649   40.756  1.00 22.13  ? 91  ASP L C   1 
ATOM   3610 O  O   . ASP C 3 92  ? 5.184   1.507   41.140  1.00 21.63  ? 91  ASP L O   1 
ATOM   3611 C  CB  . ASP C 3 92  ? 3.079   2.483   39.563  1.00 22.19  ? 91  ASP L CB  1 
ATOM   3612 C  CG  . ASP C 3 92  ? 2.609   3.052   40.905  1.00 22.38  ? 91  ASP L CG  1 
ATOM   3613 O  OD1 . ASP C 3 92  ? 1.599   2.479   41.472  1.00 22.73  ? 91  ASP L OD1 1 
ATOM   3614 O  OD2 . ASP C 3 92  ? 3.250   4.054   41.387  1.00 24.44  ? 91  ASP L OD2 1 
ATOM   3615 N  N   . TYR C 3 93  ? 4.386   -0.598  41.212  1.00 23.62  ? 92  TYR L N   1 
ATOM   3616 C  CA  . TYR C 3 93  ? 5.383   -1.051  42.214  1.00 24.70  ? 92  TYR L CA  1 
ATOM   3617 C  C   . TYR C 3 93  ? 6.740   -1.123  41.522  1.00 25.15  ? 92  TYR L C   1 
ATOM   3618 O  O   . TYR C 3 93  ? 7.718   -0.568  42.029  1.00 25.73  ? 92  TYR L O   1 
ATOM   3619 C  CB  . TYR C 3 93  ? 4.975   -2.392  42.807  1.00 26.66  ? 92  TYR L CB  1 
ATOM   3620 C  CG  . TYR C 3 93  ? 5.886   -2.863  43.904  1.00 29.03  ? 92  TYR L CG  1 
ATOM   3621 C  CD1 . TYR C 3 93  ? 5.746   -2.386  45.195  1.00 31.31  ? 92  TYR L CD1 1 
ATOM   3622 C  CD2 . TYR C 3 93  ? 6.924   -3.740  43.637  1.00 31.65  ? 92  TYR L CD2 1 
ATOM   3623 C  CE1 . TYR C 3 93  ? 6.577   -2.818  46.215  1.00 32.36  ? 92  TYR L CE1 1 
ATOM   3624 C  CE2 . TYR C 3 93  ? 7.767   -4.176  44.643  1.00 33.78  ? 92  TYR L CE2 1 
ATOM   3625 C  CZ  . TYR C 3 93  ? 7.581   -3.731  45.937  1.00 34.43  ? 92  TYR L CZ  1 
ATOM   3626 O  OH  . TYR C 3 93  ? 8.424   -4.145  46.934  1.00 38.21  ? 92  TYR L OH  1 
ATOM   3627 N  N   . GLY C 3 94  ? 6.780   -1.772  40.359  1.00 25.23  ? 93  GLY L N   1 
ATOM   3628 C  CA  . GLY C 3 94  ? 8.032   -1.933  39.610  1.00 27.64  ? 93  GLY L CA  1 
ATOM   3629 C  C   . GLY C 3 94  ? 8.105   -0.941  38.456  1.00 28.13  ? 93  GLY L C   1 
ATOM   3630 O  O   . GLY C 3 94  ? 7.054   -0.424  38.059  1.00 30.67  ? 93  GLY L O   1 
ATOM   3631 N  N   . SER C 3 95  ? 9.303   -0.629  37.989  1.00 28.76  ? 94  SER L N   1 
ATOM   3632 C  CA  . SER C 3 95  ? 9.519   0.219   36.794  1.00 29.10  ? 94  SER L CA  1 
ATOM   3633 C  C   . SER C 3 95  ? 9.805   -0.707  35.617  1.00 28.63  ? 94  SER L C   1 
ATOM   3634 O  O   . SER C 3 95  ? 10.662  -1.585  35.747  1.00 29.81  ? 94  SER L O   1 
ATOM   3635 C  CB  . SER C 3 95  ? 10.646  1.196   37.045  1.00 30.31  ? 94  SER L CB  1 
ATOM   3636 O  OG  . SER C 3 95  ? 10.749  2.082   35.947  1.00 32.73  ? 94  SER L OG  1 
ATOM   3637 N  N   . PRO C 3 96  ? 9.138   -0.571  34.445  1.00 27.22  ? 95  PRO L N   1 
ATOM   3638 C  CA  . PRO C 3 96  ? 8.122   0.457   34.214  1.00 25.81  ? 95  PRO L CA  1 
ATOM   3639 C  C   . PRO C 3 96  ? 6.767   0.089   34.781  1.00 24.40  ? 95  PRO L C   1 
ATOM   3640 O  O   . PRO C 3 96  ? 6.479   -1.070  35.022  1.00 25.47  ? 95  PRO L O   1 
ATOM   3641 C  CB  . PRO C 3 96  ? 8.005   0.476   32.683  1.00 26.68  ? 95  PRO L CB  1 
ATOM   3642 C  CG  . PRO C 3 96  ? 8.281   -0.956  32.280  1.00 27.17  ? 95  PRO L CG  1 
ATOM   3643 C  CD  . PRO C 3 96  ? 9.352   -1.411  33.257  1.00 27.80  ? 95  PRO L CD  1 
ATOM   3644 N  N   . PRO C 3 97  ? 5.865   1.057   34.973  1.00 22.87  ? 96  PRO L N   1 
ATOM   3645 C  CA  . PRO C 3 97  ? 4.454   0.758   35.230  1.00 21.53  ? 96  PRO L CA  1 
ATOM   3646 C  C   . PRO C 3 97  ? 3.878   -0.078  34.085  1.00 22.41  ? 96  PRO L C   1 
ATOM   3647 O  O   . PRO C 3 97  ? 4.278   0.170   32.954  1.00 21.35  ? 96  PRO L O   1 
ATOM   3648 C  CB  . PRO C 3 97  ? 3.754   2.140   35.301  1.00 21.16  ? 96  PRO L CB  1 
ATOM   3649 C  CG  . PRO C 3 97  ? 4.869   3.155   35.386  1.00 22.25  ? 96  PRO L CG  1 
ATOM   3650 C  CD  . PRO C 3 97  ? 6.167   2.499   34.950  1.00 23.05  ? 96  PRO L CD  1 
ATOM   3651 N  N   . THR C 3 98  ? 2.953   -1.003  34.376  1.00 22.85  ? 97  THR L N   1 
ATOM   3652 C  CA  . THR C 3 98  ? 2.409   -1.946  33.370  1.00 22.96  ? 97  THR L CA  1 
ATOM   3653 C  C   . THR C 3 98  ? 0.931   -2.109  33.642  1.00 22.47  ? 97  THR L C   1 
ATOM   3654 O  O   . THR C 3 98  ? 0.516   -1.931  34.780  1.00 22.47  ? 97  THR L O   1 
ATOM   3655 C  CB  . THR C 3 98  ? 3.126   -3.303  33.339  1.00 23.99  ? 97  THR L CB  1 
ATOM   3656 O  OG1 . THR C 3 98  ? 3.144   -3.842  34.660  1.00 24.67  ? 97  THR L OG1 1 
ATOM   3657 C  CG2 . THR C 3 98  ? 4.550   -3.183  32.838  1.00 25.37  ? 97  THR L CG2 1 
ATOM   3658 N  N   . PHE C 3 99  ? 0.177   -2.328  32.583  1.00 21.38  ? 98  PHE L N   1 
ATOM   3659 C  CA  . PHE C 3 99  ? -1.307  -2.402  32.608  1.00 21.21  ? 98  PHE L CA  1 
ATOM   3660 C  C   . PHE C 3 99  ? -1.768  -3.817  32.258  1.00 21.68  ? 98  PHE L C   1 
ATOM   3661 O  O   . PHE C 3 99  ? -1.089  -4.501  31.493  1.00 22.60  ? 98  PHE L O   1 
ATOM   3662 C  CB  . PHE C 3 99  ? -1.906  -1.449  31.553  1.00 20.64  ? 98  PHE L CB  1 
ATOM   3663 C  CG  . PHE C 3 99  ? -1.658  0.019   31.803  1.00 19.77  ? 98  PHE L CG  1 
ATOM   3664 C  CD1 . PHE C 3 99  ? -2.631  0.816   32.379  1.00 19.89  ? 98  PHE L CD1 1 
ATOM   3665 C  CD2 . PHE C 3 99  ? -0.445  0.603   31.481  1.00 20.81  ? 98  PHE L CD2 1 
ATOM   3666 C  CE1 . PHE C 3 99  ? -2.424  2.186   32.528  1.00 19.57  ? 98  PHE L CE1 1 
ATOM   3667 C  CE2 . PHE C 3 99  ? -0.230  1.965   31.651  1.00 21.02  ? 98  PHE L CE2 1 
ATOM   3668 C  CZ  . PHE C 3 99  ? -1.219  2.747   32.200  1.00 20.10  ? 98  PHE L CZ  1 
ATOM   3669 N  N   . GLY C 3 100 ? -2.934  -4.193  32.783  1.00 22.17  ? 99  GLY L N   1 
ATOM   3670 C  CA  . GLY C 3 100 ? -3.691  -5.371  32.378  1.00 22.56  ? 99  GLY L CA  1 
ATOM   3671 C  C   . GLY C 3 100 ? -4.225  -5.132  30.986  1.00 23.30  ? 99  GLY L C   1 
ATOM   3672 O  O   . GLY C 3 100 ? -4.273  -3.934  30.545  1.00 22.62  ? 99  GLY L O   1 
ATOM   3673 N  N   . GLY C 3 101 ? -4.663  -6.210  30.359  1.00 24.10  ? 100 GLY L N   1 
ATOM   3674 C  CA  . GLY C 3 101 ? -5.224  -6.161  29.000  1.00 25.14  ? 100 GLY L CA  1 
ATOM   3675 C  C   . GLY C 3 101 ? -6.660  -5.701  28.974  1.00 24.11  ? 100 GLY L C   1 
ATOM   3676 O  O   . GLY C 3 101 ? -7.199  -5.551  27.864  1.00 25.46  ? 100 GLY L O   1 
ATOM   3677 N  N   . GLY C 3 102 ? -7.301  -5.464  30.108  1.00 24.05  ? 101 GLY L N   1 
ATOM   3678 C  CA  . GLY C 3 102 ? -8.665  -4.911  30.104  1.00 23.25  ? 101 GLY L CA  1 
ATOM   3679 C  C   . GLY C 3 102 ? -9.751  -5.980  30.216  1.00 24.30  ? 101 GLY L C   1 
ATOM   3680 O  O   . GLY C 3 102 ? -9.513  -7.183  29.856  1.00 26.75  ? 101 GLY L O   1 
ATOM   3681 N  N   . THR C 3 103 ? -10.908 -5.557  30.716  1.00 24.18  ? 102 THR L N   1 
ATOM   3682 C  CA  . THR C 3 103 ? -12.144 -6.363  30.849  1.00 24.86  ? 102 THR L CA  1 
ATOM   3683 C  C   . THR C 3 103 ? -13.261 -5.512  30.279  1.00 25.63  ? 102 THR L C   1 
ATOM   3684 O  O   . THR C 3 103 ? -13.492 -4.430  30.819  1.00 23.90  ? 102 THR L O   1 
ATOM   3685 C  CB  . THR C 3 103 ? -12.495 -6.735  32.299  1.00 25.18  ? 102 THR L CB  1 
ATOM   3686 O  OG1 . THR C 3 103 ? -11.507 -7.628  32.815  1.00 25.17  ? 102 THR L OG1 1 
ATOM   3687 C  CG2 . THR C 3 103 ? -13.867 -7.355  32.421  1.00 26.24  ? 102 THR L CG2 1 
ATOM   3688 N  N   . LYS C 3 104 ? -13.885 -5.940  29.167  1.00 26.15  ? 103 LYS L N   1 
ATOM   3689 C  CA  . LYS C 3 104 ? -15.035 -5.191  28.608  1.00 26.36  ? 103 LYS L CA  1 
ATOM   3690 C  C   . LYS C 3 104 ? -16.317 -5.569  29.323  1.00 26.17  ? 103 LYS L C   1 
ATOM   3691 O  O   . LYS C 3 104 ? -16.738 -6.753  29.235  1.00 28.71  ? 103 LYS L O   1 
ATOM   3692 C  CB  . LYS C 3 104 ? -15.275 -5.458  27.119  1.00 28.59  ? 103 LYS L CB  1 
ATOM   3693 C  CG  . LYS C 3 104 ? -16.383 -4.590  26.557  1.00 29.73  ? 103 LYS L CG  1 
ATOM   3694 C  CD  . LYS C 3 104 ? -16.621 -4.893  25.081  1.00 33.13  ? 103 LYS L CD  1 
ATOM   3695 C  CE  . LYS C 3 104 ? -17.391 -3.815  24.359  1.00 33.48  ? 103 LYS L CE  1 
ATOM   3696 N  NZ  . LYS C 3 104 ? -17.557 -4.242  22.947  1.00 38.21  ? 103 LYS L NZ  1 
ATOM   3697 N  N   . VAL C 3 105 ? -16.981 -4.598  29.910  1.00 25.64  ? 104 VAL L N   1 
ATOM   3698 C  CA  . VAL C 3 105 ? -18.235 -4.820  30.667  1.00 26.84  ? 104 VAL L CA  1 
ATOM   3699 C  C   . VAL C 3 105 ? -19.386 -4.349  29.794  1.00 27.40  ? 104 VAL L C   1 
ATOM   3700 O  O   . VAL C 3 105 ? -19.454 -3.148  29.526  1.00 26.21  ? 104 VAL L O   1 
ATOM   3701 C  CB  . VAL C 3 105 ? -18.188 -4.099  32.019  1.00 26.60  ? 104 VAL L CB  1 
ATOM   3702 C  CG1 . VAL C 3 105 ? -19.549 -4.112  32.691  1.00 27.47  ? 104 VAL L CG1 1 
ATOM   3703 C  CG2 . VAL C 3 105 ? -17.138 -4.742  32.895  1.00 27.05  ? 104 VAL L CG2 1 
ATOM   3704 N  N   . GLU C 3 106 ? -20.232 -5.284  29.336  1.00 29.19  ? 105 GLU L N   1 
ATOM   3705 C  CA  . GLU C 3 106 ? -21.360 -4.974  28.429  1.00 30.63  ? 105 GLU L CA  1 
ATOM   3706 C  C   . GLU C 3 106 ? -22.648 -5.278  29.182  1.00 30.17  ? 105 GLU L C   1 
ATOM   3707 O  O   . GLU C 3 106 ? -22.639 -6.170  30.085  1.00 29.85  ? 105 GLU L O   1 
ATOM   3708 C  CB  . GLU C 3 106 ? -21.345 -5.810  27.156  1.00 33.46  ? 105 GLU L CB  1 
ATOM   3709 C  CG  . GLU C 3 106 ? -19.972 -6.229  26.710  1.00 35.59  ? 105 GLU L CG  1 
ATOM   3710 C  CD  . GLU C 3 106 ? -19.982 -6.956  25.366  1.00 39.62  ? 105 GLU L CD  1 
ATOM   3711 O  OE1 . GLU C 3 106 ? -19.802 -8.183  25.382  1.00 45.27  ? 105 GLU L OE1 1 
ATOM   3712 O  OE2 . GLU C 3 106 ? -20.174 -6.297  24.319  1.00 41.39  ? 105 GLU L OE2 1 
ATOM   3713 N  N   . ILE C 3 107 ? -23.677 -4.509  28.881  1.00 28.70  ? 106 ILE L N   1 
ATOM   3714 C  CA  . ILE C 3 107 ? -24.943 -4.537  29.650  1.00 29.37  ? 106 ILE L CA  1 
ATOM   3715 C  C   . ILE C 3 107 ? -25.927 -5.473  28.938  1.00 30.38  ? 106 ILE L C   1 
ATOM   3716 O  O   . ILE C 3 107 ? -26.096 -5.349  27.705  1.00 29.65  ? 106 ILE L O   1 
ATOM   3717 C  CB  . ILE C 3 107 ? -25.505 -3.123  29.828  1.00 28.88  ? 106 ILE L CB  1 
ATOM   3718 C  CG1 . ILE C 3 107 ? -24.523 -2.206  30.567  1.00 28.31  ? 106 ILE L CG1 1 
ATOM   3719 C  CG2 . ILE C 3 107 ? -26.867 -3.191  30.519  1.00 30.40  ? 106 ILE L CG2 1 
ATOM   3720 C  CD1 . ILE C 3 107 ? -24.006 -2.745  31.884  1.00 29.13  ? 106 ILE L CD1 1 
ATOM   3721 N  N   . LYS C 3 108 ? -26.569 -6.354  29.700  1.00 31.21  ? 107 LYS L N   1 
ATOM   3722 C  CA  . LYS C 3 108 ? -27.705 -7.183  29.211  1.00 32.55  ? 107 LYS L CA  1 
ATOM   3723 C  C   . LYS C 3 108 ? -28.990 -6.443  29.579  1.00 32.60  ? 107 LYS L C   1 
ATOM   3724 O  O   . LYS C 3 108 ? -29.096 -5.979  30.704  1.00 34.37  ? 107 LYS L O   1 
ATOM   3725 C  CB  . LYS C 3 108 ? -27.625 -8.610  29.768  1.00 34.59  ? 107 LYS L CB  1 
ATOM   3726 C  CG  . LYS C 3 108 ? -28.730 -9.568  29.316  1.00 37.19  ? 107 LYS L CG  1 
ATOM   3727 C  CD  . LYS C 3 108 ? -29.073 -10.570 30.386  1.00 40.77  ? 107 LYS L CD  1 
ATOM   3728 C  CE  . LYS C 3 108 ? -30.118 -11.594 30.006  1.00 44.46  ? 107 LYS L CE  1 
ATOM   3729 N  NZ  . LYS C 3 108 ? -29.615 -12.423 28.889  1.00 45.72  ? 107 LYS L NZ  1 
ATOM   3730 N  N   . ARG C 3 109 ? -29.912 -6.273  28.631  1.00 32.22  ? 108 ARG L N   1 
ATOM   3731 C  CA  . ARG C 3 109 ? -31.264 -5.704  28.895  1.00 32.44  ? 108 ARG L CA  1 
ATOM   3732 C  C   . ARG C 3 109 ? -32.353 -6.501  28.149  1.00 33.53  ? 108 ARG L C   1 
ATOM   3733 O  O   . ARG C 3 109 ? -32.014 -7.493  27.485  1.00 32.74  ? 108 ARG L O   1 
ATOM   3734 C  CB  . ARG C 3 109 ? -31.322 -4.248  28.446  1.00 31.47  ? 108 ARG L CB  1 
ATOM   3735 C  CG  . ARG C 3 109 ? -30.922 -4.054  26.991  1.00 30.86  ? 108 ARG L CG  1 
ATOM   3736 C  CD  . ARG C 3 109 ? -31.593 -2.819  26.440  1.00 30.89  ? 108 ARG L CD  1 
ATOM   3737 N  NE  . ARG C 3 109 ? -33.010 -3.037  26.345  1.00 32.63  ? 108 ARG L NE  1 
ATOM   3738 C  CZ  . ARG C 3 109 ? -33.940 -2.096  26.291  1.00 33.34  ? 108 ARG L CZ  1 
ATOM   3739 N  NH1 . ARG C 3 109 ? -33.613 -0.818  26.335  1.00 33.21  ? 108 ARG L NH1 1 
ATOM   3740 N  NH2 . ARG C 3 109 ? -35.208 -2.455  26.214  1.00 35.21  ? 108 ARG L NH2 1 
ATOM   3741 N  N   . THR C 3 110 ? -33.603 -6.052  28.253  1.00 33.34  ? 109 THR L N   1 
ATOM   3742 C  CA  . THR C 3 110 ? -34.776 -6.706  27.636  1.00 34.85  ? 109 THR L CA  1 
ATOM   3743 C  C   . THR C 3 110 ? -34.663 -6.502  26.122  1.00 33.94  ? 109 THR L C   1 
ATOM   3744 O  O   . THR C 3 110 ? -33.812 -5.683  25.650  1.00 31.10  ? 109 THR L O   1 
ATOM   3745 C  CB  . THR C 3 110 ? -36.072 -6.182  28.275  1.00 36.60  ? 109 THR L CB  1 
ATOM   3746 O  OG1 . THR C 3 110 ? -36.193 -4.799  27.930  1.00 36.92  ? 109 THR L OG1 1 
ATOM   3747 C  CG2 . THR C 3 110 ? -36.068 -6.356  29.781  1.00 37.35  ? 109 THR L CG2 1 
ATOM   3748 N  N   . VAL C 3 111 ? -35.432 -7.268  25.374  1.00 33.18  ? 110 VAL L N   1 
ATOM   3749 C  CA  . VAL C 3 111 ? -35.459 -7.109  23.900  1.00 32.82  ? 110 VAL L CA  1 
ATOM   3750 C  C   . VAL C 3 111 ? -36.079 -5.757  23.555  1.00 32.14  ? 110 VAL L C   1 
ATOM   3751 O  O   . VAL C 3 111 ? -37.022 -5.331  24.216  1.00 32.50  ? 110 VAL L O   1 
ATOM   3752 C  CB  . VAL C 3 111 ? -36.200 -8.283  23.239  1.00 33.80  ? 110 VAL L CB  1 
ATOM   3753 C  CG1 . VAL C 3 111 ? -36.422 -8.057  21.748  1.00 33.36  ? 110 VAL L CG1 1 
ATOM   3754 C  CG2 . VAL C 3 111 ? -35.433 -9.575  23.483  1.00 34.08  ? 110 VAL L CG2 1 
ATOM   3755 N  N   . ALA C 3 112 ? -35.553 -5.148  22.499  1.00 31.53  ? 111 ALA L N   1 
ATOM   3756 C  CA  . ALA C 3 112 ? -36.092 -3.921  21.888  1.00 30.98  ? 111 ALA L CA  1 
ATOM   3757 C  C   . ALA C 3 112 ? -35.933 -4.038  20.369  1.00 29.74  ? 111 ALA L C   1 
ATOM   3758 O  O   . ALA C 3 112 ? -34.799 -4.227  19.850  1.00 27.32  ? 111 ALA L O   1 
ATOM   3759 C  CB  . ALA C 3 112 ? -35.326 -2.744  22.426  1.00 30.51  ? 111 ALA L CB  1 
ATOM   3760 N  N   . ALA C 3 113 ? -37.034 -3.932  19.673  1.00 30.32  ? 112 ALA L N   1 
ATOM   3761 C  CA  . ALA C 3 113 ? -37.084 -3.984  18.198  1.00 29.72  ? 112 ALA L CA  1 
ATOM   3762 C  C   . ALA C 3 113 ? -36.450 -2.720  17.615  1.00 29.25  ? 112 ALA L C   1 
ATOM   3763 O  O   . ALA C 3 113 ? -36.586 -1.622  18.138  1.00 28.39  ? 112 ALA L O   1 
ATOM   3764 C  CB  . ALA C 3 113 ? -38.510 -4.100  17.771  1.00 30.81  ? 112 ALA L CB  1 
ATOM   3765 N  N   . PRO C 3 114 ? -35.747 -2.814  16.481  1.00 29.39  ? 113 PRO L N   1 
ATOM   3766 C  CA  . PRO C 3 114 ? -35.265 -1.606  15.818  1.00 29.35  ? 113 PRO L CA  1 
ATOM   3767 C  C   . PRO C 3 114 ? -36.414 -0.825  15.152  1.00 29.41  ? 113 PRO L C   1 
ATOM   3768 O  O   . PRO C 3 114 ? -37.382 -1.437  14.695  1.00 27.97  ? 113 PRO L O   1 
ATOM   3769 C  CB  . PRO C 3 114 ? -34.267 -2.206  14.801  1.00 28.07  ? 113 PRO L CB  1 
ATOM   3770 C  CG  . PRO C 3 114 ? -34.958 -3.499  14.417  1.00 28.19  ? 113 PRO L CG  1 
ATOM   3771 C  CD  . PRO C 3 114 ? -35.399 -4.046  15.753  1.00 29.00  ? 113 PRO L CD  1 
ATOM   3772 N  N   . SER C 3 115 ? -36.302 0.507   15.096  1.00 29.47  ? 114 SER L N   1 
ATOM   3773 C  CA  . SER C 3 115 ? -36.974 1.327   14.048  1.00 30.21  ? 114 SER L CA  1 
ATOM   3774 C  C   . SER C 3 115 ? -36.086 1.351   12.811  1.00 27.35  ? 114 SER L C   1 
ATOM   3775 O  O   . SER C 3 115 ? -34.846 1.559   12.918  1.00 26.74  ? 114 SER L O   1 
ATOM   3776 C  CB  . SER C 3 115 ? -37.302 2.747   14.450  1.00 33.02  ? 114 SER L CB  1 
ATOM   3777 O  OG  . SER C 3 115 ? -37.392 2.880   15.843  1.00 36.72  ? 114 SER L OG  1 
ATOM   3778 N  N   . VAL C 3 116 ? -36.711 1.186   11.663  1.00 26.44  ? 115 VAL L N   1 
ATOM   3779 C  CA  . VAL C 3 116 ? -35.991 0.964   10.388  1.00 25.59  ? 115 VAL L CA  1 
ATOM   3780 C  C   . VAL C 3 116 ? -36.250 2.139   9.438   1.00 24.89  ? 115 VAL L C   1 
ATOM   3781 O  O   . VAL C 3 116 ? -37.397 2.603   9.325   1.00 24.72  ? 115 VAL L O   1 
ATOM   3782 C  CB  . VAL C 3 116 ? -36.380 -0.385  9.765   1.00 25.13  ? 115 VAL L CB  1 
ATOM   3783 C  CG1 . VAL C 3 116 ? -35.581 -0.637  8.498   1.00 24.98  ? 115 VAL L CG1 1 
ATOM   3784 C  CG2 . VAL C 3 116 ? -36.170 -1.507  10.778  1.00 25.59  ? 115 VAL L CG2 1 
ATOM   3785 N  N   . PHE C 3 117 ? -35.184 2.587   8.779   1.00 23.48  ? 116 PHE L N   1 
ATOM   3786 C  CA  . PHE C 3 117 ? -35.225 3.695   7.803   1.00 23.47  ? 116 PHE L CA  1 
ATOM   3787 C  C   . PHE C 3 117 ? -34.329 3.346   6.629   1.00 23.34  ? 116 PHE L C   1 
ATOM   3788 O  O   . PHE C 3 117 ? -33.195 2.814   6.816   1.00 22.70  ? 116 PHE L O   1 
ATOM   3789 C  CB  . PHE C 3 117 ? -34.754 5.008   8.437   1.00 23.85  ? 116 PHE L CB  1 
ATOM   3790 C  CG  . PHE C 3 117 ? -35.436 5.406   9.716   1.00 24.98  ? 116 PHE L CG  1 
ATOM   3791 C  CD1 . PHE C 3 117 ? -36.530 6.263   9.699   1.00 26.21  ? 116 PHE L CD1 1 
ATOM   3792 C  CD2 . PHE C 3 117 ? -34.995 4.927   10.937  1.00 25.07  ? 116 PHE L CD2 1 
ATOM   3793 C  CE1 . PHE C 3 117 ? -37.155 6.648   10.872  1.00 27.20  ? 116 PHE L CE1 1 
ATOM   3794 C  CE2 . PHE C 3 117 ? -35.628 5.326   12.110  1.00 26.26  ? 116 PHE L CE2 1 
ATOM   3795 C  CZ  . PHE C 3 117 ? -36.705 6.182   12.075  1.00 26.53  ? 116 PHE L CZ  1 
ATOM   3796 N  N   . ILE C 3 118 ? -34.761 3.770   5.450   1.00 24.12  ? 117 ILE L N   1 
ATOM   3797 C  CA  . ILE C 3 118 ? -33.950 3.610   4.219   1.00 23.90  ? 117 ILE L CA  1 
ATOM   3798 C  C   . ILE C 3 118 ? -33.703 4.987   3.607   1.00 24.25  ? 117 ILE L C   1 
ATOM   3799 O  O   . ILE C 3 118 ? -34.606 5.821   3.624   1.00 24.21  ? 117 ILE L O   1 
ATOM   3800 C  CB  . ILE C 3 118 ? -34.612 2.627   3.244   1.00 24.01  ? 117 ILE L CB  1 
ATOM   3801 C  CG1 . ILE C 3 118 ? -33.631 2.310   2.112   1.00 23.36  ? 117 ILE L CG1 1 
ATOM   3802 C  CG2 . ILE C 3 118 ? -35.991 3.094   2.777   1.00 25.36  ? 117 ILE L CG2 1 
ATOM   3803 C  CD1 . ILE C 3 118 ? -34.060 1.185   1.176   1.00 23.18  ? 117 ILE L CD1 1 
ATOM   3804 N  N   . PHE C 3 119 ? -32.514 5.182   3.042   1.00 23.19  ? 118 PHE L N   1 
ATOM   3805 C  CA  . PHE C 3 119 ? -32.142 6.455   2.399   1.00 23.64  ? 118 PHE L CA  1 
ATOM   3806 C  C   . PHE C 3 119 ? -31.619 6.192   1.006   1.00 23.71  ? 118 PHE L C   1 
ATOM   3807 O  O   . PHE C 3 119 ? -30.648 5.473   0.831   1.00 23.18  ? 118 PHE L O   1 
ATOM   3808 C  CB  . PHE C 3 119 ? -31.070 7.164   3.212   1.00 24.19  ? 118 PHE L CB  1 
ATOM   3809 C  CG  . PHE C 3 119 ? -31.439 7.476   4.632   1.00 23.74  ? 118 PHE L CG  1 
ATOM   3810 C  CD1 . PHE C 3 119 ? -32.144 8.624   4.934   1.00 25.71  ? 118 PHE L CD1 1 
ATOM   3811 C  CD2 . PHE C 3 119 ? -31.083 6.623   5.656   1.00 24.45  ? 118 PHE L CD2 1 
ATOM   3812 C  CE1 . PHE C 3 119 ? -32.447 8.938   6.246   1.00 25.89  ? 118 PHE L CE1 1 
ATOM   3813 C  CE2 . PHE C 3 119 ? -31.343 6.967   6.971   1.00 24.73  ? 118 PHE L CE2 1 
ATOM   3814 C  CZ  . PHE C 3 119 ? -32.058 8.108   7.252   1.00 25.49  ? 118 PHE L CZ  1 
ATOM   3815 N  N   . PRO C 3 120 ? -32.192 6.837   -0.025  1.00 24.46  ? 119 PRO L N   1 
ATOM   3816 C  CA  . PRO C 3 120 ? -31.697 6.664   -1.380  1.00 24.65  ? 119 PRO L CA  1 
ATOM   3817 C  C   . PRO C 3 120 ? -30.385 7.430   -1.522  1.00 24.12  ? 119 PRO L C   1 
ATOM   3818 O  O   . PRO C 3 120 ? -30.052 8.254   -0.677  1.00 22.53  ? 119 PRO L O   1 
ATOM   3819 C  CB  . PRO C 3 120 ? -32.785 7.256   -2.283  1.00 25.99  ? 119 PRO L CB  1 
ATOM   3820 C  CG  . PRO C 3 120 ? -33.590 8.171   -1.397  1.00 27.53  ? 119 PRO L CG  1 
ATOM   3821 C  CD  . PRO C 3 120 ? -33.287 7.816   0.063   1.00 26.25  ? 119 PRO L CD  1 
ATOM   3822 N  N   . PRO C 3 121 ? -29.612 7.202   -2.596  1.00 23.94  ? 120 PRO L N   1 
ATOM   3823 C  CA  . PRO C 3 121 ? -28.419 7.998   -2.853  1.00 25.47  ? 120 PRO L CA  1 
ATOM   3824 C  C   . PRO C 3 121 ? -28.846 9.424   -3.210  1.00 26.54  ? 120 PRO L C   1 
ATOM   3825 O  O   . PRO C 3 121 ? -29.907 9.598   -3.814  1.00 27.15  ? 120 PRO L O   1 
ATOM   3826 C  CB  . PRO C 3 121 ? -27.732 7.279   -4.025  1.00 25.89  ? 120 PRO L CB  1 
ATOM   3827 C  CG  . PRO C 3 121 ? -28.901 6.613   -4.741  1.00 25.75  ? 120 PRO L CG  1 
ATOM   3828 C  CD  . PRO C 3 121 ? -29.817 6.182   -3.624  1.00 25.23  ? 120 PRO L CD  1 
ATOM   3829 N  N   . SER C 3 122 ? -28.005 10.383  -2.844  1.00 27.18  ? 121 SER L N   1 
ATOM   3830 C  CA  . SER C 3 122 ? -28.155 11.806  -3.216  1.00 29.61  ? 121 SER L CA  1 
ATOM   3831 C  C   . SER C 3 122 ? -27.892 11.950  -4.717  1.00 30.67  ? 121 SER L C   1 
ATOM   3832 O  O   . SER C 3 122 ? -27.052 11.234  -5.269  1.00 30.67  ? 121 SER L O   1 
ATOM   3833 C  CB  . SER C 3 122 ? -27.241 12.687  -2.408  1.00 29.26  ? 121 SER L CB  1 
ATOM   3834 O  OG  . SER C 3 122 ? -25.857 12.438  -2.701  1.00 28.83  ? 121 SER L OG  1 
ATOM   3835 N  N   . ASP C 3 123 ? -28.615 12.914  -5.341  1.00 34.56  ? 122 ASP L N   1 
ATOM   3836 C  CA  . ASP C 3 123 ? -28.308 13.309  -6.734  1.00 35.60  ? 122 ASP L CA  1 
ATOM   3837 C  C   . ASP C 3 123 ? -26.848 13.760  -6.806  1.00 35.04  ? 122 ASP L C   1 
ATOM   3838 O  O   . ASP C 3 123 ? -26.210 13.395  -7.784  1.00 35.78  ? 122 ASP L O   1 
ATOM   3839 C  CB  . ASP C 3 123 ? -29.275 14.374  -7.225  1.00 39.95  ? 122 ASP L CB  1 
ATOM   3840 C  CG  . ASP C 3 123 ? -30.680 13.844  -7.422  1.00 42.07  ? 122 ASP L CG  1 
ATOM   3841 O  OD1 . ASP C 3 123 ? -30.859 12.592  -7.543  1.00 41.29  ? 122 ASP L OD1 1 
ATOM   3842 O  OD2 . ASP C 3 123 ? -31.582 14.687  -7.484  1.00 49.35  ? 122 ASP L OD2 1 
ATOM   3843 N  N   . GLU C 3 124 ? -26.339 14.443  -5.783  1.00 33.75  ? 123 GLU L N   1 
ATOM   3844 C  CA  . GLU C 3 124 ? -24.924 14.902  -5.739  1.00 36.93  ? 123 GLU L CA  1 
ATOM   3845 C  C   . GLU C 3 124 ? -23.985 13.695  -5.914  1.00 34.64  ? 123 GLU L C   1 
ATOM   3846 O  O   . GLU C 3 124 ? -23.092 13.764  -6.779  1.00 36.07  ? 123 GLU L O   1 
ATOM   3847 C  CB  . GLU C 3 124 ? -24.628 15.671  -4.442  1.00 38.81  ? 123 GLU L CB  1 
ATOM   3848 C  CG  . GLU C 3 124 ? -23.304 16.426  -4.444  1.00 42.92  ? 123 GLU L CG  1 
ATOM   3849 C  CD  . GLU C 3 124 ? -22.830 16.856  -3.059  1.00 46.86  ? 123 GLU L CD  1 
ATOM   3850 O  OE1 . GLU C 3 124 ? -23.698 16.968  -2.139  1.00 48.74  ? 123 GLU L OE1 1 
ATOM   3851 O  OE2 . GLU C 3 124 ? -21.571 17.021  -2.865  1.00 51.91  ? 123 GLU L OE2 1 
ATOM   3852 N  N   . GLN C 3 125 ? -24.162 12.619  -5.137  1.00 31.54  ? 124 GLN L N   1 
ATOM   3853 C  CA  . GLN C 3 125 ? -23.276 11.435  -5.276  1.00 30.65  ? 124 GLN L CA  1 
ATOM   3854 C  C   . GLN C 3 125 ? -23.421 10.830  -6.683  1.00 31.32  ? 124 GLN L C   1 
ATOM   3855 O  O   . GLN C 3 125 ? -22.397 10.442  -7.273  1.00 31.51  ? 124 GLN L O   1 
ATOM   3856 C  CB  . GLN C 3 125 ? -23.585 10.373  -4.237  1.00 28.23  ? 124 GLN L CB  1 
ATOM   3857 C  CG  . GLN C 3 125 ? -22.534 9.271   -4.213  1.00 27.45  ? 124 GLN L CG  1 
ATOM   3858 C  CD  . GLN C 3 125 ? -22.864 8.114   -3.310  1.00 25.69  ? 124 GLN L CD  1 
ATOM   3859 O  OE1 . GLN C 3 125 ? -24.014 7.901   -2.891  1.00 23.82  ? 124 GLN L OE1 1 
ATOM   3860 N  NE2 . GLN C 3 125 ? -21.834 7.326   -3.049  1.00 24.88  ? 124 GLN L NE2 1 
ATOM   3861 N  N   . LEU C 3 126 ? -24.649 10.687  -7.162  1.00 32.75  ? 125 LEU L N   1 
ATOM   3862 C  CA  . LEU C 3 126 ? -24.946 10.036  -8.462  1.00 36.37  ? 125 LEU L CA  1 
ATOM   3863 C  C   . LEU C 3 126 ? -24.185 10.738  -9.585  1.00 41.19  ? 125 LEU L C   1 
ATOM   3864 O  O   . LEU C 3 126 ? -23.647 10.016  -10.456 1.00 43.20  ? 125 LEU L O   1 
ATOM   3865 C  CB  . LEU C 3 126 ? -26.441 10.105  -8.740  1.00 36.90  ? 125 LEU L CB  1 
ATOM   3866 C  CG  . LEU C 3 126 ? -27.291 9.124   -7.944  1.00 36.76  ? 125 LEU L CG  1 
ATOM   3867 C  CD1 . LEU C 3 126 ? -28.734 9.225   -8.383  1.00 38.11  ? 125 LEU L CD1 1 
ATOM   3868 C  CD2 . LEU C 3 126 ? -26.773 7.691   -8.089  1.00 37.10  ? 125 LEU L CD2 1 
ATOM   3869 N  N   . LYS C 3 127 ? -24.118 12.073  -9.536  1.00 45.74  ? 126 LYS L N   1 
ATOM   3870 C  CA  . LYS C 3 127 ? -23.373 12.906  -10.522 1.00 52.04  ? 126 LYS L CA  1 
ATOM   3871 C  C   . LYS C 3 127 ? -21.951 12.364  -10.656 1.00 51.14  ? 126 LYS L C   1 
ATOM   3872 O  O   . LYS C 3 127 ? -21.425 12.407  -11.769 1.00 53.70  ? 126 LYS L O   1 
ATOM   3873 C  CB  . LYS C 3 127 ? -23.350 14.381  -10.112 1.00 56.03  ? 126 LYS L CB  1 
ATOM   3874 C  CG  . LYS C 3 127 ? -24.396 15.231  -10.814 1.00 62.32  ? 126 LYS L CG  1 
ATOM   3875 C  CD  . LYS C 3 127 ? -24.832 16.469  -10.055 1.00 66.69  ? 126 LYS L CD  1 
ATOM   3876 C  CE  . LYS C 3 127 ? -26.233 16.892  -10.460 1.00 71.37  ? 126 LYS L CE  1 
ATOM   3877 N  NZ  . LYS C 3 127 ? -26.442 18.356  -10.322 1.00 76.80  ? 126 LYS L NZ  1 
ATOM   3878 N  N   . SER C 3 128 ? -21.399 11.831  -9.569  1.00 49.19  ? 127 SER L N   1 
ATOM   3879 C  CA  . SER C 3 128 ? -19.986 11.392  -9.452  1.00 48.46  ? 127 SER L CA  1 
ATOM   3880 C  C   . SER C 3 128 ? -19.809 9.913   -9.825  1.00 45.92  ? 127 SER L C   1 
ATOM   3881 O  O   . SER C 3 128 ? -18.665 9.451   -9.722  1.00 48.78  ? 127 SER L O   1 
ATOM   3882 C  CB  . SER C 3 128 ? -19.489 11.641  -8.075  1.00 49.24  ? 127 SER L CB  1 
ATOM   3883 O  OG  . SER C 3 128 ? -19.899 10.591  -7.199  1.00 51.88  ? 127 SER L OG  1 
ATOM   3884 N  N   . GLY C 3 129 ? -20.879 9.188   -10.178 1.00 42.47  ? 128 GLY L N   1 
ATOM   3885 C  CA  . GLY C 3 129 ? -20.806 7.825   -10.758 1.00 40.57  ? 128 GLY L CA  1 
ATOM   3886 C  C   . GLY C 3 129 ? -21.024 6.662   -9.781  1.00 37.91  ? 128 GLY L C   1 
ATOM   3887 O  O   . GLY C 3 129 ? -20.928 5.491   -10.220 1.00 36.62  ? 128 GLY L O   1 
ATOM   3888 N  N   . THR C 3 130 ? -21.269 6.933   -8.484  1.00 35.58  ? 129 THR L N   1 
ATOM   3889 C  CA  . THR C 3 130 ? -21.532 5.869   -7.474  1.00 33.57  ? 129 THR L CA  1 
ATOM   3890 C  C   . THR C 3 130 ? -22.874 6.132   -6.780  1.00 31.50  ? 129 THR L C   1 
ATOM   3891 O  O   . THR C 3 130 ? -23.250 7.299   -6.674  1.00 30.88  ? 129 THR L O   1 
ATOM   3892 C  CB  . THR C 3 130 ? -20.381 5.769   -6.483  1.00 34.57  ? 129 THR L CB  1 
ATOM   3893 O  OG1 . THR C 3 130 ? -19.247 5.436   -7.291  1.00 36.65  ? 129 THR L OG1 1 
ATOM   3894 C  CG2 . THR C 3 130 ? -20.617 4.743   -5.398  1.00 33.05  ? 129 THR L CG2 1 
ATOM   3895 N  N   . ALA C 3 131 ? -23.590 5.062   -6.409  1.00 28.53  ? 130 ALA L N   1 
ATOM   3896 C  CA  . ALA C 3 131 ? -24.816 5.075   -5.595  1.00 26.26  ? 130 ALA L CA  1 
ATOM   3897 C  C   . ALA C 3 131 ? -24.585 4.316   -4.279  1.00 25.14  ? 130 ALA L C   1 
ATOM   3898 O  O   . ALA C 3 131 ? -24.310 3.097   -4.325  1.00 24.34  ? 130 ALA L O   1 
ATOM   3899 C  CB  . ALA C 3 131 ? -25.908 4.441   -6.370  1.00 27.74  ? 130 ALA L CB  1 
ATOM   3900 N  N   . SER C 3 132 ? -24.692 5.007   -3.147  1.00 23.25  ? 131 SER L N   1 
ATOM   3901 C  CA  . SER C 3 132 ? -24.704 4.416   -1.782  1.00 22.09  ? 131 SER L CA  1 
ATOM   3902 C  C   . SER C 3 132 ? -26.167 4.487   -1.286  1.00 22.02  ? 131 SER L C   1 
ATOM   3903 O  O   . SER C 3 132 ? -26.785 5.594   -1.290  1.00 22.85  ? 131 SER L O   1 
ATOM   3904 C  CB  . SER C 3 132 ? -23.758 5.130   -0.846  1.00 22.49  ? 131 SER L CB  1 
ATOM   3905 O  OG  . SER C 3 132 ? -22.395 5.124   -1.302  1.00 22.22  ? 131 SER L OG  1 
ATOM   3906 N  N   . VAL C 3 133 ? -26.746 3.349   -0.941  1.00 21.07  ? 132 VAL L N   1 
ATOM   3907 C  CA  . VAL C 3 133 ? -28.100 3.250   -0.349  1.00 21.05  ? 132 VAL L CA  1 
ATOM   3908 C  C   . VAL C 3 133 ? -27.922 2.825   1.110   1.00 20.97  ? 132 VAL L C   1 
ATOM   3909 O  O   . VAL C 3 133 ? -27.187 1.871   1.380   1.00 21.43  ? 132 VAL L O   1 
ATOM   3910 C  CB  . VAL C 3 133 ? -28.935 2.245   -1.149  1.00 21.57  ? 132 VAL L CB  1 
ATOM   3911 C  CG1 . VAL C 3 133 ? -30.415 2.338   -0.779  1.00 21.31  ? 132 VAL L CG1 1 
ATOM   3912 C  CG2 . VAL C 3 133 ? -28.735 2.413   -2.661  1.00 22.88  ? 132 VAL L CG2 1 
ATOM   3913 N  N   . VAL C 3 134 ? -28.539 3.529   2.043   1.00 21.02  ? 133 VAL L N   1 
ATOM   3914 C  CA  . VAL C 3 134 ? -28.247 3.290   3.476   1.00 20.43  ? 133 VAL L CA  1 
ATOM   3915 C  C   . VAL C 3 134 ? -29.519 2.781   4.145   1.00 21.46  ? 133 VAL L C   1 
ATOM   3916 O  O   . VAL C 3 134 ? -30.621 3.357   3.887   1.00 22.38  ? 133 VAL L O   1 
ATOM   3917 C  CB  . VAL C 3 134 ? -27.670 4.546   4.132   1.00 20.48  ? 133 VAL L CB  1 
ATOM   3918 C  CG1 . VAL C 3 134 ? -27.494 4.381   5.627   1.00 20.16  ? 133 VAL L CG1 1 
ATOM   3919 C  CG2 . VAL C 3 134 ? -26.339 4.886   3.497   1.00 21.04  ? 133 VAL L CG2 1 
ATOM   3920 N  N   . CYS C 3 135 ? -29.368 1.781   5.022   1.00 21.00  ? 134 CYS L N   1 
ATOM   3921 C  CA  . CYS C 3 135 ? -30.470 1.290   5.865   1.00 21.27  ? 134 CYS L CA  1 
ATOM   3922 C  C   . CYS C 3 135 ? -30.025 1.430   7.314   1.00 20.70  ? 134 CYS L C   1 
ATOM   3923 O  O   . CYS C 3 135 ? -28.864 1.085   7.557   1.00 20.71  ? 134 CYS L O   1 
ATOM   3924 C  CB  . CYS C 3 135 ? -30.751 -0.174  5.527   1.00 22.15  ? 134 CYS L CB  1 
ATOM   3925 S  SG  . CYS C 3 135 ? -32.179 -0.831  6.407   1.00 25.40  ? 134 CYS L SG  1 
ATOM   3926 N  N   . LEU C 3 136 ? -30.843 2.082   8.122   1.00 20.50  ? 135 LEU L N   1 
ATOM   3927 C  CA  . LEU C 3 136 ? -30.623 2.356   9.552   1.00 21.16  ? 135 LEU L CA  1 
ATOM   3928 C  C   . LEU C 3 136 ? -31.567 1.492   10.395  1.00 21.96  ? 135 LEU L C   1 
ATOM   3929 O  O   . LEU C 3 136 ? -32.788 1.556   10.144  1.00 23.64  ? 135 LEU L O   1 
ATOM   3930 C  CB  . LEU C 3 136 ? -30.864 3.854   9.791   1.00 21.53  ? 135 LEU L CB  1 
ATOM   3931 C  CG  . LEU C 3 136 ? -30.913 4.284   11.260  1.00 21.98  ? 135 LEU L CG  1 
ATOM   3932 C  CD1 . LEU C 3 136 ? -29.590 3.962   11.890  1.00 22.16  ? 135 LEU L CD1 1 
ATOM   3933 C  CD2 . LEU C 3 136 ? -31.279 5.748   11.403  1.00 22.06  ? 135 LEU L CD2 1 
ATOM   3934 N  N   . LEU C 3 137 ? -31.012 0.765   11.378  1.00 22.17  ? 136 LEU L N   1 
ATOM   3935 C  CA  . LEU C 3 137 ? -31.745 0.060   12.459  1.00 22.15  ? 136 LEU L CA  1 
ATOM   3936 C  C   . LEU C 3 137 ? -31.414 0.852   13.720  1.00 22.54  ? 136 LEU L C   1 
ATOM   3937 O  O   . LEU C 3 137 ? -30.220 0.915   14.078  1.00 21.66  ? 136 LEU L O   1 
ATOM   3938 C  CB  . LEU C 3 137 ? -31.235 -1.374  12.632  1.00 22.03  ? 136 LEU L CB  1 
ATOM   3939 C  CG  . LEU C 3 137 ? -31.705 -2.406  11.617  1.00 22.83  ? 136 LEU L CG  1 
ATOM   3940 C  CD1 . LEU C 3 137 ? -31.362 -1.991  10.192  1.00 22.21  ? 136 LEU L CD1 1 
ATOM   3941 C  CD2 . LEU C 3 137 ? -31.153 -3.781  11.956  1.00 22.98  ? 136 LEU L CD2 1 
ATOM   3942 N  N   . ASN C 3 138 ? -32.391 1.507   14.296  1.00 23.15  ? 137 ASN L N   1 
ATOM   3943 C  CA  . ASN C 3 138 ? -32.168 2.433   15.426  1.00 24.31  ? 137 ASN L CA  1 
ATOM   3944 C  C   . ASN C 3 138 ? -32.623 1.814   16.745  1.00 24.96  ? 137 ASN L C   1 
ATOM   3945 O  O   . ASN C 3 138 ? -33.796 1.314   16.852  1.00 25.73  ? 137 ASN L O   1 
ATOM   3946 C  CB  . ASN C 3 138 ? -32.851 3.757   15.146  1.00 25.83  ? 137 ASN L CB  1 
ATOM   3947 C  CG  . ASN C 3 138 ? -32.022 4.911   15.651  1.00 27.22  ? 137 ASN L CG  1 
ATOM   3948 O  OD1 . ASN C 3 138 ? -30.785 4.862   15.661  1.00 28.30  ? 137 ASN L OD1 1 
ATOM   3949 N  ND2 . ASN C 3 138 ? -32.696 5.959   16.051  1.00 28.99  ? 137 ASN L ND2 1 
ATOM   3950 N  N   . ASN C 3 139 ? -31.739 1.887   17.725  1.00 25.45  ? 138 ASN L N   1 
ATOM   3951 C  CA  . ASN C 3 139 ? -32.036 1.710   19.172  1.00 26.64  ? 138 ASN L CA  1 
ATOM   3952 C  C   . ASN C 3 139 ? -32.652 0.328   19.425  1.00 27.09  ? 138 ASN L C   1 
ATOM   3953 O  O   . ASN C 3 139 ? -33.823 0.258   19.819  1.00 26.77  ? 138 ASN L O   1 
ATOM   3954 C  CB  . ASN C 3 139 ? -32.897 2.878   19.662  1.00 28.52  ? 138 ASN L CB  1 
ATOM   3955 C  CG  . ASN C 3 139 ? -32.201 4.218   19.460  1.00 29.30  ? 138 ASN L CG  1 
ATOM   3956 O  OD1 . ASN C 3 139 ? -30.971 4.307   19.476  1.00 27.91  ? 138 ASN L OD1 1 
ATOM   3957 N  ND2 . ASN C 3 139 ? -32.977 5.253   19.190  1.00 31.44  ? 138 ASN L ND2 1 
ATOM   3958 N  N   . PHE C 3 140 ? -31.876 -0.741  19.271  1.00 26.05  ? 139 PHE L N   1 
ATOM   3959 C  CA  . PHE C 3 140 ? -32.420 -2.113  19.436  1.00 26.89  ? 139 PHE L CA  1 
ATOM   3960 C  C   . PHE C 3 140 ? -31.489 -2.938  20.318  1.00 26.94  ? 139 PHE L C   1 
ATOM   3961 O  O   . PHE C 3 140 ? -30.322 -2.540  20.574  1.00 25.81  ? 139 PHE L O   1 
ATOM   3962 C  CB  . PHE C 3 140 ? -32.638 -2.798  18.082  1.00 26.62  ? 139 PHE L CB  1 
ATOM   3963 C  CG  . PHE C 3 140 ? -31.409 -2.996  17.253  1.00 25.30  ? 139 PHE L CG  1 
ATOM   3964 C  CD1 . PHE C 3 140 ? -30.737 -4.204  17.262  1.00 26.31  ? 139 PHE L CD1 1 
ATOM   3965 C  CD2 . PHE C 3 140 ? -30.926 -1.976  16.457  1.00 24.89  ? 139 PHE L CD2 1 
ATOM   3966 C  CE1 . PHE C 3 140 ? -29.557 -4.369  16.540  1.00 26.30  ? 139 PHE L CE1 1 
ATOM   3967 C  CE2 . PHE C 3 140 ? -29.752 -2.144  15.741  1.00 23.75  ? 139 PHE L CE2 1 
ATOM   3968 C  CZ  . PHE C 3 140 ? -29.063 -3.328  15.784  1.00 24.54  ? 139 PHE L CZ  1 
ATOM   3969 N  N   . TYR C 3 141 ? -32.026 -4.064  20.770  1.00 26.91  ? 140 TYR L N   1 
ATOM   3970 C  CA  . TYR C 3 141 ? -31.346 -5.034  21.652  1.00 27.59  ? 140 TYR L CA  1 
ATOM   3971 C  C   . TYR C 3 141 ? -32.019 -6.389  21.474  1.00 28.50  ? 140 TYR L C   1 
ATOM   3972 O  O   . TYR C 3 141 ? -33.246 -6.447  21.477  1.00 28.73  ? 140 TYR L O   1 
ATOM   3973 C  CB  . TYR C 3 141 ? -31.391 -4.605  23.125  1.00 28.32  ? 140 TYR L CB  1 
ATOM   3974 C  CG  . TYR C 3 141 ? -30.427 -5.438  23.931  1.00 29.23  ? 140 TYR L CG  1 
ATOM   3975 C  CD1 . TYR C 3 141 ? -30.801 -6.672  24.421  1.00 30.34  ? 140 TYR L CD1 1 
ATOM   3976 C  CD2 . TYR C 3 141 ? -29.086 -5.067  24.075  1.00 28.74  ? 140 TYR L CD2 1 
ATOM   3977 C  CE1 . TYR C 3 141 ? -29.901 -7.505  25.060  1.00 30.39  ? 140 TYR L CE1 1 
ATOM   3978 C  CE2 . TYR C 3 141 ? -28.175 -5.880  24.736  1.00 28.74  ? 140 TYR L CE2 1 
ATOM   3979 C  CZ  . TYR C 3 141 ? -28.590 -7.108  25.239  1.00 30.01  ? 140 TYR L CZ  1 
ATOM   3980 O  OH  . TYR C 3 141 ? -27.731 -7.969  25.874  1.00 30.82  ? 140 TYR L OH  1 
ATOM   3981 N  N   . PRO C 3 142 ? -31.273 -7.508  21.335  1.00 29.64  ? 141 PRO L N   1 
ATOM   3982 C  CA  . PRO C 3 142 ? -29.813 -7.514  21.261  1.00 29.80  ? 141 PRO L CA  1 
ATOM   3983 C  C   . PRO C 3 142 ? -29.186 -7.118  19.916  1.00 31.21  ? 141 PRO L C   1 
ATOM   3984 O  O   . PRO C 3 142 ? -29.925 -6.786  18.986  1.00 29.09  ? 141 PRO L O   1 
ATOM   3985 C  CB  . PRO C 3 142 ? -29.490 -8.980  21.560  1.00 30.75  ? 141 PRO L CB  1 
ATOM   3986 C  CG  . PRO C 3 142 ? -30.634 -9.734  20.953  1.00 31.53  ? 141 PRO L CG  1 
ATOM   3987 C  CD  . PRO C 3 142 ? -31.836 -8.870  21.258  1.00 31.65  ? 141 PRO L CD  1 
ATOM   3988 N  N   . ARG C 3 143 ? -27.852 -7.210  19.842  1.00 31.88  ? 142 ARG L N   1 
ATOM   3989 C  CA  A ARG C 3 143 ? -27.025 -6.810  18.666  0.50 33.46  ? 142 ARG L CA  1 
ATOM   3990 C  CA  B ARG C 3 143 ? -27.018 -6.812  18.664  0.50 32.90  ? 142 ARG L CA  1 
ATOM   3991 C  C   . ARG C 3 143 ? -27.332 -7.662  17.427  1.00 33.33  ? 142 ARG L C   1 
ATOM   3992 O  O   . ARG C 3 143 ? -27.145 -7.169  16.296  1.00 33.25  ? 142 ARG L O   1 
ATOM   3993 C  CB  A ARG C 3 143 ? -25.543 -6.977  19.024  0.50 35.05  ? 142 ARG L CB  1 
ATOM   3994 C  CB  B ARG C 3 143 ? -25.530 -6.979  19.006  0.50 33.64  ? 142 ARG L CB  1 
ATOM   3995 C  CG  A ARG C 3 143 ? -24.684 -5.765  18.712  0.50 36.00  ? 142 ARG L CG  1 
ATOM   3996 C  CG  B ARG C 3 143 ? -24.548 -6.460  17.962  0.50 33.69  ? 142 ARG L CG  1 
ATOM   3997 C  CD  A ARG C 3 143 ? -23.263 -6.034  19.157  0.50 37.11  ? 142 ARG L CD  1 
ATOM   3998 C  CD  B ARG C 3 143 ? -23.164 -6.380  18.599  0.50 34.15  ? 142 ARG L CD  1 
ATOM   3999 N  NE  A ARG C 3 143 ? -23.137 -6.097  20.600  0.50 38.91  ? 142 ARG L NE  1 
ATOM   4000 N  NE  B ARG C 3 143 ? -22.108 -5.758  17.802  0.50 33.98  ? 142 ARG L NE  1 
ATOM   4001 C  CZ  A ARG C 3 143 ? -21.979 -6.189  21.233  0.50 39.19  ? 142 ARG L CZ  1 
ATOM   4002 C  CZ  B ARG C 3 143 ? -21.769 -6.127  16.575  0.50 32.97  ? 142 ARG L CZ  1 
ATOM   4003 N  NH1 A ARG C 3 143 ? -21.942 -6.225  22.550  0.50 41.33  ? 142 ARG L NH1 1 
ATOM   4004 N  NH1 B ARG C 3 143 ? -20.762 -5.534  15.972  0.50 32.47  ? 142 ARG L NH1 1 
ATOM   4005 N  NH2 A ARG C 3 143 ? -20.860 -6.263  20.544  0.50 39.01  ? 142 ARG L NH2 1 
ATOM   4006 N  NH2 B ARG C 3 143 ? -22.428 -7.086  15.956  0.50 34.30  ? 142 ARG L NH2 1 
ATOM   4007 N  N   . GLU C 3 144 ? -27.753 -8.912  17.614  1.00 34.89  ? 143 GLU L N   1 
ATOM   4008 C  CA  . GLU C 3 144 ? -27.927 -9.857  16.487  1.00 35.56  ? 143 GLU L CA  1 
ATOM   4009 C  C   . GLU C 3 144 ? -29.121 -9.381  15.649  1.00 33.88  ? 143 GLU L C   1 
ATOM   4010 O  O   . GLU C 3 144 ? -30.170 -9.135  16.220  1.00 33.06  ? 143 GLU L O   1 
ATOM   4011 C  CB  . GLU C 3 144 ? -28.093 -11.267 17.052  1.00 40.12  ? 143 GLU L CB  1 
ATOM   4012 C  CG  . GLU C 3 144 ? -26.777 -11.827 17.603  1.00 43.60  ? 143 GLU L CG  1 
ATOM   4013 C  CD  . GLU C 3 144 ? -26.189 -11.172 18.855  1.00 44.98  ? 143 GLU L CD  1 
ATOM   4014 O  OE1 . GLU C 3 144 ? -26.967 -10.745 19.771  1.00 41.44  ? 143 GLU L OE1 1 
ATOM   4015 O  OE2 . GLU C 3 144 ? -24.932 -11.044 18.899  1.00 50.50  ? 143 GLU L OE2 1 
ATOM   4016 N  N   . ALA C 3 145 ? -28.929 -9.220  14.342  1.00 32.62  ? 144 ALA L N   1 
ATOM   4017 C  CA  . ALA C 3 145 ? -29.954 -8.755  13.381  1.00 32.70  ? 144 ALA L CA  1 
ATOM   4018 C  C   . ALA C 3 145 ? -29.586 -9.236  11.970  1.00 32.76  ? 144 ALA L C   1 
ATOM   4019 O  O   . ALA C 3 145 ? -28.389 -9.416  11.665  1.00 33.47  ? 144 ALA L O   1 
ATOM   4020 C  CB  . ALA C 3 145 ? -30.079 -7.267  13.444  1.00 31.45  ? 144 ALA L CB  1 
ATOM   4021 N  N   . LYS C 3 146 ? -30.578 -9.528  11.150  1.00 34.69  ? 145 LYS L N   1 
ATOM   4022 C  CA  . LYS C 3 146 ? -30.335 -9.918  9.732   1.00 35.09  ? 145 LYS L CA  1 
ATOM   4023 C  C   . LYS C 3 146 ? -30.896 -8.772  8.878   1.00 32.69  ? 145 LYS L C   1 
ATOM   4024 O  O   . LYS C 3 146 ? -32.122 -8.496  8.973   1.00 32.20  ? 145 LYS L O   1 
ATOM   4025 C  CB  . LYS C 3 146 ? -30.911 -11.290 9.372   1.00 38.54  ? 145 LYS L CB  1 
ATOM   4026 C  CG  . LYS C 3 146 ? -30.494 -11.803 7.987   1.00 41.31  ? 145 LYS L CG  1 
ATOM   4027 C  CD  . LYS C 3 146 ? -31.048 -13.159 7.515   1.00 45.74  ? 145 LYS L CD  1 
ATOM   4028 C  CE  . LYS C 3 146 ? -32.517 -13.394 7.819   1.00 47.45  ? 145 LYS L CE  1 
ATOM   4029 N  NZ  . LYS C 3 146 ? -33.103 -14.487 7.006   1.00 49.22  ? 145 LYS L NZ  1 
ATOM   4030 N  N   . VAL C 3 147 ? -30.003 -8.102  8.145   1.00 29.52  ? 146 VAL L N   1 
ATOM   4031 C  CA  . VAL C 3 147 ? -30.316 -6.970  7.233   1.00 28.01  ? 146 VAL L CA  1 
ATOM   4032 C  C   . VAL C 3 147 ? -30.032 -7.466  5.824   1.00 25.81  ? 146 VAL L C   1 
ATOM   4033 O  O   . VAL C 3 147 ? -28.900 -7.831  5.546   1.00 25.13  ? 146 VAL L O   1 
ATOM   4034 C  CB  . VAL C 3 147 ? -29.507 -5.724  7.623   1.00 29.57  ? 146 VAL L CB  1 
ATOM   4035 C  CG1 . VAL C 3 147 ? -29.822 -4.549  6.743   1.00 30.08  ? 146 VAL L CG1 1 
ATOM   4036 C  CG2 . VAL C 3 147 ? -29.761 -5.406  9.086   1.00 30.94  ? 146 VAL L CG2 1 
ATOM   4037 N  N   . GLN C 3 148 ? -31.066 -7.577  5.011   1.00 24.29  ? 147 GLN L N   1 
ATOM   4038 C  CA  A GLN C 3 148 ? -30.934 -8.122  3.640   0.50 24.44  ? 147 GLN L CA  1 
ATOM   4039 C  CA  B GLN C 3 148 ? -30.993 -8.137  3.645   0.50 24.42  ? 147 GLN L CA  1 
ATOM   4040 C  C   . GLN C 3 148 ? -31.367 -7.028  2.664   1.00 23.68  ? 147 GLN L C   1 
ATOM   4041 O  O   . GLN C 3 148 ? -32.459 -6.421  2.871   1.00 25.14  ? 147 GLN L O   1 
ATOM   4042 C  CB  A GLN C 3 148 ? -31.728 -9.424  3.495   0.50 25.27  ? 147 GLN L CB  1 
ATOM   4043 C  CB  B GLN C 3 148 ? -31.971 -9.307  3.550   0.50 25.15  ? 147 GLN L CB  1 
ATOM   4044 C  CG  A GLN C 3 148 ? -31.105 -10.605 4.242   0.50 25.83  ? 147 GLN L CG  1 
ATOM   4045 C  CG  B GLN C 3 148 ? -32.065 -9.915  2.166   0.50 25.64  ? 147 GLN L CG  1 
ATOM   4046 C  CD  A GLN C 3 148 ? -31.667 -11.950 3.830   0.50 26.99  ? 147 GLN L CD  1 
ATOM   4047 C  CD  B GLN C 3 148 ? -30.744 -10.513 1.742   0.50 25.56  ? 147 GLN L CD  1 
ATOM   4048 O  OE1 A GLN C 3 148 ? -30.939 -12.909 3.593   0.50 27.86  ? 147 GLN L OE1 1 
ATOM   4049 O  OE1 B GLN C 3 148 ? -30.317 -11.538 2.278   0.50 26.96  ? 147 GLN L OE1 1 
ATOM   4050 N  NE2 A GLN C 3 148 ? -32.976 -12.047 3.744   0.50 27.60  ? 147 GLN L NE2 1 
ATOM   4051 N  NE2 B GLN C 3 148 ? -30.085 -9.888  0.770   0.50 24.98  ? 147 GLN L NE2 1 
ATOM   4052 N  N   . TRP C 3 149 ? -30.540 -6.800  1.661   1.00 22.81  ? 148 TRP L N   1 
ATOM   4053 C  CA  . TRP C 3 149 ? -30.863 -5.885  0.536   1.00 21.89  ? 148 TRP L CA  1 
ATOM   4054 C  C   . TRP C 3 149 ? -31.562 -6.676  -0.577  1.00 23.14  ? 148 TRP L C   1 
ATOM   4055 O  O   . TRP C 3 149 ? -31.034 -7.738  -0.931  1.00 22.52  ? 148 TRP L O   1 
ATOM   4056 C  CB  . TRP C 3 149 ? -29.595 -5.211  0.037   1.00 21.38  ? 148 TRP L CB  1 
ATOM   4057 C  CG  . TRP C 3 149 ? -29.086 -4.129  0.953   1.00 21.18  ? 148 TRP L CG  1 
ATOM   4058 C  CD1 . TRP C 3 149 ? -28.089 -4.226  1.877   1.00 21.61  ? 148 TRP L CD1 1 
ATOM   4059 C  CD2 . TRP C 3 149 ? -29.623 -2.805  1.086   1.00 21.11  ? 148 TRP L CD2 1 
ATOM   4060 N  NE1 . TRP C 3 149 ? -27.889 -3.014  2.499   1.00 21.46  ? 148 TRP L NE1 1 
ATOM   4061 C  CE2 . TRP C 3 149 ? -28.861 -2.140  2.077   1.00 20.97  ? 148 TRP L CE2 1 
ATOM   4062 C  CE3 . TRP C 3 149 ? -30.692 -2.117  0.489   1.00 21.30  ? 148 TRP L CE3 1 
ATOM   4063 C  CZ2 . TRP C 3 149 ? -29.118 -0.814  2.425   1.00 20.56  ? 148 TRP L CZ2 1 
ATOM   4064 C  CZ3 . TRP C 3 149 ? -30.927 -0.808  0.818   1.00 20.95  ? 148 TRP L CZ3 1 
ATOM   4065 C  CH2 . TRP C 3 149 ? -30.154 -0.166  1.795   1.00 20.79  ? 148 TRP L CH2 1 
ATOM   4066 N  N   . LYS C 3 150 ? -32.685 -6.156  -1.072  1.00 23.63  ? 149 LYS L N   1 
ATOM   4067 C  CA  . LYS C 3 150 ? -33.356 -6.616  -2.316  1.00 26.12  ? 149 LYS L CA  1 
ATOM   4068 C  C   . LYS C 3 150 ? -33.421 -5.462  -3.316  1.00 25.27  ? 149 LYS L C   1 
ATOM   4069 O  O   . LYS C 3 150 ? -33.803 -4.366  -2.899  1.00 24.81  ? 149 LYS L O   1 
ATOM   4070 C  CB  . LYS C 3 150 ? -34.740 -7.164  -1.975  1.00 29.18  ? 149 LYS L CB  1 
ATOM   4071 C  CG  . LYS C 3 150 ? -34.709 -8.342  -1.020  1.00 32.28  ? 149 LYS L CG  1 
ATOM   4072 C  CD  . LYS C 3 150 ? -36.056 -9.030  -0.842  1.00 35.98  ? 149 LYS L CD  1 
ATOM   4073 C  CE  . LYS C 3 150 ? -36.037 -9.954  0.369   1.00 41.05  ? 149 LYS L CE  1 
ATOM   4074 N  NZ  . LYS C 3 150 ? -37.199 -9.719  1.272   1.00 44.24  ? 149 LYS L NZ  1 
ATOM   4075 N  N   . VAL C 3 151 ? -33.135 -5.753  -4.591  1.00 24.94  ? 150 VAL L N   1 
ATOM   4076 C  CA  . VAL C 3 151 ? -33.118 -4.796  -5.728  1.00 24.86  ? 150 VAL L CA  1 
ATOM   4077 C  C   . VAL C 3 151 ? -33.994 -5.459  -6.801  1.00 25.55  ? 150 VAL L C   1 
ATOM   4078 O  O   . VAL C 3 151 ? -33.655 -6.570  -7.205  1.00 25.88  ? 150 VAL L O   1 
ATOM   4079 C  CB  . VAL C 3 151 ? -31.671 -4.531  -6.215  1.00 24.46  ? 150 VAL L CB  1 
ATOM   4080 C  CG1 . VAL C 3 151 ? -31.643 -3.671  -7.468  1.00 24.79  ? 150 VAL L CG1 1 
ATOM   4081 C  CG2 . VAL C 3 151 ? -30.784 -3.931  -5.125  1.00 24.15  ? 150 VAL L CG2 1 
ATOM   4082 N  N   . ASP C 3 152 ? -35.180 -4.909  -7.049  1.00 26.83  ? 151 ASP L N   1 
ATOM   4083 C  CA  . ASP C 3 152 ? -36.266 -5.535  -7.863  1.00 27.08  ? 151 ASP L CA  1 
ATOM   4084 C  C   . ASP C 3 152 ? -36.523 -6.962  -7.351  1.00 27.16  ? 151 ASP L C   1 
ATOM   4085 O  O   . ASP C 3 152 ? -36.610 -7.886  -8.169  1.00 26.25  ? 151 ASP L O   1 
ATOM   4086 C  CB  . ASP C 3 152 ? -35.894 -5.453  -9.344  1.00 27.92  ? 151 ASP L CB  1 
ATOM   4087 C  CG  . ASP C 3 152 ? -36.009 -4.039  -9.892  1.00 29.79  ? 151 ASP L CG  1 
ATOM   4088 O  OD1 . ASP C 3 152 ? -36.854 -3.275  -9.358  1.00 31.46  ? 151 ASP L OD1 1 
ATOM   4089 O  OD2 . ASP C 3 152 ? -35.316 -3.736  -10.894 1.00 31.91  ? 151 ASP L OD2 1 
ATOM   4090 N  N   . ASN C 3 153 ? -36.590 -7.110  -6.020  1.00 25.50  ? 152 ASN L N   1 
ATOM   4091 C  CA  . ASN C 3 153 ? -36.871 -8.353  -5.277  1.00 25.67  ? 152 ASN L CA  1 
ATOM   4092 C  C   . ASN C 3 153 ? -35.726 -9.389  -5.389  1.00 25.98  ? 152 ASN L C   1 
ATOM   4093 O  O   . ASN C 3 153 ? -35.960 -10.473 -4.902  1.00 26.86  ? 152 ASN L O   1 
ATOM   4094 C  CB  . ASN C 3 153 ? -38.219 -8.953  -5.697  1.00 27.14  ? 152 ASN L CB  1 
ATOM   4095 C  CG  . ASN C 3 153 ? -38.817 -9.784  -4.598  1.00 27.23  ? 152 ASN L CG  1 
ATOM   4096 O  OD1 . ASN C 3 153 ? -38.640 -9.483  -3.421  1.00 28.46  ? 152 ASN L OD1 1 
ATOM   4097 N  ND2 . ASN C 3 153 ? -39.440 -10.867 -4.977  1.00 28.48  ? 152 ASN L ND2 1 
ATOM   4098 N  N   . ALA C 3 154 ? -34.527 -9.058  -5.898  1.00 24.75  ? 153 ALA L N   1 
ATOM   4099 C  CA  . ALA C 3 154 ? -33.351 -9.972  -5.938  1.00 24.92  ? 153 ALA L CA  1 
ATOM   4100 C  C   . ALA C 3 154 ? -32.500 -9.782  -4.685  1.00 24.53  ? 153 ALA L C   1 
ATOM   4101 O  O   . ALA C 3 154 ? -32.084 -8.654  -4.430  1.00 23.05  ? 153 ALA L O   1 
ATOM   4102 C  CB  . ALA C 3 154 ? -32.531 -9.763  -7.188  1.00 26.00  ? 153 ALA L CB  1 
ATOM   4103 N  N   . LEU C 3 155 ? -32.350 -10.834 -3.896  1.00 24.70  ? 154 LEU L N   1 
ATOM   4104 C  CA  A LEU C 3 155 ? -31.494 -10.867 -2.704  0.60 24.85  ? 154 LEU L CA  1 
ATOM   4105 C  CA  B LEU C 3 155 ? -31.514 -10.768 -2.673  0.40 24.31  ? 154 LEU L CA  1 
ATOM   4106 C  C   . LEU C 3 155 ? -30.056 -10.516 -3.091  1.00 23.99  ? 154 LEU L C   1 
ATOM   4107 O  O   . LEU C 3 155 ? -29.498 -11.277 -3.878  1.00 24.80  ? 154 LEU L O   1 
ATOM   4108 C  CB  A LEU C 3 155 ? -31.528 -12.282 -2.142  0.60 26.15  ? 154 LEU L CB  1 
ATOM   4109 C  CB  B LEU C 3 155 ? -31.675 -12.021 -1.809  0.40 24.69  ? 154 LEU L CB  1 
ATOM   4110 C  CG  A LEU C 3 155 ? -30.783 -12.386 -0.832  0.60 26.45  ? 154 LEU L CG  1 
ATOM   4111 C  CG  B LEU C 3 155 ? -32.866 -12.004 -0.850  0.40 24.93  ? 154 LEU L CG  1 
ATOM   4112 C  CD1 A LEU C 3 155 ? -31.454 -11.399 0.068   0.60 26.67  ? 154 LEU L CD1 1 
ATOM   4113 C  CD1 B LEU C 3 155 ? -34.179 -11.933 -1.608  0.40 25.24  ? 154 LEU L CD1 1 
ATOM   4114 C  CD2 A LEU C 3 155 ? -30.813 -13.768 -0.211  0.60 27.19  ? 154 LEU L CD2 1 
ATOM   4115 C  CD2 B LEU C 3 155 ? -32.861 -13.212 0.076   0.40 25.47  ? 154 LEU L CD2 1 
ATOM   4116 N  N   . GLN C 3 156 ? -29.494 -9.432  -2.570  1.00 23.13  ? 155 GLN L N   1 
ATOM   4117 C  CA  . GLN C 3 156 ? -28.090 -9.032  -2.892  1.00 24.13  ? 155 GLN L CA  1 
ATOM   4118 C  C   . GLN C 3 156 ? -27.081 -9.798  -2.020  1.00 24.32  ? 155 GLN L C   1 
ATOM   4119 O  O   . GLN C 3 156 ? -27.396 -10.175 -0.880  1.00 24.27  ? 155 GLN L O   1 
ATOM   4120 C  CB  . GLN C 3 156 ? -27.957 -7.509  -2.751  1.00 24.15  ? 155 GLN L CB  1 
ATOM   4121 C  CG  . GLN C 3 156 ? -28.930 -6.718  -3.631  1.00 24.97  ? 155 GLN L CG  1 
ATOM   4122 C  CD  . GLN C 3 156 ? -28.630 -6.901  -5.101  1.00 27.16  ? 155 GLN L CD  1 
ATOM   4123 O  OE1 . GLN C 3 156 ? -27.579 -6.462  -5.583  1.00 28.85  ? 155 GLN L OE1 1 
ATOM   4124 N  NE2 . GLN C 3 156 ? -29.497 -7.622  -5.812  1.00 26.12  ? 155 GLN L NE2 1 
ATOM   4125 N  N   . SER C 3 157 ? -25.843 -9.969  -2.493  1.00 25.65  ? 156 SER L N   1 
ATOM   4126 C  CA  . SER C 3 157 ? -24.711 -10.404 -1.639  1.00 27.64  ? 156 SER L CA  1 
ATOM   4127 C  C   . SER C 3 157 ? -23.410 -9.821  -2.201  1.00 27.34  ? 156 SER L C   1 
ATOM   4128 O  O   . SER C 3 157 ? -23.285 -9.651  -3.447  1.00 26.95  ? 156 SER L O   1 
ATOM   4129 C  CB  . SER C 3 157 ? -24.587 -11.920 -1.433  1.00 29.46  ? 156 SER L CB  1 
ATOM   4130 O  OG  . SER C 3 157 ? -24.242 -12.557 -2.631  1.00 30.03  ? 156 SER L OG  1 
ATOM   4131 N  N   . GLY C 3 158 ? -22.527 -9.511  -1.271  1.00 27.37  ? 157 GLY L N   1 
ATOM   4132 C  CA  . GLY C 3 158 ? -21.123 -9.140  -1.527  1.00 28.04  ? 157 GLY L CA  1 
ATOM   4133 C  C   . GLY C 3 158 ? -20.967 -7.650  -1.771  1.00 27.81  ? 157 GLY L C   1 
ATOM   4134 O  O   . GLY C 3 158 ? -19.811 -7.225  -1.978  1.00 29.08  ? 157 GLY L O   1 
ATOM   4135 N  N   . ASN C 3 159 ? -22.061 -6.875  -1.739  1.00 25.82  ? 158 ASN L N   1 
ATOM   4136 C  CA  . ASN C 3 159 ? -22.026 -5.451  -2.166  1.00 24.37  ? 158 ASN L CA  1 
ATOM   4137 C  C   . ASN C 3 159 ? -22.521 -4.544  -1.047  1.00 23.26  ? 158 ASN L C   1 
ATOM   4138 O  O   . ASN C 3 159 ? -22.895 -3.393  -1.354  1.00 23.58  ? 158 ASN L O   1 
ATOM   4139 C  CB  . ASN C 3 159 ? -22.744 -5.230  -3.489  1.00 23.68  ? 158 ASN L CB  1 
ATOM   4140 C  CG  . ASN C 3 159 ? -24.188 -5.691  -3.494  1.00 23.48  ? 158 ASN L CG  1 
ATOM   4141 O  OD1 . ASN C 3 159 ? -24.690 -6.200  -2.488  1.00 22.36  ? 158 ASN L OD1 1 
ATOM   4142 N  ND2 . ASN C 3 159 ? -24.819 -5.612  -4.658  1.00 23.94  ? 158 ASN L ND2 1 
ATOM   4143 N  N   . SER C 3 160 ? -22.429 -4.990  0.204   1.00 23.09  ? 159 SER L N   1 
ATOM   4144 C  CA  . SER C 3 160 ? -22.885 -4.198  1.369   1.00 22.68  ? 159 SER L CA  1 
ATOM   4145 C  C   . SER C 3 160 ? -21.937 -4.391  2.550   1.00 22.54  ? 159 SER L C   1 
ATOM   4146 O  O   . SER C 3 160 ? -21.230 -5.435  2.625   1.00 22.62  ? 159 SER L O   1 
ATOM   4147 C  CB  . SER C 3 160 ? -24.332 -4.502  1.742   1.00 23.25  ? 159 SER L CB  1 
ATOM   4148 O  OG  . SER C 3 160 ? -24.519 -5.860  2.109   1.00 22.81  ? 159 SER L OG  1 
ATOM   4149 N  N   . GLN C 3 161 ? -21.841 -3.360  3.388   1.00 21.74  ? 160 GLN L N   1 
ATOM   4150 C  CA  . GLN C 3 161 ? -21.056 -3.392  4.648   1.00 21.99  ? 160 GLN L CA  1 
ATOM   4151 C  C   . GLN C 3 161 ? -21.931 -2.840  5.763   1.00 20.58  ? 160 GLN L C   1 
ATOM   4152 O  O   . GLN C 3 161 ? -22.687 -1.923  5.511   1.00 18.49  ? 160 GLN L O   1 
ATOM   4153 C  CB  . GLN C 3 161 ? -19.774 -2.546  4.543   1.00 22.79  ? 160 GLN L CB  1 
ATOM   4154 C  CG  . GLN C 3 161 ? -18.842 -3.024  3.461   1.00 25.06  ? 160 GLN L CG  1 
ATOM   4155 C  CD  . GLN C 3 161 ? -17.499 -2.328  3.551   1.00 26.89  ? 160 GLN L CD  1 
ATOM   4156 O  OE1 . GLN C 3 161 ? -17.302 -1.255  2.985   1.00 29.47  ? 160 GLN L OE1 1 
ATOM   4157 N  NE2 . GLN C 3 161 ? -16.555 -2.956  4.229   1.00 26.60  ? 160 GLN L NE2 1 
ATOM   4158 N  N   . GLU C 3 162 ? -21.706 -3.299  6.981   1.00 21.20  ? 161 GLU L N   1 
ATOM   4159 C  CA  . GLU C 3 162 ? -22.512 -2.938  8.163   1.00 21.64  ? 161 GLU L CA  1 
ATOM   4160 C  C   . GLU C 3 162 ? -21.587 -2.309  9.204   1.00 21.49  ? 161 GLU L C   1 
ATOM   4161 O  O   . GLU C 3 162 ? -20.395 -2.630  9.207   1.00 20.10  ? 161 GLU L O   1 
ATOM   4162 C  CB  . GLU C 3 162 ? -23.124 -4.189  8.821   1.00 23.28  ? 161 GLU L CB  1 
ATOM   4163 C  CG  . GLU C 3 162 ? -24.166 -4.932  8.010   1.00 25.41  ? 161 GLU L CG  1 
ATOM   4164 C  CD  . GLU C 3 162 ? -24.917 -5.942  8.848   1.00 25.41  ? 161 GLU L CD  1 
ATOM   4165 O  OE1 . GLU C 3 162 ? -24.370 -6.296  9.942   1.00 25.73  ? 161 GLU L OE1 1 
ATOM   4166 O  OE2 . GLU C 3 162 ? -26.020 -6.428  8.397   1.00 27.86  ? 161 GLU L OE2 1 
ATOM   4167 N  N   . SER C 3 163 ? -22.099 -1.381  9.987   1.00 20.75  ? 162 SER L N   1 
ATOM   4168 C  CA  . SER C 3 163 ? -21.407 -0.823  11.183  1.00 21.34  ? 162 SER L CA  1 
ATOM   4169 C  C   . SER C 3 163 ? -22.385 -0.826  12.345  1.00 20.73  ? 162 SER L C   1 
ATOM   4170 O  O   . SER C 3 163 ? -23.579 -0.550  12.142  1.00 18.77  ? 162 SER L O   1 
ATOM   4171 C  CB  . SER C 3 163 ? -20.909 0.569   10.841  1.00 22.13  ? 162 SER L CB  1 
ATOM   4172 O  OG  . SER C 3 163 ? -20.254 1.168   11.905  1.00 23.51  ? 162 SER L OG  1 
ATOM   4173 N  N   . VAL C 3 164 ? -21.886 -1.034  13.570  1.00 21.47  ? 163 VAL L N   1 
ATOM   4174 C  CA  . VAL C 3 164 ? -22.762 -1.047  14.756  1.00 22.76  ? 163 VAL L CA  1 
ATOM   4175 C  C   . VAL C 3 164 ? -22.176 -0.083  15.785  1.00 22.30  ? 163 VAL L C   1 
ATOM   4176 O  O   . VAL C 3 164 ? -20.949 -0.043  15.929  1.00 22.26  ? 163 VAL L O   1 
ATOM   4177 C  CB  . VAL C 3 164 ? -22.888 -2.466  15.335  1.00 24.41  ? 163 VAL L CB  1 
ATOM   4178 C  CG1 . VAL C 3 164 ? -23.885 -2.494  16.492  1.00 25.53  ? 163 VAL L CG1 1 
ATOM   4179 C  CG2 . VAL C 3 164 ? -23.297 -3.458  14.260  1.00 24.79  ? 163 VAL L CG2 1 
ATOM   4180 N  N   . THR C 3 165 ? -23.010 0.725   16.394  1.00 22.38  ? 164 THR L N   1 
ATOM   4181 C  CA  . THR C 3 165 ? -22.561 1.685   17.413  1.00 23.33  ? 164 THR L CA  1 
ATOM   4182 C  C   . THR C 3 165 ? -22.198 0.915   18.671  1.00 25.52  ? 164 THR L C   1 
ATOM   4183 O  O   . THR C 3 165 ? -22.556 -0.282  18.801  1.00 23.98  ? 164 THR L O   1 
ATOM   4184 C  CB  . THR C 3 165 ? -23.614 2.741   17.731  1.00 23.53  ? 164 THR L CB  1 
ATOM   4185 O  OG1 . THR C 3 165 ? -24.810 2.086   18.172  1.00 24.24  ? 164 THR L OG1 1 
ATOM   4186 C  CG2 . THR C 3 165 ? -23.921 3.637   16.552  1.00 24.96  ? 164 THR L CG2 1 
ATOM   4187 N  N   . GLU C 3 166 ? -21.422 1.587   19.524  1.00 27.66  ? 165 GLU L N   1 
ATOM   4188 C  CA  . GLU C 3 166 ? -21.178 1.109   20.900  1.00 30.85  ? 165 GLU L CA  1 
ATOM   4189 C  C   . GLU C 3 166 ? -22.507 1.253   21.633  1.00 29.57  ? 165 GLU L C   1 
ATOM   4190 O  O   . GLU C 3 166 ? -23.358 2.100   21.257  1.00 27.92  ? 165 GLU L O   1 
ATOM   4191 C  CB  . GLU C 3 166 ? -19.986 1.822   21.552  1.00 36.95  ? 165 GLU L CB  1 
ATOM   4192 C  CG  . GLU C 3 166 ? -18.634 1.308   21.049  1.00 43.22  ? 165 GLU L CG  1 
ATOM   4193 C  CD  . GLU C 3 166 ? -17.946 0.126   21.758  1.00 52.75  ? 165 GLU L CD  1 
ATOM   4194 O  OE1 . GLU C 3 166 ? -18.076 -0.060  23.036  1.00 53.42  ? 165 GLU L OE1 1 
ATOM   4195 O  OE2 . GLU C 3 166 ? -17.215 -0.610  21.038  1.00 60.12  ? 165 GLU L OE2 1 
ATOM   4196 N  N   . GLN C 3 167 ? -22.661 0.415   22.642  1.00 30.33  ? 166 GLN L N   1 
ATOM   4197 C  CA  . GLN C 3 167 ? -23.874 0.336   23.480  1.00 30.08  ? 166 GLN L CA  1 
ATOM   4198 C  C   . GLN C 3 167 ? -24.157 1.704   24.048  1.00 27.99  ? 166 GLN L C   1 
ATOM   4199 O  O   . GLN C 3 167 ? -23.213 2.343   24.577  1.00 26.95  ? 166 GLN L O   1 
ATOM   4200 C  CB  . GLN C 3 167 ? -23.660 -0.689  24.598  1.00 31.77  ? 166 GLN L CB  1 
ATOM   4201 C  CG  . GLN C 3 167 ? -24.943 -1.135  25.258  1.00 33.15  ? 166 GLN L CG  1 
ATOM   4202 C  CD  . GLN C 3 167 ? -24.779 -2.481  25.941  1.00 34.71  ? 166 GLN L CD  1 
ATOM   4203 O  OE1 . GLN C 3 167 ? -23.692 -2.845  26.409  1.00 32.00  ? 166 GLN L OE1 1 
ATOM   4204 N  NE2 . GLN C 3 167 ? -25.868 -3.235  25.978  1.00 31.49  ? 166 GLN L NE2 1 
ATOM   4205 N  N   . ASP C 3 168 ? -25.414 2.105   24.020  1.00 26.16  ? 167 ASP L N   1 
ATOM   4206 C  CA  . ASP C 3 168 ? -25.869 3.383   24.582  1.00 27.21  ? 167 ASP L CA  1 
ATOM   4207 C  C   . ASP C 3 168 ? -25.722 3.337   26.109  1.00 28.53  ? 167 ASP L C   1 
ATOM   4208 O  O   . ASP C 3 168 ? -26.209 2.382   26.730  1.00 27.28  ? 167 ASP L O   1 
ATOM   4209 C  CB  . ASP C 3 168 ? -27.337 3.647   24.268  1.00 29.36  ? 167 ASP L CB  1 
ATOM   4210 C  CG  . ASP C 3 168 ? -27.766 5.047   24.652  1.00 31.27  ? 167 ASP L CG  1 
ATOM   4211 O  OD1 . ASP C 3 168 ? -27.526 5.937   23.813  1.00 32.07  ? 167 ASP L OD1 1 
ATOM   4212 O  OD2 . ASP C 3 168 ? -28.302 5.234   25.782  1.00 32.54  ? 167 ASP L OD2 1 
ATOM   4213 N  N   . SER C 3 169 ? -25.168 4.383   26.712  1.00 28.59  ? 168 SER L N   1 
ATOM   4214 C  CA  . SER C 3 169 ? -24.855 4.413   28.156  1.00 29.69  ? 168 SER L CA  1 
ATOM   4215 C  C   . SER C 3 169 ? -26.116 4.561   28.991  1.00 31.39  ? 168 SER L C   1 
ATOM   4216 O  O   . SER C 3 169 ? -25.997 4.309   30.225  1.00 31.74  ? 168 SER L O   1 
ATOM   4217 C  CB  . SER C 3 169 ? -23.892 5.539   28.483  1.00 31.10  ? 168 SER L CB  1 
ATOM   4218 O  OG  . SER C 3 169 ? -24.523 6.789   28.211  1.00 31.98  ? 168 SER L OG  1 
ATOM   4219 N  N   . LYS C 3 170 ? -27.224 5.019   28.392  1.00 32.81  ? 169 LYS L N   1 
ATOM   4220 C  CA  . LYS C 3 170 ? -28.529 5.210   29.078  1.00 36.75  ? 169 LYS L CA  1 
ATOM   4221 C  C   . LYS C 3 170 ? -29.477 4.006   28.888  1.00 36.22  ? 169 LYS L C   1 
ATOM   4222 O  O   . LYS C 3 170 ? -30.061 3.565   29.915  1.00 35.84  ? 169 LYS L O   1 
ATOM   4223 C  CB  . LYS C 3 170 ? -29.217 6.487   28.585  1.00 41.13  ? 169 LYS L CB  1 
ATOM   4224 C  CG  . LYS C 3 170 ? -30.535 6.810   29.286  1.00 47.32  ? 169 LYS L CG  1 
ATOM   4225 C  CD  . LYS C 3 170 ? -31.389 7.888   28.605  1.00 52.62  ? 169 LYS L CD  1 
ATOM   4226 C  CE  . LYS C 3 170 ? -31.954 7.501   27.243  1.00 54.69  ? 169 LYS L CE  1 
ATOM   4227 N  NZ  . LYS C 3 170 ? -33.336 6.955   27.341  1.00 58.54  ? 169 LYS L NZ  1 
ATOM   4228 N  N   . ASP C 3 171 ? -29.728 3.544   27.654  1.00 35.61  ? 170 ASP L N   1 
ATOM   4229 C  CA  . ASP C 3 171 ? -30.817 2.549   27.387  1.00 35.86  ? 170 ASP L CA  1 
ATOM   4230 C  C   . ASP C 3 171 ? -30.224 1.185   26.999  1.00 32.59  ? 170 ASP L C   1 
ATOM   4231 O  O   . ASP C 3 171 ? -31.020 0.243   26.830  1.00 32.50  ? 170 ASP L O   1 
ATOM   4232 C  CB  . ASP C 3 171 ? -31.856 3.055   26.365  1.00 37.47  ? 170 ASP L CB  1 
ATOM   4233 C  CG  . ASP C 3 171 ? -31.364 3.259   24.939  1.00 38.45  ? 170 ASP L CG  1 
ATOM   4234 O  OD1 . ASP C 3 171 ? -30.276 2.733   24.575  1.00 38.34  ? 170 ASP L OD1 1 
ATOM   4235 O  OD2 . ASP C 3 171 ? -32.097 3.926   24.170  1.00 43.05  ? 170 ASP L OD2 1 
ATOM   4236 N  N   . SER C 3 172 ? -28.904 1.077   26.852  1.00 28.40  ? 171 SER L N   1 
ATOM   4237 C  CA  . SER C 3 172 ? -28.180 -0.208  26.670  1.00 27.49  ? 171 SER L CA  1 
ATOM   4238 C  C   . SER C 3 172 ? -28.479 -0.795  25.281  1.00 27.09  ? 171 SER L C   1 
ATOM   4239 O  O   . SER C 3 172 ? -28.167 -1.951  25.056  1.00 26.81  ? 171 SER L O   1 
ATOM   4240 C  CB  . SER C 3 172 ? -28.531 -1.161  27.800  1.00 28.28  ? 171 SER L CB  1 
ATOM   4241 O  OG  . SER C 3 172 ? -28.313 -0.525  29.065  1.00 28.24  ? 171 SER L OG  1 
ATOM   4242 N  N   . THR C 3 173 ? -29.015 0.003   24.362  1.00 26.08  ? 172 THR L N   1 
ATOM   4243 C  CA  . THR C 3 173 ? -29.318 -0.457  22.980  1.00 25.97  ? 172 THR L CA  1 
ATOM   4244 C  C   . THR C 3 173 ? -28.141 -0.185  22.046  1.00 24.94  ? 172 THR L C   1 
ATOM   4245 O  O   . THR C 3 173 ? -27.218 0.600   22.397  1.00 23.90  ? 172 THR L O   1 
ATOM   4246 C  CB  . THR C 3 173 ? -30.583 0.209   22.431  1.00 26.68  ? 172 THR L CB  1 
ATOM   4247 O  OG1 . THR C 3 173 ? -30.344 1.593   22.197  1.00 27.53  ? 172 THR L OG1 1 
ATOM   4248 C  CG2 . THR C 3 173 ? -31.798 0.056   23.328  1.00 27.95  ? 172 THR L CG2 1 
ATOM   4249 N  N   . TYR C 3 174 ? -28.252 -0.750  20.852  1.00 25.46  ? 173 TYR L N   1 
ATOM   4250 C  CA  . TYR C 3 174 ? -27.314 -0.593  19.726  1.00 24.09  ? 173 TYR L CA  1 
ATOM   4251 C  C   . TYR C 3 174 ? -28.057 0.077   18.566  1.00 23.00  ? 173 TYR L C   1 
ATOM   4252 O  O   . TYR C 3 174 ? -29.336 0.020   18.483  1.00 22.89  ? 173 TYR L O   1 
ATOM   4253 C  CB  . TYR C 3 174 ? -26.786 -1.967  19.330  1.00 26.43  ? 173 TYR L CB  1 
ATOM   4254 C  CG  . TYR C 3 174 ? -26.002 -2.649  20.420  1.00 29.83  ? 173 TYR L CG  1 
ATOM   4255 C  CD1 . TYR C 3 174 ? -26.614 -3.521  21.310  1.00 33.04  ? 173 TYR L CD1 1 
ATOM   4256 C  CD2 . TYR C 3 174 ? -24.643 -2.408  20.576  1.00 31.79  ? 173 TYR L CD2 1 
ATOM   4257 C  CE1 . TYR C 3 174 ? -25.890 -4.118  22.339  1.00 35.02  ? 173 TYR L CE1 1 
ATOM   4258 C  CE2 . TYR C 3 174 ? -23.907 -3.003  21.595  1.00 33.49  ? 173 TYR L CE2 1 
ATOM   4259 C  CZ  . TYR C 3 174 ? -24.533 -3.862  22.483  1.00 36.39  ? 173 TYR L CZ  1 
ATOM   4260 O  OH  . TYR C 3 174 ? -23.807 -4.459  23.480  1.00 38.28  ? 173 TYR L OH  1 
ATOM   4261 N  N   . SER C 3 175 ? -27.304 0.686   17.666  1.00 20.66  ? 174 SER L N   1 
ATOM   4262 C  CA  . SER C 3 175 ? -27.832 1.076   16.334  1.00 20.68  ? 174 SER L CA  1 
ATOM   4263 C  C   . SER C 3 175 ? -26.964 0.459   15.243  1.00 20.19  ? 174 SER L C   1 
ATOM   4264 O  O   . SER C 3 175 ? -25.747 0.172   15.503  1.00 20.53  ? 174 SER L O   1 
ATOM   4265 C  CB  . SER C 3 175 ? -28.000 2.582   16.246  1.00 20.91  ? 174 SER L CB  1 
ATOM   4266 O  OG  . SER C 3 175 ? -29.126 3.027   16.999  1.00 21.11  ? 174 SER L OG  1 
ATOM   4267 N  N   . LEU C 3 176 ? -27.492 0.289   14.028  1.00 20.26  ? 175 LEU L N   1 
ATOM   4268 C  CA  . LEU C 3 176 ? -26.731 -0.406  12.968  1.00 20.07  ? 175 LEU L CA  1 
ATOM   4269 C  C   . LEU C 3 176 ? -27.030 0.298   11.628  1.00 20.71  ? 175 LEU L C   1 
ATOM   4270 O  O   . LEU C 3 176 ? -28.191 0.701   11.403  1.00 21.04  ? 175 LEU L O   1 
ATOM   4271 C  CB  . LEU C 3 176 ? -27.124 -1.888  12.933  1.00 20.85  ? 175 LEU L CB  1 
ATOM   4272 C  CG  . LEU C 3 176 ? -26.501 -2.763  11.845  1.00 20.96  ? 175 LEU L CG  1 
ATOM   4273 C  CD1 . LEU C 3 176 ? -26.541 -4.219  12.267  1.00 22.10  ? 175 LEU L CD1 1 
ATOM   4274 C  CD2 . LEU C 3 176 ? -27.138 -2.613  10.488  1.00 21.11  ? 175 LEU L CD2 1 
ATOM   4275 N  N   . SER C 3 177 ? -25.989 0.471   10.828  1.00 20.06  ? 176 SER L N   1 
ATOM   4276 C  CA  A SER C 3 177 ? -26.024 0.981   9.436   0.50 21.72  ? 176 SER L CA  1 
ATOM   4277 C  CA  B SER C 3 177 ? -26.046 0.971   9.431   0.50 20.76  ? 176 SER L CA  1 
ATOM   4278 C  C   . SER C 3 177 ? -25.704 -0.194  8.504   1.00 21.74  ? 176 SER L C   1 
ATOM   4279 O  O   . SER C 3 177 ? -24.783 -0.992  8.830   1.00 22.29  ? 176 SER L O   1 
ATOM   4280 C  CB  A SER C 3 177 ? -25.024 2.119   9.302   0.50 22.76  ? 176 SER L CB  1 
ATOM   4281 C  CB  B SER C 3 177 ? -25.116 2.157   9.225   0.50 20.64  ? 176 SER L CB  1 
ATOM   4282 O  OG  A SER C 3 177 ? -25.468 3.127   8.408   0.50 24.51  ? 176 SER L OG  1 
ATOM   4283 O  OG  B SER C 3 177 ? -23.739 1.766   9.151   0.50 19.21  ? 176 SER L OG  1 
ATOM   4284 N  N   . SER C 3 178 ? -26.400 -0.312  7.393   1.00 21.39  ? 177 SER L N   1 
ATOM   4285 C  CA  . SER C 3 178 ? -26.021 -1.225  6.294   1.00 20.86  ? 177 SER L CA  1 
ATOM   4286 C  C   . SER C 3 178 ? -25.972 -0.352  5.051   1.00 20.63  ? 177 SER L C   1 
ATOM   4287 O  O   . SER C 3 178 ? -26.958 0.377   4.838   1.00 20.60  ? 177 SER L O   1 
ATOM   4288 C  CB  . SER C 3 178 ? -26.966 -2.344  6.118   1.00 21.53  ? 177 SER L CB  1 
ATOM   4289 O  OG  . SER C 3 178 ? -26.538 -3.169  5.038   1.00 22.07  ? 177 SER L OG  1 
ATOM   4290 N  N   . THR C 3 179 ? -24.828 -0.305  4.368   1.00 19.85  ? 178 THR L N   1 
ATOM   4291 C  CA  . THR C 3 179 ? -24.662 0.496   3.127   1.00 20.03  ? 178 THR L CA  1 
ATOM   4292 C  C   . THR C 3 179 ? -24.475 -0.438  1.930   1.00 20.22  ? 178 THR L C   1 
ATOM   4293 O  O   . THR C 3 179 ? -23.479 -1.223  1.902   1.00 19.81  ? 178 THR L O   1 
ATOM   4294 C  CB  . THR C 3 179 ? -23.495 1.468   3.232   1.00 20.77  ? 178 THR L CB  1 
ATOM   4295 O  OG1 . THR C 3 179 ? -23.650 2.104   4.509   1.00 21.76  ? 178 THR L OG1 1 
ATOM   4296 C  CG2 . THR C 3 179 ? -23.442 2.420   2.065   1.00 21.28  ? 178 THR L CG2 1 
ATOM   4297 N  N   . LEU C 3 180 ? -25.300 -0.240  0.926   1.00 20.45  ? 179 LEU L N   1 
ATOM   4298 C  CA  . LEU C 3 180 ? -25.279 -1.003  -0.353  1.00 21.63  ? 179 LEU L CA  1 
ATOM   4299 C  C   . LEU C 3 180 ? -24.581 -0.101  -1.362  1.00 22.63  ? 179 LEU L C   1 
ATOM   4300 O  O   . LEU C 3 180 ? -25.037 1.043   -1.509  1.00 22.22  ? 179 LEU L O   1 
ATOM   4301 C  CB  . LEU C 3 180 ? -26.705 -1.339  -0.793  1.00 21.78  ? 179 LEU L CB  1 
ATOM   4302 C  CG  . LEU C 3 180 ? -26.862 -1.958  -2.187  1.00 22.30  ? 179 LEU L CG  1 
ATOM   4303 C  CD1 . LEU C 3 180 ? -26.372 -3.401  -2.177  1.00 22.85  ? 179 LEU L CD1 1 
ATOM   4304 C  CD2 . LEU C 3 180 ? -28.308 -1.892  -2.663  1.00 22.80  ? 179 LEU L CD2 1 
ATOM   4305 N  N   . THR C 3 181 ? -23.486 -0.544  -1.972  1.00 23.23  ? 180 THR L N   1 
ATOM   4306 C  CA  . THR C 3 181 ? -22.748 0.301   -2.933  1.00 24.21  ? 180 THR L CA  1 
ATOM   4307 C  C   . THR C 3 181 ? -22.930 -0.302  -4.321  1.00 24.96  ? 180 THR L C   1 
ATOM   4308 O  O   . THR C 3 181 ? -22.606 -1.485  -4.483  1.00 24.14  ? 180 THR L O   1 
ATOM   4309 C  CB  . THR C 3 181 ? -21.281 0.493   -2.524  1.00 25.40  ? 180 THR L CB  1 
ATOM   4310 O  OG1 . THR C 3 181 ? -21.375 1.009   -1.202  1.00 25.34  ? 180 THR L OG1 1 
ATOM   4311 C  CG2 . THR C 3 181 ? -20.543 1.455   -3.437  1.00 26.76  ? 180 THR L CG2 1 
ATOM   4312 N  N   . LEU C 3 182 ? -23.399 0.502   -5.266  1.00 26.24  ? 181 LEU L N   1 
ATOM   4313 C  CA  . LEU C 3 182 ? -23.552 0.130   -6.704  1.00 29.31  ? 181 LEU L CA  1 
ATOM   4314 C  C   . LEU C 3 182 ? -22.905 1.198   -7.574  1.00 30.27  ? 181 LEU L C   1 
ATOM   4315 O  O   . LEU C 3 182 ? -22.857 2.342   -7.141  1.00 30.73  ? 181 LEU L O   1 
ATOM   4316 C  CB  . LEU C 3 182 ? -25.041 0.084   -7.054  1.00 31.43  ? 181 LEU L CB  1 
ATOM   4317 C  CG  . LEU C 3 182 ? -25.873 -0.856  -6.201  1.00 33.09  ? 181 LEU L CG  1 
ATOM   4318 C  CD1 . LEU C 3 182 ? -27.343 -0.745  -6.537  1.00 35.18  ? 181 LEU L CD1 1 
ATOM   4319 C  CD2 . LEU C 3 182 ? -25.387 -2.272  -6.410  1.00 34.74  ? 181 LEU L CD2 1 
ATOM   4320 N  N   . SER C 3 183 ? -22.541 0.872   -8.819  1.00 32.44  ? 182 SER L N   1 
ATOM   4321 C  CA  . SER C 3 183 ? -22.254 1.914   -9.839  1.00 33.28  ? 182 SER L CA  1 
ATOM   4322 C  C   . SER C 3 183 ? -23.552 2.669   -10.155 1.00 33.61  ? 182 SER L C   1 
ATOM   4323 O  O   . SER C 3 183 ? -24.657 2.124   -9.921  1.00 32.88  ? 182 SER L O   1 
ATOM   4324 C  CB  . SER C 3 183 ? -21.620 1.340   -11.076 1.00 34.74  ? 182 SER L CB  1 
ATOM   4325 O  OG  . SER C 3 183 ? -22.531 0.504   -11.743 1.00 35.20  ? 182 SER L OG  1 
ATOM   4326 N  N   . LYS C 3 184 ? -23.415 3.898   -10.664 1.00 34.25  ? 183 LYS L N   1 
ATOM   4327 C  CA  . LYS C 3 184 ? -24.575 4.687   -11.156 1.00 35.15  ? 183 LYS L CA  1 
ATOM   4328 C  C   . LYS C 3 184 ? -25.273 3.840   -12.228 1.00 33.99  ? 183 LYS L C   1 
ATOM   4329 O  O   . LYS C 3 184 ? -26.525 3.704   -12.182 1.00 32.62  ? 183 LYS L O   1 
ATOM   4330 C  CB  . LYS C 3 184 ? -24.159 6.071   -11.677 1.00 37.64  ? 183 LYS L CB  1 
ATOM   4331 C  CG  . LYS C 3 184 ? -25.249 6.786   -12.486 1.00 40.95  ? 183 LYS L CG  1 
ATOM   4332 C  CD  . LYS C 3 184 ? -24.990 8.255   -12.829 1.00 44.77  ? 183 LYS L CD  1 
ATOM   4333 C  CE  . LYS C 3 184 ? -25.626 8.656   -14.143 1.00 49.87  ? 183 LYS L CE  1 
ATOM   4334 N  NZ  . LYS C 3 184 ? -26.152 10.041  -14.123 1.00 53.53  ? 183 LYS L NZ  1 
ATOM   4335 N  N   . ALA C 3 185 ? -24.494 3.204   -13.091 1.00 34.29  ? 184 ALA L N   1 
ATOM   4336 C  CA  . ALA C 3 185 ? -25.031 2.417   -14.230 1.00 36.80  ? 184 ALA L CA  1 
ATOM   4337 C  C   . ALA C 3 185 ? -25.933 1.307   -13.678 1.00 35.91  ? 184 ALA L C   1 
ATOM   4338 O  O   . ALA C 3 185 ? -27.112 1.240   -14.103 1.00 36.79  ? 184 ALA L O   1 
ATOM   4339 C  CB  . ALA C 3 185 ? -23.892 1.884   -15.067 1.00 37.70  ? 184 ALA L CB  1 
ATOM   4340 N  N   . ASP C 3 186 ? -25.426 0.521   -12.716 1.00 36.28  ? 185 ASP L N   1 
ATOM   4341 C  CA  . ASP C 3 186 ? -26.201 -0.593  -12.103 1.00 34.98  ? 185 ASP L CA  1 
ATOM   4342 C  C   . ASP C 3 186 ? -27.412 -0.037  -11.357 1.00 32.81  ? 185 ASP L C   1 
ATOM   4343 O  O   . ASP C 3 186 ? -28.459 -0.659  -11.435 1.00 31.65  ? 185 ASP L O   1 
ATOM   4344 C  CB  . ASP C 3 186 ? -25.346 -1.480  -11.200 1.00 35.69  ? 185 ASP L CB  1 
ATOM   4345 C  CG  . ASP C 3 186 ? -24.368 -2.334  -11.972 1.00 38.23  ? 185 ASP L CG  1 
ATOM   4346 O  OD1 . ASP C 3 186 ? -24.524 -2.418  -13.218 1.00 42.82  ? 185 ASP L OD1 1 
ATOM   4347 O  OD2 . ASP C 3 186 ? -23.473 -2.911  -11.337 1.00 38.03  ? 185 ASP L OD2 1 
ATOM   4348 N  N   . TYR C 3 187 ? -27.242 1.015   -10.547 1.00 31.77  ? 186 TYR L N   1 
ATOM   4349 C  CA  . TYR C 3 187 ? -28.351 1.633   -9.778  1.00 30.71  ? 186 TYR L CA  1 
ATOM   4350 C  C   . TYR C 3 187 ? -29.508 1.963   -10.726 1.00 32.58  ? 186 TYR L C   1 
ATOM   4351 O  O   . TYR C 3 187 ? -30.707 1.730   -10.407 1.00 30.80  ? 186 TYR L O   1 
ATOM   4352 C  CB  . TYR C 3 187 ? -27.844 2.895   -9.072  1.00 30.34  ? 186 TYR L CB  1 
ATOM   4353 C  CG  . TYR C 3 187 ? -28.922 3.630   -8.322  1.00 29.40  ? 186 TYR L CG  1 
ATOM   4354 C  CD1 . TYR C 3 187 ? -29.485 3.053   -7.200  1.00 28.95  ? 186 TYR L CD1 1 
ATOM   4355 C  CD2 . TYR C 3 187 ? -29.324 4.908   -8.661  1.00 29.30  ? 186 TYR L CD2 1 
ATOM   4356 C  CE1 . TYR C 3 187 ? -30.480 3.683   -6.481  1.00 28.88  ? 186 TYR L CE1 1 
ATOM   4357 C  CE2 . TYR C 3 187 ? -30.326 5.553   -7.950  1.00 29.85  ? 186 TYR L CE2 1 
ATOM   4358 C  CZ  . TYR C 3 187 ? -30.909 4.937   -6.849  1.00 29.78  ? 186 TYR L CZ  1 
ATOM   4359 O  OH  . TYR C 3 187 ? -31.898 5.517   -6.106  1.00 30.19  ? 186 TYR L OH  1 
ATOM   4360 N  N   . GLU C 3 188 ? -29.155 2.524   -11.882 1.00 34.59  ? 187 GLU L N   1 
ATOM   4361 C  CA  . GLU C 3 188 ? -30.152 3.055   -12.863 1.00 37.93  ? 187 GLU L CA  1 
ATOM   4362 C  C   . GLU C 3 188 ? -30.821 1.923   -13.656 1.00 38.25  ? 187 GLU L C   1 
ATOM   4363 O  O   . GLU C 3 188 ? -31.799 2.220   -14.370 1.00 38.01  ? 187 GLU L O   1 
ATOM   4364 C  CB  . GLU C 3 188 ? -29.501 4.121   -13.744 1.00 39.41  ? 187 GLU L CB  1 
ATOM   4365 C  CG  . GLU C 3 188 ? -29.211 5.379   -12.956 1.00 41.65  ? 187 GLU L CG  1 
ATOM   4366 C  CD  . GLU C 3 188 ? -28.729 6.557   -13.780 1.00 44.57  ? 187 GLU L CD  1 
ATOM   4367 O  OE1 . GLU C 3 188 ? -28.335 6.344   -14.932 1.00 45.48  ? 187 GLU L OE1 1 
ATOM   4368 O  OE2 . GLU C 3 188 ? -28.716 7.664   -13.238 1.00 47.43  ? 187 GLU L OE2 1 
ATOM   4369 N  N   . LYS C 3 189 ? -30.362 0.677   -13.528 1.00 39.19  ? 188 LYS L N   1 
ATOM   4370 C  CA  . LYS C 3 189 ? -30.995 -0.474  -14.230 1.00 39.60  ? 188 LYS L CA  1 
ATOM   4371 C  C   . LYS C 3 189 ? -32.187 -0.995  -13.424 1.00 37.49  ? 188 LYS L C   1 
ATOM   4372 O  O   . LYS C 3 189 ? -32.877 -1.850  -13.946 1.00 36.05  ? 188 LYS L O   1 
ATOM   4373 C  CB  . LYS C 3 189 ? -30.037 -1.656  -14.388 1.00 41.66  ? 188 LYS L CB  1 
ATOM   4374 C  CG  . LYS C 3 189 ? -28.883 -1.475  -15.363 1.00 46.55  ? 188 LYS L CG  1 
ATOM   4375 C  CD  . LYS C 3 189 ? -28.141 -2.789  -15.562 1.00 50.37  ? 188 LYS L CD  1 
ATOM   4376 C  CE  . LYS C 3 189 ? -26.647 -2.723  -15.328 1.00 54.57  ? 188 LYS L CE  1 
ATOM   4377 N  NZ  . LYS C 3 189 ? -25.910 -2.507  -16.594 1.00 59.15  ? 188 LYS L NZ  1 
ATOM   4378 N  N   . HIS C 3 190 ? -32.383 -0.566  -12.174 1.00 34.25  ? 189 HIS L N   1 
ATOM   4379 C  CA  . HIS C 3 190 ? -33.389 -1.188  -11.277 1.00 34.57  ? 189 HIS L CA  1 
ATOM   4380 C  C   . HIS C 3 190 ? -34.319 -0.143  -10.697 1.00 33.66  ? 189 HIS L C   1 
ATOM   4381 O  O   . HIS C 3 190 ? -33.917 0.996   -10.635 1.00 34.08  ? 189 HIS L O   1 
ATOM   4382 C  CB  . HIS C 3 190 ? -32.692 -1.992  -10.175 1.00 33.82  ? 189 HIS L CB  1 
ATOM   4383 C  CG  . HIS C 3 190 ? -31.859 -3.055  -10.783 1.00 35.34  ? 189 HIS L CG  1 
ATOM   4384 N  ND1 . HIS C 3 190 ? -32.428 -4.088  -11.493 1.00 37.16  ? 189 HIS L ND1 1 
ATOM   4385 C  CD2 . HIS C 3 190 ? -30.522 -3.222  -10.849 1.00 37.34  ? 189 HIS L CD2 1 
ATOM   4386 C  CE1 . HIS C 3 190 ? -31.465 -4.872  -11.948 1.00 37.41  ? 189 HIS L CE1 1 
ATOM   4387 N  NE2 . HIS C 3 190 ? -30.296 -4.359  -11.578 1.00 39.27  ? 189 HIS L NE2 1 
ATOM   4388 N  N   . LYS C 3 191 ? -35.488 -0.568  -10.228 1.00 32.71  ? 190 LYS L N   1 
ATOM   4389 C  CA  . LYS C 3 191 ? -36.530 0.351   -9.734  1.00 33.95  ? 190 LYS L CA  1 
ATOM   4390 C  C   . LYS C 3 191 ? -36.652 0.289   -8.219  1.00 31.54  ? 190 LYS L C   1 
ATOM   4391 O  O   . LYS C 3 191 ? -36.664 1.379   -7.600  1.00 30.55  ? 190 LYS L O   1 
ATOM   4392 C  CB  . LYS C 3 191 ? -37.898 0.014   -10.335 1.00 38.15  ? 190 LYS L CB  1 
ATOM   4393 C  CG  . LYS C 3 191 ? -38.977 1.001   -9.912  1.00 42.11  ? 190 LYS L CG  1 
ATOM   4394 C  CD  . LYS C 3 191 ? -40.317 0.761   -10.558 1.00 46.64  ? 190 LYS L CD  1 
ATOM   4395 C  CE  . LYS C 3 191 ? -41.444 1.187   -9.634  1.00 50.92  ? 190 LYS L CE  1 
ATOM   4396 N  NZ  . LYS C 3 191 ? -42.658 0.377   -9.893  1.00 53.48  ? 190 LYS L NZ  1 
ATOM   4397 N  N   . VAL C 3 192 ? -36.809 -0.915  -7.653  1.00 30.30  ? 191 VAL L N   1 
ATOM   4398 C  CA  . VAL C 3 192 ? -37.226 -1.084  -6.226  1.00 29.34  ? 191 VAL L CA  1 
ATOM   4399 C  C   . VAL C 3 192 ? -35.997 -1.453  -5.395  1.00 26.92  ? 191 VAL L C   1 
ATOM   4400 O  O   . VAL C 3 192 ? -35.291 -2.401  -5.728  1.00 25.75  ? 191 VAL L O   1 
ATOM   4401 C  CB  . VAL C 3 192 ? -38.393 -2.080  -6.040  1.00 30.34  ? 191 VAL L CB  1 
ATOM   4402 C  CG1 . VAL C 3 192 ? -38.853 -2.122  -4.588  1.00 30.23  ? 191 VAL L CG1 1 
ATOM   4403 C  CG2 . VAL C 3 192 ? -39.579 -1.757  -6.952  1.00 31.86  ? 191 VAL L CG2 1 
ATOM   4404 N  N   . TYR C 3 193 ? -35.749 -0.650  -4.365  1.00 25.69  ? 192 TYR L N   1 
ATOM   4405 C  CA  . TYR C 3 193 ? -34.648 -0.810  -3.411  1.00 25.57  ? 192 TYR L CA  1 
ATOM   4406 C  C   . TYR C 3 193 ? -35.279 -1.029  -2.038  1.00 25.08  ? 192 TYR L C   1 
ATOM   4407 O  O   . TYR C 3 193 ? -36.024 -0.169  -1.581  1.00 25.58  ? 192 TYR L O   1 
ATOM   4408 C  CB  . TYR C 3 193 ? -33.733 0.414   -3.479  1.00 24.94  ? 192 TYR L CB  1 
ATOM   4409 C  CG  . TYR C 3 193 ? -32.925 0.437   -4.738  1.00 24.36  ? 192 TYR L CG  1 
ATOM   4410 C  CD1 . TYR C 3 193 ? -31.667 -0.139  -4.760  1.00 24.66  ? 192 TYR L CD1 1 
ATOM   4411 C  CD2 . TYR C 3 193 ? -33.444 0.935   -5.917  1.00 25.26  ? 192 TYR L CD2 1 
ATOM   4412 C  CE1 . TYR C 3 193 ? -30.941 -0.215  -5.927  1.00 25.10  ? 192 TYR L CE1 1 
ATOM   4413 C  CE2 . TYR C 3 193 ? -32.733 0.849   -7.100  1.00 25.63  ? 192 TYR L CE2 1 
ATOM   4414 C  CZ  . TYR C 3 193 ? -31.473 0.285   -7.098  1.00 25.48  ? 192 TYR L CZ  1 
ATOM   4415 O  OH  . TYR C 3 193 ? -30.727 0.196   -8.225  1.00 26.71  ? 192 TYR L OH  1 
ATOM   4416 N  N   . ALA C 3 194 ? -34.971 -2.168  -1.411  1.00 24.75  ? 193 ALA L N   1 
ATOM   4417 C  CA  . ALA C 3 194 ? -35.602 -2.579  -0.152  1.00 24.82  ? 193 ALA L CA  1 
ATOM   4418 C  C   . ALA C 3 194 ? -34.545 -3.070  0.821   1.00 23.81  ? 193 ALA L C   1 
ATOM   4419 O  O   . ALA C 3 194 ? -33.622 -3.794  0.416   1.00 23.44  ? 193 ALA L O   1 
ATOM   4420 C  CB  . ALA C 3 194 ? -36.640 -3.629  -0.445  1.00 25.58  ? 193 ALA L CB  1 
ATOM   4421 N  N   . CYS C 3 195 ? -34.706 -2.644  2.057   1.00 23.87  ? 194 CYS L N   1 
ATOM   4422 C  CA  . CYS C 3 195 ? -33.983 -3.144  3.220   1.00 24.58  ? 194 CYS L CA  1 
ATOM   4423 C  C   . CYS C 3 195 ? -34.946 -4.003  4.044   1.00 24.58  ? 194 CYS L C   1 
ATOM   4424 O  O   . CYS C 3 195 ? -35.960 -3.487  4.478   1.00 25.39  ? 194 CYS L O   1 
ATOM   4425 C  CB  . CYS C 3 195 ? -33.458 -1.938  4.001   1.00 26.26  ? 194 CYS L CB  1 
ATOM   4426 S  SG  . CYS C 3 195 ? -32.559 -2.521  5.432   1.00 30.01  ? 194 CYS L SG  1 
ATOM   4427 N  N   . GLU C 3 196 ? -34.631 -5.285  4.217   1.00 24.62  ? 195 GLU L N   1 
ATOM   4428 C  CA  . GLU C 3 196 ? -35.457 -6.250  4.978   1.00 26.37  ? 195 GLU L CA  1 
ATOM   4429 C  C   . GLU C 3 196 ? -34.710 -6.624  6.264   1.00 25.08  ? 195 GLU L C   1 
ATOM   4430 O  O   . GLU C 3 196 ? -33.562 -7.094  6.176   1.00 25.38  ? 195 GLU L O   1 
ATOM   4431 C  CB  . GLU C 3 196 ? -35.795 -7.495  4.156   1.00 27.84  ? 195 GLU L CB  1 
ATOM   4432 C  CG  . GLU C 3 196 ? -36.593 -8.488  4.959   1.00 30.28  ? 195 GLU L CG  1 
ATOM   4433 C  CD  . GLU C 3 196 ? -36.479 -9.911  4.461   1.00 33.49  ? 195 GLU L CD  1 
ATOM   4434 O  OE1 . GLU C 3 196 ? -35.382 -10.563 4.690   1.00 35.36  ? 195 GLU L OE1 1 
ATOM   4435 O  OE2 . GLU C 3 196 ? -37.448 -10.342 3.831   1.00 33.16  ? 195 GLU L OE2 1 
ATOM   4436 N  N   . VAL C 3 197 ? -35.353 -6.379  7.385   1.00 25.14  ? 196 VAL L N   1 
ATOM   4437 C  CA  . VAL C 3 197 ? -34.767 -6.533  8.743   1.00 25.28  ? 196 VAL L CA  1 
ATOM   4438 C  C   . VAL C 3 197 ? -35.502 -7.635  9.517   1.00 26.22  ? 196 VAL L C   1 
ATOM   4439 O  O   . VAL C 3 197 ? -36.778 -7.590  9.684   1.00 26.80  ? 196 VAL L O   1 
ATOM   4440 C  CB  . VAL C 3 197 ? -34.767 -5.174  9.464   1.00 24.71  ? 196 VAL L CB  1 
ATOM   4441 C  CG1 . VAL C 3 197 ? -34.311 -5.304  10.915  1.00 24.67  ? 196 VAL L CG1 1 
ATOM   4442 C  CG2 . VAL C 3 197 ? -33.919 -4.162  8.726   1.00 23.78  ? 196 VAL L CG2 1 
ATOM   4443 N  N   . THR C 3 198 ? -34.726 -8.602  10.005  1.00 26.84  ? 197 THR L N   1 
ATOM   4444 C  CA  . THR C 3 198 ? -35.202 -9.717  10.860  1.00 28.32  ? 197 THR L CA  1 
ATOM   4445 C  C   . THR C 3 198 ? -34.518 -9.555  12.222  1.00 27.85  ? 197 THR L C   1 
ATOM   4446 O  O   . THR C 3 198 ? -33.304 -9.328  12.243  1.00 27.37  ? 197 THR L O   1 
ATOM   4447 C  CB  . THR C 3 198 ? -34.868 -11.078 10.250  1.00 30.11  ? 197 THR L CB  1 
ATOM   4448 O  OG1 . THR C 3 198 ? -35.428 -11.157 8.933   1.00 31.49  ? 197 THR L OG1 1 
ATOM   4449 C  CG2 . THR C 3 198 ? -35.349 -12.220 11.120  1.00 32.23  ? 197 THR L CG2 1 
ATOM   4450 N  N   . HIS C 3 199 ? -35.268 -9.626  13.308  1.00 28.49  ? 198 HIS L N   1 
ATOM   4451 C  CA  . HIS C 3 199 ? -34.719 -9.366  14.670  1.00 28.67  ? 198 HIS L CA  1 
ATOM   4452 C  C   . HIS C 3 199 ? -35.651 -9.992  15.711  1.00 30.78  ? 198 HIS L C   1 
ATOM   4453 O  O   . HIS C 3 199 ? -36.855 -10.028 15.424  1.00 31.73  ? 198 HIS L O   1 
ATOM   4454 C  CB  . HIS C 3 199 ? -34.560 -7.859  14.880  1.00 27.68  ? 198 HIS L CB  1 
ATOM   4455 C  CG  . HIS C 3 199 ? -34.000 -7.524  16.219  1.00 27.79  ? 198 HIS L CG  1 
ATOM   4456 N  ND1 . HIS C 3 199 ? -32.629 -7.519  16.469  1.00 28.11  ? 198 HIS L ND1 1 
ATOM   4457 C  CD2 . HIS C 3 199 ? -34.608 -7.219  17.383  1.00 28.59  ? 198 HIS L CD2 1 
ATOM   4458 C  CE1 . HIS C 3 199 ? -32.428 -7.209  17.733  1.00 27.58  ? 198 HIS L CE1 1 
ATOM   4459 N  NE2 . HIS C 3 199 ? -33.624 -7.043  18.324  1.00 29.62  ? 198 HIS L NE2 1 
ATOM   4460 N  N   . GLN C 3 200 ? -35.127 -10.433 16.880  1.00 31.32  ? 199 GLN L N   1 
ATOM   4461 C  CA  A GLN C 3 200 ? -35.933 -11.130 17.921  0.50 32.63  ? 199 GLN L CA  1 
ATOM   4462 C  CA  B GLN C 3 200 ? -35.943 -11.129 17.911  0.50 33.34  ? 199 GLN L CA  1 
ATOM   4463 C  C   . GLN C 3 200 ? -37.132 -10.265 18.314  1.00 33.61  ? 199 GLN L C   1 
ATOM   4464 O  O   . GLN C 3 200 ? -38.135 -10.828 18.710  1.00 34.38  ? 199 GLN L O   1 
ATOM   4465 C  CB  A GLN C 3 200 ? -35.134 -11.394 19.203  0.50 32.47  ? 199 GLN L CB  1 
ATOM   4466 C  CB  B GLN C 3 200 ? -35.151 -11.376 19.193  0.50 34.11  ? 199 GLN L CB  1 
ATOM   4467 C  CG  A GLN C 3 200 ? -35.904 -12.222 20.223  0.50 33.51  ? 199 GLN L CG  1 
ATOM   4468 C  CG  B GLN C 3 200 ? -34.128 -12.476 19.030  0.50 34.52  ? 199 GLN L CG  1 
ATOM   4469 C  CD  A GLN C 3 200 ? -35.013 -12.743 21.324  0.50 33.64  ? 199 GLN L CD  1 
ATOM   4470 C  CD  B GLN C 3 200 ? -33.002 -12.273 19.998  0.50 33.80  ? 199 GLN L CD  1 
ATOM   4471 O  OE1 A GLN C 3 200 ? -33.813 -12.502 21.311  0.50 31.52  ? 199 GLN L OE1 1 
ATOM   4472 O  OE1 B GLN C 3 200 ? -33.232 -12.216 21.197  0.50 34.36  ? 199 GLN L OE1 1 
ATOM   4473 N  NE2 A GLN C 3 200 ? -35.588 -13.505 22.247  0.50 34.39  ? 199 GLN L NE2 1 
ATOM   4474 N  NE2 B GLN C 3 200 ? -31.797 -12.148 19.467  0.50 32.95  ? 199 GLN L NE2 1 
ATOM   4475 N  N   . GLY C 3 201 ? -36.959 -8.950  18.257  1.00 33.30  ? 200 GLY L N   1 
ATOM   4476 C  CA  . GLY C 3 201 ? -37.991 -7.986  18.693  1.00 34.95  ? 200 GLY L CA  1 
ATOM   4477 C  C   . GLY C 3 201 ? -39.137 -7.811  17.707  1.00 35.28  ? 200 GLY L C   1 
ATOM   4478 O  O   . GLY C 3 201 ? -40.131 -7.194  18.094  1.00 36.35  ? 200 GLY L O   1 
ATOM   4479 N  N   . LEU C 3 202 ? -38.985 -8.289  16.474  1.00 35.03  ? 201 LEU L N   1 
ATOM   4480 C  CA  . LEU C 3 202 ? -40.011 -8.191  15.403  1.00 36.21  ? 201 LEU L CA  1 
ATOM   4481 C  C   . LEU C 3 202 ? -40.691 -9.554  15.191  1.00 37.92  ? 201 LEU L C   1 
ATOM   4482 O  O   . LEU C 3 202 ? -39.969 -10.525 14.910  1.00 37.72  ? 201 LEU L O   1 
ATOM   4483 C  CB  . LEU C 3 202 ? -39.301 -7.746  14.127  1.00 35.04  ? 201 LEU L CB  1 
ATOM   4484 C  CG  . LEU C 3 202 ? -38.600 -6.394  14.222  1.00 33.64  ? 201 LEU L CG  1 
ATOM   4485 C  CD1 . LEU C 3 202 ? -37.703 -6.191  13.021  1.00 32.99  ? 201 LEU L CD1 1 
ATOM   4486 C  CD2 . LEU C 3 202 ? -39.618 -5.267  14.352  1.00 33.68  ? 201 LEU L CD2 1 
ATOM   4487 N  N   . SER C 3 203 ? -42.023 -9.634  15.273  1.00 40.79  ? 202 SER L N   1 
ATOM   4488 C  CA  . SER C 3 203 ? -42.765 -10.915 15.078  1.00 43.16  ? 202 SER L CA  1 
ATOM   4489 C  C   . SER C 3 203 ? -42.599 -11.429 13.640  1.00 41.94  ? 202 SER L C   1 
ATOM   4490 O  O   . SER C 3 203 ? -42.656 -12.655 13.426  1.00 42.65  ? 202 SER L O   1 
ATOM   4491 C  CB  . SER C 3 203 ? -44.217 -10.789 15.471  1.00 45.79  ? 202 SER L CB  1 
ATOM   4492 O  OG  . SER C 3 203 ? -44.796 -9.611  14.923  1.00 47.75  ? 202 SER L OG  1 
ATOM   4493 N  N   . SER C 3 204 ? -42.378 -10.539 12.674  1.00 40.99  ? 203 SER L N   1 
ATOM   4494 C  CA  . SER C 3 204 ? -42.049 -10.904 11.266  1.00 40.38  ? 203 SER L CA  1 
ATOM   4495 C  C   . SER C 3 204 ? -41.130 -9.841  10.677  1.00 37.16  ? 203 SER L C   1 
ATOM   4496 O  O   . SER C 3 204 ? -41.082 -8.739  11.204  1.00 36.09  ? 203 SER L O   1 
ATOM   4497 C  CB  . SER C 3 204 ? -43.300 -11.104 10.445  1.00 42.00  ? 203 SER L CB  1 
ATOM   4498 O  OG  . SER C 3 204 ? -44.086 -9.932  10.439  1.00 43.67  ? 203 SER L OG  1 
ATOM   4499 N  N   . PRO C 3 205 ? -40.369 -10.116 9.593   1.00 36.69  ? 204 PRO L N   1 
ATOM   4500 C  CA  . PRO C 3 205 ? -39.384 -9.151  9.079   1.00 35.52  ? 204 PRO L CA  1 
ATOM   4501 C  C   . PRO C 3 205 ? -40.031 -7.832  8.627   1.00 33.63  ? 204 PRO L C   1 
ATOM   4502 O  O   . PRO C 3 205 ? -41.149 -7.857  8.135   1.00 32.42  ? 204 PRO L O   1 
ATOM   4503 C  CB  . PRO C 3 205 ? -38.714 -9.860  7.892   1.00 35.62  ? 204 PRO L CB  1 
ATOM   4504 C  CG  . PRO C 3 205 ? -38.993 -11.321 8.164   1.00 37.58  ? 204 PRO L CG  1 
ATOM   4505 C  CD  . PRO C 3 205 ? -40.379 -11.352 8.797   1.00 37.99  ? 204 PRO L CD  1 
ATOM   4506 N  N   . VAL C 3 206 ? -39.354 -6.715  8.895   1.00 31.34  ? 205 VAL L N   1 
ATOM   4507 C  CA  . VAL C 3 206 ? -39.814 -5.354  8.501   1.00 30.69  ? 205 VAL L CA  1 
ATOM   4508 C  C   . VAL C 3 206 ? -39.027 -4.967  7.259   1.00 29.28  ? 205 VAL L C   1 
ATOM   4509 O  O   . VAL C 3 206 ? -37.770 -5.152  7.256   1.00 27.80  ? 205 VAL L O   1 
ATOM   4510 C  CB  . VAL C 3 206 ? -39.637 -4.336  9.634   1.00 31.60  ? 205 VAL L CB  1 
ATOM   4511 C  CG1 . VAL C 3 206 ? -39.693 -2.906  9.105   1.00 31.93  ? 205 VAL L CG1 1 
ATOM   4512 C  CG2 . VAL C 3 206 ? -40.651 -4.552  10.758  1.00 33.75  ? 205 VAL L CG2 1 
ATOM   4513 N  N   . THR C 3 207 ? -39.734 -4.485  6.238   1.00 28.76  ? 206 THR L N   1 
ATOM   4514 C  CA  . THR C 3 207 ? -39.134 -4.033  4.969   1.00 28.73  ? 206 THR L CA  1 
ATOM   4515 C  C   . THR C 3 207 ? -39.405 -2.536  4.841   1.00 28.49  ? 206 THR L C   1 
ATOM   4516 O  O   . THR C 3 207 ? -40.569 -2.136  5.028   1.00 29.65  ? 206 THR L O   1 
ATOM   4517 C  CB  . THR C 3 207 ? -39.631 -4.810  3.745   1.00 28.36  ? 206 THR L CB  1 
ATOM   4518 O  OG1 . THR C 3 207 ? -39.211 -6.169  3.895   1.00 28.79  ? 206 THR L OG1 1 
ATOM   4519 C  CG2 . THR C 3 207 ? -39.042 -4.275  2.461   1.00 28.00  ? 206 THR L CG2 1 
ATOM   4520 N  N   . LYS C 3 208 ? -38.367 -1.765  4.528   1.00 26.87  ? 207 LYS L N   1 
ATOM   4521 C  CA  . LYS C 3 208 ? -38.493 -0.359  4.088   1.00 26.41  ? 207 LYS L CA  1 
ATOM   4522 C  C   . LYS C 3 208 ? -37.924 -0.271  2.680   1.00 26.12  ? 207 LYS L C   1 
ATOM   4523 O  O   . LYS C 3 208 ? -36.853 -0.875  2.397   1.00 25.41  ? 207 LYS L O   1 
ATOM   4524 C  CB  . LYS C 3 208 ? -37.765 0.588   5.034   1.00 26.89  ? 207 LYS L CB  1 
ATOM   4525 C  CG  . LYS C 3 208 ? -38.241 0.597   6.469   1.00 27.49  ? 207 LYS L CG  1 
ATOM   4526 C  CD  . LYS C 3 208 ? -39.613 1.162   6.659   1.00 29.86  ? 207 LYS L CD  1 
ATOM   4527 C  CE  . LYS C 3 208 ? -40.024 1.055   8.109   1.00 30.93  ? 207 LYS L CE  1 
ATOM   4528 N  NZ  . LYS C 3 208 ? -41.431 1.444   8.264   1.00 33.92  ? 207 LYS L NZ  1 
ATOM   4529 N  N   . SER C 3 209 ? -38.589 0.455   1.801   1.00 26.35  ? 208 SER L N   1 
ATOM   4530 C  CA  . SER C 3 209 ? -38.182 0.493   0.381   1.00 26.73  ? 208 SER L CA  1 
ATOM   4531 C  C   . SER C 3 209 ? -38.511 1.851   -0.232  1.00 27.52  ? 208 SER L C   1 
ATOM   4532 O  O   . SER C 3 209 ? -39.236 2.628   0.380   1.00 29.48  ? 208 SER L O   1 
ATOM   4533 C  CB  . SER C 3 209 ? -38.808 -0.638  -0.400  1.00 27.33  ? 208 SER L CB  1 
ATOM   4534 O  OG  . SER C 3 209 ? -40.213 -0.549  -0.371  1.00 28.96  ? 208 SER L OG  1 
ATOM   4535 N  N   . PHE C 3 210 ? -38.033 2.055   -1.451  1.00 27.63  ? 209 PHE L N   1 
ATOM   4536 C  CA  . PHE C 3 210 ? -38.338 3.228   -2.304  1.00 27.95  ? 209 PHE L CA  1 
ATOM   4537 C  C   . PHE C 3 210 ? -38.173 2.772   -3.747  1.00 28.41  ? 209 PHE L C   1 
ATOM   4538 O  O   . PHE C 3 210 ? -37.524 1.751   -3.959  1.00 25.71  ? 209 PHE L O   1 
ATOM   4539 C  CB  . PHE C 3 210 ? -37.428 4.403   -1.935  1.00 27.37  ? 209 PHE L CB  1 
ATOM   4540 C  CG  . PHE C 3 210 ? -35.972 4.244   -2.311  1.00 26.30  ? 209 PHE L CG  1 
ATOM   4541 C  CD1 . PHE C 3 210 ? -35.050 3.759   -1.398  1.00 25.43  ? 209 PHE L CD1 1 
ATOM   4542 C  CD2 . PHE C 3 210 ? -35.540 4.471   -3.615  1.00 26.57  ? 209 PHE L CD2 1 
ATOM   4543 C  CE1 . PHE C 3 210 ? -33.716 3.618   -1.744  1.00 24.31  ? 209 PHE L CE1 1 
ATOM   4544 C  CE2 . PHE C 3 210 ? -34.201 4.290   -3.965  1.00 25.90  ? 209 PHE L CE2 1 
ATOM   4545 C  CZ  . PHE C 3 210 ? -33.301 3.868   -3.028  1.00 24.81  ? 209 PHE L CZ  1 
ATOM   4546 N  N   . ASN C 3 211 ? -38.764 3.494   -4.691  1.00 31.15  ? 210 ASN L N   1 
ATOM   4547 C  CA  . ASN C 3 211 ? -38.650 3.252   -6.158  1.00 34.92  ? 210 ASN L CA  1 
ATOM   4548 C  C   . ASN C 3 211 ? -37.857 4.388   -6.784  1.00 36.24  ? 210 ASN L C   1 
ATOM   4549 O  O   . ASN C 3 211 ? -38.244 5.513   -6.547  1.00 39.01  ? 210 ASN L O   1 
ATOM   4550 C  CB  . ASN C 3 211 ? -40.006 3.186   -6.854  1.00 39.03  ? 210 ASN L CB  1 
ATOM   4551 C  CG  . ASN C 3 211 ? -40.975 2.289   -6.132  1.00 42.04  ? 210 ASN L CG  1 
ATOM   4552 O  OD1 . ASN C 3 211 ? -42.107 2.688   -5.882  1.00 50.48  ? 210 ASN L OD1 1 
ATOM   4553 N  ND2 . ASN C 3 211 ? -40.538 1.100   -5.768  1.00 42.98  ? 210 ASN L ND2 1 
ATOM   4554 N  N   . ARG C 3 212 ? -36.712 4.104   -7.399  1.00 39.24  ? 211 ARG L N   1 
ATOM   4555 C  CA  . ARG C 3 212 ? -35.898 5.072   -8.176  1.00 41.66  ? 211 ARG L CA  1 
ATOM   4556 C  C   . ARG C 3 212 ? -36.792 5.564   -9.330  1.00 49.08  ? 211 ARG L C   1 
ATOM   4557 O  O   . ARG C 3 212 ? -37.564 4.743   -9.852  1.00 51.06  ? 211 ARG L O   1 
ATOM   4558 C  CB  . ARG C 3 212 ? -34.629 4.365   -8.664  1.00 40.01  ? 211 ARG L CB  1 
ATOM   4559 C  CG  . ARG C 3 212 ? -33.661 5.244   -9.442  1.00 40.68  ? 211 ARG L CG  1 
ATOM   4560 C  CD  . ARG C 3 212 ? -32.643 4.426   -10.185 1.00 40.33  ? 211 ARG L CD  1 
ATOM   4561 N  NE  . ARG C 3 212 ? -33.336 3.641   -11.185 1.00 43.08  ? 211 ARG L NE  1 
ATOM   4562 C  CZ  . ARG C 3 212 ? -33.651 4.051   -12.391 1.00 45.22  ? 211 ARG L CZ  1 
ATOM   4563 N  NH1 . ARG C 3 212 ? -33.306 5.258   -12.802 1.00 46.27  ? 211 ARG L NH1 1 
ATOM   4564 N  NH2 . ARG C 3 212 ? -34.320 3.244   -13.193 1.00 49.18  ? 211 ARG L NH2 1 
ATOM   4565 N  N   . GLY C 3 213 ? -36.718 6.844   -9.709  1.00 57.83  ? 212 GLY L N   1 
ATOM   4566 C  CA  . GLY C 3 213 ? -37.518 7.422   -10.818 1.00 63.60  ? 212 GLY L CA  1 
ATOM   4567 C  C   . GLY C 3 213 ? -38.216 6.352   -11.661 1.00 66.26  ? 212 GLY L C   1 
ATOM   4568 O  O   . GLY C 3 213 ? -38.475 6.473   -12.871 1.00 69.20  ? 212 GLY L O   1 
HETATM 4569 CA CA  . CA  D 4 .   ? -2.071  20.001  48.716  1.00 22.01  ? 401 CA  A CA  1 
HETATM 4570 CA CA  . CA  E 4 .   ? -5.814  18.597  49.609  1.00 32.47  ? 402 CA  A CA  1 
HETATM 4571 ZN ZN  . ZN  F 5 .   ? -1.066  11.058  54.041  1.00 25.40  ? 403 ZN  A ZN  1 
HETATM 4572 CL CL  A CL  G 6 .   ? -4.290  8.831   54.933  0.60 42.95  ? 404 CL  A CL  1 
HETATM 4573 S  S   B SO4 H 7 .   ? -3.639  8.993   53.399  0.40 22.69  ? 405 SO4 A S   1 
HETATM 4574 O  O1  B SO4 H 7 .   ? -2.927  10.168  52.999  0.40 21.22  ? 405 SO4 A O1  1 
HETATM 4575 O  O2  B SO4 H 7 .   ? -4.318  8.435   52.248  0.40 22.07  ? 405 SO4 A O2  1 
HETATM 4576 O  O3  B SO4 H 7 .   ? -2.697  8.033   53.918  0.40 22.17  ? 405 SO4 A O3  1 
HETATM 4577 O  O4  B SO4 H 7 .   ? -4.609  9.329   54.405  0.40 22.09  ? 405 SO4 A O4  1 
HETATM 4578 O  O   . HOH I 8 .   ? -12.128 16.643  45.415  0.60 33.81  ? 501 HOH A O   1 
HETATM 4579 O  O   . HOH I 8 .   ? 8.612   15.092  69.801  0.60 31.30  ? 502 HOH A O   1 
HETATM 4580 O  O   . HOH I 8 .   ? 8.241   9.055   66.775  1.00 32.95  ? 503 HOH A O   1 
HETATM 4581 O  O   . HOH I 8 .   ? -4.397  6.084   51.601  0.60 33.66  ? 504 HOH A O   1 
HETATM 4582 O  O   . HOH I 8 .   ? 6.082   15.290  41.311  0.60 27.38  ? 505 HOH A O   1 
HETATM 4583 O  O   A HOH I 8 .   ? -1.765  9.724   52.583  0.60 15.68  ? 506 HOH A O   1 
HETATM 4584 O  O   . HOH I 8 .   ? 17.186  11.507  42.275  0.60 37.84  ? 507 HOH A O   1 
HETATM 4585 O  O   . HOH I 8 .   ? -7.605  9.739   68.821  0.60 35.73  ? 508 HOH A O   1 
HETATM 4586 O  O   . HOH I 8 .   ? 3.929   6.095   67.964  1.00 31.18  ? 509 HOH A O   1 
HETATM 4587 O  O   . HOH I 8 .   ? 16.529  29.157  58.492  1.00 40.27  ? 510 HOH A O   1 
HETATM 4588 O  O   . HOH I 8 .   ? -10.735 7.470   49.392  0.60 33.57  ? 511 HOH A O   1 
HETATM 4589 O  O   . HOH I 8 .   ? -4.881  19.711  51.618  1.00 26.48  ? 512 HOH A O   1 
HETATM 4590 O  O   . HOH I 8 .   ? -6.201  19.543  74.423  1.00 53.87  ? 513 HOH A O   1 
HETATM 4591 O  O   . HOH I 8 .   ? -8.296  23.097  50.017  1.00 33.32  ? 514 HOH A O   1 
HETATM 4592 O  O   . HOH I 8 .   ? -12.095 17.673  55.491  1.00 45.37  ? 515 HOH A O   1 
HETATM 4593 O  O   . HOH I 8 .   ? -3.470  23.908  50.352  1.00 25.42  ? 516 HOH A O   1 
HETATM 4594 O  O   . HOH I 8 .   ? -4.830  21.540  67.668  1.00 44.51  ? 517 HOH A O   1 
HETATM 4595 O  O   . HOH I 8 .   ? 0.122   19.399  71.259  0.60 31.32  ? 518 HOH A O   1 
HETATM 4596 O  O   . HOH I 8 .   ? -2.602  30.811  54.686  1.00 34.91  ? 519 HOH A O   1 
HETATM 4597 O  O   . HOH I 8 .   ? 18.973  19.210  46.426  0.60 32.20  ? 520 HOH A O   1 
HETATM 4598 O  O   . HOH I 8 .   ? 2.894   -1.565  54.317  1.00 27.80  ? 521 HOH A O   1 
HETATM 4599 O  O   . HOH I 8 .   ? 10.570  6.952   46.354  0.60 26.69  ? 522 HOH A O   1 
HETATM 4600 O  O   . HOH I 8 .   ? 4.705   8.256   69.612  1.00 41.90  ? 523 HOH A O   1 
HETATM 4601 O  O   . HOH I 8 .   ? -3.233  24.412  41.060  0.60 33.66  ? 524 HOH A O   1 
HETATM 4602 O  O   . HOH I 8 .   ? 20.314  12.279  44.347  1.00 48.03  ? 525 HOH A O   1 
HETATM 4603 O  O   . HOH I 8 .   ? 19.527  17.903  62.932  0.60 30.39  ? 526 HOH A O   1 
HETATM 4604 O  O   . HOH I 8 .   ? -3.319  30.037  48.823  0.60 30.56  ? 527 HOH A O   1 
HETATM 4605 O  O   . HOH I 8 .   ? 13.881  6.614   49.201  1.00 27.87  ? 528 HOH A O   1 
HETATM 4606 O  O   . HOH I 8 .   ? -7.848  16.883  65.088  1.00 42.63  ? 529 HOH A O   1 
HETATM 4607 O  O   . HOH I 8 .   ? 12.514  28.225  60.373  1.00 23.39  ? 530 HOH A O   1 
HETATM 4608 O  O   . HOH I 8 .   ? -3.158  16.560  67.277  1.00 35.69  ? 531 HOH A O   1 
HETATM 4609 O  O   . HOH I 8 .   ? 5.935   28.508  54.760  1.00 26.09  ? 532 HOH A O   1 
HETATM 4610 O  O   . HOH I 8 .   ? -3.784  28.265  55.981  1.00 32.98  ? 533 HOH A O   1 
HETATM 4611 O  O   A HOH I 8 .   ? -2.791  16.680  46.257  0.50 42.55  ? 534 HOH A O   1 
HETATM 4612 O  O   B HOH I 8 .   ? -4.001  15.174  46.854  0.50 30.70  ? 534 HOH A O   1 
HETATM 4613 O  O   . HOH I 8 .   ? 14.569  3.433   51.543  0.60 35.80  ? 535 HOH A O   1 
HETATM 4614 O  O   . HOH I 8 .   ? 18.943  23.253  60.790  1.00 38.49  ? 536 HOH A O   1 
HETATM 4615 O  O   . HOH I 8 .   ? -9.494  22.818  47.506  1.00 36.49  ? 537 HOH A O   1 
HETATM 4616 O  O   . HOH I 8 .   ? 1.374   13.868  47.766  1.00 26.80  ? 538 HOH A O   1 
HETATM 4617 O  O   . HOH I 8 .   ? 14.493  14.387  62.983  1.00 24.21  ? 539 HOH A O   1 
HETATM 4618 O  O   . HOH I 8 .   ? 19.682  15.730  60.061  1.00 30.89  ? 540 HOH A O   1 
HETATM 4619 O  O   . HOH I 8 .   ? -5.018  9.865   69.137  1.00 41.08  ? 541 HOH A O   1 
HETATM 4620 O  O   . HOH I 8 .   ? 6.578   -1.928  59.220  0.60 28.12  ? 542 HOH A O   1 
HETATM 4621 O  O   A HOH I 8 .   ? 7.040   10.966  69.418  0.50 36.63  ? 543 HOH A O   1 
HETATM 4622 O  O   B HOH I 8 .   ? 7.546   8.894   69.420  0.50 26.86  ? 543 HOH A O   1 
HETATM 4623 O  O   . HOH I 8 .   ? 16.723  7.598   51.556  1.00 31.86  ? 544 HOH A O   1 
HETATM 4624 O  O   . HOH I 8 .   ? 13.178  -0.783  61.098  0.60 34.41  ? 545 HOH A O   1 
HETATM 4625 O  O   . HOH I 8 .   ? 10.262  -2.806  50.820  0.60 33.94  ? 546 HOH A O   1 
HETATM 4626 O  O   . HOH I 8 .   ? 13.240  22.311  56.263  1.00 22.02  ? 547 HOH A O   1 
HETATM 4627 O  O   . HOH I 8 .   ? 1.391   -1.024  52.228  1.00 35.59  ? 548 HOH A O   1 
HETATM 4628 O  O   . HOH I 8 .   ? 14.964  18.571  64.956  1.00 25.22  ? 549 HOH A O   1 
HETATM 4629 O  O   . HOH I 8 .   ? 14.590  31.006  56.269  1.00 37.68  ? 550 HOH A O   1 
HETATM 4630 O  O   . HOH I 8 .   ? -4.543  8.712   57.871  1.00 35.40  ? 551 HOH A O   1 
HETATM 4631 O  O   . HOH I 8 .   ? -5.141  18.760  45.300  1.00 40.86  ? 552 HOH A O   1 
HETATM 4632 O  O   . HOH I 8 .   ? 21.362  11.167  54.077  1.00 44.35  ? 553 HOH A O   1 
HETATM 4633 O  O   . HOH I 8 .   ? 10.333  13.401  41.787  1.00 35.14  ? 554 HOH A O   1 
HETATM 4634 O  O   . HOH I 8 .   ? 11.518  24.671  62.520  1.00 21.91  ? 555 HOH A O   1 
HETATM 4635 O  O   . HOH I 8 .   ? -13.075 10.662  48.962  1.00 43.82  ? 556 HOH A O   1 
HETATM 4636 O  O   . HOH I 8 .   ? -14.182 21.915  53.863  0.60 34.27  ? 557 HOH A O   1 
HETATM 4637 O  O   . HOH I 8 .   ? 18.032  4.522   62.481  1.00 43.78  ? 558 HOH A O   1 
HETATM 4638 O  O   . HOH I 8 .   ? -7.248  5.570   70.067  0.60 36.35  ? 559 HOH A O   1 
HETATM 4639 O  O   . HOH I 8 .   ? 10.181  22.771  46.679  1.00 32.05  ? 560 HOH A O   1 
HETATM 4640 O  O   . HOH I 8 .   ? 23.531  22.654  59.706  0.50 39.87  ? 561 HOH A O   1 
HETATM 4641 O  O   . HOH I 8 .   ? -6.426  16.726  67.949  0.60 38.53  ? 562 HOH A O   1 
HETATM 4642 O  O   . HOH I 8 .   ? 5.766   18.180  70.627  1.00 44.40  ? 563 HOH A O   1 
HETATM 4643 O  O   . HOH I 8 .   ? 6.827   6.878   64.394  1.00 30.76  ? 564 HOH A O   1 
HETATM 4644 O  O   . HOH I 8 .   ? -8.852  29.618  51.705  0.60 33.95  ? 565 HOH A O   1 
HETATM 4645 O  O   . HOH I 8 .   ? 18.286  24.234  53.679  1.00 41.10  ? 566 HOH A O   1 
HETATM 4646 O  O   . HOH I 8 .   ? 4.531   8.685   72.145  0.60 36.52  ? 567 HOH A O   1 
HETATM 4647 O  O   . HOH I 8 .   ? -0.665  2.971   50.438  1.00 40.80  ? 568 HOH A O   1 
HETATM 4648 O  O   . HOH I 8 .   ? -3.542  13.273  48.340  1.00 30.23  ? 569 HOH A O   1 
HETATM 4649 O  O   . HOH I 8 .   ? 13.941  11.432  42.136  1.00 32.93  ? 570 HOH A O   1 
HETATM 4650 O  O   . HOH I 8 .   ? 7.980   12.384  42.786  1.00 37.26  ? 571 HOH A O   1 
HETATM 4651 O  O   . HOH I 8 .   ? -8.970  24.172  45.488  0.60 31.17  ? 572 HOH A O   1 
HETATM 4652 O  O   . HOH I 8 .   ? -5.463  17.365  47.556  1.00 38.75  ? 573 HOH A O   1 
HETATM 4653 O  O   . HOH I 8 .   ? 1.519   17.262  71.858  1.00 42.98  ? 574 HOH A O   1 
HETATM 4654 O  O   . HOH I 8 .   ? -7.305  26.886  54.310  0.60 32.09  ? 575 HOH A O   1 
HETATM 4655 O  O   . HOH I 8 .   ? 5.741   27.395  50.521  1.00 21.36  ? 576 HOH A O   1 
HETATM 4656 O  O   . HOH I 8 .   ? 10.930  6.257   41.553  1.00 32.25  ? 577 HOH A O   1 
HETATM 4657 O  O   . HOH I 8 .   ? 0.213   28.436  51.187  1.00 35.87  ? 578 HOH A O   1 
HETATM 4658 O  O   . HOH I 8 .   ? 6.056   22.975  45.798  1.00 18.83  ? 579 HOH A O   1 
HETATM 4659 O  O   . HOH I 8 .   ? 9.690   17.018  68.613  1.00 48.33  ? 580 HOH A O   1 
HETATM 4660 O  O   . HOH I 8 .   ? 23.384  21.444  55.788  0.60 33.18  ? 581 HOH A O   1 
HETATM 4661 O  O   . HOH I 8 .   ? -0.408  27.024  43.285  1.00 50.14  ? 582 HOH A O   1 
HETATM 4662 O  O   . HOH I 8 .   ? 22.850  10.312  58.249  0.60 37.01  ? 583 HOH A O   1 
HETATM 4663 O  O   . HOH I 8 .   ? 20.115  10.469  48.143  0.60 34.77  ? 584 HOH A O   1 
HETATM 4664 O  O   . HOH I 8 .   ? -7.828  20.689  50.927  1.00 37.85  ? 585 HOH A O   1 
HETATM 4665 O  O   . HOH I 8 .   ? -3.253  1.725   59.306  1.00 34.63  ? 586 HOH A O   1 
HETATM 4666 O  O   . HOH I 8 .   ? 8.628   -0.806  65.109  1.00 39.24  ? 587 HOH A O   1 
HETATM 4667 O  O   . HOH I 8 .   ? 5.766   12.303  41.487  0.60 41.45  ? 588 HOH A O   1 
HETATM 4668 O  O   . HOH I 8 .   ? -5.290  2.208   60.923  1.00 39.30  ? 589 HOH A O   1 
HETATM 4669 O  O   . HOH I 8 .   ? -12.721 29.486  56.118  0.60 35.88  ? 590 HOH A O   1 
HETATM 4670 O  O   . HOH I 8 .   ? -0.281  29.452  42.398  0.60 41.88  ? 591 HOH A O   1 
HETATM 4671 O  O   . HOH I 8 .   ? 2.287   27.903  50.180  0.60 22.88  ? 592 HOH A O   1 
HETATM 4672 O  O   . HOH I 8 .   ? 9.150   21.747  42.593  1.00 32.06  ? 593 HOH A O   1 
HETATM 4673 O  O   . HOH I 8 .   ? -1.055  30.222  52.611  1.00 45.27  ? 594 HOH A O   1 
HETATM 4674 O  O   . HOH I 8 .   ? 11.643  20.493  42.987  1.00 46.77  ? 595 HOH A O   1 
HETATM 4675 O  O   . HOH I 8 .   ? -16.815 12.138  59.486  0.60 45.75  ? 596 HOH A O   1 
HETATM 4676 O  O   . HOH I 8 .   ? 5.232   25.590  46.605  0.60 28.17  ? 597 HOH A O   1 
HETATM 4677 O  O   . HOH I 8 .   ? 3.818   26.803  63.526  1.00 30.74  ? 598 HOH A O   1 
HETATM 4678 O  O   . HOH I 8 .   ? 10.360  3.702   40.337  0.60 29.72  ? 599 HOH A O   1 
HETATM 4679 O  O   . HOH I 8 .   ? 14.555  -1.430  56.562  0.60 36.98  ? 600 HOH A O   1 
HETATM 4680 O  O   . HOH I 8 .   ? 8.513   30.184  52.425  0.60 35.34  ? 601 HOH A O   1 
HETATM 4681 O  O   . HOH I 8 .   ? 12.698  27.986  50.004  1.00 42.36  ? 602 HOH A O   1 
HETATM 4682 O  O   . HOH I 8 .   ? 13.137  3.135   47.945  0.60 41.29  ? 603 HOH A O   1 
HETATM 4683 O  O   . HOH I 8 .   ? -4.218  16.879  43.589  1.00 43.58  ? 604 HOH A O   1 
HETATM 4684 O  O   . HOH I 8 .   ? 14.554  6.558   44.017  1.00 42.67  ? 605 HOH A O   1 
HETATM 4685 O  O   . HOH I 8 .   ? 19.706  10.055  51.625  1.00 41.48  ? 606 HOH A O   1 
HETATM 4686 O  O   . HOH I 8 .   ? 15.329  8.566   42.480  1.00 45.06  ? 607 HOH A O   1 
HETATM 4687 O  O   . HOH I 8 .   ? 5.992   5.608   67.881  1.00 49.28  ? 608 HOH A O   1 
HETATM 4688 O  O   . HOH I 8 .   ? 14.252  15.894  65.201  1.00 27.99  ? 609 HOH A O   1 
HETATM 4689 O  O   . HOH I 8 .   ? -3.594  -3.197  64.341  1.00 49.31  ? 610 HOH A O   1 
HETATM 4690 O  O   . HOH I 8 .   ? 13.253  8.498   69.170  0.60 41.67  ? 611 HOH A O   1 
HETATM 4691 O  O   . HOH I 8 .   ? 8.260   23.466  44.970  1.00 42.43  ? 612 HOH A O   1 
HETATM 4692 O  O   . HOH I 8 .   ? 17.720  18.479  64.645  1.00 37.72  ? 613 HOH A O   1 
HETATM 4693 O  O   . HOH I 8 .   ? 14.281  32.139  58.674  0.60 27.69  ? 614 HOH A O   1 
HETATM 4694 O  O   . HOH I 8 .   ? 12.778  30.940  60.803  1.00 27.64  ? 615 HOH A O   1 
HETATM 4695 O  O   . HOH I 8 .   ? 13.766  26.179  61.703  1.00 30.98  ? 616 HOH A O   1 
HETATM 4696 O  O   . HOH I 8 .   ? 19.195  14.702  62.556  1.00 42.29  ? 617 HOH A O   1 
HETATM 4697 O  O   . HOH I 8 .   ? -6.014  20.863  43.725  0.60 33.62  ? 618 HOH A O   1 
HETATM 4698 O  O   . HOH I 8 .   ? 16.337  4.936   50.820  0.60 34.22  ? 619 HOH A O   1 
HETATM 4699 O  O   . HOH I 8 .   ? -14.045 19.054  54.310  0.60 41.91  ? 620 HOH A O   1 
HETATM 4700 O  O   . HOH I 8 .   ? 8.153   5.875   66.531  1.00 31.75  ? 621 HOH A O   1 
HETATM 4701 O  O   . HOH I 8 .   ? 6.467   27.731  47.854  0.60 35.29  ? 622 HOH A O   1 
HETATM 4702 O  O   . HOH I 8 .   ? 18.698  20.632  66.412  1.00 37.00  ? 623 HOH A O   1 
HETATM 4703 O  O   . HOH I 8 .   ? 11.125  2.810   45.829  0.60 43.54  ? 624 HOH A O   1 
HETATM 4704 O  O   . HOH I 8 .   ? 19.233  7.548   52.652  1.00 48.74  ? 625 HOH A O   1 
HETATM 4705 O  O   . HOH I 8 .   ? 16.911  13.389  63.561  1.00 31.10  ? 626 HOH A O   1 
HETATM 4706 O  O   . HOH I 8 .   ? -6.808  28.920  56.273  0.60 35.74  ? 627 HOH A O   1 
HETATM 4707 O  O   . HOH I 8 .   ? 11.762  25.161  46.859  1.00 45.85  ? 628 HOH A O   1 
HETATM 4708 O  O   . HOH I 8 .   ? 16.447  5.229   45.141  0.60 34.17  ? 629 HOH A O   1 
HETATM 4709 O  O   . HOH I 8 .   ? 11.786  5.739   44.007  1.00 31.76  ? 630 HOH A O   1 
HETATM 4710 O  O   . HOH I 8 .   ? 24.256  23.950  55.410  0.60 39.00  ? 631 HOH A O   1 
HETATM 4711 O  O   . HOH I 8 .   ? 21.499  13.039  63.159  0.60 36.80  ? 632 HOH A O   1 
HETATM 4712 O  O   . HOH I 8 .   ? 10.449  4.094   66.823  0.60 32.56  ? 633 HOH A O   1 
HETATM 4713 O  O   . HOH I 8 .   ? -2.924  -0.358  55.623  0.60 31.26  ? 634 HOH A O   1 
HETATM 4714 O  O   . HOH J 8 .   ? -45.458 12.275  10.587  0.60 48.11  ? 301 HOH H O   1 
HETATM 4715 O  O   . HOH J 8 .   ? -6.384  20.276  9.860   1.00 42.59  ? 302 HOH H O   1 
HETATM 4716 O  O   . HOH J 8 .   ? 9.492   15.129  14.302  1.00 45.15  ? 303 HOH H O   1 
HETATM 4717 O  O   . HOH J 8 .   ? 1.113   25.034  43.749  1.00 36.69  ? 304 HOH H O   1 
HETATM 4718 O  O   . HOH J 8 .   ? 8.347   -0.669  15.311  1.00 48.37  ? 305 HOH H O   1 
HETATM 4719 O  O   . HOH J 8 .   ? 5.766   10.987  38.992  0.60 33.03  ? 306 HOH H O   1 
HETATM 4720 O  O   . HOH J 8 .   ? 14.842  7.936   24.806  0.60 25.52  ? 307 HOH H O   1 
HETATM 4721 O  O   . HOH J 8 .   ? 3.997   -1.449  21.432  0.60 30.14  ? 308 HOH H O   1 
HETATM 4722 O  O   . HOH J 8 .   ? -8.705  24.353  32.043  1.00 41.89  ? 309 HOH H O   1 
HETATM 4723 O  O   . HOH J 8 .   ? 4.735   -3.288  27.114  1.00 30.01  ? 310 HOH H O   1 
HETATM 4724 O  O   . HOH J 8 .   ? -9.753  17.734  24.303  1.00 37.90  ? 311 HOH H O   1 
HETATM 4725 O  O   . HOH J 8 .   ? 14.244  15.714  27.238  1.00 40.84  ? 312 HOH H O   1 
HETATM 4726 O  O   . HOH J 8 .   ? 6.916   29.354  24.528  0.60 33.47  ? 313 HOH H O   1 
HETATM 4727 O  O   . HOH J 8 .   ? -26.283 19.369  23.715  0.60 31.32  ? 314 HOH H O   1 
HETATM 4728 O  O   . HOH J 8 .   ? 11.783  1.191   15.201  0.60 31.42  ? 315 HOH H O   1 
HETATM 4729 O  O   . HOH J 8 .   ? -12.050 16.474  13.571  1.00 35.29  ? 316 HOH H O   1 
HETATM 4730 O  O   . HOH J 8 .   ? -34.650 19.020  16.352  1.00 43.80  ? 317 HOH H O   1 
HETATM 4731 O  O   . HOH J 8 .   ? -0.406  15.786  16.744  1.00 22.25  ? 318 HOH H O   1 
HETATM 4732 O  O   . HOH J 8 .   ? 5.973   3.994   40.692  1.00 38.22  ? 319 HOH H O   1 
HETATM 4733 O  O   . HOH J 8 .   ? 2.078   16.728  10.773  0.60 32.08  ? 320 HOH H O   1 
HETATM 4734 O  O   . HOH J 8 .   ? -29.467 10.867  22.490  1.00 44.73  ? 321 HOH H O   1 
HETATM 4735 O  O   . HOH J 8 .   ? -20.937 12.580  16.210  1.00 31.09  ? 322 HOH H O   1 
HETATM 4736 O  O   . HOH J 8 .   ? 9.991   16.063  22.343  1.00 30.61  ? 323 HOH H O   1 
HETATM 4737 O  O   . HOH J 8 .   ? 3.409   15.149  40.142  1.00 26.33  ? 324 HOH H O   1 
HETATM 4738 O  O   . HOH J 8 .   ? 0.820   -5.008  26.576  1.00 39.37  ? 325 HOH H O   1 
HETATM 4739 O  O   . HOH J 8 .   ? -5.623  23.401  39.980  0.60 31.24  ? 326 HOH H O   1 
HETATM 4740 O  O   . HOH J 8 .   ? 12.167  16.116  20.469  1.00 36.57  ? 327 HOH H O   1 
HETATM 4741 O  O   . HOH J 8 .   ? 5.343   3.162   19.534  1.00 27.94  ? 328 HOH H O   1 
HETATM 4742 O  O   . HOH J 8 .   ? 7.641   0.251   17.799  1.00 47.35  ? 329 HOH H O   1 
HETATM 4743 O  O   . HOH J 8 .   ? 5.592   25.756  23.169  1.00 39.47  ? 330 HOH H O   1 
HETATM 4744 O  O   . HOH J 8 .   ? 1.666   8.213   3.803   1.00 18.89  ? 331 HOH H O   1 
HETATM 4745 O  O   . HOH J 8 .   ? -0.507  0.884   10.789  0.60 32.39  ? 332 HOH H O   1 
HETATM 4746 O  O   . HOH J 8 .   ? 2.437   19.185  34.306  1.00 31.41  ? 333 HOH H O   1 
HETATM 4747 O  O   . HOH J 8 .   ? -9.411  20.395  9.172   1.00 33.44  ? 334 HOH H O   1 
HETATM 4748 O  O   . HOH J 8 .   ? -4.394  9.038   12.207  1.00 17.60  ? 335 HOH H O   1 
HETATM 4749 O  O   . HOH J 8 .   ? -10.269 10.423  24.540  1.00 36.86  ? 336 HOH H O   1 
HETATM 4750 O  O   . HOH J 8 .   ? -7.858  2.151   -3.819  1.00 34.92  ? 337 HOH H O   1 
HETATM 4751 O  O   . HOH J 8 .   ? -0.478  15.369  46.080  1.00 47.28  ? 338 HOH H O   1 
HETATM 4752 O  O   . HOH J 8 .   ? -19.480 3.123   8.861   1.00 28.88  ? 339 HOH H O   1 
HETATM 4753 O  O   . HOH J 8 .   ? -17.525 3.300   -3.790  1.00 35.17  ? 340 HOH H O   1 
HETATM 4754 O  O   . HOH J 8 .   ? -32.442 16.573  -0.131  0.60 39.08  ? 341 HOH H O   1 
HETATM 4755 O  O   . HOH J 8 .   ? -24.231 6.385   19.101  1.00 28.04  ? 342 HOH H O   1 
HETATM 4756 O  O   . HOH J 8 .   ? 7.402   13.561  45.258  1.00 19.70  ? 343 HOH H O   1 
HETATM 4757 O  O   . HOH J 8 .   ? -5.198  10.803  -1.893  1.00 31.23  ? 344 HOH H O   1 
HETATM 4758 O  O   . HOH J 8 .   ? -8.618  17.054  26.705  1.00 32.21  ? 345 HOH H O   1 
HETATM 4759 O  O   . HOH J 8 .   ? -35.478 20.404  8.029   0.60 30.85  ? 346 HOH H O   1 
HETATM 4760 O  O   . HOH J 8 .   ? 15.035  13.088  27.436  0.60 32.74  ? 347 HOH H O   1 
HETATM 4761 O  O   . HOH J 8 .   ? 2.601   13.343  10.349  0.60 26.35  ? 348 HOH H O   1 
HETATM 4762 O  O   . HOH J 8 .   ? -0.037  -0.210  23.114  1.00 27.09  ? 349 HOH H O   1 
HETATM 4763 O  O   . HOH J 8 .   ? -36.181 9.375   7.171   1.00 37.32  ? 350 HOH H O   1 
HETATM 4764 O  O   . HOH J 8 .   ? -14.495 5.049   13.276  1.00 30.57  ? 351 HOH H O   1 
HETATM 4765 O  O   . HOH J 8 .   ? -5.993  14.387  18.832  1.00 16.89  ? 352 HOH H O   1 
HETATM 4766 O  O   . HOH J 8 .   ? -2.219  1.828   5.354   1.00 36.82  ? 353 HOH H O   1 
HETATM 4767 O  O   . HOH J 8 .   ? 6.222   -3.078  23.339  1.00 45.83  ? 354 HOH H O   1 
HETATM 4768 O  O   . HOH J 8 .   ? -13.936 3.720   -2.216  1.00 24.16  ? 355 HOH H O   1 
HETATM 4769 O  O   . HOH J 8 .   ? -2.749  15.707  10.266  1.00 33.63  ? 356 HOH H O   1 
HETATM 4770 O  O   . HOH J 8 .   ? -23.519 17.345  17.589  1.00 27.54  ? 357 HOH H O   1 
HETATM 4771 O  O   . HOH J 8 .   ? -31.682 8.396   17.115  1.00 34.85  ? 358 HOH H O   1 
HETATM 4772 O  O   . HOH J 8 .   ? 10.957  6.506   4.947   0.60 31.09  ? 359 HOH H O   1 
HETATM 4773 O  O   . HOH J 8 .   ? -32.870 14.907  18.185  1.00 34.82  ? 360 HOH H O   1 
HETATM 4774 O  O   . HOH J 8 .   ? -9.563  10.395  36.247  1.00 29.19  ? 361 HOH H O   1 
HETATM 4775 O  O   . HOH J 8 .   ? 3.316   17.088  14.340  1.00 39.10  ? 362 HOH H O   1 
HETATM 4776 O  O   . HOH J 8 .   ? -1.823  20.363  40.640  1.00 32.95  ? 363 HOH H O   1 
HETATM 4777 O  O   . HOH J 8 .   ? -2.971  0.479   16.846  0.60 33.93  ? 364 HOH H O   1 
HETATM 4778 O  O   . HOH J 8 .   ? 11.501  23.227  25.282  1.00 34.20  ? 365 HOH H O   1 
HETATM 4779 O  O   . HOH J 8 .   ? 5.061   21.852  43.632  1.00 26.31  ? 366 HOH H O   1 
HETATM 4780 O  O   . HOH J 8 .   ? 12.649  10.284  19.408  1.00 39.79  ? 367 HOH H O   1 
HETATM 4781 O  O   . HOH J 8 .   ? 1.406   -2.043  19.473  1.00 38.52  ? 368 HOH H O   1 
HETATM 4782 O  O   . HOH J 8 .   ? -3.150  13.732  -0.482  1.00 36.86  ? 369 HOH H O   1 
HETATM 4783 O  O   . HOH J 8 .   ? 7.032   15.322  27.077  1.00 21.87  ? 370 HOH H O   1 
HETATM 4784 O  O   . HOH J 8 .   ? -18.698 21.744  15.172  1.00 39.25  ? 371 HOH H O   1 
HETATM 4785 O  O   . HOH J 8 .   ? -8.913  4.233   22.730  1.00 45.19  ? 372 HOH H O   1 
HETATM 4786 O  O   . HOH J 8 .   ? -2.123  13.994  6.498   1.00 28.33  ? 373 HOH H O   1 
HETATM 4787 O  O   . HOH J 8 .   ? -9.655  8.067   23.481  1.00 34.10  ? 374 HOH H O   1 
HETATM 4788 O  O   . HOH J 8 .   ? -1.791  20.714  22.269  1.00 37.70  ? 375 HOH H O   1 
HETATM 4789 O  O   . HOH J 8 .   ? 16.241  9.982   30.548  1.00 38.58  ? 376 HOH H O   1 
HETATM 4790 O  O   . HOH J 8 .   ? -13.473 8.560   13.105  1.00 26.39  ? 377 HOH H O   1 
HETATM 4791 O  O   . HOH J 8 .   ? -8.493  16.348  16.782  0.60 36.29  ? 378 HOH H O   1 
HETATM 4792 O  O   . HOH J 8 .   ? -4.097  9.081   49.494  1.00 32.51  ? 379 HOH H O   1 
HETATM 4793 O  O   . HOH J 8 .   ? -36.688 13.784  1.043   1.00 46.89  ? 380 HOH H O   1 
HETATM 4794 O  O   . HOH J 8 .   ? -10.236 19.572  37.947  1.00 38.10  ? 381 HOH H O   1 
HETATM 4795 O  O   . HOH J 8 .   ? 1.689   -2.177  30.013  1.00 21.21  ? 382 HOH H O   1 
HETATM 4796 O  O   . HOH J 8 .   ? -31.942 21.512  6.902   1.00 27.39  ? 383 HOH H O   1 
HETATM 4797 O  O   . HOH J 8 .   ? -1.078  23.148  40.529  1.00 33.67  ? 384 HOH H O   1 
HETATM 4798 O  O   . HOH J 8 .   ? -0.125  10.370  41.616  1.00 22.17  ? 385 HOH H O   1 
HETATM 4799 O  O   . HOH J 8 .   ? -20.490 4.032   4.968   1.00 35.32  ? 386 HOH H O   1 
HETATM 4800 O  O   . HOH J 8 .   ? -16.894 17.933  13.368  1.00 25.51  ? 387 HOH H O   1 
HETATM 4801 O  O   . HOH J 8 .   ? -9.452  13.929  28.129  1.00 35.36  ? 388 HOH H O   1 
HETATM 4802 O  O   . HOH J 8 .   ? -27.825 8.772   20.689  0.60 31.65  ? 389 HOH H O   1 
HETATM 4803 O  O   . HOH J 8 .   ? 14.205  17.781  29.394  0.60 32.73  ? 390 HOH H O   1 
HETATM 4804 O  O   . HOH J 8 .   ? -0.262  14.526  21.609  1.00 21.80  ? 391 HOH H O   1 
HETATM 4805 O  O   . HOH J 8 .   ? -9.779  14.473  11.901  1.00 18.57  ? 392 HOH H O   1 
HETATM 4806 O  O   . HOH J 8 .   ? -22.600 8.637   18.188  1.00 29.65  ? 393 HOH H O   1 
HETATM 4807 O  O   . HOH J 8 .   ? -4.154  19.993  40.532  0.60 31.32  ? 394 HOH H O   1 
HETATM 4808 O  O   . HOH J 8 .   ? 5.953   -1.922  29.103  1.00 27.57  ? 395 HOH H O   1 
HETATM 4809 O  O   . HOH J 8 .   ? -7.608  16.402  30.757  1.00 32.95  ? 396 HOH H O   1 
HETATM 4810 O  O   . HOH J 8 .   ? 12.153  0.142   31.407  1.00 35.14  ? 397 HOH H O   1 
HETATM 4811 O  O   . HOH J 8 .   ? -1.568  17.189  43.509  1.00 37.22  ? 398 HOH H O   1 
HETATM 4812 O  O   . HOH J 8 .   ? -2.726  19.817  16.069  1.00 33.03  ? 399 HOH H O   1 
HETATM 4813 O  O   . HOH J 8 .   ? -29.969 17.880  21.375  1.00 32.27  ? 400 HOH H O   1 
HETATM 4814 O  O   . HOH J 8 .   ? -6.426  19.861  16.514  0.60 25.62  ? 401 HOH H O   1 
HETATM 4815 O  O   . HOH J 8 .   ? -24.410 13.559  20.251  1.00 40.92  ? 402 HOH H O   1 
HETATM 4816 O  O   . HOH J 8 .   ? -23.863 10.469  19.780  0.60 32.76  ? 403 HOH H O   1 
HETATM 4817 O  O   . HOH J 8 .   ? -5.657  3.989   1.458   1.00 25.02  ? 404 HOH H O   1 
HETATM 4818 O  O   . HOH J 8 .   ? -13.014 19.999  14.807  0.60 45.56  ? 405 HOH H O   1 
HETATM 4819 O  O   . HOH J 8 .   ? -6.341  17.804  1.051   0.60 34.49  ? 406 HOH H O   1 
HETATM 4820 O  O   . HOH J 8 .   ? -5.563  2.972   8.796   0.60 30.60  ? 407 HOH H O   1 
HETATM 4821 O  O   . HOH J 8 .   ? -5.317  22.644  28.199  1.00 26.47  ? 408 HOH H O   1 
HETATM 4822 O  O   . HOH J 8 .   ? 18.840  5.344   16.689  0.60 38.95  ? 409 HOH H O   1 
HETATM 4823 O  O   . HOH J 8 .   ? -6.341  12.193  16.979  1.00 17.58  ? 410 HOH H O   1 
HETATM 4824 O  O   . HOH J 8 .   ? -5.769  2.001   19.606  1.00 41.77  ? 411 HOH H O   1 
HETATM 4825 O  O   . HOH J 8 .   ? -6.556  18.300  18.754  1.00 37.84  ? 412 HOH H O   1 
HETATM 4826 O  O   . HOH J 8 .   ? -20.765 18.051  -0.142  0.60 30.77  ? 413 HOH H O   1 
HETATM 4827 O  O   . HOH J 8 .   ? -24.052 24.431  11.657  1.00 25.41  ? 414 HOH H O   1 
HETATM 4828 O  O   . HOH J 8 .   ? -3.826  17.276  13.121  1.00 37.99  ? 415 HOH H O   1 
HETATM 4829 O  O   . HOH J 8 .   ? -16.975 7.163   14.185  1.00 31.98  ? 416 HOH H O   1 
HETATM 4830 O  O   . HOH J 8 .   ? -3.733  4.440   13.486  1.00 34.30  ? 417 HOH H O   1 
HETATM 4831 O  O   . HOH J 8 .   ? -3.330  18.250  9.224   0.60 32.92  ? 418 HOH H O   1 
HETATM 4832 O  O   . HOH J 8 .   ? 7.918   4.970   3.690   1.00 32.38  ? 419 HOH H O   1 
HETATM 4833 O  O   . HOH J 8 .   ? -33.222 26.669  11.646  0.60 30.80  ? 420 HOH H O   1 
HETATM 4834 O  O   . HOH J 8 .   ? 15.398  8.622   18.035  0.60 43.92  ? 421 HOH H O   1 
HETATM 4835 O  O   . HOH J 8 .   ? 2.355   12.477  5.837   1.00 32.91  ? 422 HOH H O   1 
HETATM 4836 O  O   . HOH J 8 .   ? -8.585  15.057  -0.593  1.00 32.32  ? 423 HOH H O   1 
HETATM 4837 O  O   . HOH J 8 .   ? -9.008  13.315  32.462  1.00 28.80  ? 424 HOH H O   1 
HETATM 4838 O  O   . HOH J 8 .   ? 1.153   28.608  29.815  1.00 45.91  ? 425 HOH H O   1 
HETATM 4839 O  O   . HOH J 8 .   ? -8.732  11.708  20.194  1.00 26.68  ? 426 HOH H O   1 
HETATM 4840 O  O   . HOH J 8 .   ? -6.234  1.323   4.110   1.00 27.19  ? 427 HOH H O   1 
HETATM 4841 O  O   . HOH J 8 .   ? -15.992 -2.190  0.090   1.00 39.15  ? 428 HOH H O   1 
HETATM 4842 O  O   . HOH J 8 .   ? -8.561  15.601  19.314  1.00 29.77  ? 429 HOH H O   1 
HETATM 4843 O  O   . HOH J 8 .   ? 15.225  13.845  41.170  0.60 34.81  ? 430 HOH H O   1 
HETATM 4844 O  O   . HOH J 8 .   ? -9.897  17.122  31.914  0.60 29.83  ? 431 HOH H O   1 
HETATM 4845 O  O   . HOH J 8 .   ? -17.534 12.418  15.624  1.00 27.53  ? 432 HOH H O   1 
HETATM 4846 O  O   . HOH J 8 .   ? -42.577 7.716   14.396  0.60 33.58  ? 433 HOH H O   1 
HETATM 4847 O  O   . HOH J 8 .   ? -6.234  5.426   10.209  1.00 22.36  ? 434 HOH H O   1 
HETATM 4848 O  O   . HOH J 8 .   ? -0.940  14.269  8.938   1.00 29.82  ? 435 HOH H O   1 
HETATM 4849 O  O   . HOH J 8 .   ? -13.213 11.084  15.843  1.00 35.35  ? 436 HOH H O   1 
HETATM 4850 O  O   . HOH J 8 .   ? 5.331   11.252  6.156   1.00 24.61  ? 437 HOH H O   1 
HETATM 4851 O  O   . HOH J 8 .   ? 11.274  24.669  38.624  0.60 35.43  ? 438 HOH H O   1 
HETATM 4852 O  O   . HOH J 8 .   ? -2.808  26.768  39.326  1.00 51.05  ? 439 HOH H O   1 
HETATM 4853 O  O   . HOH J 8 .   ? -13.634 -2.079  8.724   1.00 40.71  ? 440 HOH H O   1 
HETATM 4854 O  O   . HOH J 8 .   ? -36.796 17.614  -2.303  0.60 41.28  ? 441 HOH H O   1 
HETATM 4855 O  O   . HOH J 8 .   ? 15.536  6.791   31.076  1.00 34.42  ? 442 HOH H O   1 
HETATM 4856 O  O   . HOH J 8 .   ? 3.924   10.665  41.692  1.00 25.25  ? 443 HOH H O   1 
HETATM 4857 O  O   . HOH J 8 .   ? 10.864  25.284  29.330  1.00 29.94  ? 444 HOH H O   1 
HETATM 4858 O  O   . HOH J 8 .   ? 1.720   20.304  18.167  0.60 31.90  ? 445 HOH H O   1 
HETATM 4859 O  O   . HOH J 8 .   ? 15.332  3.414   29.173  0.60 25.89  ? 446 HOH H O   1 
HETATM 4860 O  O   . HOH J 8 .   ? -34.396 18.255  7.044   1.00 37.45  ? 447 HOH H O   1 
HETATM 4861 O  O   . HOH J 8 .   ? -28.741 24.744  11.637  0.60 28.30  ? 448 HOH H O   1 
HETATM 4862 O  O   . HOH J 8 .   ? -30.268 17.559  1.436   1.00 34.40  ? 449 HOH H O   1 
HETATM 4863 O  O   . HOH J 8 .   ? 1.596   1.251   4.605   1.00 34.68  ? 450 HOH H O   1 
HETATM 4864 O  O   . HOH J 8 .   ? -0.474  12.168  2.147   1.00 23.57  ? 451 HOH H O   1 
HETATM 4865 O  O   . HOH J 8 .   ? 1.464   27.025  34.779  0.60 30.89  ? 452 HOH H O   1 
HETATM 4866 O  O   . HOH J 8 .   ? 12.558  19.474  27.839  1.00 39.07  ? 453 HOH H O   1 
HETATM 4867 O  O   . HOH J 8 .   ? -9.685  21.921  12.472  1.00 37.25  ? 454 HOH H O   1 
HETATM 4868 O  O   . HOH J 8 .   ? -11.284 13.700  -2.167  0.60 26.54  ? 455 HOH H O   1 
HETATM 4869 O  O   . HOH J 8 .   ? -18.382 17.053  0.005   1.00 31.20  ? 456 HOH H O   1 
HETATM 4870 O  O   . HOH J 8 .   ? -9.151  19.665  1.589   0.60 32.08  ? 457 HOH H O   1 
HETATM 4871 O  O   . HOH J 8 .   ? -1.863  -2.854  17.256  0.60 32.11  ? 458 HOH H O   1 
HETATM 4872 O  O   . HOH J 8 .   ? 9.468   7.162   37.368  1.00 48.22  ? 459 HOH H O   1 
HETATM 4873 O  O   . HOH J 8 .   ? -9.073  -2.624  2.542   0.60 31.98  ? 460 HOH H O   1 
HETATM 4874 O  O   . HOH J 8 .   ? -19.499 3.006   2.081   1.00 28.79  ? 461 HOH H O   1 
HETATM 4875 O  O   . HOH J 8 .   ? -6.120  1.045   6.938   1.00 38.40  ? 462 HOH H O   1 
HETATM 4876 O  O   . HOH J 8 .   ? -17.956 15.127  17.465  1.00 48.16  ? 463 HOH H O   1 
HETATM 4877 O  O   . HOH J 8 .   ? -3.613  27.322  33.321  0.60 31.62  ? 464 HOH H O   1 
HETATM 4878 O  O   . HOH J 8 .   ? -26.015 9.663   0.849   1.00 24.33  ? 465 HOH H O   1 
HETATM 4879 O  O   . HOH J 8 .   ? 16.965  12.820  33.241  1.00 38.45  ? 466 HOH H O   1 
HETATM 4880 O  O   . HOH J 8 .   ? -6.874  -1.433  24.955  1.00 42.63  ? 467 HOH H O   1 
HETATM 4881 O  O   . HOH J 8 .   ? -43.458 15.404  14.988  0.60 30.26  ? 468 HOH H O   1 
HETATM 4882 O  O   . HOH J 8 .   ? -17.314 9.501   -2.747  1.00 33.53  ? 469 HOH H O   1 
HETATM 4883 O  O   . HOH J 8 .   ? -29.625 27.502  5.529   1.00 34.35  ? 470 HOH H O   1 
HETATM 4884 O  O   . HOH J 8 .   ? -38.055 9.530   8.588   1.00 38.76  ? 471 HOH H O   1 
HETATM 4885 O  O   . HOH J 8 .   ? 6.432   -0.363  8.784   1.00 42.13  ? 472 HOH H O   1 
HETATM 4886 O  O   . HOH J 8 .   ? -12.024 -0.896  -4.882  0.60 34.97  ? 473 HOH H O   1 
HETATM 4887 O  O   . HOH J 8 .   ? 4.380   26.288  35.713  1.00 45.44  ? 474 HOH H O   1 
HETATM 4888 O  O   . HOH J 8 .   ? -30.578 22.367  16.863  1.00 39.08  ? 475 HOH H O   1 
HETATM 4889 O  O   A HOH J 8 .   ? -7.701  17.475  40.963  0.60 32.52  ? 476 HOH H O   1 
HETATM 4890 O  O   B HOH J 8 .   ? -9.249  16.312  40.838  0.40 23.30  ? 476 HOH H O   1 
HETATM 4891 O  O   . HOH J 8 .   ? -17.961 0.621   -0.975  0.60 31.56  ? 477 HOH H O   1 
HETATM 4892 O  O   . HOH J 8 .   ? -10.702 21.669  16.551  0.60 36.71  ? 478 HOH H O   1 
HETATM 4893 O  O   . HOH J 8 .   ? -21.175 20.567  0.555   0.60 35.67  ? 479 HOH H O   1 
HETATM 4894 O  O   . HOH J 8 .   ? 0.000   2.613   0.000   0.50 33.02  ? 480 HOH H O   1 
HETATM 4895 O  O   . HOH J 8 .   ? -22.873 25.806  9.672   1.00 31.53  ? 481 HOH H O   1 
HETATM 4896 O  O   . HOH J 8 .   ? 8.344   25.493  22.824  0.60 41.37  ? 482 HOH H O   1 
HETATM 4897 O  O   . HOH J 8 .   ? -19.450 8.271   18.002  0.60 35.15  ? 483 HOH H O   1 
HETATM 4898 O  O   . HOH J 8 .   ? -19.181 23.776  13.535  1.00 41.04  ? 484 HOH H O   1 
HETATM 4899 O  O   . HOH J 8 .   ? -11.274 6.893   14.924  1.00 39.22  ? 485 HOH H O   1 
HETATM 4900 O  O   . HOH J 8 .   ? -6.992  -0.871  22.379  0.60 39.16  ? 486 HOH H O   1 
HETATM 4901 O  O   . HOH J 8 .   ? -2.282  10.943  -4.007  1.00 37.87  ? 487 HOH H O   1 
HETATM 4902 O  O   . HOH J 8 .   ? -1.798  -5.819  27.834  1.00 45.36  ? 488 HOH H O   1 
HETATM 4903 O  O   . HOH J 8 .   ? -29.906 7.608   21.371  0.60 41.32  ? 489 HOH H O   1 
HETATM 4904 O  O   . HOH J 8 .   ? -3.389  21.254  20.128  1.00 38.86  ? 490 HOH H O   1 
HETATM 4905 O  O   . HOH J 8 .   ? -4.450  2.703   16.035  0.60 32.08  ? 491 HOH H O   1 
HETATM 4906 O  O   . HOH J 8 .   ? -5.454  27.319  37.873  0.60 34.82  ? 492 HOH H O   1 
HETATM 4907 O  O   . HOH J 8 .   ? -33.211 21.511  16.871  0.60 46.42  ? 493 HOH H O   1 
HETATM 4908 O  O   . HOH J 8 .   ? -29.950 25.164  16.320  1.00 49.69  ? 494 HOH H O   1 
HETATM 4909 O  O   . HOH J 8 .   ? -9.639  1.699   22.778  0.60 36.88  ? 495 HOH H O   1 
HETATM 4910 O  O   . HOH J 8 .   ? -17.437 17.609  16.169  1.00 43.24  ? 496 HOH H O   1 
HETATM 4911 O  O   . HOH J 8 .   ? -26.507 25.503  11.984  1.00 32.74  ? 497 HOH H O   1 
HETATM 4912 O  O   A HOH J 8 .   ? -0.977  23.203  22.236  0.50 28.38  ? 498 HOH H O   1 
HETATM 4913 O  O   B HOH J 8 .   ? 0.819   24.408  23.170  0.50 24.99  ? 498 HOH H O   1 
HETATM 4914 O  O   . HOH J 8 .   ? -34.489 22.476  5.833   1.00 39.00  ? 499 HOH H O   1 
HETATM 4915 O  O   . HOH J 8 .   ? -3.612  1.922   11.097  1.00 47.21  ? 500 HOH H O   1 
HETATM 4916 O  O   . HOH J 8 .   ? -21.360 18.290  19.221  0.60 31.82  ? 501 HOH H O   1 
HETATM 4917 O  O   . HOH J 8 .   ? 12.578  7.920   39.501  0.60 38.87  ? 502 HOH H O   1 
HETATM 4918 O  O   . HOH J 8 .   ? -3.448  2.166   7.626   1.00 40.78  ? 503 HOH H O   1 
HETATM 4919 O  O   . HOH J 8 .   ? -11.732 20.881  1.335   0.60 30.30  ? 504 HOH H O   1 
HETATM 4920 O  O   . HOH J 8 .   ? -12.505 4.807   -4.467  1.00 33.74  ? 505 HOH H O   1 
HETATM 4921 O  O   . HOH J 8 .   ? -11.598 11.477  37.407  1.00 46.18  ? 506 HOH H O   1 
HETATM 4922 O  O   . HOH J 8 .   ? -23.032 14.693  18.090  1.00 46.96  ? 507 HOH H O   1 
HETATM 4923 O  O   . HOH J 8 .   ? -16.510 20.856  13.185  0.60 34.54  ? 508 HOH H O   1 
HETATM 4924 O  O   . HOH J 8 .   ? -7.295  3.684   12.579  1.00 41.90  ? 509 HOH H O   1 
HETATM 4925 O  O   . HOH J 8 .   ? 10.519  1.846   5.877   0.60 28.12  ? 510 HOH H O   1 
HETATM 4926 O  O   . HOH J 8 .   ? 2.789   -4.140  28.466  1.00 33.25  ? 511 HOH H O   1 
HETATM 4927 O  O   . HOH J 8 .   ? 16.408  5.729   28.907  0.60 36.05  ? 512 HOH H O   1 
HETATM 4928 O  O   . HOH J 8 .   ? -5.207  24.518  26.396  0.60 33.41  ? 513 HOH H O   1 
HETATM 4929 O  O   . HOH J 8 .   ? -3.950  1.924   3.085   1.00 38.46  ? 514 HOH H O   1 
HETATM 4930 O  O   . HOH J 8 .   ? 0.586   20.063  16.049  1.00 45.93  ? 515 HOH H O   1 
HETATM 4931 O  O   . HOH J 8 .   ? -39.674 7.295   8.603   0.60 28.20  ? 516 HOH H O   1 
HETATM 4932 O  O   . HOH J 8 .   ? -34.741 19.285  -3.590  0.60 41.19  ? 517 HOH H O   1 
HETATM 4933 O  O   . HOH J 8 .   ? 0.000   12.986  0.000   0.50 35.73  ? 518 HOH H O   1 
HETATM 4934 O  O   . HOH J 8 .   ? -3.197  -7.178  25.976  0.60 33.02  ? 519 HOH H O   1 
HETATM 4935 O  O   . HOH J 8 .   ? -0.545  14.137  4.233   1.00 36.96  ? 520 HOH H O   1 
HETATM 4936 O  O   . HOH J 8 .   ? -10.054 14.797  14.795  1.00 25.01  ? 521 HOH H O   1 
HETATM 4937 O  O   . HOH J 8 .   ? -9.429  -2.216  25.084  0.60 34.22  ? 522 HOH H O   1 
HETATM 4938 O  O   . HOH J 8 .   ? 6.878   11.352  3.960   1.00 38.63  ? 523 HOH H O   1 
HETATM 4939 O  O   . HOH J 8 .   ? -8.769  11.213  17.639  1.00 19.23  ? 524 HOH H O   1 
HETATM 4940 O  O   . HOH J 8 .   ? -14.556 3.964   15.713  1.00 47.18  ? 525 HOH H O   1 
HETATM 4941 O  O   . HOH J 8 .   ? 5.628   13.525  7.756   0.60 27.54  ? 526 HOH H O   1 
HETATM 4942 O  O   . HOH J 8 .   ? -12.792 8.257   15.932  1.00 46.48  ? 527 HOH H O   1 
HETATM 4943 O  O   . HOH J 8 .   ? 0.387   19.484  10.878  0.60 50.55  ? 528 HOH H O   1 
HETATM 4944 O  O   . HOH J 8 .   ? -0.937  16.468  2.595   0.60 31.75  ? 529 HOH H O   1 
HETATM 4945 O  O   . HOH J 8 .   ? -33.973 17.407  18.442  1.00 35.35  ? 530 HOH H O   1 
HETATM 4946 O  O   . HOH J 8 .   ? -31.030 14.649  -1.169  0.60 28.69  ? 531 HOH H O   1 
HETATM 4947 O  O   . HOH J 8 .   ? -32.602 18.961  20.124  0.60 32.36  ? 532 HOH H O   1 
HETATM 4948 O  O   . HOH J 8 .   ? -11.022 12.676  16.684  1.00 26.27  ? 533 HOH H O   1 
HETATM 4949 O  O   . HOH J 8 .   ? -9.331  8.503   17.496  0.60 30.84  ? 534 HOH H O   1 
HETATM 4950 O  O   . HOH J 8 .   ? 2.892   -8.826  28.500  0.60 30.56  ? 535 HOH H O   1 
HETATM 4951 O  O   . HOH J 8 .   ? -8.962  5.402   17.370  0.60 35.92  ? 536 HOH H O   1 
HETATM 4952 O  O   . HOH K 8 .   ? 7.772   -10.815 37.184  0.60 35.21  ? 301 HOH L O   1 
HETATM 4953 O  O   . HOH K 8 .   ? -12.591 -7.624  47.218  1.00 38.40  ? 302 HOH L O   1 
HETATM 4954 O  O   . HOH K 8 .   ? 10.604  -2.383  29.594  1.00 42.89  ? 303 HOH L O   1 
HETATM 4955 O  O   . HOH K 8 .   ? 7.056   -4.199  30.129  1.00 33.62  ? 304 HOH L O   1 
HETATM 4956 O  O   . HOH K 8 .   ? -26.446 -10.316 10.602  1.00 28.15  ? 305 HOH L O   1 
HETATM 4957 O  O   . HOH K 8 .   ? -27.092 4.896   -16.385 0.60 35.69  ? 306 HOH L O   1 
HETATM 4958 O  O   . HOH K 8 .   ? -26.894 -8.693  8.578   1.00 33.12  ? 307 HOH L O   1 
HETATM 4959 O  O   . HOH K 8 .   ? -27.397 5.339   32.685  1.00 40.00  ? 308 HOH L O   1 
HETATM 4960 O  O   . HOH K 8 .   ? -29.762 -4.198  32.252  1.00 33.10  ? 309 HOH L O   1 
HETATM 4961 O  O   . HOH K 8 .   ? -26.126 17.358  -1.925  1.00 37.74  ? 310 HOH L O   1 
HETATM 4962 O  O   . HOH K 8 .   ? -18.693 7.267   26.215  1.00 37.80  ? 311 HOH L O   1 
HETATM 4963 O  O   . HOH K 8 .   ? -11.207 -13.901 36.721  0.60 25.55  ? 312 HOH L O   1 
HETATM 4964 O  O   . HOH K 8 .   ? -2.741  -16.991 44.090  1.00 36.30  ? 313 HOH L O   1 
HETATM 4965 O  O   . HOH K 8 .   ? -31.142 10.330  -5.867  0.60 31.27  ? 314 HOH L O   1 
HETATM 4966 O  O   . HOH K 8 .   ? -16.184 -12.306 36.887  1.00 33.87  ? 315 HOH L O   1 
HETATM 4967 O  O   . HOH K 8 .   ? -17.309 6.954   36.305  1.00 37.00  ? 316 HOH L O   1 
HETATM 4968 O  O   . HOH K 8 .   ? 4.717   -15.245 38.335  1.00 41.29  ? 317 HOH L O   1 
HETATM 4969 O  O   . HOH K 8 .   ? -4.059  -0.279  50.294  1.00 36.36  ? 318 HOH L O   1 
HETATM 4970 O  O   . HOH K 8 .   ? -28.580 1.251   35.366  1.00 42.61  ? 319 HOH L O   1 
HETATM 4971 O  O   . HOH K 8 .   ? -38.545 -7.590  1.754   1.00 35.65  ? 320 HOH L O   1 
HETATM 4972 O  O   . HOH K 8 .   ? -20.383 -1.132  23.384  1.00 33.86  ? 321 HOH L O   1 
HETATM 4973 O  O   . HOH K 8 .   ? -29.914 -7.447  38.482  1.00 55.40  ? 322 HOH L O   1 
HETATM 4974 O  O   . HOH K 8 .   ? -10.482 -12.007 42.344  1.00 32.58  ? 323 HOH L O   1 
HETATM 4975 O  O   . HOH K 8 .   ? -17.767 -8.744  -1.561  0.60 30.16  ? 324 HOH L O   1 
HETATM 4976 O  O   . HOH K 8 .   ? -20.631 4.009   29.765  1.00 26.52  ? 325 HOH L O   1 
HETATM 4977 O  O   . HOH K 8 .   ? -20.704 3.409   -0.367  1.00 24.37  ? 326 HOH L O   1 
HETATM 4978 O  O   . HOH K 8 .   ? 0.717   -14.224 40.029  1.00 38.63  ? 327 HOH L O   1 
HETATM 4979 O  O   . HOH K 8 .   ? -21.204 -2.438  19.293  1.00 35.29  ? 328 HOH L O   1 
HETATM 4980 O  O   . HOH K 8 .   ? -8.910  9.675   47.455  1.00 38.17  ? 329 HOH L O   1 
HETATM 4981 O  O   . HOH K 8 .   ? -24.065 -5.898  4.684   0.60 33.21  ? 330 HOH L O   1 
HETATM 4982 O  O   . HOH K 8 .   ? -21.994 -11.493 34.168  0.60 29.78  ? 331 HOH L O   1 
HETATM 4983 O  O   . HOH K 8 .   ? -7.395  -8.851  29.714  1.00 31.57  ? 332 HOH L O   1 
HETATM 4984 O  O   . HOH K 8 .   ? -43.186 -9.412  7.585   1.00 45.93  ? 333 HOH L O   1 
HETATM 4985 O  O   . HOH K 8 .   ? -12.521 -0.123  47.880  1.00 26.43  ? 334 HOH L O   1 
HETATM 4986 O  O   . HOH K 8 .   ? -27.388 -1.313  39.800  0.60 38.46  ? 335 HOH L O   1 
HETATM 4987 O  O   . HOH K 8 .   ? -17.364 -13.746 30.784  0.60 31.61  ? 336 HOH L O   1 
HETATM 4988 O  O   . HOH K 8 .   ? -25.808 -7.363  14.038  1.00 39.08  ? 337 HOH L O   1 
HETATM 4989 O  O   . HOH K 8 .   ? -15.312 6.983   32.789  1.00 33.26  ? 338 HOH L O   1 
HETATM 4990 O  O   . HOH K 8 .   ? -9.339  11.021  32.691  1.00 42.82  ? 339 HOH L O   1 
HETATM 4991 O  O   . HOH K 8 .   ? 0.427   -12.974 46.236  1.00 28.15  ? 340 HOH L O   1 
HETATM 4992 O  O   . HOH K 8 .   ? -15.232 1.546   26.402  1.00 32.00  ? 341 HOH L O   1 
HETATM 4993 O  O   . HOH K 8 .   ? -26.506 -5.802  5.856   1.00 26.55  ? 342 HOH L O   1 
HETATM 4994 O  O   . HOH K 8 .   ? -25.734 3.044   20.516  1.00 29.23  ? 343 HOH L O   1 
HETATM 4995 O  O   . HOH K 8 .   ? -35.757 -13.521 7.746   0.60 34.03  ? 344 HOH L O   1 
HETATM 4996 O  O   . HOH K 8 .   ? 8.142   -7.084  42.905  0.60 32.57  ? 345 HOH L O   1 
HETATM 4997 O  O   . HOH K 8 .   ? -21.595 -7.794  1.427   1.00 27.05  ? 346 HOH L O   1 
HETATM 4998 O  O   . HOH K 8 .   ? -25.567 -7.200  0.047   1.00 19.27  ? 347 HOH L O   1 
HETATM 4999 O  O   . HOH K 8 .   ? 0.691   -12.053 35.223  1.00 28.57  ? 348 HOH L O   1 
HETATM 5000 O  O   . HOH K 8 .   ? -27.818 -5.328  -8.004  1.00 40.26  ? 349 HOH L O   1 
HETATM 5001 O  O   . HOH K 8 .   ? -23.283 -11.115 38.354  0.60 28.99  ? 350 HOH L O   1 
HETATM 5002 O  O   . HOH K 8 .   ? -36.721 -2.743  -12.960 0.60 32.63  ? 351 HOH L O   1 
HETATM 5003 O  O   . HOH K 8 .   ? -27.574 7.298   0.639   1.00 21.46  ? 352 HOH L O   1 
HETATM 5004 O  O   . HOH K 8 .   ? -39.083 5.048   1.550   1.00 45.65  ? 353 HOH L O   1 
HETATM 5005 O  O   . HOH K 8 .   ? -25.903 0.758   28.997  1.00 31.54  ? 354 HOH L O   1 
HETATM 5006 O  O   . HOH K 8 .   ? -28.036 -8.191  1.223   1.00 26.56  ? 355 HOH L O   1 
HETATM 5007 O  O   . HOH K 8 .   ? -10.769 0.616   25.471  1.00 33.96  ? 356 HOH L O   1 
HETATM 5008 O  O   . HOH K 8 .   ? -16.089 -9.405  44.046  0.60 28.98  ? 357 HOH L O   1 
HETATM 5009 O  O   . HOH K 8 .   ? -6.092  -12.353 30.362  0.60 29.08  ? 358 HOH L O   1 
HETATM 5010 O  O   . HOH K 8 .   ? -21.079 -0.909  0.677   1.00 23.28  ? 359 HOH L O   1 
HETATM 5011 O  O   . HOH K 8 .   ? -12.730 -12.280 38.280  1.00 34.54  ? 360 HOH L O   1 
HETATM 5012 O  O   . HOH K 8 .   ? -38.747 -10.790 -1.054  0.60 28.93  ? 361 HOH L O   1 
HETATM 5013 O  O   . HOH K 8 .   ? -22.797 0.807   6.801   1.00 28.32  ? 362 HOH L O   1 
HETATM 5014 O  O   . HOH K 8 .   ? -30.529 10.469  0.808   1.00 34.44  ? 363 HOH L O   1 
HETATM 5015 O  O   . HOH K 8 .   ? -38.877 4.416   7.960   0.60 23.83  ? 364 HOH L O   1 
HETATM 5016 O  O   . HOH K 8 .   ? 11.314  2.083   33.295  0.60 29.30  ? 365 HOH L O   1 
HETATM 5017 O  O   . HOH K 8 .   ? -19.343 0.384   2.273   1.00 31.27  ? 366 HOH L O   1 
HETATM 5018 O  O   . HOH K 8 .   ? -36.843 -12.772 -3.754  1.00 25.99  ? 367 HOH L O   1 
HETATM 5019 O  O   . HOH K 8 .   ? -22.159 -2.119  -9.090  1.00 35.06  ? 368 HOH L O   1 
HETATM 5020 O  O   . HOH K 8 .   ? -22.294 -6.328  11.701  1.00 49.58  ? 369 HOH L O   1 
HETATM 5021 O  O   . HOH K 8 .   ? -12.778 13.987  41.567  0.60 28.21  ? 370 HOH L O   1 
HETATM 5022 O  O   . HOH K 8 .   ? -19.655 4.820   35.768  1.00 30.33  ? 371 HOH L O   1 
HETATM 5023 O  O   . HOH K 8 .   ? -27.093 -12.263 0.850   0.60 28.96  ? 372 HOH L O   1 
HETATM 5024 O  O   . HOH K 8 .   ? -32.513 8.005   -7.046  0.60 28.71  ? 373 HOH L O   1 
HETATM 5025 O  O   . HOH K 8 .   ? -32.480 -6.964  -9.638  1.00 32.77  ? 374 HOH L O   1 
HETATM 5026 O  O   . HOH K 8 .   ? -28.773 -10.495 25.875  0.60 29.78  ? 375 HOH L O   1 
HETATM 5027 O  O   . HOH K 8 .   ? -6.243  -12.818 36.302  1.00 30.43  ? 376 HOH L O   1 
HETATM 5028 O  O   . HOH K 8 .   ? -14.551 10.930  40.370  1.00 36.95  ? 377 HOH L O   1 
HETATM 5029 O  O   . HOH K 8 .   ? -11.977 -3.039  49.861  0.60 26.36  ? 378 HOH L O   1 
HETATM 5030 O  O   . HOH K 8 .   ? -21.938 4.672   25.276  1.00 32.19  ? 379 HOH L O   1 
HETATM 5031 O  O   . HOH K 8 .   ? -0.579  1.874   39.909  1.00 19.91  ? 380 HOH L O   1 
HETATM 5032 O  O   . HOH K 8 .   ? -11.998 11.518  27.736  1.00 38.50  ? 381 HOH L O   1 
HETATM 5033 O  O   . HOH K 8 .   ? -5.640  -14.792 46.201  1.00 32.58  ? 382 HOH L O   1 
HETATM 5034 O  O   . HOH K 8 .   ? -32.246 -10.818 16.903  1.00 31.57  ? 383 HOH L O   1 
HETATM 5035 O  O   . HOH K 8 .   ? -41.136 -7.475  5.401   1.00 29.77  ? 384 HOH L O   1 
HETATM 5036 O  O   . HOH K 8 .   ? 0.975   -6.310  31.837  1.00 29.05  ? 385 HOH L O   1 
HETATM 5037 O  O   . HOH K 8 .   ? -2.207  2.818   43.164  1.00 22.75  ? 386 HOH L O   1 
HETATM 5038 O  O   . HOH K 8 .   ? -33.782 -9.982  6.873   1.00 25.37  ? 387 HOH L O   1 
HETATM 5039 O  O   . HOH K 8 .   ? -22.790 4.273   6.003   1.00 24.70  ? 388 HOH L O   1 
HETATM 5040 O  O   . HOH K 8 .   ? -25.475 9.892   -1.634  1.00 22.78  ? 389 HOH L O   1 
HETATM 5041 O  O   . HOH K 8 .   ? -26.055 -7.920  11.564  1.00 34.46  ? 390 HOH L O   1 
HETATM 5042 O  O   . HOH K 8 .   ? -38.123 -14.614 22.051  1.00 34.89  ? 391 HOH L O   1 
HETATM 5043 O  O   . HOH K 8 .   ? -19.000 -0.812  17.750  1.00 41.34  ? 392 HOH L O   1 
HETATM 5044 O  O   . HOH K 8 .   ? -23.590 -4.676  -6.969  0.60 25.25  ? 393 HOH L O   1 
HETATM 5045 O  O   . HOH K 8 .   ? -7.477  -3.883  43.881  1.00 21.89  ? 394 HOH L O   1 
HETATM 5046 O  O   . HOH K 8 .   ? 3.842   -0.510  30.283  1.00 23.40  ? 395 HOH L O   1 
HETATM 5047 O  O   . HOH K 8 .   ? -7.741  -10.145 45.686  1.00 29.33  ? 396 HOH L O   1 
HETATM 5048 O  O   . HOH K 8 .   ? -12.168 10.327  30.931  0.60 34.55  ? 397 HOH L O   1 
HETATM 5049 O  O   . HOH K 8 .   ? -0.848  -8.493  30.059  0.60 31.40  ? 398 HOH L O   1 
HETATM 5050 O  O   . HOH K 8 .   ? 7.369   -3.668  35.560  1.00 26.52  ? 399 HOH L O   1 
HETATM 5051 O  O   . HOH K 8 .   ? -20.369 4.104   18.890  1.00 37.66  ? 400 HOH L O   1 
HETATM 5052 O  O   . HOH K 8 .   ? -21.866 3.795   8.667   1.00 26.29  ? 401 HOH L O   1 
HETATM 5053 O  O   . HOH K 8 .   ? -25.403 -9.648  -5.290  1.00 37.65  ? 402 HOH L O   1 
HETATM 5054 O  O   A HOH K 8 .   ? -36.078 1.291   18.487  0.50 25.53  ? 403 HOH L O   1 
HETATM 5055 O  O   B HOH K 8 .   ? -36.484 2.763   17.888  0.50 29.14  ? 403 HOH L O   1 
HETATM 5056 O  O   . HOH K 8 .   ? 5.460   -5.529  50.989  1.00 31.64  ? 404 HOH L O   1 
HETATM 5057 O  O   . HOH K 8 .   ? -13.156 -5.711  45.151  1.00 27.70  ? 405 HOH L O   1 
HETATM 5058 O  O   . HOH K 8 .   ? -1.909  -11.768 46.751  1.00 29.85  ? 406 HOH L O   1 
HETATM 5059 O  O   . HOH K 8 .   ? -21.030 -2.669  25.525  1.00 31.88  ? 407 HOH L O   1 
HETATM 5060 O  O   . HOH K 8 .   ? -4.257  -8.919  31.026  1.00 27.09  ? 408 HOH L O   1 
HETATM 5061 O  O   . HOH K 8 .   ? -20.414 -12.774 30.785  1.00 32.75  ? 409 HOH L O   1 
HETATM 5062 O  O   . HOH K 8 .   ? -18.202 -3.083  45.283  0.60 24.99  ? 410 HOH L O   1 
HETATM 5063 O  O   . HOH K 8 .   ? -13.208 9.798   20.731  0.60 36.69  ? 411 HOH L O   1 
HETATM 5064 O  O   . HOH K 8 .   ? -13.862 7.045   30.441  1.00 21.09  ? 412 HOH L O   1 
HETATM 5065 O  O   . HOH K 8 .   ? -21.683 -8.067  -5.162  1.00 29.87  ? 413 HOH L O   1 
HETATM 5066 O  O   . HOH K 8 .   ? -24.569 -6.408  25.389  1.00 41.32  ? 414 HOH L O   1 
HETATM 5067 O  O   . HOH K 8 .   ? -26.228 -8.091  21.990  1.00 30.33  ? 415 HOH L O   1 
HETATM 5068 O  O   . HOH K 8 .   ? -36.604 -5.044  -4.080  1.00 24.55  ? 416 HOH L O   1 
HETATM 5069 O  O   . HOH K 8 .   ? -18.680 -2.289  26.936  1.00 31.24  ? 417 HOH L O   1 
HETATM 5070 O  O   . HOH K 8 .   ? -40.840 0.991   -2.949  1.00 38.55  ? 418 HOH L O   1 
HETATM 5071 O  O   . HOH K 8 .   ? -1.012  -15.340 41.435  1.00 34.61  ? 419 HOH L O   1 
HETATM 5072 O  O   . HOH K 8 .   ? -39.583 -4.053  -9.510  0.60 38.00  ? 420 HOH L O   1 
HETATM 5073 O  O   . HOH K 8 .   ? -28.591 2.753   20.284  1.00 27.19  ? 421 HOH L O   1 
HETATM 5074 O  O   . HOH K 8 .   ? -24.305 6.659   25.239  1.00 34.09  ? 422 HOH L O   1 
HETATM 5075 O  O   . HOH K 8 .   ? -29.923 -1.550  31.176  1.00 41.88  ? 423 HOH L O   1 
HETATM 5076 O  O   . HOH K 8 .   ? -10.965 -7.447  26.715  1.00 51.11  ? 424 HOH L O   1 
HETATM 5077 O  O   . HOH K 8 .   ? -30.092 4.424   32.633  1.00 45.49  ? 425 HOH L O   1 
HETATM 5078 O  O   . HOH K 8 .   ? -16.873 9.552   39.690  1.00 42.07  ? 426 HOH L O   1 
HETATM 5079 O  O   . HOH K 8 .   ? -23.216 6.841   37.971  0.60 32.39  ? 427 HOH L O   1 
HETATM 5080 O  O   . HOH K 8 .   ? 11.688  -1.824  39.016  0.60 30.64  ? 428 HOH L O   1 
HETATM 5081 O  O   . HOH K 8 .   ? -36.518 6.832   1.744   1.00 43.01  ? 429 HOH L O   1 
HETATM 5082 O  O   . HOH K 8 .   ? -23.521 6.875   40.872  0.60 36.22  ? 430 HOH L O   1 
HETATM 5083 O  O   . HOH K 8 .   ? -42.666 -1.280  6.807   1.00 38.93  ? 431 HOH L O   1 
HETATM 5084 O  O   . HOH K 8 .   ? 0.350   3.301   43.934  1.00 27.34  ? 432 HOH L O   1 
HETATM 5085 O  O   . HOH K 8 .   ? -21.669 7.428   30.973  1.00 35.52  ? 433 HOH L O   1 
HETATM 5086 O  O   . HOH K 8 .   ? -4.927  -3.443  50.268  1.00 26.37  ? 434 HOH L O   1 
HETATM 5087 O  O   . HOH K 8 .   ? -1.523  -3.781  28.733  0.60 31.89  ? 435 HOH L O   1 
HETATM 5088 O  O   . HOH K 8 .   ? -19.166 -2.003  13.497  1.00 32.32  ? 436 HOH L O   1 
HETATM 5089 O  O   . HOH K 8 .   ? -39.502 0.438   11.624  1.00 29.24  ? 437 HOH L O   1 
HETATM 5090 O  O   . HOH K 8 .   ? -33.644 5.251   29.660  0.60 42.72  ? 438 HOH L O   1 
HETATM 5091 O  O   . HOH K 8 .   ? 8.591   -9.873  31.759  0.60 41.44  ? 439 HOH L O   1 
HETATM 5092 O  O   . HOH K 8 .   ? -27.868 13.263  -10.165 1.00 38.11  ? 440 HOH L O   1 
HETATM 5093 O  O   . HOH K 8 .   ? -21.692 3.725   -13.679 1.00 39.58  ? 441 HOH L O   1 
HETATM 5094 O  O   . HOH K 8 .   ? -23.266 -9.818  1.530   1.00 34.44  ? 442 HOH L O   1 
HETATM 5095 O  O   . HOH K 8 .   ? -37.031 -9.290  26.740  1.00 38.51  ? 443 HOH L O   1 
HETATM 5096 O  O   . HOH K 8 .   ? -20.566 -9.858  36.049  1.00 47.68  ? 444 HOH L O   1 
HETATM 5097 O  O   . HOH K 8 .   ? -25.315 -12.589 31.452  1.00 48.10  ? 445 HOH L O   1 
HETATM 5098 O  O   . HOH K 8 .   ? -32.331 11.232  -3.615  0.60 33.88  ? 446 HOH L O   1 
HETATM 5099 O  O   . HOH K 8 .   ? -29.464 -4.800  42.874  0.60 38.79  ? 447 HOH L O   1 
HETATM 5100 O  O   . HOH K 8 .   ? -16.301 8.954   32.433  0.60 29.48  ? 448 HOH L O   1 
HETATM 5101 O  O   . HOH K 8 .   ? -18.503 -11.097 37.497  1.00 29.45  ? 449 HOH L O   1 
HETATM 5102 O  O   . HOH K 8 .   ? -19.213 8.212   -4.109  1.00 25.08  ? 450 HOH L O   1 
HETATM 5103 O  O   . HOH K 8 .   ? -31.737 7.887   19.759  1.00 37.92  ? 451 HOH L O   1 
HETATM 5104 O  O   . HOH K 8 .   ? -42.667 -4.244  6.616   1.00 39.36  ? 452 HOH L O   1 
HETATM 5105 O  O   . HOH K 8 .   ? -7.540  -5.164  50.411  1.00 35.13  ? 453 HOH L O   1 
HETATM 5106 O  O   . HOH K 8 .   ? -43.253 -7.095  16.220  0.60 34.43  ? 454 HOH L O   1 
HETATM 5107 O  O   . HOH K 8 .   ? -19.743 -5.536  6.922   1.00 32.27  ? 455 HOH L O   1 
HETATM 5108 O  O   . HOH K 8 .   ? -24.885 -10.642 40.849  1.00 47.28  ? 456 HOH L O   1 
HETATM 5109 O  O   . HOH K 8 .   ? -35.981 7.108   5.940   0.60 26.93  ? 457 HOH L O   1 
HETATM 5110 O  O   . HOH K 8 .   ? -37.838 -10.942 12.543  0.60 26.97  ? 458 HOH L O   1 
HETATM 5111 O  O   . HOH K 8 .   ? -26.032 -10.075 13.382  1.00 43.34  ? 459 HOH L O   1 
HETATM 5112 O  O   . HOH K 8 .   ? -12.033 4.455   49.718  1.00 32.81  ? 460 HOH L O   1 
HETATM 5113 O  O   . HOH K 8 .   ? -8.908  11.399  45.441  1.00 37.93  ? 461 HOH L O   1 
HETATM 5114 O  O   . HOH K 8 .   ? -18.706 -5.342  0.072   1.00 49.39  ? 462 HOH L O   1 
HETATM 5115 O  O   . HOH K 8 .   ? -34.221 -3.702  30.011  1.00 35.49  ? 463 HOH L O   1 
HETATM 5116 O  O   . HOH K 8 .   ? -41.044 1.618   3.101   1.00 36.12  ? 464 HOH L O   1 
HETATM 5117 O  O   . HOH K 8 .   ? -30.615 14.394  -3.643  1.00 37.47  ? 465 HOH L O   1 
HETATM 5118 O  O   . HOH K 8 .   ? 3.593   4.413   44.360  1.00 29.34  ? 466 HOH L O   1 
HETATM 5119 O  O   . HOH K 8 .   ? 9.734   -4.109  37.125  1.00 33.21  ? 467 HOH L O   1 
HETATM 5120 O  O   . HOH K 8 .   ? -39.524 -11.850 -7.841  1.00 33.35  ? 468 HOH L O   1 
HETATM 5121 O  O   . HOH K 8 .   ? -8.394  -9.475  48.287  1.00 25.58  ? 469 HOH L O   1 
HETATM 5122 O  O   . HOH K 8 .   ? -29.833 -11.653 39.036  0.60 40.47  ? 470 HOH L O   1 
HETATM 5123 O  O   . HOH K 8 .   ? -37.060 -13.055 5.238   0.60 35.61  ? 471 HOH L O   1 
HETATM 5124 O  O   . HOH K 8 .   ? 9.989   -1.347  43.946  1.00 50.40  ? 472 HOH L O   1 
HETATM 5125 O  O   . HOH K 8 .   ? -20.074 -2.767  -3.286  1.00 28.77  ? 473 HOH L O   1 
HETATM 5126 O  O   . HOH K 8 .   ? -37.645 4.834   5.659   1.00 24.17  ? 474 HOH L O   1 
HETATM 5127 O  O   . HOH K 8 .   ? -13.943 -13.545 28.939  1.00 39.35  ? 475 HOH L O   1 
HETATM 5128 O  O   . HOH K 8 .   ? 6.695   2.622   38.375  1.00 34.15  ? 476 HOH L O   1 
HETATM 5129 O  O   . HOH K 8 .   ? -11.205 5.520   23.508  1.00 34.60  ? 477 HOH L O   1 
HETATM 5130 O  O   . HOH K 8 .   ? -41.983 -15.184 15.081  1.00 47.10  ? 478 HOH L O   1 
HETATM 5131 O  O   . HOH K 8 .   ? -27.668 16.027  -3.474  1.00 36.49  ? 479 HOH L O   1 
HETATM 5132 O  O   . HOH K 8 .   ? -17.286 -5.724  5.429   1.00 45.82  ? 480 HOH L O   1 
HETATM 5133 O  O   . HOH K 8 .   ? -40.578 5.613   -3.286  1.00 31.99  ? 481 HOH L O   1 
HETATM 5134 O  O   . HOH K 8 .   ? -31.822 -8.170  31.671  1.00 41.83  ? 482 HOH L O   1 
HETATM 5135 O  O   . HOH K 8 .   ? -23.011 3.532   44.077  1.00 30.61  ? 483 HOH L O   1 
HETATM 5136 O  O   . HOH K 8 .   ? -39.722 -3.349  21.234  0.60 30.03  ? 484 HOH L O   1 
HETATM 5137 O  O   . HOH K 8 .   ? -12.352 12.029  24.040  1.00 39.92  ? 485 HOH L O   1 
HETATM 5138 O  O   A HOH K 8 .   ? 4.876   -6.885  47.904  0.50 21.94  ? 486 HOH L O   1 
HETATM 5139 O  O   . HOH K 8 .   ? -19.847 -2.863  -0.595  1.00 27.99  ? 487 HOH L O   1 
HETATM 5140 O  O   . HOH K 8 .   ? -40.691 -3.535  -1.392  1.00 39.02  ? 488 HOH L O   1 
HETATM 5141 O  O   . HOH K 8 .   ? 10.196  -6.782  29.584  1.00 54.46  ? 489 HOH L O   1 
HETATM 5142 O  O   . HOH K 8 .   ? -33.372 -15.244 23.824  0.50 29.31  ? 490 HOH L O   1 
HETATM 5143 O  O   . HOH K 8 .   ? -10.983 -14.674 30.336  1.00 48.85  ? 491 HOH L O   1 
HETATM 5144 O  O   . HOH K 8 .   ? -35.953 5.776   16.109  1.00 30.98  ? 492 HOH L O   1 
HETATM 5145 O  O   . HOH K 8 .   ? -16.794 -0.653  25.962  1.00 32.94  ? 493 HOH L O   1 
HETATM 5146 O  O   . HOH K 8 .   ? -1.519  -1.830  52.251  1.00 35.34  ? 494 HOH L O   1 
HETATM 5147 O  O   . HOH K 8 .   ? -18.447 -10.375 23.360  0.60 38.19  ? 495 HOH L O   1 
HETATM 5148 O  O   . HOH K 8 .   ? 6.983   -3.585  49.825  1.00 38.68  ? 496 HOH L O   1 
HETATM 5149 O  O   . HOH K 8 .   ? -42.443 -9.953  18.527  0.60 45.21  ? 497 HOH L O   1 
HETATM 5150 O  O   . HOH K 8 .   ? -7.139  -8.377  50.405  1.00 34.08  ? 498 HOH L O   1 
HETATM 5151 O  O   . HOH K 8 .   ? -25.475 -8.449  -7.194  1.00 33.52  ? 499 HOH L O   1 
HETATM 5152 O  O   . HOH K 8 .   ? -33.667 13.919  -4.905  0.60 45.28  ? 500 HOH L O   1 
HETATM 5153 O  O   . HOH K 8 .   ? -42.595 1.990   0.683   1.00 46.45  ? 501 HOH L O   1 
HETATM 5154 O  O   . HOH K 8 .   ? 1.316   -15.967 43.723  1.00 47.35  ? 502 HOH L O   1 
HETATM 5155 O  O   . HOH K 8 .   ? 8.651   4.619   37.119  1.00 50.20  ? 503 HOH L O   1 
HETATM 5156 O  O   A HOH K 8 .   ? -31.388 -12.643 18.775  0.50 23.95  ? 504 HOH L O   1 
HETATM 5157 O  O   B HOH K 8 .   ? -38.007 -12.039 22.866  0.50 31.69  ? 504 HOH L O   1 
HETATM 5158 O  O   . HOH K 8 .   ? -9.848  -4.081  50.815  0.60 35.58  ? 505 HOH L O   1 
HETATM 5159 O  O   . HOH K 8 .   ? -41.406 -12.380 18.426  0.60 35.39  ? 506 HOH L O   1 
HETATM 5160 O  O   . HOH K 8 .   ? -24.705 5.559   21.520  1.00 46.73  ? 507 HOH L O   1 
HETATM 5161 O  O   . HOH K 8 .   ? -39.662 -5.837  -7.644  1.00 38.90  ? 508 HOH L O   1 
HETATM 5162 O  O   . HOH K 8 .   ? -24.486 -9.912  9.121   0.60 33.28  ? 509 HOH L O   1 
HETATM 5163 O  O   . HOH K 8 .   ? -20.531 1.545   6.480   0.60 32.12  ? 510 HOH L O   1 
HETATM 5164 O  O   . HOH K 8 .   ? -23.125 -7.489  -7.404  0.60 30.70  ? 511 HOH L O   1 
HETATM 5165 O  O   . HOH K 8 .   ? -12.711 -15.190 35.073  1.00 42.62  ? 512 HOH L O   1 
HETATM 5166 O  O   . HOH K 8 .   ? -0.124  -14.161 37.012  1.00 44.10  ? 513 HOH L O   1 
HETATM 5167 O  O   . HOH K 8 .   ? -31.642 -12.796 12.765  1.00 49.83  ? 514 HOH L O   1 
HETATM 5168 O  O   . HOH K 8 .   ? -39.166 -13.092 11.969  1.00 46.30  ? 515 HOH L O   1 
HETATM 5169 O  O   . HOH K 8 .   ? -19.910 -5.248  11.947  0.60 35.66  ? 516 HOH L O   1 
HETATM 5170 O  O   . HOH K 8 .   ? -5.109  0.554   52.479  0.60 32.64  ? 517 HOH L O   1 
HETATM 5171 O  O   . HOH K 8 .   ? -14.493 -2.075  23.801  1.00 44.07  ? 518 HOH L O   1 
HETATM 5172 O  O   . HOH K 8 .   ? -21.732 -7.090  6.119   0.60 36.75  ? 519 HOH L O   1 
HETATM 5173 O  O   . HOH K 8 .   ? -19.315 6.324   37.677  0.60 32.26  ? 520 HOH L O   1 
HETATM 5174 O  O   . HOH K 8 .   ? -13.311 7.764   49.742  0.60 48.46  ? 521 HOH L O   1 
HETATM 5175 O  O   . HOH K 8 .   ? 6.893   -8.407  30.254  0.60 33.09  ? 522 HOH L O   1 
HETATM 5176 O  O   . HOH K 8 .   ? -40.184 -5.515  -5.372  0.60 28.83  ? 523 HOH L O   1 
HETATM 5177 O  O   . HOH K 8 .   ? -12.553 -13.086 43.449  1.00 37.22  ? 524 HOH L O   1 
HETATM 5178 O  O   . HOH K 8 .   ? 3.216   -6.437  30.103  1.00 34.31  ? 525 HOH L O   1 
HETATM 5179 O  O   . HOH K 8 .   ? -12.919 -10.612 46.956  0.60 36.10  ? 526 HOH L O   1 
HETATM 5180 O  O   . HOH K 8 .   ? 2.600   -13.646 34.037  1.00 36.83  ? 527 HOH L O   1 
HETATM 5181 O  O   . HOH K 8 .   ? -35.060 8.159   -5.562  1.00 44.79  ? 528 HOH L O   1 
HETATM 5182 O  O   . HOH K 8 .   ? -20.630 5.625   27.331  1.00 38.65  ? 529 HOH L O   1 
HETATM 5183 O  O   . HOH K 8 .   ? -7.613  -13.051 45.566  1.00 29.13  ? 530 HOH L O   1 
HETATM 5184 O  O   . HOH K 8 .   ? -14.488 -13.901 39.812  0.60 35.96  ? 531 HOH L O   1 
HETATM 5185 O  O   . HOH K 8 .   ? -13.402 -1.223  50.097  1.00 38.74  ? 532 HOH L O   1 
HETATM 5186 O  O   . HOH K 8 .   ? -2.238  -15.470 36.223  0.60 28.74  ? 533 HOH L O   1 
HETATM 5187 O  O   . HOH K 8 .   ? -38.185 -14.358 9.275   1.00 47.83  ? 534 HOH L O   1 
HETATM 5188 O  O   . HOH K 8 .   ? -38.923 -5.212  -2.756  0.60 31.32  ? 535 HOH L O   1 
HETATM 5189 O  O   . HOH K 8 .   ? -14.961 -14.665 35.243  1.00 44.26  ? 536 HOH L O   1 
HETATM 5190 O  O   . HOH K 8 .   ? -7.712  -13.497 42.961  0.60 29.60  ? 537 HOH L O   1 
HETATM 5191 O  O   . HOH K 8 .   ? -32.497 8.330   -9.739  0.60 29.49  ? 538 HOH L O   1 
HETATM 5192 O  O   . HOH K 8 .   ? -4.731  -15.188 36.023  1.00 33.92  ? 539 HOH L O   1 
HETATM 5193 O  O   . HOH K 8 .   ? -18.140 -1.020  -3.996  0.60 32.40  ? 540 HOH L O   1 
HETATM 5194 O  O   . HOH K 8 .   ? -11.525 -16.041 32.769  0.60 37.50  ? 541 HOH L O   1 
HETATM 5195 O  O   . HOH K 8 .   ? -14.148 -11.778 44.846  0.60 29.20  ? 542 HOH L O   1 
HETATM 5196 O  O   . HOH K 8 .   ? -40.310 4.974   13.032  0.60 42.25  ? 543 HOH L O   1 
HETATM 5197 O  O   . HOH K 8 .   ? -30.718 -0.070  33.211  1.00 41.06  ? 544 HOH L O   1 
HETATM 5198 O  O   . HOH K 8 .   ? -21.850 -14.157 28.535  0.60 38.41  ? 545 HOH L O   1 
HETATM 5199 O  O   . HOH K 8 .   ? -21.164 6.156   22.727  1.00 39.56  ? 546 HOH L O   1 
HETATM 5200 O  O   . HOH K 8 .   ? 2.477   -15.540 36.366  0.60 38.90  ? 547 HOH L O   1 
HETATM 5201 O  O   . HOH K 8 .   ? -13.214 -14.217 26.148  0.60 34.25  ? 548 HOH L O   1 
HETATM 5202 O  O   . HOH K 8 .   ? -21.863 -7.474  -10.079 1.00 51.30  ? 549 HOH L O   1 
HETATM 5203 O  O   . HOH K 8 .   ? -12.671 -3.911  24.033  0.60 37.00  ? 550 HOH L O   1 
HETATM 5204 O  O   . HOH K 8 .   ? -40.683 -14.707 7.440   0.60 40.96  ? 551 HOH L O   1 
HETATM 5205 O  O   . HOH K 8 .   ? -43.287 -4.496  13.562  0.60 35.13  ? 552 HOH L O   1 
HETATM 5206 O  O   . HOH K 8 .   ? -5.324  -16.455 33.159  1.00 38.32  ? 553 HOH L O   1 
HETATM 5207 O  O   . HOH K 8 .   ? -11.819 -15.144 45.191  0.60 34.90  ? 554 HOH L O   1 
HETATM 5208 O  O   . HOH K 8 .   ? -32.926 -0.850  34.248  0.60 33.97  ? 555 HOH L 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   . LEU A 11  ? 0.7966 0.6441 0.8801 0.1224  -0.2853 0.0428  39  LEU A N   
2    C CA  . LEU A 11  ? 0.7647 0.5964 0.7994 0.1088  -0.2524 0.0388  39  LEU A CA  
3    C C   . LEU A 11  ? 0.7340 0.5687 0.7748 0.1260  -0.2265 0.0338  39  LEU A C   
4    O O   . LEU A 11  ? 0.7118 0.5905 0.8107 0.1397  -0.2093 0.0310  39  LEU A O   
5    C CB  . LEU A 11  ? 0.7481 0.6145 0.8024 0.0904  -0.2344 0.0374  39  LEU A CB  
6    C CG  . LEU A 11  ? 0.7760 0.6286 0.8077 0.0708  -0.2557 0.0401  39  LEU A CG  
7    C CD1 . LEU A 11  ? 0.7386 0.6115 0.7718 0.0531  -0.2329 0.0374  39  LEU A CD1 
8    C CD2 . LEU A 11  ? 0.8276 0.6197 0.7820 0.0629  -0.2715 0.0419  39  LEU A CD2 
9    N N   . THR A 12  ? 0.7228 0.5103 0.7023 0.1235  -0.2219 0.0325  40  THR A N   
10   C CA  . THR A 12  ? 0.7008 0.4763 0.6698 0.1376  -0.2011 0.0269  40  THR A CA  
11   C C   . THR A 12  ? 0.6293 0.4000 0.5635 0.1190  -0.1747 0.0233  40  THR A C   
12   O O   . THR A 12  ? 0.6011 0.3461 0.4900 0.0985  -0.1774 0.0254  40  THR A O   
13   C CB  . THR A 12  ? 0.7759 0.4973 0.7057 0.1499  -0.2220 0.0286  40  THR A CB  
14   O OG1 . THR A 12  ? 0.8480 0.5263 0.7136 0.1265  -0.2306 0.0331  40  THR A OG1 
15   C CG2 . THR A 12  ? 0.7875 0.5121 0.7530 0.1697  -0.2531 0.0327  40  THR A CG2 
16   N N   . PRO A 13  ? 0.5875 0.3824 0.5419 0.1260  -0.1480 0.0177  41  PRO A N   
17   C CA  . PRO A 13  ? 0.5508 0.3420 0.4754 0.1097  -0.1269 0.0145  41  PRO A CA  
18   C C   . PRO A 13  ? 0.5744 0.3140 0.4400 0.1025  -0.1317 0.0134  41  PRO A C   
19   O O   . PRO A 13  ? 0.5997 0.3079 0.4504 0.1163  -0.1430 0.0130  41  PRO A O   
20   C CB  . PRO A 13  ? 0.5420 0.3592 0.4934 0.1233  -0.1014 0.0091  41  PRO A CB  
21   C CG  . PRO A 13  ? 0.5805 0.4059 0.5683 0.1503  -0.1057 0.0076  41  PRO A CG  
22   C CD  . PRO A 13  ? 0.5854 0.4101 0.5899 0.1505  -0.1364 0.0140  41  PRO A CD  
23   N N   . LEU A 14  ? 0.5527 0.2834 0.3880 0.0807  -0.1248 0.0135  42  LEU A N   
24   C CA  . LEU A 14  ? 0.5750 0.2629 0.3616 0.0709  -0.1252 0.0122  42  LEU A CA  
25   C C   . LEU A 14  ? 0.5751 0.2549 0.3568 0.0835  -0.1122 0.0050  42  LEU A C   
26   O O   . LEU A 14  ? 0.5551 0.2668 0.3628 0.0902  -0.0959 0.0014  42  LEU A O   
27   C CB  . LEU A 14  ? 0.5602 0.2502 0.3277 0.0454  -0.1182 0.0132  42  LEU A CB  
28   C CG  . LEU A 14  ? 0.5813 0.2538 0.3252 0.0292  -0.1288 0.0191  42  LEU A CG  
29   C CD1 . LEU A 14  ? 0.5661 0.2630 0.3357 0.0326  -0.1372 0.0221  42  LEU A CD1 
30   C CD2 . LEU A 14  ? 0.5761 0.2509 0.3040 0.0062  -0.1169 0.0185  42  LEU A CD2 
31   N N   . ALA A 15  ? 0.6155 0.2490 0.3590 0.0848  -0.1190 0.0031  43  ALA A N   
32   C CA  . ALA A 15  ? 0.6353 0.2464 0.3590 0.0945  -0.1096 -0.0048 43  ALA A CA  
33   C C   . ALA A 15  ? 0.6202 0.2327 0.3255 0.0725  -0.1014 -0.0069 43  ALA A C   
34   O O   . ALA A 15  ? 0.6020 0.2209 0.3033 0.0500  -0.1049 -0.0020 43  ALA A O   
35   C CB  . ALA A 15  ? 0.6923 0.2483 0.3803 0.1030  -0.1234 -0.0060 43  ALA A CB  
36   N N   . TYR A 16  ? 0.6383 0.2420 0.3309 0.0798  -0.0913 -0.0144 44  TYR A N   
37   C CA  . TYR A 16  ? 0.6297 0.2302 0.3037 0.0611  -0.0882 -0.0170 44  TYR A CA  
38   C C   . TYR A 16  ? 0.6357 0.2023 0.2807 0.0391  -0.1024 -0.0141 44  TYR A C   
39   O O   . TYR A 16  ? 0.6765 0.1995 0.2940 0.0444  -0.1121 -0.0150 44  TYR A O   
40   C CB  . TYR A 16  ? 0.6673 0.2507 0.3209 0.0754  -0.0784 -0.0259 44  TYR A CB  
41   C CG  . TYR A 16  ? 0.6757 0.2576 0.3121 0.0588  -0.0784 -0.0285 44  TYR A CG  
42   C CD1 . TYR A 16  ? 0.6432 0.2653 0.3060 0.0447  -0.0755 -0.0236 44  TYR A CD1 
43   C CD2 . TYR A 16  ? 0.7335 0.2704 0.3261 0.0575  -0.0844 -0.0360 44  TYR A CD2 
44   C CE1 . TYR A 16  ? 0.6473 0.2686 0.2983 0.0308  -0.0793 -0.0254 44  TYR A CE1 
45   C CE2 . TYR A 16  ? 0.7336 0.2686 0.3120 0.0417  -0.0897 -0.0378 44  TYR A CE2 
46   C CZ  . TYR A 16  ? 0.6972 0.2761 0.3072 0.0288  -0.0877 -0.0322 44  TYR A CZ  
47   O OH  . TYR A 16  ? 0.7101 0.2903 0.3122 0.0149  -0.0958 -0.0334 44  TYR A OH  
48   N N   . LYS A 17  ? 0.5901 0.1779 0.2446 0.0158  -0.1023 -0.0105 45  LYS A N   
49   C CA  . LYS A 17  ? 0.6079 0.1774 0.2463 -0.0103 -0.1104 -0.0069 45  LYS A CA  
50   C C   . LYS A 17  ? 0.6262 0.1848 0.2592 -0.0171 -0.1151 0.0011  45  LYS A C   
51   O O   . LYS A 17  ? 0.6526 0.1969 0.2722 -0.0403 -0.1178 0.0055  45  LYS A O   
52   C CB  . LYS A 17  ? 0.6583 0.1806 0.2604 -0.0156 -0.1201 -0.0119 45  LYS A CB  
53   C CG  . LYS A 17  ? 0.6608 0.1864 0.2582 -0.0118 -0.1184 -0.0198 45  LYS A CG  
54   C CD  . LYS A 17  ? 0.6242 0.1857 0.2461 -0.0316 -0.1181 -0.0182 45  LYS A CD  
55   C CE  . LYS A 17  ? 0.6364 0.1925 0.2454 -0.0270 -0.1211 -0.0253 45  LYS A CE  
56   N NZ  . LYS A 17  ? 0.6088 0.1937 0.2406 -0.0454 -0.1268 -0.0241 45  LYS A NZ  
57   N N   . GLN A 18  ? 0.6259 0.1945 0.2716 0.0009  -0.1156 0.0033  46  GLN A N   
58   C CA  . GLN A 18  ? 0.6469 0.1994 0.2808 -0.0039 -0.1239 0.0114  46  GLN A CA  
59   C C   . GLN A 18  ? 0.6122 0.1946 0.2590 -0.0242 -0.1156 0.0155  46  GLN A C   
60   O O   . GLN A 18  ? 0.5521 0.1776 0.2304 -0.0229 -0.1057 0.0123  46  GLN A O   
61   C CB  . GLN A 18  ? 0.6595 0.2185 0.3092 0.0202  -0.1307 0.0127  46  GLN A CB  
62   C CG  . GLN A 18  ? 0.6948 0.2301 0.3251 0.0156  -0.1444 0.0213  46  GLN A CG  
63   C CD  . GLN A 18  ? 0.7163 0.2506 0.3625 0.0417  -0.1578 0.0222  46  GLN A CD  
64   O OE1 . GLN A 18  ? 0.7208 0.2848 0.4031 0.0622  -0.1522 0.0166  46  GLN A OE1 
65   N NE2 . GLN A 18  ? 0.7593 0.2595 0.3791 0.0402  -0.1761 0.0301  46  GLN A NE2 
66   N N   . PHE A 19  ? 0.6438 0.2020 0.2647 -0.0411 -0.1185 0.0224  47  PHE A N   
67   C CA  . PHE A 19  ? 0.6304 0.2122 0.2582 -0.0583 -0.1079 0.0256  47  PHE A CA  
68   C C   . PHE A 19  ? 0.6646 0.2178 0.2622 -0.0599 -0.1161 0.0331  47  PHE A C   
69   O O   . PHE A 19  ? 0.7101 0.2155 0.2712 -0.0612 -0.1277 0.0383  47  PHE A O   
70   C CB  . PHE A 19  ? 0.6485 0.2338 0.2747 -0.0839 -0.0966 0.0259  47  PHE A CB  
71   C CG  . PHE A 19  ? 0.7233 0.2616 0.3151 -0.0983 -0.1029 0.0300  47  PHE A CG  
72   C CD1 . PHE A 19  ? 0.7382 0.2607 0.3276 -0.0957 -0.1104 0.0254  47  PHE A CD1 
73   C CD2 . PHE A 19  ? 0.7724 0.2744 0.3268 -0.1140 -0.1027 0.0388  47  PHE A CD2 
74   C CE1 . PHE A 19  ? 0.8020 0.2755 0.3571 -0.1098 -0.1184 0.0291  47  PHE A CE1 
75   C CE2 . PHE A 19  ? 0.8304 0.2837 0.3501 -0.1286 -0.1094 0.0438  47  PHE A CE2 
76   C CZ  . PHE A 19  ? 0.8532 0.2921 0.3746 -0.1265 -0.1181 0.0388  47  PHE A CZ  
77   N N   . ILE A 20  ? 0.6473 0.2257 0.2567 -0.0602 -0.1113 0.0332  48  ILE A N   
78   C CA  . ILE A 20  ? 0.6904 0.2427 0.2687 -0.0610 -0.1213 0.0395  48  ILE A CA  
79   C C   . ILE A 20  ? 0.6937 0.2594 0.2643 -0.0789 -0.1041 0.0394  48  ILE A C   
80   O O   . ILE A 20  ? 0.6312 0.2395 0.2367 -0.0772 -0.0927 0.0333  48  ILE A O   
81   C CB  . ILE A 20  ? 0.6778 0.2435 0.2788 -0.0377 -0.1381 0.0383  48  ILE A CB  
82   C CG1 . ILE A 20  ? 0.6989 0.2479 0.3057 -0.0182 -0.1521 0.0380  48  ILE A CG1 
83   C CG2 . ILE A 20  ? 0.7148 0.2562 0.2855 -0.0396 -0.1520 0.0439  48  ILE A CG2 
84   C CD1 . ILE A 20  ? 0.6790 0.2563 0.3266 0.0056  -0.1628 0.0354  48  ILE A CD1 
85   N N   . PRO A 21  ? 0.7701 0.2957 0.2913 -0.0959 -0.1009 0.0462  49  PRO A N   
86   C CA  . PRO A 21  ? 0.8276 0.2960 0.3020 -0.0981 -0.1167 0.0548  49  PRO A CA  
87   C C   . PRO A 21  ? 0.8399 0.2989 0.3183 -0.1067 -0.1120 0.0550  49  PRO A C   
88   O O   . PRO A 21  ? 0.7814 0.2786 0.2948 -0.1144 -0.0958 0.0493  49  PRO A O   
89   C CB  . PRO A 21  ? 0.8919 0.3230 0.3104 -0.1183 -0.1080 0.0619  49  PRO A CB  
90   C CG  . PRO A 21  ? 0.8613 0.3353 0.3053 -0.1325 -0.0780 0.0559  49  PRO A CG  
91   C CD  . PRO A 21  ? 0.7925 0.3221 0.2965 -0.1138 -0.0801 0.0462  49  PRO A CD  
92   N N   . ASN A 22  ? 0.9138 0.3192 0.3539 -0.1055 -0.1285 0.0616  50  ASN A N   
93   C CA  . ASN A 22  ? 0.9510 0.3253 0.3785 -0.1122 -0.1324 0.0632  50  ASN A CA  
94   C C   . ASN A 22  ? 0.9633 0.3286 0.3759 -0.1457 -0.1129 0.0674  50  ASN A C   
95   O O   . ASN A 22  ? 1.0345 0.3500 0.4122 -0.1573 -0.1203 0.0736  50  ASN A O   
96   C CB  . ASN A 22  ? 1.0793 0.3840 0.4526 -0.1073 -0.1548 0.0723  50  ASN A CB  
97   C CG  . ASN A 22  ? 1.1126 0.4073 0.4992 -0.0744 -0.1785 0.0684  50  ASN A CG  
98   O OD1 . ASN A 22  ? 1.1512 0.4097 0.5090 -0.0605 -0.2012 0.0751  50  ASN A OD1 
99   N ND2 . ASN A 22  ? 1.1332 0.4564 0.5597 -0.0610 -0.1749 0.0582  50  ASN A ND2 
100  N N   . VAL A 23  ? 0.9165 0.3253 0.3545 -0.1611 -0.0892 0.0647  51  VAL A N   
101  C CA  . VAL A 23  ? 0.9320 0.3425 0.3662 -0.1939 -0.0666 0.0689  51  VAL A CA  
102  C C   . VAL A 23  ? 0.8697 0.3473 0.3677 -0.1966 -0.0508 0.0595  51  VAL A C   
103  O O   . VAL A 23  ? 0.8255 0.3407 0.3579 -0.1745 -0.0555 0.0513  51  VAL A O   
104  C CB  . VAL A 23  ? 0.9803 0.3689 0.3715 -0.2101 -0.0503 0.0768  51  VAL A CB  
105  C CG1 . VAL A 23  ? 1.0543 0.3683 0.3749 -0.2094 -0.0692 0.0879  51  VAL A CG1 
106  C CG2 . VAL A 23  ? 0.9342 0.3620 0.3442 -0.1968 -0.0411 0.0701  51  VAL A CG2 
107  N N   . ALA A 24  ? 0.8863 0.3780 0.4007 -0.2235 -0.0334 0.0613  52  ALA A N   
108  C CA  . ALA A 24  ? 0.8347 0.3895 0.4130 -0.2276 -0.0210 0.0531  52  ALA A CA  
109  C C   . ALA A 24  ? 0.7985 0.3941 0.3974 -0.2168 -0.0043 0.0479  52  ALA A C   
110  O O   . ALA A 24  ? 0.8237 0.3971 0.3839 -0.2205 0.0070  0.0525  52  ALA A O   
111  C CB  . ALA A 24  ? 0.8570 0.4191 0.4519 -0.2602 -0.0062 0.0573  52  ALA A CB  
112  N N   . GLU A 25  ? 0.7354 0.3822 0.3872 -0.2035 -0.0048 0.0387  53  GLU A N   
113  C CA  . GLU A 25  ? 0.6960 0.3818 0.3723 -0.1897 0.0070  0.0321  53  GLU A CA  
114  C C   . GLU A 25  ? 0.7221 0.4185 0.3960 -0.2077 0.0370  0.0337  53  GLU A C   
115  O O   . GLU A 25  ? 0.7173 0.4101 0.3706 -0.1996 0.0470  0.0318  53  GLU A O   
116  C CB  . GLU A 25  ? 0.6346 0.3699 0.3688 -0.1789 0.0026  0.0237  53  GLU A CB  
117  C CG  . GLU A 25  ? 0.5991 0.3705 0.3581 -0.1652 0.0142  0.0171  53  GLU A CG  
118  C CD  . GLU A 25  ? 0.5458 0.3574 0.3534 -0.1511 0.0054  0.0099  53  GLU A CD  
119  O OE1 . GLU A 25  ? 0.5312 0.3594 0.3688 -0.1597 0.0000  0.0090  53  GLU A OE1 
120  O OE2 . GLU A 25  ? 0.5069 0.3301 0.3203 -0.1329 0.0026  0.0058  53  GLU A OE2 
121  N N   . LYS A 26  ? 0.7361 0.4483 0.4343 -0.2312 0.0520  0.0361  54  LYS A N   
122  C CA  . LYS A 26  ? 0.7651 0.5030 0.4787 -0.2461 0.0862  0.0353  54  LYS A CA  
123  C C   . LYS A 26  ? 0.8212 0.5081 0.4705 -0.2666 0.1025  0.0456  54  LYS A C   
124  O O   . LYS A 26  ? 0.8491 0.5530 0.5072 -0.2835 0.1352  0.0463  54  LYS A O   
125  C CB  . LYS A 26  ? 0.7557 0.5477 0.5416 -0.2585 0.0945  0.0318  54  LYS A CB  
126  C CG  . LYS A 26  ? 0.7221 0.5515 0.5566 -0.2361 0.0730  0.0228  54  LYS A CG  
127  C CD  . LYS A 26  ? 0.7046 0.5963 0.6147 -0.2385 0.0828  0.0164  54  LYS A CD  
128  C CE  . LYS A 26  ? 0.6651 0.5776 0.6098 -0.2214 0.0537  0.0108  54  LYS A CE  
129  N NZ  . LYS A 26  ? 0.6543 0.6051 0.6603 -0.2361 0.0478  0.0096  54  LYS A NZ  
130  N N   . THR A 27  ? 0.8519 0.4788 0.4386 -0.2632 0.0817  0.0529  55  THR A N   
131  C CA  . THR A 27  ? 0.9332 0.4994 0.4452 -0.2803 0.0918  0.0640  55  THR A CA  
132  C C   . THR A 27  ? 0.9603 0.5069 0.4271 -0.2662 0.0978  0.0616  55  THR A C   
133  O O   . THR A 27  ? 0.9229 0.4908 0.4087 -0.2402 0.0831  0.0528  55  THR A O   
134  C CB  . THR A 27  ? 0.9685 0.4717 0.4298 -0.2821 0.0628  0.0737  55  THR A CB  
135  O OG1 . THR A 27  ? 0.9418 0.4340 0.3942 -0.2515 0.0323  0.0694  55  THR A OG1 
136  C CG2 . THR A 27  ? 0.9673 0.4741 0.4582 -0.2979 0.0540  0.0764  55  THR A CG2 
137  N N   . LEU A 28  ? 1.0381 0.5386 0.4405 -0.2841 0.1167  0.0699  56  LEU A N   
138  C CA  . LEU A 28  ? 1.0788 0.5562 0.4301 -0.2765 0.1288  0.0672  56  LEU A CA  
139  C C   . LEU A 28  ? 1.0693 0.5199 0.3935 -0.2497 0.0902  0.0652  56  LEU A C   
140  O O   . LEU A 28  ? 1.0777 0.5425 0.4031 -0.2337 0.0918  0.0562  56  LEU A O   
141  C CB  . LEU A 28  ? 1.1790 0.5973 0.4524 -0.3029 0.1514  0.0792  56  LEU A CB  
142  C CG  . LEU A 28  ? 1.2420 0.6214 0.4446 -0.2977 0.1630  0.0772  56  LEU A CG  
143  C CD1 . LEU A 28  ? 1.2148 0.6500 0.4613 -0.2906 0.1968  0.0629  56  LEU A CD1 
144  C CD2 . LEU A 28  ? 1.3451 0.6540 0.4581 -0.3246 0.1817  0.0914  56  LEU A CD2 
145  N N   . GLY A 29  ? 1.0759 0.4910 0.3810 -0.2445 0.0568  0.0728  57  GLY A N   
146  C CA  . GLY A 29  ? 1.0716 0.4604 0.3538 -0.2200 0.0196  0.0725  57  GLY A CA  
147  C C   . GLY A 29  ? 0.9909 0.4370 0.3437 -0.1956 0.0053  0.0612  57  GLY A C   
148  O O   . GLY A 29  ? 0.9917 0.4296 0.3400 -0.1751 -0.0216 0.0594  57  GLY A O   
149  N N   . ALA A 30  ? 0.9324 0.4341 0.3500 -0.1982 0.0209  0.0546  58  ALA A N   
150  C CA  . ALA A 30  ? 0.8499 0.4034 0.3315 -0.1769 0.0092  0.0449  58  ALA A CA  
151  C C   . ALA A 30  ? 0.8101 0.4065 0.3222 -0.1744 0.0325  0.0352  58  ALA A C   
152  O O   . ALA A 30  ? 0.8431 0.4179 0.3160 -0.1711 0.0363  0.0335  58  ALA A O   
153  C CB  . ALA A 30  ? 0.8197 0.3928 0.3419 -0.1797 0.0028  0.0452  58  ALA A CB  
154  N N   . SER A 31  ? 0.7566 0.4044 0.3290 -0.1768 0.0468  0.0293  59  SER A N   
155  C CA  . SER A 31  ? 0.7239 0.4159 0.3347 -0.1704 0.0667  0.0191  59  SER A CA  
156  C C   . SER A 31  ? 0.7473 0.4523 0.3637 -0.1905 0.1023  0.0189  59  SER A C   
157  O O   . SER A 31  ? 0.7381 0.4715 0.3762 -0.1852 0.1234  0.0104  59  SER A O   
158  C CB  . SER A 31  ? 0.6542 0.3940 0.3295 -0.1561 0.0554  0.0126  59  SER A CB  
159  O OG  . SER A 31  ? 0.6363 0.3676 0.3070 -0.1371 0.0293  0.0119  59  SER A OG  
160  N N   . GLY A 32  ? 0.7936 0.4782 0.3926 -0.2129 0.1098  0.0280  60  GLY A N   
161  C CA  . GLY A 32  ? 0.8367 0.5325 0.4404 -0.2359 0.1470  0.0298  60  GLY A CA  
162  C C   . GLY A 32  ? 0.8025 0.5662 0.4915 -0.2377 0.1602  0.0229  60  GLY A C   
163  O O   . GLY A 32  ? 0.7431 0.5375 0.4791 -0.2218 0.1369  0.0178  60  GLY A O   
164  N N   . ARG A 33  ? 0.8576 0.6441 0.5674 -0.2567 0.1961  0.0232  61  ARG A N   
165  C CA  . ARG A 33  ? 0.8524 0.6968 0.6439 -0.2687 0.2042  0.0216  61  ARG A CA  
166  C C   . ARG A 33  ? 0.8080 0.7123 0.6695 -0.2460 0.2051  0.0086  61  ARG A C   
167  O O   . ARG A 33  ? 0.7831 0.6864 0.6290 -0.2267 0.2153  0.0004  61  ARG A O   
168  C CB  . ARG A 33  ? 0.9331 0.7830 0.7275 -0.2992 0.2431  0.0278  61  ARG A CB  
169  C CG  . ARG A 33  ? 0.9657 0.8510 0.7839 -0.2948 0.2858  0.0189  61  ARG A CG  
170  C CD  . ARG A 33  ? 1.0391 0.9296 0.8585 -0.3265 0.3295  0.0258  61  ARG A CD  
171  N NE  . ARG A 33  ? 1.0806 0.9909 0.9024 -0.3171 0.3721  0.0160  61  ARG A NE  
172  C CZ  . ARG A 33  ? 1.0573 1.0336 0.9590 -0.2999 0.3864  0.0031  61  ARG A CZ  
173  N NH1 . ARG A 33  ? 0.9950 1.0253 0.9819 -0.2920 0.3601  -0.0003 61  ARG A NH1 
174  N NH2 . ARG A 33  ? 1.0985 1.0827 0.9910 -0.2896 0.4266  -0.0065 61  ARG A NH2 
175  N N   . TYR A 34  ? 0.7740 0.7233 0.7065 -0.2490 0.1914  0.0073  62  TYR A N   
176  C CA  . TYR A 34  ? 0.7299 0.7407 0.7414 -0.2322 0.1894  -0.0029 62  TYR A CA  
177  C C   . TYR A 34  ? 0.7582 0.8086 0.8076 -0.2361 0.2328  -0.0088 62  TYR A C   
178  O O   . TYR A 34  ? 0.7918 0.8566 0.8609 -0.2622 0.2574  -0.0033 62  TYR A O   
179  C CB  . TYR A 34  ? 0.6973 0.7350 0.7632 -0.2421 0.1629  -0.0001 62  TYR A CB  
180  C CG  . TYR A 34  ? 0.6592 0.7509 0.7994 -0.2238 0.1495  -0.0088 62  TYR A CG  
181  C CD1 . TYR A 34  ? 0.6390 0.7247 0.7694 -0.1954 0.1281  -0.0148 62  TYR A CD1 
182  C CD2 . TYR A 34  ? 0.6611 0.8088 0.8822 -0.2355 0.1563  -0.0105 62  TYR A CD2 
183  C CE1 . TYR A 34  ? 0.6093 0.7373 0.8006 -0.1783 0.1138  -0.0217 62  TYR A CE1 
184  C CE2 . TYR A 34  ? 0.6316 0.8255 0.9196 -0.2172 0.1392  -0.0180 62  TYR A CE2 
185  C CZ  . TYR A 34  ? 0.6042 0.7851 0.8734 -0.1882 0.1175  -0.0233 62  TYR A CZ  
186  O OH  . TYR A 34  ? 0.5804 0.7992 0.9077 -0.1696 0.0992  -0.0296 62  TYR A OH  
187  N N   . GLU A 35  ? 0.7598 0.8255 0.8183 -0.2110 0.2437  -0.0198 63  GLU A N   
188  C CA  . GLU A 35  ? 0.7946 0.8960 0.8871 -0.2084 0.2875  -0.0283 63  GLU A CA  
189  C C   . GLU A 35  ? 0.7421 0.9134 0.9360 -0.1941 0.2813  -0.0366 63  GLU A C   
190  O O   . GLU A 35  ? 0.7639 0.9715 0.9984 -0.1819 0.3132  -0.0468 63  GLU A O   
191  C CB  . GLU A 35  ? 0.8413 0.9023 0.8661 -0.1902 0.3027  -0.0356 63  GLU A CB  
192  C CG  . GLU A 35  ? 0.9134 0.9031 0.8389 -0.2038 0.2998  -0.0262 63  GLU A CG  
193  C CD  . GLU A 35  ? 0.9860 0.9297 0.8361 -0.1937 0.3200  -0.0322 63  GLU A CD  
194  O OE1 . GLU A 35  ? 1.0095 0.9745 0.8808 -0.1749 0.3400  -0.0451 63  GLU A OE1 
195  O OE2 . GLU A 35  ? 1.0589 0.9420 0.8267 -0.2041 0.3135  -0.0241 63  GLU A OE2 
196  N N   . GLY A 36  ? 0.6934 0.8787 0.9224 -0.1931 0.2404  -0.0331 64  GLY A N   
197  C CA  . GLY A 36  ? 0.6532 0.9015 0.9787 -0.1855 0.2270  -0.0379 64  GLY A CA  
198  C C   . GLY A 36  ? 0.6175 0.8694 0.9539 -0.1527 0.1996  -0.0458 64  GLY A C   
199  O O   . GLY A 36  ? 0.6260 0.8413 0.9060 -0.1352 0.2023  -0.0499 64  GLY A O   
200  N N   . LYS A 37  ? 0.5918 0.8836 0.9971 -0.1464 0.1721  -0.0471 65  LYS A N   
201  C CA  . LYS A 37  ? 0.5696 0.8617 0.9861 -0.1184 0.1389  -0.0519 65  LYS A CA  
202  C C   . LYS A 37  ? 0.5649 0.8708 0.9964 -0.0912 0.1608  -0.0635 65  LYS A C   
203  O O   . LYS A 37  ? 0.5697 0.9159 1.0513 -0.0917 0.1944  -0.0695 65  LYS A O   
204  C CB  . LYS A 37  ? 0.5661 0.8984 1.0549 -0.1221 0.1069  -0.0500 65  LYS A CB  
205  C CG  . LYS A 37  ? 0.5615 0.8978 1.0697 -0.0953 0.0718  -0.0539 65  LYS A CG  
206  C CD  . LYS A 37  ? 0.5755 0.9469 1.1497 -0.1019 0.0379  -0.0514 65  LYS A CD  
207  C CE  . LYS A 37  ? 0.5796 0.9367 1.1495 -0.0802 -0.0043 -0.0517 65  LYS A CE  
208  N NZ  . LYS A 37  ? 0.5993 0.9299 1.1428 -0.0954 -0.0419 -0.0442 65  LYS A NZ  
209  N N   . ILE A 38  ? 0.5459 0.8180 0.9353 -0.0688 0.1433  -0.0665 66  ILE A N   
210  C CA  . ILE A 38  ? 0.5413 0.8184 0.9425 -0.0396 0.1539  -0.0778 66  ILE A CA  
211  C C   . ILE A 38  ? 0.5070 0.8009 0.9520 -0.0198 0.1166  -0.0789 66  ILE A C   
212  O O   . ILE A 38  ? 0.4726 0.7352 0.8807 -0.0191 0.0836  -0.0722 66  ILE A O   
213  C CB  . ILE A 38  ? 0.5537 0.7737 0.8697 -0.0318 0.1615  -0.0800 66  ILE A CB  
214  C CG1 . ILE A 38  ? 0.5892 0.7884 0.8579 -0.0493 0.1983  -0.0796 66  ILE A CG1 
215  C CG2 . ILE A 38  ? 0.5561 0.7725 0.8794 -0.0021 0.1632  -0.0910 66  ILE A CG2 
216  C CD1 . ILE A 38  ? 0.6072 0.7454 0.7871 -0.0465 0.1968  -0.0793 66  ILE A CD1 
217  N N   . SER A 39  ? 0.5089 0.8496 1.0294 -0.0033 0.1223  -0.0869 67  SER A N   
218  C CA  . SER A 39  ? 0.5113 0.8648 1.0731 0.0194  0.0866  -0.0885 67  SER A CA  
219  C C   . SER A 39  ? 0.5283 0.8648 1.0784 0.0499  0.0963  -0.0990 67  SER A C   
220  O O   . SER A 39  ? 0.5377 0.8637 1.0625 0.0535  0.1342  -0.1071 67  SER A O   
221  C CB  . SER A 39  ? 0.5111 0.9280 1.1713 0.0173  0.0764  -0.0891 67  SER A CB  
222  O OG  . SER A 39  ? 0.5212 0.9764 1.2474 0.0436  0.0908  -0.1005 67  SER A OG  
223  N N   . ARG A 40  ? 0.5285 0.8569 1.0910 0.0704  0.0617  -0.0986 68  ARG A N   
224  C CA  . ARG A 40  ? 0.5692 0.8717 1.1163 0.1001  0.0596  -0.1066 68  ARG A CA  
225  C C   . ARG A 40  ? 0.6242 0.9670 1.2345 0.1204  0.0916  -0.1210 68  ARG A C   
226  O O   . ARG A 40  ? 0.6617 0.9764 1.2436 0.1409  0.1077  -0.1309 68  ARG A O   
227  C CB  . ARG A 40  ? 0.5448 0.8333 1.0973 0.1122  0.0120  -0.0998 68  ARG A CB  
228  C CG  . ARG A 40  ? 0.5561 0.7980 1.0673 0.1353  0.0005  -0.1026 68  ARG A CG  
229  C CD  . ARG A 40  ? 0.5436 0.7688 1.0553 0.1438  -0.0458 -0.0936 68  ARG A CD  
230  N NE  . ARG A 40  ? 0.5216 0.7062 0.9656 0.1247  -0.0643 -0.0812 68  ARG A NE  
231  C CZ  . ARG A 40  ? 0.5157 0.6513 0.8902 0.1220  -0.0606 -0.0782 68  ARG A CZ  
232  N NH1 . ARG A 40  ? 0.5344 0.6501 0.8908 0.1352  -0.0412 -0.0868 68  ARG A NH1 
233  N NH2 . ARG A 40  ? 0.5025 0.6091 0.8262 0.1057  -0.0756 -0.0671 68  ARG A NH2 
234  N N   . ASN A 41  ? 0.6624 1.0683 1.3563 0.1145  0.1007  -0.1223 69  ASN A N   
235  C CA  . ASN A 41  ? 0.7198 1.1783 1.4896 0.1306  0.1374  -0.1357 69  ASN A CA  
236  C C   . ASN A 41  ? 0.7572 1.2004 1.4799 0.1207  0.1916  -0.1427 69  ASN A C   
237  O O   . ASN A 41  ? 0.7711 1.2130 1.4990 0.1443  0.2223  -0.1569 69  ASN A O   
238  C CB  . ASN A 41  ? 0.7187 1.2508 1.5903 0.1187  0.1319  -0.1324 69  ASN A CB  
239  C CG  . ASN A 41  ? 0.7521 1.3491 1.7233 0.1399  0.1617  -0.1456 69  ASN A CG  
240  O OD1 . ASN A 41  ? 0.8057 1.3931 1.7801 0.1723  0.1757  -0.1582 69  ASN A OD1 
241  N ND2 . ASN A 41  ? 0.7508 1.4153 1.8084 0.1224  0.1707  -0.1431 69  ASN A ND2 
242  N N   . SER A 42  ? 0.7560 1.1820 1.4285 0.0878  0.2011  -0.1331 70  SER A N   
243  C CA  . SER A 42  ? 0.7726 1.1943 1.4118 0.0695  0.2514  -0.1360 70  SER A CA  
244  C C   . SER A 42  ? 0.7864 1.1619 1.3610 0.0885  0.2811  -0.1486 70  SER A C   
245  O O   . SER A 42  ? 0.7921 1.1235 1.3241 0.1077  0.2564  -0.1514 70  SER A O   
246  C CB  . SER A 42  ? 0.7634 1.1541 1.3401 0.0353  0.2430  -0.1220 70  SER A CB  
247  O OG  . SER A 42  ? 0.7917 1.1156 1.2777 0.0385  0.2227  -0.1188 70  SER A OG  
248  N N   . GLU A 43  ? 0.7936 1.1740 1.3547 0.0804  0.3322  -0.1553 71  GLU A N   
249  C CA  . GLU A 43  ? 0.8291 1.1533 1.3063 0.0904  0.3631  -0.1662 71  GLU A CA  
250  C C   . GLU A 43  ? 0.8154 1.0717 1.1882 0.0698  0.3425  -0.1554 71  GLU A C   
251  O O   . GLU A 43  ? 0.8554 1.0553 1.1592 0.0828  0.3356  -0.1613 71  GLU A O   
252  C CB  . GLU A 43  ? 0.8778 1.2252 1.3662 0.0845  0.4250  -0.1749 71  GLU A CB  
253  C CG  . GLU A 43  ? 0.9410 1.2339 1.3530 0.1022  0.4588  -0.1903 71  GLU A CG  
254  C CD  . GLU A 43  ? 0.9549 1.2549 1.4048 0.1438  0.4636  -0.2085 71  GLU A CD  
255  O OE1 . GLU A 43  ? 0.9201 1.2223 1.4007 0.1619  0.4190  -0.2071 71  GLU A OE1 
256  O OE2 . GLU A 43  ? 1.0020 1.3010 1.4460 0.1586  0.5127  -0.2243 71  GLU A OE2 
257  N N   . ARG A 44  ? 0.7710 1.0325 1.1357 0.0394  0.3304  -0.1403 72  ARG A N   
258  C CA  . ARG A 44  ? 0.7641 0.9658 1.0369 0.0199  0.3110  -0.1294 72  ARG A CA  
259  C C   . ARG A 44  ? 0.7143 0.8876 0.9670 0.0317  0.2621  -0.1251 72  ARG A C   
260  O O   . ARG A 44  ? 0.7123 0.8349 0.8909 0.0210  0.2452  -0.1182 72  ARG A O   
261  C CB  . ARG A 44  ? 0.7571 0.9726 1.0328 -0.0133 0.3110  -0.1151 72  ARG A CB  
262  C CG  . ARG A 44  ? 0.8115 1.0110 1.0431 -0.0334 0.3562  -0.1149 72  ARG A CG  
263  C CD  . ARG A 44  ? 0.8083 1.0290 1.0588 -0.0662 0.3596  -0.1011 72  ARG A CD  
264  N NE  . ARG A 44  ? 0.8040 0.9797 0.9933 -0.0834 0.3257  -0.0877 72  ARG A NE  
265  C CZ  . ARG A 44  ? 0.7726 0.9641 0.9917 -0.0971 0.2931  -0.0768 72  ARG A CZ  
266  N NH1 . ARG A 44  ? 0.7642 0.9101 0.9219 -0.1092 0.2669  -0.0665 72  ARG A NH1 
267  N NH2 . ARG A 44  ? 0.7463 0.9971 1.0553 -0.0982 0.2858  -0.0767 72  ARG A NH2 
268  N N   . PHE A 45  ? 0.6721 0.8748 0.9868 0.0525  0.2397  -0.1284 73  PHE A N   
269  C CA  . PHE A 45  ? 0.6463 0.8212 0.9430 0.0644  0.1959  -0.1240 73  PHE A CA  
270  C C   . PHE A 45  ? 0.6799 0.7950 0.9020 0.0754  0.1976  -0.1306 73  PHE A C   
271  O O   . PHE A 45  ? 0.6493 0.7274 0.8270 0.0714  0.1677  -0.1229 73  PHE A O   
272  C CB  . PHE A 45  ? 0.6208 0.8319 0.9922 0.0876  0.1760  -0.1278 73  PHE A CB  
273  C CG  . PHE A 45  ? 0.5912 0.7747 0.9440 0.0948  0.1314  -0.1201 73  PHE A CG  
274  C CD1 . PHE A 45  ? 0.5545 0.7292 0.8869 0.0753  0.1044  -0.1062 73  PHE A CD1 
275  C CD2 . PHE A 45  ? 0.6080 0.7717 0.9618 0.1212  0.1178  -0.1267 73  PHE A CD2 
276  C CE1 . PHE A 45  ? 0.5469 0.6959 0.8599 0.0812  0.0680  -0.0989 73  PHE A CE1 
277  C CE2 . PHE A 45  ? 0.5874 0.7237 0.9215 0.1254  0.0791  -0.1182 73  PHE A CE2 
278  C CZ  . PHE A 45  ? 0.5609 0.6911 0.8746 0.1050  0.0559  -0.1042 73  PHE A CZ  
279  N N   . LYS A 46  ? 0.7366 0.8433 0.9473 0.0883  0.2326  -0.1448 74  LYS A N   
280  C CA  . LYS A 46  ? 0.7914 0.8394 0.9326 0.1009  0.2385  -0.1550 74  LYS A CA  
281  C C   . LYS A 46  ? 0.8056 0.8038 0.8607 0.0781  0.2366  -0.1480 74  LYS A C   
282  O O   . LYS A 46  ? 0.8222 0.7688 0.8195 0.0829  0.2218  -0.1508 74  LYS A O   
283  C CB  . LYS A 46  ? 0.8620 0.9170 1.0148 0.1196  0.2819  -0.1730 74  LYS A CB  
284  C CG  . LYS A 46  ? 0.8685 0.9832 1.1189 0.1426  0.2900  -0.1808 74  LYS A CG  
285  C CD  . LYS A 46  ? 0.8454 0.9681 1.1379 0.1599  0.2459  -0.1766 74  LYS A CD  
286  C CE  . LYS A 46  ? 0.8573 1.0320 1.2419 0.1876  0.2535  -0.1866 74  LYS A CE  
287  N NZ  . LYS A 46  ? 0.8677 1.0170 1.2576 0.2152  0.2216  -0.1904 74  LYS A NZ  
288  N N   . GLU A 47  ? 0.7987 0.8103 0.8471 0.0537  0.2479  -0.1386 75  GLU A N   
289  C CA  . GLU A 47  ? 0.8226 0.7884 0.7936 0.0318  0.2405  -0.1297 75  GLU A CA  
290  C C   . GLU A 47  ? 0.7669 0.7193 0.7289 0.0262  0.1956  -0.1172 75  GLU A C   
291  O O   . GLU A 47  ? 0.7567 0.6690 0.6583 0.0130  0.1827  -0.1106 75  GLU A O   
292  C CB  . GLU A 47  ? 0.8451 0.8295 0.8172 0.0082  0.2639  -0.1221 75  GLU A CB  
293  C CG  . GLU A 47  ? 0.8996 0.9120 0.8990 0.0111  0.3122  -0.1323 75  GLU A CG  
294  C CD  . GLU A 47  ? 0.9453 0.9576 0.9207 -0.0157 0.3409  -0.1248 75  GLU A CD  
295  O OE1 . GLU A 47  ? 0.9899 1.0317 0.9948 -0.0169 0.3840  -0.1314 75  GLU A OE1 
296  O OE2 . GLU A 47  ? 0.9554 0.9366 0.8822 -0.0353 0.3213  -0.1123 75  GLU A OE2 
297  N N   . LEU A 48  ? 0.7194 0.7045 0.7397 0.0353  0.1728  -0.1135 76  LEU A N   
298  C CA  . LEU A 48  ? 0.6626 0.6365 0.6773 0.0325  0.1339  -0.1025 76  LEU A CA  
299  C C   . LEU A 48  ? 0.6649 0.6068 0.6599 0.0494  0.1184  -0.1082 76  LEU A C   
300  O O   . LEU A 48  ? 0.6889 0.6396 0.7126 0.0692  0.1261  -0.1184 76  LEU A O   
301  C CB  . LEU A 48  ? 0.6205 0.6383 0.6988 0.0330  0.1171  -0.0956 76  LEU A CB  
302  C CG  . LEU A 48  ? 0.6231 0.6743 0.7292 0.0150  0.1286  -0.0898 76  LEU A CG  
303  C CD1 . LEU A 48  ? 0.5976 0.6851 0.7614 0.0163  0.1052  -0.0838 76  LEU A CD1 
304  C CD2 . LEU A 48  ? 0.6221 0.6441 0.6731 -0.0061 0.1265  -0.0807 76  LEU A CD2 
305  N N   . THR A 49  ? 0.6495 0.5561 0.6000 0.0414  0.0968  -0.1014 77  THR A N   
306  C CA  . THR A 49  ? 0.6589 0.5274 0.5813 0.0511  0.0806  -0.1050 77  THR A CA  
307  C C   . THR A 49  ? 0.5774 0.4461 0.5076 0.0454  0.0497  -0.0919 77  THR A C   
308  O O   . THR A 49  ? 0.5480 0.4243 0.4728 0.0308  0.0417  -0.0816 77  THR A O   
309  C CB  . THR A 49  ? 0.7229 0.5453 0.5793 0.0439  0.0877  -0.1104 77  THR A CB  
310  O OG1 . THR A 49  ? 0.7938 0.5807 0.6289 0.0516  0.0693  -0.1137 77  THR A OG1 
311  C CG2 . THR A 49  ? 0.7279 0.5410 0.5530 0.0235  0.0789  -0.0995 77  THR A CG2 
312  N N   . PRO A 50  ? 0.5427 0.4009 0.4840 0.0569  0.0328  -0.0917 78  PRO A N   
313  C CA  . PRO A 50  ? 0.5017 0.3587 0.4473 0.0505  0.0077  -0.0786 78  PRO A CA  
314  C C   . PRO A 50  ? 0.4883 0.3136 0.3933 0.0374  -0.0046 -0.0731 78  PRO A C   
315  O O   . PRO A 50  ? 0.5283 0.3204 0.4030 0.0394  -0.0045 -0.0803 78  PRO A O   
316  C CB  . PRO A 50  ? 0.5119 0.3614 0.4768 0.0670  -0.0036 -0.0805 78  PRO A CB  
317  C CG  . PRO A 50  ? 0.5629 0.3903 0.5141 0.0807  0.0110  -0.0958 78  PRO A CG  
318  C CD  . PRO A 50  ? 0.5719 0.4161 0.5200 0.0768  0.0379  -0.1035 78  PRO A CD  
319  N N   . ASN A 51  ? 0.4477 0.2830 0.3546 0.0254  -0.0162 -0.0611 79  ASN A N   
320  C CA  . ASN A 51  ? 0.4434 0.2581 0.3254 0.0132  -0.0300 -0.0541 79  ASN A CA  
321  C C   . ASN A 51  ? 0.4340 0.2389 0.3247 0.0144  -0.0457 -0.0471 79  ASN A C   
322  O O   . ASN A 51  ? 0.4082 0.2313 0.3208 0.0164  -0.0499 -0.0394 79  ASN A O   
323  C CB  . ASN A 51  ? 0.4321 0.2631 0.3135 0.0018  -0.0310 -0.0460 79  ASN A CB  
324  C CG  . ASN A 51  ? 0.4452 0.2611 0.3098 -0.0088 -0.0452 -0.0394 79  ASN A CG  
325  O OD1 . ASN A 51  ? 0.4554 0.2628 0.3249 -0.0105 -0.0567 -0.0349 79  ASN A OD1 
326  N ND2 . ASN A 51  ? 0.4441 0.2573 0.2916 -0.0165 -0.0454 -0.0378 79  ASN A ND2 
327  N N   . TYR A 52  ? 0.4441 0.2173 0.3148 0.0121  -0.0546 -0.0494 80  TYR A N   
328  C CA  . TYR A 52  ? 0.4514 0.2095 0.3264 0.0097  -0.0687 -0.0416 80  TYR A CA  
329  C C   . TYR A 52  ? 0.4502 0.2000 0.3173 -0.0072 -0.0805 -0.0333 80  TYR A C   
330  O O   . TYR A 52  ? 0.4615 0.1885 0.3239 -0.0134 -0.0918 -0.0295 80  TYR A O   
331  C CB  . TYR A 52  ? 0.4872 0.2138 0.3514 0.0212  -0.0708 -0.0506 80  TYR A CB  
332  C CG  . TYR A 52  ? 0.4922 0.2325 0.3773 0.0399  -0.0626 -0.0563 80  TYR A CG  
333  C CD1 . TYR A 52  ? 0.4765 0.2337 0.3849 0.0439  -0.0690 -0.0468 80  TYR A CD1 
334  C CD2 . TYR A 52  ? 0.5183 0.2544 0.4008 0.0540  -0.0490 -0.0711 80  TYR A CD2 
335  C CE1 . TYR A 52  ? 0.4763 0.2479 0.4089 0.0612  -0.0665 -0.0514 80  TYR A CE1 
336  C CE2 . TYR A 52  ? 0.5329 0.2883 0.4455 0.0721  -0.0422 -0.0763 80  TYR A CE2 
337  C CZ  . TYR A 52  ? 0.4995 0.2746 0.4397 0.0753  -0.0532 -0.0661 80  TYR A CZ  
338  O OH  . TYR A 52  ? 0.5057 0.3007 0.4795 0.0933  -0.0510 -0.0710 80  TYR A OH  
339  N N   . ASN A 53  ? 0.4316 0.1997 0.3000 -0.0148 -0.0790 -0.0302 81  ASN A N   
340  C CA  . ASN A 53  ? 0.4316 0.2003 0.3030 -0.0292 -0.0912 -0.0221 81  ASN A CA  
341  C C   . ASN A 53  ? 0.4222 0.2021 0.3166 -0.0343 -0.0941 -0.0098 81  ASN A C   
342  O O   . ASN A 53  ? 0.4003 0.2023 0.3084 -0.0298 -0.0859 -0.0043 81  ASN A O   
343  C CB  . ASN A 53  ? 0.4101 0.1976 0.2820 -0.0323 -0.0891 -0.0204 81  ASN A CB  
344  C CG  . ASN A 53  ? 0.4114 0.2007 0.2901 -0.0443 -0.1038 -0.0138 81  ASN A CG  
345  O OD1 . ASN A 53  ? 0.4097 0.1987 0.3051 -0.0522 -0.1124 -0.0072 81  ASN A OD1 
346  N ND2 . ASN A 53  ? 0.4180 0.2083 0.2851 -0.0460 -0.1077 -0.0151 81  ASN A ND2 
347  N N   . PRO A 54  ? 0.4496 0.2119 0.3457 -0.0449 -0.1050 -0.0050 82  PRO A N   
348  C CA  . PRO A 54  ? 0.4458 0.2151 0.3597 -0.0515 -0.1039 0.0076  82  PRO A CA  
349  C C   . PRO A 54  ? 0.4197 0.2233 0.3577 -0.0570 -0.0981 0.0168  82  PRO A C   
350  O O   . PRO A 54  ? 0.4197 0.2325 0.3684 -0.0594 -0.0906 0.0266  82  PRO A O   
351  C CB  . PRO A 54  ? 0.4865 0.2282 0.3974 -0.0654 -0.1172 0.0104  82  PRO A CB  
352  C CG  . PRO A 54  ? 0.5030 0.2284 0.3974 -0.0683 -0.1291 -0.0002 82  PRO A CG  
353  C CD  . PRO A 54  ? 0.4838 0.2148 0.3616 -0.0527 -0.1189 -0.0111 82  PRO A CD  
354  N N   . ASP A 55  ? 0.3975 0.2162 0.3398 -0.0571 -0.1005 0.0135  83  ASP A N   
355  C CA  . ASP A 55  ? 0.3807 0.2306 0.3484 -0.0598 -0.0959 0.0214  83  ASP A CA  
356  C C   . ASP A 55  ? 0.3474 0.2129 0.3098 -0.0477 -0.0844 0.0191  83  ASP A C   
357  O O   . ASP A 55  ? 0.3376 0.2228 0.3139 -0.0468 -0.0825 0.0221  83  ASP A O   
358  C CB  . ASP A 55  ? 0.3944 0.2494 0.3758 -0.0687 -0.1107 0.0216  83  ASP A CB  
359  C CG  . ASP A 55  ? 0.4245 0.2723 0.4231 -0.0842 -0.1221 0.0271  83  ASP A CG  
360  O OD1 . ASP A 55  ? 0.4247 0.2824 0.4423 -0.0903 -0.1124 0.0367  83  ASP A OD1 
361  O OD2 . ASP A 55  ? 0.4584 0.2864 0.4471 -0.0915 -0.1409 0.0219  83  ASP A OD2 
362  N N   . ILE A 56  ? 0.3433 0.1996 0.2878 -0.0387 -0.0789 0.0132  84  ILE A N   
363  C CA  . ILE A 56  ? 0.3294 0.1986 0.2701 -0.0297 -0.0699 0.0114  84  ILE A CA  
364  C C   . ILE A 56  ? 0.3255 0.1920 0.2643 -0.0251 -0.0649 0.0152  84  ILE A C   
365  O O   . ILE A 56  ? 0.3354 0.1854 0.2679 -0.0230 -0.0686 0.0132  84  ILE A O   
366  C CB  . ILE A 56  ? 0.3304 0.1949 0.2565 -0.0249 -0.0688 0.0015  84  ILE A CB  
367  C CG1 . ILE A 56  ? 0.3481 0.2061 0.2656 -0.0304 -0.0761 -0.0011 84  ILE A CG1 
368  C CG2 . ILE A 56  ? 0.3090 0.1874 0.2357 -0.0195 -0.0613 0.0012  84  ILE A CG2 
369  C CD1 . ILE A 56  ? 0.3693 0.2171 0.2649 -0.0282 -0.0723 -0.0097 84  ILE A CD1 
370  N N   . ILE A 57  ? 0.3249 0.2027 0.2652 -0.0225 -0.0582 0.0202  85  ILE A N   
371  C CA  . ILE A 57  ? 0.3409 0.2106 0.2709 -0.0180 -0.0561 0.0242  85  ILE A CA  
372  C C   . ILE A 57  ? 0.3291 0.2027 0.2550 -0.0100 -0.0584 0.0170  85  ILE A C   
373  O O   . ILE A 57  ? 0.3096 0.1946 0.2366 -0.0097 -0.0554 0.0142  85  ILE A O   
374  C CB  . ILE A 57  ? 0.3534 0.2274 0.2796 -0.0194 -0.0470 0.0325  85  ILE A CB  
375  C CG1 . ILE A 57  ? 0.3687 0.2472 0.3090 -0.0289 -0.0414 0.0402  85  ILE A CG1 
376  C CG2 . ILE A 57  ? 0.3680 0.2257 0.2731 -0.0148 -0.0481 0.0362  85  ILE A CG2 
377  C CD1 . ILE A 57  ? 0.4147 0.2749 0.3527 -0.0356 -0.0471 0.0440  85  ILE A CD1 
378  N N   . PHE A 58  ? 0.3340 0.1984 0.2582 -0.0040 -0.0643 0.0143  86  PHE A N   
379  C CA  . PHE A 58  ? 0.3247 0.1979 0.2544 0.0030  -0.0675 0.0080  86  PHE A CA  
380  C C   . PHE A 58  ? 0.3365 0.2011 0.2558 0.0071  -0.0747 0.0134  86  PHE A C   
381  O O   . PHE A 58  ? 0.3544 0.2016 0.2660 0.0099  -0.0808 0.0179  86  PHE A O   
382  C CB  . PHE A 58  ? 0.3370 0.2099 0.2783 0.0091  -0.0692 -0.0004 86  PHE A CB  
383  C CG  . PHE A 58  ? 0.3377 0.2151 0.2797 0.0049  -0.0616 -0.0070 86  PHE A CG  
384  C CD1 . PHE A 58  ? 0.3286 0.2211 0.2759 0.0038  -0.0550 -0.0126 86  PHE A CD1 
385  C CD2 . PHE A 58  ? 0.3617 0.2239 0.2950 0.0006  -0.0624 -0.0071 86  PHE A CD2 
386  C CE1 . PHE A 58  ? 0.3486 0.2382 0.2872 -0.0006 -0.0482 -0.0178 86  PHE A CE1 
387  C CE2 . PHE A 58  ? 0.3547 0.2145 0.2807 -0.0032 -0.0586 -0.0133 86  PHE A CE2 
388  C CZ  . PHE A 58  ? 0.3563 0.2281 0.2821 -0.0033 -0.0509 -0.0185 86  PHE A CZ  
389  N N   . LYS A 59  ? 0.3315 0.2031 0.2462 0.0068  -0.0756 0.0131  87  LYS A N   
390  C CA  . LYS A 59  ? 0.3410 0.1976 0.2364 0.0098  -0.0848 0.0181  87  LYS A CA  
391  C C   . LYS A 59  ? 0.3581 0.2097 0.2635 0.0179  -0.0998 0.0164  87  LYS A C   
392  O O   . LYS A 59  ? 0.3921 0.2200 0.2774 0.0209  -0.1086 0.0233  87  LYS A O   
393  C CB  . LYS A 59  ? 0.3403 0.2023 0.2283 0.0076  -0.0855 0.0156  87  LYS A CB  
394  C CG  . LYS A 59  ? 0.3678 0.2071 0.2249 0.0096  -0.0955 0.0201  87  LYS A CG  
395  C CD  . LYS A 59  ? 0.3743 0.2121 0.2186 0.0069  -0.0965 0.0167  87  LYS A CD  
396  C CE  . LYS A 59  ? 0.4188 0.2276 0.2247 0.0087  -0.1083 0.0196  87  LYS A CE  
397  N NZ  . LYS A 59  ? 0.4338 0.2385 0.2279 0.0055  -0.1115 0.0144  87  LYS A NZ  
398  N N   . ASP A 60  ? 0.3515 0.2240 0.2867 0.0217  -0.1027 0.0080  88  ASP A N   
399  C CA  . ASP A 60  ? 0.3704 0.2455 0.3272 0.0325  -0.1163 0.0046  88  ASP A CA  
400  C C   . ASP A 60  ? 0.3962 0.2530 0.3362 0.0367  -0.1368 0.0107  88  ASP A C   
401  O O   . ASP A 60  ? 0.4083 0.2503 0.3496 0.0464  -0.1506 0.0128  88  ASP A O   
402  C CB  . ASP A 60  ? 0.3991 0.2607 0.3574 0.0386  -0.1139 0.0041  88  ASP A CB  
403  C CG  . ASP A 60  ? 0.4248 0.2924 0.4118 0.0530  -0.1245 -0.0021 88  ASP A CG  
404  O OD1 . ASP A 60  ? 0.4199 0.3156 0.4393 0.0566  -0.1263 -0.0089 88  ASP A OD1 
405  O OD2 . ASP A 60  ? 0.4854 0.3292 0.4641 0.0608  -0.1310 0.0000  88  ASP A OD2 
406  N N   . GLU A 61  ? 0.4047 0.2589 0.3271 0.0304  -0.1407 0.0126  89  GLU A N   
407  C CA  . GLU A 61  ? 0.4396 0.2725 0.3401 0.0334  -0.1635 0.0171  89  GLU A CA  
408  C C   . GLU A 61  ? 0.4521 0.3027 0.3937 0.0430  -0.1846 0.0122  89  GLU A C   
409  O O   . GLU A 61  ? 0.4949 0.3228 0.4218 0.0499  -0.2100 0.0170  89  GLU A O   
410  C CB  . GLU A 61  ? 0.4400 0.2662 0.3137 0.0245  -0.1613 0.0173  89  GLU A CB  
411  C CG  . GLU A 61  ? 0.4149 0.2691 0.3186 0.0186  -0.1634 0.0094  89  GLU A CG  
412  C CD  . GLU A 61  ? 0.3689 0.2521 0.3014 0.0133  -0.1418 0.0037  89  GLU A CD  
413  O OE1 . GLU A 61  ? 0.3704 0.2527 0.2991 0.0143  -0.1254 0.0052  89  GLU A OE1 
414  O OE2 . GLU A 61  ? 0.3507 0.2544 0.3067 0.0068  -0.1424 -0.0014 89  GLU A OE2 
415  N N   . GLU A 62  ? 0.4285 0.3168 0.4192 0.0441  -0.1755 0.0033  90  GLU A N   
416  C CA  . GLU A 62  ? 0.4434 0.3582 0.4863 0.0545  -0.1901 -0.0026 90  GLU A CA  
417  C C   . GLU A 62  ? 0.4737 0.3709 0.5191 0.0707  -0.2002 -0.0008 90  GLU A C   
418  O O   . GLU A 62  ? 0.4882 0.3947 0.5663 0.0831  -0.2223 -0.0027 90  GLU A O   
419  C CB  . GLU A 62  ? 0.4051 0.3615 0.4945 0.0514  -0.1690 -0.0123 90  GLU A CB  
420  C CG  . GLU A 62  ? 0.3908 0.3622 0.4797 0.0349  -0.1604 -0.0138 90  GLU A CG  
421  C CD  . GLU A 62  ? 0.3735 0.3309 0.4251 0.0248  -0.1386 -0.0118 90  GLU A CD  
422  O OE1 . GLU A 62  ? 0.3857 0.3178 0.4042 0.0277  -0.1337 -0.0071 90  GLU A OE1 
423  O OE2 . GLU A 62  ? 0.3705 0.3415 0.4273 0.0136  -0.1276 -0.0145 90  GLU A OE2 
424  N N   . ASN A 63  ? 0.4943 0.3671 0.5098 0.0708  -0.1862 0.0026  91  ASN A N   
425  C CA  . ASN A 63  ? 0.5307 0.3825 0.5463 0.0847  -0.1916 0.0034  91  ASN A CA  
426  C C   . ASN A 63  ? 0.4863 0.3709 0.5576 0.0979  -0.1852 -0.0089 91  ASN A C   
427  O O   . ASN A 63  ? 0.5051 0.3815 0.5943 0.1153  -0.2007 -0.0105 91  ASN A O   
428  C CB  . ASN A 63  ? 0.6126 0.4276 0.6014 0.0927  -0.2210 0.0129  91  ASN A CB  
429  C CG  . ASN A 63  ? 0.6941 0.4676 0.6188 0.0804  -0.2180 0.0253  91  ASN A CG  
430  O OD1 . ASN A 63  ? 0.7418 0.5024 0.6459 0.0728  -0.1982 0.0284  91  ASN A OD1 
431  N ND2 . ASN A 63  ? 0.7638 0.5148 0.6561 0.0782  -0.2375 0.0325  91  ASN A ND2 
432  N N   . THR A 64  ? 0.4375 0.3542 0.5313 0.0906  -0.1616 -0.0172 92  THR A N   
433  C CA  . THR A 64  ? 0.4119 0.3604 0.5541 0.1014  -0.1471 -0.0299 92  THR A CA  
434  C C   . THR A 64  ? 0.4035 0.3464 0.5283 0.0960  -0.1193 -0.0356 92  THR A C   
435  O O   . THR A 64  ? 0.4107 0.3691 0.5636 0.1066  -0.1051 -0.0466 92  THR A O   
436  C CB  . THR A 64  ? 0.3787 0.3736 0.5672 0.0957  -0.1432 -0.0351 92  THR A CB  
437  O OG1 . THR A 64  ? 0.3464 0.3426 0.5084 0.0754  -0.1299 -0.0320 92  THR A OG1 
438  C CG2 . THR A 64  ? 0.3892 0.3950 0.6050 0.1011  -0.1739 -0.0315 92  THR A CG2 
439  N N   . GLY A 65  ? 0.3933 0.3163 0.4757 0.0806  -0.1121 -0.0292 93  GLY A N   
440  C CA  . GLY A 65  ? 0.3909 0.3090 0.4550 0.0723  -0.0901 -0.0337 93  GLY A CA  
441  C C   . GLY A 65  ? 0.3681 0.3171 0.4487 0.0631  -0.0720 -0.0396 93  GLY A C   
442  O O   . GLY A 65  ? 0.3666 0.3105 0.4320 0.0580  -0.0544 -0.0447 93  GLY A O   
443  N N   . ALA A 66  ? 0.3536 0.3299 0.4603 0.0589  -0.0769 -0.0386 94  ALA A N   
444  C CA  . ALA A 66  ? 0.3307 0.3350 0.4547 0.0481  -0.0595 -0.0432 94  ALA A CA  
445  C C   . ALA A 66  ? 0.3188 0.3068 0.4021 0.0325  -0.0503 -0.0388 94  ALA A C   
446  O O   . ALA A 66  ? 0.3248 0.3185 0.4032 0.0252  -0.0312 -0.0433 94  ALA A O   
447  C CB  . ALA A 66  ? 0.3298 0.3623 0.4895 0.0445  -0.0717 -0.0416 94  ALA A CB  
448  N N   . ASP A 67  ? 0.3078 0.2744 0.3615 0.0282  -0.0626 -0.0301 95  ASP A N   
449  C CA  . ASP A 67  ? 0.3010 0.2548 0.3226 0.0158  -0.0567 -0.0253 95  ASP A CA  
450  C C   . ASP A 67  ? 0.3111 0.2521 0.3152 0.0147  -0.0438 -0.0292 95  ASP A C   
451  O O   . ASP A 67  ? 0.3019 0.2388 0.2882 0.0050  -0.0368 -0.0281 95  ASP A O   
452  C CB  . ASP A 67  ? 0.2958 0.2301 0.2928 0.0144  -0.0687 -0.0162 95  ASP A CB  
453  C CG  . ASP A 67  ? 0.3020 0.2401 0.3003 0.0122  -0.0811 -0.0124 95  ASP A CG  
454  O OD1 . ASP A 67  ? 0.2856 0.2426 0.3039 0.0077  -0.0810 -0.0161 95  ASP A OD1 
455  O OD2 . ASP A 67  ? 0.3068 0.2265 0.2839 0.0139  -0.0904 -0.0059 95  ASP A OD2 
456  N N   . ARG A 68  ? 0.3349 0.2653 0.3410 0.0246  -0.0437 -0.0336 96  ARG A N   
457  C CA  . ARG A 68  ? 0.3525 0.2638 0.3372 0.0239  -0.0348 -0.0386 96  ARG A CA  
458  C C   . ARG A 68  ? 0.3696 0.2907 0.3581 0.0236  -0.0160 -0.0483 96  ARG A C   
459  O O   . ARG A 68  ? 0.3862 0.2862 0.3461 0.0204  -0.0088 -0.0524 96  ARG A O   
460  C CB  . ARG A 68  ? 0.3861 0.2771 0.3689 0.0350  -0.0415 -0.0412 96  ARG A CB  
461  C CG  . ARG A 68  ? 0.3916 0.2634 0.3598 0.0315  -0.0561 -0.0308 96  ARG A CG  
462  C CD  . ARG A 68  ? 0.4284 0.2740 0.3911 0.0408  -0.0634 -0.0327 96  ARG A CD  
463  N NE  . ARG A 68  ? 0.4328 0.2615 0.3829 0.0352  -0.0754 -0.0208 96  ARG A NE  
464  C CZ  . ARG A 68  ? 0.4554 0.2720 0.3886 0.0222  -0.0762 -0.0142 96  ARG A CZ  
465  N NH1 . ARG A 68  ? 0.4395 0.2547 0.3640 0.0146  -0.0706 -0.0188 96  ARG A NH1 
466  N NH2 . ARG A 68  ? 0.4608 0.2659 0.3859 0.0167  -0.0829 -0.0027 96  ARG A NH2 
467  N N   . LEU A 69  ? 0.3657 0.3147 0.3878 0.0278  -0.0084 -0.0525 97  LEU A N   
468  C CA  . LEU A 69  ? 0.3838 0.3445 0.4137 0.0283  0.0148  -0.0622 97  LEU A CA  
469  C C   . LEU A 69  ? 0.3746 0.3377 0.3865 0.0110  0.0247  -0.0585 97  LEU A C   
470  O O   . LEU A 69  ? 0.3540 0.3297 0.3755 0.0023  0.0158  -0.0512 97  LEU A O   
471  C CB  . LEU A 69  ? 0.3912 0.3859 0.4737 0.0394  0.0194  -0.0678 97  LEU A CB  
472  C CG  . LEU A 69  ? 0.4176 0.4065 0.5174 0.0602  0.0141  -0.0745 97  LEU A CG  
473  C CD1 . LEU A 69  ? 0.4199 0.4487 0.5807 0.0718  0.0163  -0.0794 97  LEU A CD1 
474  C CD2 . LEU A 69  ? 0.4563 0.4183 0.5259 0.0668  0.0314  -0.0848 97  LEU A CD2 
475  N N   . MET A 70  ? 0.3959 0.3418 0.3766 0.0062  0.0419  -0.0635 98  MET A N   
476  C CA  . MET A 70  ? 0.4005 0.3388 0.3539 -0.0101 0.0506  -0.0593 98  MET A CA  
477  C C   . MET A 70  ? 0.4386 0.3565 0.3581 -0.0118 0.0736  -0.0674 98  MET A C   
478  O O   . MET A 70  ? 0.4537 0.3611 0.3691 0.0008  0.0805  -0.0769 98  MET A O   
479  C CB  . MET A 70  ? 0.4110 0.3265 0.3336 -0.0171 0.0307  -0.0502 98  MET A CB  
480  C CG  . MET A 70  ? 0.4350 0.3195 0.3259 -0.0128 0.0217  -0.0520 98  MET A CG  
481  S SD  . MET A 70  ? 0.4456 0.3199 0.3272 -0.0173 -0.0029 -0.0409 98  MET A SD  
482  C CE  . MET A 70  ? 0.4067 0.3061 0.3290 -0.0095 -0.0125 -0.0367 98  MET A CE  
483  N N   . THR A 71  ? 0.4507 0.3577 0.3412 -0.0265 0.0852  -0.0641 99  THR A N   
484  C CA  . THR A 71  ? 0.5035 0.3819 0.3478 -0.0299 0.1074  -0.0708 99  THR A CA  
485  C C   . THR A 71  ? 0.5270 0.3596 0.3170 -0.0285 0.0910  -0.0713 99  THR A C   
486  O O   . THR A 71  ? 0.4905 0.3173 0.2810 -0.0287 0.0640  -0.0642 99  THR A O   
487  C CB  . THR A 71  ? 0.5226 0.3973 0.3465 -0.0482 0.1234  -0.0650 99  THR A CB  
488  O OG1 . THR A 71  ? 0.5065 0.3632 0.3076 -0.0572 0.0989  -0.0540 99  THR A OG1 
489  C CG2 . THR A 71  ? 0.5065 0.4267 0.3859 -0.0533 0.1409  -0.0647 99  THR A CG2 
490  N N   . GLN A 72  ? 0.5910 0.3903 0.3333 -0.0281 0.1075  -0.0797 100 GLN A N   
491  C CA  . GLN A 72  ? 0.6340 0.3846 0.3196 -0.0283 0.0901  -0.0815 100 GLN A CA  
492  C C   . GLN A 72  ? 0.6282 0.3618 0.2886 -0.0412 0.0658  -0.0689 100 GLN A C   
493  O O   . GLN A 72  ? 0.6352 0.3570 0.2931 -0.0396 0.0373  -0.0651 100 GLN A O   
494  C CB  . GLN A 72  ? 0.7088 0.4201 0.3364 -0.0279 0.1138  -0.0926 100 GLN A CB  
495  C CG  . GLN A 72  ? 0.7587 0.4170 0.3287 -0.0277 0.0911  -0.0959 100 GLN A CG  
496  C CD  . GLN A 72  ? 0.7393 0.4028 0.3393 -0.0147 0.0738  -0.1009 100 GLN A CD  
497  O OE1 . GLN A 72  ? 0.7547 0.4298 0.3771 -0.0007 0.0925  -0.1117 100 GLN A OE1 
498  N NE2 . GLN A 72  ? 0.7128 0.3692 0.3170 -0.0192 0.0391  -0.0927 100 GLN A NE2 
499  N N   . ARG A 73  ? 0.6444 0.3789 0.2922 -0.0535 0.0761  -0.0620 101 ARG A N   
500  C CA  . ARG A 73  ? 0.6449 0.3601 0.2675 -0.0639 0.0536  -0.0502 101 ARG A CA  
501  C C   . ARG A 73  ? 0.5851 0.3316 0.2582 -0.0596 0.0308  -0.0427 101 ARG A C   
502  O O   . ARG A 73  ? 0.5759 0.3091 0.2399 -0.0598 0.0052  -0.0365 101 ARG A O   
503  C CB  . ARG A 73  ? 0.6721 0.3779 0.2695 -0.0781 0.0714  -0.0444 101 ARG A CB  
504  C CG  . ARG A 73  ? 0.6803 0.3587 0.2457 -0.0868 0.0482  -0.0327 101 ARG A CG  
505  C CD  . ARG A 73  ? 0.7238 0.3798 0.2501 -0.1025 0.0671  -0.0270 101 ARG A CD  
506  N NE  . ARG A 73  ? 0.7341 0.3587 0.2279 -0.1085 0.0417  -0.0157 101 ARG A NE  
507  C CZ  . ARG A 73  ? 0.7881 0.3626 0.2209 -0.1101 0.0231  -0.0129 101 ARG A CZ  
508  N NH1 . ARG A 73  ? 0.8287 0.3750 0.2199 -0.1079 0.0279  -0.0211 101 ARG A NH1 
509  N NH2 . ARG A 73  ? 0.7965 0.3466 0.2090 -0.1129 -0.0019 -0.0023 101 ARG A NH2 
510  N N   . CYS A 74  ? 0.5582 0.3455 0.2839 -0.0556 0.0398  -0.0432 102 CYS A N   
511  C CA  . CYS A 74  ? 0.5032 0.3165 0.2706 -0.0511 0.0213  -0.0369 102 CYS A CA  
512  C C   . CYS A 74  ? 0.4964 0.3031 0.2679 -0.0424 0.0029  -0.0381 102 CYS A C   
513  O O   . CYS A 74  ? 0.4729 0.2769 0.2467 -0.0430 -0.0167 -0.0311 102 CYS A O   
514  C CB  . CYS A 74  ? 0.4819 0.3336 0.2981 -0.0478 0.0324  -0.0388 102 CYS A CB  
515  S SG  . CYS A 74  ? 0.4359 0.3082 0.2843 -0.0469 0.0126  -0.0299 102 CYS A SG  
516  N N   . LYS A 75  ? 0.5256 0.3270 0.2960 -0.0352 0.0101  -0.0471 103 LYS A N   
517  C CA  . LYS A 75  ? 0.5350 0.3240 0.3055 -0.0294 -0.0070 -0.0486 103 LYS A CA  
518  C C   . LYS A 75  ? 0.5356 0.2961 0.2730 -0.0366 -0.0271 -0.0440 103 LYS A C   
519  O O   . LYS A 75  ? 0.4899 0.2557 0.2454 -0.0366 -0.0466 -0.0382 103 LYS A O   
520  C CB  . LYS A 75  ? 0.5974 0.3673 0.3512 -0.0222 0.0032  -0.0605 103 LYS A CB  
521  C CG  . LYS A 75  ? 0.6170 0.4097 0.4090 -0.0098 0.0134  -0.0663 103 LYS A CG  
522  C CD  . LYS A 75  ? 0.6656 0.4292 0.4352 -0.0008 0.0175  -0.0781 103 LYS A CD  
523  C CE  . LYS A 75  ? 0.6740 0.4497 0.4795 0.0116  0.0117  -0.0798 103 LYS A CE  
524  N NZ  . LYS A 75  ? 0.7187 0.4680 0.5065 0.0239  0.0211  -0.0936 103 LYS A NZ  
525  N N   . ASP A 76  ? 0.5682 0.2985 0.2586 -0.0427 -0.0224 -0.0466 104 ASP A N   
526  C CA  . ASP A 76  ? 0.6052 0.3008 0.2571 -0.0489 -0.0452 -0.0436 104 ASP A CA  
527  C C   . ASP A 76  ? 0.5715 0.2829 0.2458 -0.0515 -0.0636 -0.0318 104 ASP A C   
528  O O   . ASP A 76  ? 0.5700 0.2810 0.2575 -0.0517 -0.0875 -0.0276 104 ASP A O   
529  C CB  . ASP A 76  ? 0.6826 0.3356 0.2699 -0.0547 -0.0354 -0.0488 104 ASP A CB  
530  C CG  . ASP A 76  ? 0.7187 0.3513 0.2792 -0.0497 -0.0152 -0.0625 104 ASP A CG  
531  O OD1 . ASP A 76  ? 0.7031 0.3452 0.2891 -0.0414 -0.0164 -0.0686 104 ASP A OD1 
532  O OD2 . ASP A 76  ? 0.7912 0.3967 0.3038 -0.0537 0.0037  -0.0670 104 ASP A OD2 
533  N N   . LYS A 77  ? 0.5425 0.2701 0.2271 -0.0531 -0.0528 -0.0269 105 LYS A N   
534  C CA  . LYS A 77  ? 0.5265 0.2633 0.2273 -0.0531 -0.0693 -0.0171 105 LYS A CA  
535  C C   . LYS A 77  ? 0.4775 0.2484 0.2304 -0.0463 -0.0757 -0.0144 105 LYS A C   
536  O O   . LYS A 77  ? 0.4884 0.2644 0.2580 -0.0444 -0.0943 -0.0086 105 LYS A O   
537  C CB  . LYS A 77  ? 0.5295 0.2681 0.2233 -0.0574 -0.0572 -0.0130 105 LYS A CB  
538  C CG  . LYS A 77  ? 0.5775 0.2808 0.2173 -0.0667 -0.0471 -0.0136 105 LYS A CG  
539  C CD  . LYS A 77  ? 0.6273 0.2878 0.2165 -0.0694 -0.0634 -0.0144 105 LYS A CD  
540  C CE  . LYS A 77  ? 0.6847 0.3049 0.2128 -0.0797 -0.0526 -0.0127 105 LYS A CE  
541  N NZ  . LYS A 77  ? 0.7438 0.3153 0.2133 -0.0824 -0.0702 -0.0140 105 LYS A NZ  
542  N N   . LEU A 78  ? 0.4523 0.2446 0.2295 -0.0426 -0.0602 -0.0185 106 LEU A N   
543  C CA  . LEU A 78  ? 0.4146 0.2336 0.2328 -0.0370 -0.0637 -0.0153 106 LEU A CA  
544  C C   . LEU A 78  ? 0.4236 0.2354 0.2471 -0.0378 -0.0795 -0.0144 106 LEU A C   
545  O O   . LEU A 78  ? 0.4091 0.2359 0.2585 -0.0370 -0.0893 -0.0077 106 LEU A O   
546  C CB  . LEU A 78  ? 0.4000 0.2362 0.2372 -0.0325 -0.0487 -0.0197 106 LEU A CB  
547  C CG  . LEU A 78  ? 0.3736 0.2315 0.2429 -0.0277 -0.0515 -0.0148 106 LEU A CG  
548  C CD1 . LEU A 78  ? 0.3716 0.2414 0.2488 -0.0276 -0.0508 -0.0096 106 LEU A CD1 
549  C CD2 . LEU A 78  ? 0.3779 0.2443 0.2617 -0.0221 -0.0437 -0.0195 106 LEU A CD2 
550  N N   . ASN A 79  ? 0.4478 0.2349 0.2457 -0.0404 -0.0825 -0.0209 107 ASN A N   
551  C CA  . ASN A 79  ? 0.4638 0.2401 0.2659 -0.0437 -0.0997 -0.0207 107 ASN A CA  
552  C C   . ASN A 79  ? 0.4744 0.2488 0.2794 -0.0483 -0.1209 -0.0138 107 ASN A C   
553  O O   . ASN A 79  ? 0.4710 0.2596 0.3076 -0.0509 -0.1339 -0.0083 107 ASN A O   
554  C CB  . ASN A 79  ? 0.5016 0.2455 0.2692 -0.0445 -0.0982 -0.0310 107 ASN A CB  
555  C CG  . ASN A 79  ? 0.4975 0.2481 0.2774 -0.0370 -0.0821 -0.0369 107 ASN A CG  
556  O OD1 . ASN A 79  ? 0.4832 0.2589 0.2980 -0.0334 -0.0788 -0.0320 107 ASN A OD1 
557  N ND2 . ASN A 79  ? 0.5297 0.2569 0.2791 -0.0331 -0.0704 -0.0478 107 ASN A ND2 
558  N N   . ALA A 80  ? 0.5062 0.2633 0.2808 -0.0495 -0.1247 -0.0134 108 ALA A N   
559  C CA  . ALA A 80  ? 0.5103 0.2640 0.2890 -0.0512 -0.1483 -0.0067 108 ALA A CA  
560  C C   . ALA A 80  ? 0.4580 0.2501 0.2878 -0.0453 -0.1468 0.0010  108 ALA A C   
561  O O   . ALA A 80  ? 0.4499 0.2569 0.3125 -0.0456 -0.1634 0.0062  108 ALA A O   
562  C CB  . ALA A 80  ? 0.5564 0.2781 0.2863 -0.0530 -0.1520 -0.0069 108 ALA A CB  
563  N N   . LEU A 81  ? 0.4456 0.2533 0.2827 -0.0402 -0.1270 0.0015  109 LEU A N   
564  C CA  . LEU A 81  ? 0.4228 0.2594 0.2970 -0.0332 -0.1226 0.0073  109 LEU A CA  
565  C C   . LEU A 81  ? 0.3939 0.2555 0.3075 -0.0335 -0.1198 0.0100  109 LEU A C   
566  O O   . LEU A 81  ? 0.3929 0.2769 0.3411 -0.0294 -0.1223 0.0156  109 LEU A O   
567  C CB  . LEU A 81  ? 0.4123 0.2519 0.2763 -0.0301 -0.1038 0.0057  109 LEU A CB  
568  C CG  . LEU A 81  ? 0.3992 0.2606 0.2902 -0.0224 -0.0972 0.0097  109 LEU A CG  
569  C CD1 . LEU A 81  ? 0.4053 0.2672 0.3068 -0.0161 -0.1101 0.0142  109 LEU A CD1 
570  C CD2 . LEU A 81  ? 0.3997 0.2587 0.2768 -0.0219 -0.0833 0.0074  109 LEU A CD2 
571  N N   . ALA A 82  ? 0.3956 0.2515 0.3039 -0.0380 -0.1148 0.0062  110 ALA A N   
572  C CA  . ALA A 82  ? 0.3745 0.2463 0.3131 -0.0408 -0.1125 0.0099  110 ALA A CA  
573  C C   . ALA A 82  ? 0.3778 0.2586 0.3440 -0.0465 -0.1303 0.0151  110 ALA A C   
574  O O   . ALA A 82  ? 0.3429 0.2490 0.3467 -0.0472 -0.1253 0.0216  110 ALA A O   
575  C CB  . ALA A 82  ? 0.3834 0.2383 0.3061 -0.0444 -0.1094 0.0046  110 ALA A CB  
576  N N   . ILE A 83  ? 0.4060 0.2651 0.3527 -0.0513 -0.1505 0.0121  111 ILE A N   
577  C CA  . ILE A 83  ? 0.4139 0.2799 0.3886 -0.0583 -0.1741 0.0166  111 ILE A CA  
578  C C   . ILE A 83  ? 0.3962 0.2917 0.4087 -0.0500 -0.1765 0.0230  111 ILE A C   
579  O O   . ILE A 83  ? 0.3909 0.3175 0.4554 -0.0524 -0.1798 0.0293  111 ILE A O   
580  C CB  . ILE A 83  ? 0.4551 0.2827 0.3890 -0.0646 -0.1980 0.0111  111 ILE A CB  
581  C CG1 . ILE A 83  ? 0.4796 0.2778 0.3798 -0.0709 -0.1937 0.0035  111 ILE A CG1 
582  C CG2 . ILE A 83  ? 0.4734 0.3098 0.4394 -0.0707 -0.2277 0.0162  111 ILE A CG2 
583  C CD1 . ILE A 83  ? 0.5375 0.2885 0.3828 -0.0760 -0.2120 -0.0042 111 ILE A CD1 
584  N N   . SER A 84  ? 0.4022 0.2879 0.3906 -0.0404 -0.1738 0.0216  112 SER A N   
585  C CA  . SER A 84  ? 0.4048 0.3101 0.4227 -0.0295 -0.1791 0.0263  112 SER A CA  
586  C C   . SER A 84  ? 0.3551 0.2945 0.4104 -0.0219 -0.1546 0.0296  112 SER A C   
587  O O   . SER A 84  ? 0.3377 0.3051 0.4384 -0.0151 -0.1566 0.0340  112 SER A O   
588  C CB  . SER A 84  ? 0.4304 0.3082 0.4075 -0.0226 -0.1856 0.0246  112 SER A CB  
589  O OG  . SER A 84  ? 0.4268 0.2937 0.3721 -0.0202 -0.1631 0.0212  112 SER A OG  
590  N N   . VAL A 85  ? 0.3492 0.2868 0.3882 -0.0231 -0.1325 0.0276  113 VAL A N   
591  C CA  . VAL A 85  ? 0.3359 0.2985 0.4006 -0.0173 -0.1097 0.0308  113 VAL A CA  
592  C C   . VAL A 85  ? 0.3323 0.3224 0.4444 -0.0247 -0.1083 0.0369  113 VAL A C   
593  O O   . VAL A 85  ? 0.3243 0.3423 0.4742 -0.0179 -0.0971 0.0410  113 VAL A O   
594  C CB  . VAL A 85  ? 0.3331 0.2825 0.3655 -0.0178 -0.0919 0.0277  113 VAL A CB  
595  C CG1 . VAL A 85  ? 0.3213 0.2876 0.3697 -0.0149 -0.0711 0.0315  113 VAL A CG1 
596  C CG2 . VAL A 85  ? 0.3468 0.2770 0.3444 -0.0114 -0.0911 0.0230  113 VAL A CG2 
597  N N   . MET A 86  ? 0.3526 0.3343 0.4637 -0.0387 -0.1181 0.0374  114 MET A N   
598  C CA  . MET A 86  ? 0.3567 0.3615 0.5120 -0.0502 -0.1164 0.0443  114 MET A CA  
599  C C   . MET A 86  ? 0.3603 0.3940 0.5681 -0.0491 -0.1321 0.0483  114 MET A C   
600  O O   . MET A 86  ? 0.3452 0.4142 0.6053 -0.0520 -0.1204 0.0550  114 MET A O   
601  C CB  . MET A 86  ? 0.3784 0.3596 0.5157 -0.0656 -0.1281 0.0430  114 MET A CB  
602  C CG  . MET A 86  ? 0.3789 0.3386 0.4784 -0.0650 -0.1113 0.0405  114 MET A CG  
603  S SD  . MET A 86  ? 0.4110 0.3392 0.4898 -0.0799 -0.1229 0.0384  114 MET A SD  
604  C CE  . MET A 86  ? 0.4433 0.3410 0.4857 -0.0787 -0.1474 0.0280  114 MET A CE  
605  N N   . ASN A 87  ? 0.3745 0.3935 0.5687 -0.0444 -0.1568 0.0445  115 ASN A N   
606  C CA  A ASN A 87  ? 0.3838 0.4257 0.6255 -0.0410 -0.1795 0.0477  115 ASN A CA  
607  C CA  B ASN A 87  ? 0.3866 0.4282 0.6278 -0.0409 -0.1796 0.0476  115 ASN A CA  
608  C C   . ASN A 87  ? 0.3734 0.4446 0.6473 -0.0221 -0.1618 0.0494  115 ASN A C   
609  O O   . ASN A 87  ? 0.3555 0.4670 0.6953 -0.0198 -0.1630 0.0544  115 ASN A O   
610  C CB  A ASN A 87  ? 0.4116 0.4187 0.6164 -0.0415 -0.2132 0.0436  115 ASN A CB  
611  C CB  B ASN A 87  ? 0.4180 0.4242 0.6210 -0.0411 -0.2128 0.0434  115 ASN A CB  
612  C CG  A ASN A 87  ? 0.4256 0.4520 0.6760 -0.0357 -0.2418 0.0471  115 ASN A CG  
613  C CG  B ASN A 87  ? 0.4434 0.4260 0.6296 -0.0597 -0.2353 0.0418  115 ASN A CG  
614  O OD1 A ASN A 87  ? 0.4251 0.4858 0.7383 -0.0436 -0.2521 0.0522  115 ASN A OD1 
615  O OD1 B ASN A 87  ? 0.4468 0.4453 0.6639 -0.0732 -0.2316 0.0452  115 ASN A OD1 
616  N ND2 A ASN A 87  ? 0.4369 0.4408 0.6577 -0.0225 -0.2559 0.0450  115 ASN A ND2 
617  N ND2 B ASN A 87  ? 0.4832 0.4233 0.6164 -0.0612 -0.2588 0.0367  115 ASN A ND2 
618  N N   . GLN A 88  ? 0.3668 0.4188 0.5981 -0.0095 -0.1452 0.0452  116 GLN A N   
619  C CA  . GLN A 88  ? 0.3653 0.4339 0.6147 0.0102  -0.1293 0.0448  116 GLN A CA  
620  C C   . GLN A 88  ? 0.3462 0.4513 0.6380 0.0116  -0.0981 0.0487  116 GLN A C   
621  O O   . GLN A 88  ? 0.3591 0.4969 0.7025 0.0240  -0.0918 0.0506  116 GLN A O   
622  C CB  . GLN A 88  ? 0.3702 0.4040 0.5584 0.0187  -0.1196 0.0392  116 GLN A CB  
623  C CG  . GLN A 88  ? 0.3809 0.4181 0.5763 0.0397  -0.1117 0.0373  116 GLN A CG  
624  C CD  . GLN A 88  ? 0.4099 0.4425 0.6195 0.0501  -0.1402 0.0378  116 GLN A CD  
625  O OE1 . GLN A 88  ? 0.4254 0.4415 0.6222 0.0408  -0.1681 0.0390  116 GLN A OE1 
626  N NE2 . GLN A 88  ? 0.4148 0.4592 0.6496 0.0707  -0.1346 0.0368  116 GLN A NE2 
627  N N   . TRP A 89  ? 0.3396 0.4375 0.6090 0.0004  -0.0781 0.0500  117 TRP A N   
628  C CA  . TRP A 89  ? 0.3323 0.4543 0.6253 0.0001  -0.0451 0.0545  117 TRP A CA  
629  C C   . TRP A 89  ? 0.3469 0.4734 0.6507 -0.0218 -0.0427 0.0609  117 TRP A C   
630  O O   . TRP A 89  ? 0.3540 0.4499 0.6114 -0.0307 -0.0434 0.0597  117 TRP A O   
631  C CB  . TRP A 89  ? 0.3295 0.4271 0.5704 0.0104  -0.0221 0.0503  117 TRP A CB  
632  C CG  . TRP A 89  ? 0.3284 0.4119 0.5484 0.0300  -0.0247 0.0437  117 TRP A CG  
633  C CD1 . TRP A 89  ? 0.3340 0.4347 0.5805 0.0486  -0.0121 0.0419  117 TRP A CD1 
634  C CD2 . TRP A 89  ? 0.3205 0.3668 0.4869 0.0327  -0.0387 0.0378  117 TRP A CD2 
635  N NE1 . TRP A 89  ? 0.3377 0.4100 0.5475 0.0624  -0.0206 0.0354  117 TRP A NE1 
636  C CE2 . TRP A 89  ? 0.3300 0.3696 0.4911 0.0515  -0.0363 0.0334  117 TRP A CE2 
637  C CE3 . TRP A 89  ? 0.3141 0.3324 0.4379 0.0213  -0.0510 0.0356  117 TRP A CE3 
638  C CZ2 . TRP A 89  ? 0.3359 0.3405 0.4498 0.0560  -0.0472 0.0283  117 TRP A CZ2 
639  C CZ3 . TRP A 89  ? 0.3133 0.3029 0.3963 0.0262  -0.0597 0.0304  117 TRP A CZ3 
640  C CH2 . TRP A 89  ? 0.3260 0.3078 0.4024 0.0418  -0.0575 0.0274  117 TRP A CH2 
641  N N   . PRO A 90  ? 0.3605 0.5247 0.7280 -0.0315 -0.0400 0.0681  118 PRO A N   
642  C CA  . PRO A 90  ? 0.3718 0.5381 0.7507 -0.0546 -0.0361 0.0755  118 PRO A CA  
643  C C   . PRO A 90  ? 0.3802 0.5222 0.7115 -0.0590 -0.0088 0.0781  118 PRO A C   
644  O O   . PRO A 90  ? 0.3861 0.5368 0.7140 -0.0492 0.0209  0.0795  118 PRO A O   
645  C CB  . PRO A 90  ? 0.3748 0.5940 0.8362 -0.0606 -0.0253 0.0835  118 PRO A CB  
646  C CG  . PRO A 90  ? 0.3683 0.6122 0.8690 -0.0414 -0.0412 0.0788  118 PRO A CG  
647  C CD  . PRO A 90  ? 0.3640 0.5717 0.8002 -0.0209 -0.0415 0.0697  118 PRO A CD  
648  N N   . GLY A 91  ? 0.3815 0.4904 0.6750 -0.0726 -0.0209 0.0783  119 GLY A N   
649  C CA  . GLY A 91  ? 0.3943 0.4764 0.6449 -0.0788 -0.0020 0.0821  119 GLY A CA  
650  C C   . GLY A 91  ? 0.3844 0.4345 0.5742 -0.0636 -0.0006 0.0742  119 GLY A C   
651  O O   . GLY A 91  ? 0.4067 0.4302 0.5571 -0.0667 0.0081  0.0764  119 GLY A O   
652  N N   . VAL A 92  ? 0.3581 0.4088 0.5409 -0.0486 -0.0110 0.0659  120 VAL A N   
653  C CA  . VAL A 92  ? 0.3521 0.3757 0.4831 -0.0358 -0.0099 0.0585  120 VAL A CA  
654  C C   . VAL A 92  ? 0.3507 0.3508 0.4560 -0.0390 -0.0335 0.0520  120 VAL A C   
655  O O   . VAL A 92  ? 0.3455 0.3502 0.4696 -0.0441 -0.0533 0.0505  120 VAL A O   
656  C CB  . VAL A 92  ? 0.3474 0.3810 0.4812 -0.0182 -0.0033 0.0537  120 VAL A CB  
657  C CG1 . VAL A 92  ? 0.3463 0.3511 0.4301 -0.0091 -0.0072 0.0462  120 VAL A CG1 
658  C CG2 . VAL A 92  ? 0.3602 0.4128 0.5122 -0.0125 0.0252  0.0583  120 VAL A CG2 
659  N N   . LYS A 93  ? 0.3473 0.3224 0.4106 -0.0352 -0.0318 0.0479  121 LYS A N   
660  C CA  . LYS A 93  ? 0.3429 0.2967 0.3807 -0.0360 -0.0483 0.0406  121 LYS A CA  
661  C C   . LYS A 93  ? 0.3299 0.2741 0.3404 -0.0253 -0.0471 0.0340  121 LYS A C   
662  O O   . LYS A 93  ? 0.3045 0.2496 0.3053 -0.0180 -0.0345 0.0348  121 LYS A O   
663  C CB  . LYS A 93  ? 0.3692 0.3036 0.3911 -0.0436 -0.0495 0.0420  121 LYS A CB  
664  C CG  . LYS A 93  ? 0.3973 0.3339 0.4428 -0.0576 -0.0576 0.0470  121 LYS A CG  
665  C CD  . LYS A 93  ? 0.4404 0.3573 0.4736 -0.0656 -0.0557 0.0513  121 LYS A CD  
666  C CE  . LYS A 93  ? 0.4671 0.3854 0.5259 -0.0823 -0.0646 0.0568  121 LYS A CE  
667  N NZ  . LYS A 93  ? 0.5109 0.3967 0.5466 -0.0891 -0.0696 0.0579  121 LYS A NZ  
668  N N   . LEU A 94  ? 0.3204 0.2523 0.3157 -0.0257 -0.0593 0.0275  122 LEU A N   
669  C CA  . LEU A 94  ? 0.3121 0.2329 0.2814 -0.0198 -0.0579 0.0214  122 LEU A CA  
670  C C   . LEU A 94  ? 0.3063 0.2192 0.2616 -0.0185 -0.0513 0.0208  122 LEU A C   
671  O O   . LEU A 94  ? 0.3038 0.2102 0.2602 -0.0227 -0.0530 0.0222  122 LEU A O   
672  C CB  . LEU A 94  ? 0.3165 0.2248 0.2721 -0.0230 -0.0689 0.0156  122 LEU A CB  
673  C CG  . LEU A 94  ? 0.3188 0.2173 0.2514 -0.0207 -0.0657 0.0097  122 LEU A CG  
674  C CD1 . LEU A 94  ? 0.3171 0.2172 0.2449 -0.0159 -0.0635 0.0106  122 LEU A CD1 
675  C CD2 . LEU A 94  ? 0.3369 0.2198 0.2519 -0.0254 -0.0726 0.0046  122 LEU A CD2 
676  N N   . ARG A 95  ? 0.3045 0.2149 0.2461 -0.0130 -0.0469 0.0186  123 ARG A N   
677  C CA  . ARG A 95  ? 0.2970 0.1995 0.2261 -0.0109 -0.0456 0.0178  123 ARG A CA  
678  C C   . ARG A 95  ? 0.2927 0.1936 0.2132 -0.0094 -0.0486 0.0114  123 ARG A C   
679  O O   . ARG A 95  ? 0.2914 0.1927 0.2069 -0.0088 -0.0480 0.0099  123 ARG A O   
680  C CB  . ARG A 95  ? 0.3011 0.2004 0.2216 -0.0078 -0.0378 0.0233  123 ARG A CB  
681  C CG  . ARG A 95  ? 0.3138 0.2001 0.2156 -0.0050 -0.0411 0.0231  123 ARG A CG  
682  C CD  . ARG A 95  ? 0.3304 0.2060 0.2159 -0.0040 -0.0325 0.0302  123 ARG A CD  
683  N NE  . ARG A 95  ? 0.3523 0.2094 0.2119 -0.0007 -0.0392 0.0302  123 ARG A NE  
684  C CZ  . ARG A 95  ? 0.3575 0.2067 0.1991 0.0028  -0.0424 0.0262  123 ARG A CZ  
685  N NH1 . ARG A 95  ? 0.3464 0.2020 0.1906 0.0045  -0.0373 0.0223  123 ARG A NH1 
686  N NH2 . ARG A 95  ? 0.3906 0.2207 0.2082 0.0047  -0.0529 0.0267  123 ARG A NH2 
687  N N   . VAL A 96  ? 0.2947 0.1942 0.2169 -0.0091 -0.0518 0.0076  124 VAL A N   
688  C CA  . VAL A 96  ? 0.2887 0.1925 0.2119 -0.0091 -0.0531 0.0019  124 VAL A CA  
689  C C   . VAL A 96  ? 0.2943 0.1962 0.2157 -0.0056 -0.0588 0.0030  124 VAL A C   
690  O O   . VAL A 96  ? 0.3090 0.2060 0.2322 -0.0018 -0.0628 0.0050  124 VAL A O   
691  C CB  . VAL A 96  ? 0.2931 0.1997 0.2246 -0.0096 -0.0514 -0.0039 124 VAL A CB  
692  C CG1 . VAL A 96  ? 0.2928 0.2100 0.2342 -0.0102 -0.0492 -0.0094 124 VAL A CG1 
693  C CG2 . VAL A 96  ? 0.3085 0.2097 0.2318 -0.0141 -0.0489 -0.0051 124 VAL A CG2 
694  N N   . THR A 97  ? 0.2983 0.2001 0.2142 -0.0073 -0.0616 0.0016  125 THR A N   
695  C CA  . THR A 97  ? 0.3122 0.2091 0.2238 -0.0050 -0.0719 0.0021  125 THR A CA  
696  C C   . THR A 97  ? 0.3045 0.2177 0.2412 -0.0068 -0.0774 -0.0033 125 THR A C   
697  O O   . THR A 97  ? 0.3102 0.2249 0.2562 -0.0028 -0.0892 -0.0035 125 THR A O   
698  C CB  . THR A 97  ? 0.3259 0.2087 0.2139 -0.0063 -0.0738 0.0031  125 THR A CB  
699  O OG1 . THR A 97  ? 0.3256 0.2119 0.2159 -0.0123 -0.0714 -0.0002 125 THR A OG1 
700  C CG2 . THR A 97  ? 0.3389 0.2096 0.2074 -0.0024 -0.0647 0.0079  125 THR A CG2 
701  N N   . GLU A 98  ? 0.2963 0.2211 0.2442 -0.0128 -0.0688 -0.0073 126 GLU A N   
702  C CA  . GLU A 98  ? 0.2950 0.2400 0.2713 -0.0163 -0.0672 -0.0126 126 GLU A CA  
703  C C   . GLU A 98  ? 0.2960 0.2463 0.2751 -0.0191 -0.0514 -0.0162 126 GLU A C   
704  O O   . GLU A 98  ? 0.3044 0.2432 0.2626 -0.0248 -0.0458 -0.0144 126 GLU A O   
705  C CB  . GLU A 98  ? 0.3149 0.2620 0.2924 -0.0264 -0.0718 -0.0130 126 GLU A CB  
706  C CG  . GLU A 98  ? 0.3399 0.2814 0.3163 -0.0247 -0.0908 -0.0116 126 GLU A CG  
707  C CD  . GLU A 98  ? 0.3439 0.3058 0.3564 -0.0195 -0.1010 -0.0141 126 GLU A CD  
708  O OE1 . GLU A 98  ? 0.3890 0.3742 0.4351 -0.0262 -0.1011 -0.0175 126 GLU A OE1 
709  O OE2 . GLU A 98  ? 0.3637 0.3193 0.3741 -0.0086 -0.1084 -0.0123 126 GLU A OE2 
710  N N   . GLY A 99  ? 0.2917 0.2568 0.2942 -0.0150 -0.0452 -0.0215 127 GLY A N   
711  C CA  . GLY A 99  ? 0.2986 0.2669 0.3004 -0.0182 -0.0277 -0.0266 127 GLY A CA  
712  C C   . GLY A 99  ? 0.3050 0.2993 0.3400 -0.0225 -0.0187 -0.0313 127 GLY A C   
713  O O   . GLY A 99  ? 0.3106 0.3124 0.3529 -0.0333 -0.0220 -0.0288 127 GLY A O   
714  N N   . TRP A 100 ? 0.3085 0.3169 0.3670 -0.0139 -0.0085 -0.0382 128 TRP A N   
715  C CA  . TRP A 100 ? 0.3127 0.3546 0.4170 -0.0153 0.0001  -0.0431 128 TRP A CA  
716  C C   . TRP A 100 ? 0.3172 0.3743 0.4518 -0.0125 -0.0232 -0.0399 128 TRP A C   
717  O O   . TRP A 100 ? 0.3290 0.3713 0.4532 -0.0017 -0.0408 -0.0371 128 TRP A O   
718  C CB  . TRP A 100 ? 0.3198 0.3719 0.4428 -0.0024 0.0167  -0.0523 128 TRP A CB  
719  C CG  . TRP A 100 ? 0.3178 0.4108 0.4985 -0.0008 0.0271  -0.0578 128 TRP A CG  
720  C CD1 . TRP A 100 ? 0.3297 0.4450 0.5293 -0.0149 0.0483  -0.0592 128 TRP A CD1 
721  C CD2 . TRP A 100 ? 0.3201 0.4381 0.5511 0.0159  0.0167  -0.0622 128 TRP A CD2 
722  N NE1 . TRP A 100 ? 0.3246 0.4827 0.5895 -0.0087 0.0536  -0.0647 128 TRP A NE1 
723  C CE2 . TRP A 100 ? 0.3241 0.4852 0.6109 0.0114  0.0324  -0.0668 128 TRP A CE2 
724  C CE3 . TRP A 100 ? 0.3199 0.4272 0.5551 0.0335  -0.0054 -0.0619 128 TRP A CE3 
725  C CZ2 . TRP A 100 ? 0.3269 0.5244 0.6790 0.0265  0.0252  -0.0719 128 TRP A CZ2 
726  C CZ3 . TRP A 100 ? 0.3273 0.4636 0.6188 0.0487  -0.0138 -0.0665 128 TRP A CZ3 
727  C CH2 . TRP A 100 ? 0.3277 0.5108 0.6802 0.0462  0.0001  -0.0718 128 TRP A CH2 
728  N N   . ASP A 101 ? 0.3166 0.3977 0.4823 -0.0240 -0.0247 -0.0393 129 ASP A N   
729  C CA  . ASP A 101 ? 0.3250 0.4159 0.5150 -0.0234 -0.0518 -0.0364 129 ASP A CA  
730  C C   . ASP A 101 ? 0.3281 0.4638 0.5866 -0.0223 -0.0510 -0.0414 129 ASP A C   
731  O O   . ASP A 101 ? 0.3252 0.4856 0.6102 -0.0350 -0.0304 -0.0438 129 ASP A O   
732  C CB  . ASP A 101 ? 0.3359 0.4064 0.4949 -0.0387 -0.0642 -0.0302 129 ASP A CB  
733  C CG  . ASP A 101 ? 0.3561 0.4292 0.5308 -0.0381 -0.0942 -0.0280 129 ASP A CG  
734  O OD1 . ASP A 101 ? 0.3594 0.4253 0.5334 -0.0222 -0.1101 -0.0275 129 ASP A OD1 
735  O OD2 . ASP A 101 ? 0.3573 0.4384 0.5461 -0.0537 -0.1027 -0.0270 129 ASP A OD2 
736  N N   . GLU A 102 ? 0.3452 0.4908 0.6330 -0.0077 -0.0736 -0.0422 130 GLU A N   
737  C CA  . GLU A 102 ? 0.3594 0.5502 0.7210 -0.0047 -0.0824 -0.0461 130 GLU A CA  
738  C C   . GLU A 102 ? 0.3758 0.5631 0.7452 -0.0099 -0.1211 -0.0408 130 GLU A C   
739  O O   . GLU A 102 ? 0.3910 0.6147 0.8241 -0.0066 -0.1366 -0.0432 130 GLU A O   
740  C CB  . GLU A 102 ? 0.3648 0.5696 0.7581 0.0199  -0.0769 -0.0529 130 GLU A CB  
741  C CG  . GLU A 102 ? 0.3739 0.5379 0.7231 0.0367  -0.0956 -0.0498 130 GLU A CG  
742  C CD  . GLU A 102 ? 0.3887 0.5571 0.7647 0.0624  -0.0980 -0.0556 130 GLU A CD  
743  O OE1 . GLU A 102 ? 0.3791 0.5886 0.8185 0.0717  -0.0871 -0.0636 130 GLU A OE1 
744  O OE2 . GLU A 102 ? 0.3987 0.5276 0.7315 0.0732  -0.1103 -0.0520 130 GLU A OE2 
745  N N   . ASP A 103 ? 0.4005 0.5462 0.7097 -0.0174 -0.1368 -0.0345 131 ASP A N   
746  C CA  . ASP A 103 ? 0.4367 0.5664 0.7364 -0.0211 -0.1747 -0.0302 131 ASP A CA  
747  C C   . ASP A 103 ? 0.4422 0.5764 0.7469 -0.0455 -0.1810 -0.0288 131 ASP A C   
748  O O   . ASP A 103 ? 0.4579 0.5769 0.7543 -0.0507 -0.2145 -0.0264 131 ASP A O   
749  C CB  . ASP A 103 ? 0.4615 0.5377 0.6865 -0.0146 -0.1866 -0.0247 131 ASP A CB  
750  C CG  . ASP A 103 ? 0.4667 0.5272 0.6737 0.0051  -0.1815 -0.0239 131 ASP A CG  
751  O OD1 . ASP A 103 ? 0.4501 0.5233 0.6913 0.0200  -0.1974 -0.0252 131 ASP A OD1 
752  O OD2 . ASP A 103 ? 0.4661 0.5001 0.6253 0.0053  -0.1634 -0.0216 131 ASP A OD2 
753  N N   . GLY A 104 ? 0.4329 0.5809 0.7445 -0.0608 -0.1522 -0.0300 132 GLY A N   
754  C CA  . GLY A 104 ? 0.4326 0.5767 0.7402 -0.0861 -0.1547 -0.0278 132 GLY A CA  
755  C C   . GLY A 104 ? 0.4524 0.5412 0.6843 -0.0904 -0.1679 -0.0240 132 GLY A C   
756  O O   . GLY A 104 ? 0.4762 0.5509 0.6998 -0.1072 -0.1872 -0.0227 132 GLY A O   
757  N N   . HIS A 105 ? 0.4436 0.5016 0.6229 -0.0766 -0.1571 -0.0226 133 HIS A N   
758  C CA  . HIS A 105 ? 0.4718 0.4795 0.5814 -0.0753 -0.1656 -0.0197 133 HIS A CA  
759  C C   . HIS A 105 ? 0.4725 0.4612 0.5488 -0.0862 -0.1445 -0.0185 133 HIS A C   
760  O O   . HIS A 105 ? 0.4906 0.4444 0.5149 -0.0792 -0.1413 -0.0167 133 HIS A O   
761  C CB  . HIS A 105 ? 0.4796 0.4686 0.5592 -0.0547 -0.1670 -0.0181 133 HIS A CB  
762  C CG  . HIS A 105 ? 0.5145 0.4920 0.5908 -0.0468 -0.1980 -0.0169 133 HIS A CG  
763  N ND1 . HIS A 105 ? 0.5374 0.4849 0.5719 -0.0322 -0.2038 -0.0135 133 HIS A ND1 
764  C CD2 . HIS A 105 ? 0.5356 0.5234 0.6406 -0.0526 -0.2268 -0.0179 133 HIS A CD2 
765  C CE1 . HIS A 105 ? 0.5715 0.5073 0.6035 -0.0288 -0.2349 -0.0123 133 HIS A CE1 
766  N NE2 . HIS A 105 ? 0.5511 0.5118 0.6274 -0.0407 -0.2514 -0.0153 133 HIS A NE2 
767  N N   . HIS A 106 ? 0.4734 0.4827 0.5782 -0.1030 -0.1310 -0.0188 134 HIS A N   
768  C CA  . HIS A 106 ? 0.4908 0.4791 0.5627 -0.1136 -0.1118 -0.0166 134 HIS A CA  
769  C C   . HIS A 106 ? 0.5171 0.5096 0.6068 -0.1386 -0.1143 -0.0153 134 HIS A C   
770  O O   . HIS A 106 ? 0.5257 0.5405 0.6568 -0.1472 -0.1326 -0.0166 134 HIS A O   
771  C CB  . HIS A 106 ? 0.4647 0.4676 0.5414 -0.1070 -0.0832 -0.0170 134 HIS A CB  
772  C CG  . HIS A 106 ? 0.4529 0.4458 0.5085 -0.0859 -0.0830 -0.0176 134 HIS A CG  
773  N ND1 . HIS A 106 ? 0.4793 0.4380 0.4859 -0.0788 -0.0835 -0.0151 134 HIS A ND1 
774  C CD2 . HIS A 106 ? 0.4438 0.4554 0.5224 -0.0709 -0.0836 -0.0199 134 HIS A CD2 
775  C CE1 . HIS A 106 ? 0.4700 0.4287 0.4713 -0.0628 -0.0825 -0.0153 134 HIS A CE1 
776  N NE2 . HIS A 106 ? 0.4544 0.4422 0.4962 -0.0576 -0.0831 -0.0182 134 HIS A NE2 
777  N N   . SER A 107 ? 0.5381 0.5090 0.5985 -0.1504 -0.0983 -0.0122 135 SER A N   
778  C CA  . SER A 107 ? 0.5743 0.5457 0.6480 -0.1776 -0.0952 -0.0093 135 SER A CA  
779  C C   . SER A 107 ? 0.5652 0.5924 0.7090 -0.1875 -0.0800 -0.0103 135 SER A C   
780  O O   . SER A 107 ? 0.5340 0.5906 0.7030 -0.1706 -0.0670 -0.0137 135 SER A O   
781  C CB  . SER A 107 ? 0.5987 0.5326 0.6231 -0.1856 -0.0793 -0.0048 135 SER A CB  
782  O OG  . SER A 107 ? 0.5945 0.5337 0.6072 -0.1730 -0.0559 -0.0045 135 SER A OG  
783  N N   . GLU A 108 ? 0.5685 0.6089 0.7432 -0.2140 -0.0800 -0.0076 136 GLU A N   
784  C CA  . GLU A 108 ? 0.5579 0.6583 0.8136 -0.2258 -0.0701 -0.0089 136 GLU A CA  
785  C C   . GLU A 108 ? 0.5301 0.6584 0.8026 -0.2209 -0.0296 -0.0099 136 GLU A C   
786  O O   . GLU A 108 ? 0.5259 0.7089 0.8677 -0.2164 -0.0193 -0.0140 136 GLU A O   
787  C CB  . GLU A 108 ? 0.5922 0.6940 0.8698 -0.2598 -0.0757 -0.0042 136 GLU A CB  
788  C CG  . GLU A 108 ? 0.6013 0.7692 0.9729 -0.2727 -0.0730 -0.0056 136 GLU A CG  
789  C CD  . GLU A 108 ? 0.6464 0.8169 1.0418 -0.3108 -0.0742 0.0003  136 GLU A CD  
790  O OE1 . GLU A 108 ? 0.6833 0.8134 1.0470 -0.3232 -0.1062 0.0020  136 GLU A OE1 
791  O OE2 . GLU A 108 ? 0.6742 0.8824 1.1145 -0.3286 -0.0413 0.0032  136 GLU A OE2 
792  N N   . GLU A 109 ? 0.5133 0.6054 0.7272 -0.2227 -0.0079 -0.0064 137 GLU A N   
793  C CA  . GLU A 109 ? 0.5024 0.6081 0.7146 -0.2170 0.0296  -0.0080 137 GLU A CA  
794  C C   . GLU A 109 ? 0.4812 0.5442 0.6253 -0.1964 0.0300  -0.0084 137 GLU A C   
795  O O   . GLU A 109 ? 0.5022 0.5335 0.5972 -0.2029 0.0484  -0.0045 137 GLU A O   
796  C CB  . GLU A 109 ? 0.5371 0.6419 0.7481 -0.2459 0.0581  -0.0020 137 GLU A CB  
797  C CG  . GLU A 109 ? 0.5451 0.7099 0.8415 -0.2632 0.0695  -0.0030 137 GLU A CG  
798  C CD  . GLU A 109 ? 0.5869 0.7515 0.8836 -0.2956 0.1012  0.0042  137 GLU A CD  
799  O OE1 . GLU A 109 ? 0.6193 0.7284 0.8417 -0.3054 0.1083  0.0110  137 GLU A OE1 
800  O OE2 . GLU A 109 ? 0.5885 0.8081 0.9605 -0.3109 0.1188  0.0036  137 GLU A OE2 
801  N N   . SER A 110 ? 0.4310 0.4918 0.5723 -0.1737 0.0083  -0.0123 138 SER A N   
802  C CA  . SER A 110 ? 0.4134 0.4389 0.5000 -0.1543 0.0040  -0.0126 138 SER A CA  
803  C C   . SER A 110 ? 0.4076 0.4390 0.4861 -0.1450 0.0313  -0.0158 138 SER A C   
804  O O   . SER A 110 ? 0.3879 0.4577 0.5129 -0.1392 0.0450  -0.0214 138 SER A O   
805  C CB  . SER A 110 ? 0.3866 0.4155 0.4817 -0.1352 -0.0207 -0.0156 138 SER A CB  
806  O OG  . SER A 110 ? 0.3667 0.3673 0.4177 -0.1186 -0.0231 -0.0153 138 SER A OG  
807  N N   . LEU A 111 ? 0.4210 0.4143 0.4429 -0.1422 0.0371  -0.0131 139 LEU A N   
808  C CA  . LEU A 111 ? 0.4241 0.4136 0.4279 -0.1296 0.0551  -0.0173 139 LEU A CA  
809  C C   . LEU A 111 ? 0.3890 0.3957 0.4155 -0.1066 0.0443  -0.0234 139 LEU A C   
810  O O   . LEU A 111 ? 0.3871 0.3993 0.4139 -0.0966 0.0600  -0.0290 139 LEU A O   
811  C CB  . LEU A 111 ? 0.4511 0.3929 0.3894 -0.1309 0.0541  -0.0124 139 LEU A CB  
812  C CG  . LEU A 111 ? 0.4979 0.4165 0.4057 -0.1531 0.0694  -0.0062 139 LEU A CG  
813  C CD1 . LEU A 111 ? 0.5312 0.4009 0.3732 -0.1509 0.0658  -0.0018 139 LEU A CD1 
814  C CD2 . LEU A 111 ? 0.5187 0.4634 0.4507 -0.1635 0.1017  -0.0095 139 LEU A CD2 
815  N N   . HIS A 112 ? 0.3545 0.3673 0.3979 -0.0990 0.0198  -0.0227 140 HIS A N   
816  C CA  . HIS A 112 ? 0.3375 0.3634 0.4007 -0.0788 0.0097  -0.0271 140 HIS A CA  
817  C C   . HIS A 112 ? 0.3297 0.3956 0.4474 -0.0741 0.0221  -0.0336 140 HIS A C   
818  O O   . HIS A 112 ? 0.3157 0.3860 0.4407 -0.0572 0.0246  -0.0388 140 HIS A O   
819  C CB  . HIS A 112 ? 0.3228 0.3419 0.3859 -0.0728 -0.0180 -0.0241 140 HIS A CB  
820  C CG  . HIS A 112 ? 0.3281 0.3114 0.3431 -0.0710 -0.0277 -0.0194 140 HIS A CG  
821  N ND1 . HIS A 112 ? 0.3218 0.2906 0.3158 -0.0568 -0.0319 -0.0188 140 HIS A ND1 
822  C CD2 . HIS A 112 ? 0.3457 0.3062 0.3342 -0.0809 -0.0346 -0.0152 140 HIS A CD2 
823  C CE1 . HIS A 112 ? 0.3252 0.2685 0.2861 -0.0578 -0.0390 -0.0146 140 HIS A CE1 
824  N NE2 . HIS A 112 ? 0.3395 0.2755 0.2951 -0.0712 -0.0418 -0.0128 140 HIS A NE2 
825  N N   . TYR A 113 ? 0.3334 0.4272 0.4901 -0.0886 0.0298  -0.0336 141 TYR A N   
826  C CA  . TYR A 113 ? 0.3419 0.4824 0.5647 -0.0835 0.0401  -0.0399 141 TYR A CA  
827  C C   . TYR A 113 ? 0.3638 0.5089 0.5826 -0.0767 0.0739  -0.0467 141 TYR A C   
828  O O   . TYR A 113 ? 0.3572 0.5372 0.6268 -0.0643 0.0848  -0.0543 141 TYR A O   
829  C CB  . TYR A 113 ? 0.3569 0.5270 0.6254 -0.1042 0.0380  -0.0370 141 TYR A CB  
830  C CG  . TYR A 113 ? 0.3598 0.5202 0.6283 -0.1101 0.0022  -0.0321 141 TYR A CG  
831  C CD1 . TYR A 113 ? 0.3589 0.5010 0.6089 -0.0928 -0.0250 -0.0319 141 TYR A CD1 
832  C CD2 . TYR A 113 ? 0.3817 0.5473 0.6648 -0.1341 -0.0042 -0.0276 141 TYR A CD2 
833  C CE1 . TYR A 113 ? 0.3701 0.4970 0.6109 -0.0978 -0.0562 -0.0282 141 TYR A CE1 
834  C CE2 . TYR A 113 ? 0.3939 0.5451 0.6716 -0.1394 -0.0383 -0.0245 141 TYR A CE2 
835  C CZ  . TYR A 113 ? 0.3876 0.5178 0.6409 -0.1205 -0.0640 -0.0251 141 TYR A CZ  
836  O OH  . TYR A 113 ? 0.3960 0.5054 0.6345 -0.1251 -0.0962 -0.0228 141 TYR A OH  
837  N N   . GLU A 114 ? 0.3945 0.5035 0.5538 -0.0831 0.0895  -0.0449 142 GLU A N   
838  C CA  . GLU A 114 ? 0.4373 0.5398 0.5780 -0.0768 0.1207  -0.0520 142 GLU A CA  
839  C C   . GLU A 114 ? 0.4414 0.4995 0.5215 -0.0648 0.1120  -0.0529 142 GLU A C   
840  O O   . GLU A 114 ? 0.4736 0.5102 0.5168 -0.0636 0.1336  -0.0574 142 GLU A O   
841  C CB  . GLU A 114 ? 0.4846 0.5854 0.6113 -0.0984 0.1519  -0.0497 142 GLU A CB  
842  C CG  . GLU A 114 ? 0.5124 0.5748 0.5853 -0.1185 0.1437  -0.0391 142 GLU A CG  
843  C CD  . GLU A 114 ? 0.5738 0.6299 0.6283 -0.1405 0.1768  -0.0360 142 GLU A CD  
844  O OE1 . GLU A 114 ? 0.6207 0.6633 0.6458 -0.1363 0.2046  -0.0415 142 GLU A OE1 
845  O OE2 . GLU A 114 ? 0.5940 0.6565 0.6617 -0.1624 0.1761  -0.0284 142 GLU A OE2 
846  N N   . GLY A 115 ? 0.4088 0.4545 0.4809 -0.0561 0.0823  -0.0491 143 GLY A N   
847  C CA  . GLY A 115 ? 0.4152 0.4282 0.4463 -0.0437 0.0721  -0.0502 143 GLY A CA  
848  C C   . GLY A 115 ? 0.4355 0.4090 0.4066 -0.0540 0.0715  -0.0450 143 GLY A C   
849  O O   . GLY A 115 ? 0.4504 0.3970 0.3875 -0.0463 0.0676  -0.0471 143 GLY A O   
850  N N   . ARG A 116 ? 0.4426 0.4096 0.4009 -0.0704 0.0708  -0.0378 144 ARG A N   
851  C CA  . ARG A 116 ? 0.4655 0.3928 0.3667 -0.0801 0.0698  -0.0321 144 ARG A CA  
852  C C   . ARG A 116 ? 0.4346 0.3478 0.3244 -0.0801 0.0438  -0.0245 144 ARG A C   
853  O O   . ARG A 116 ? 0.4484 0.3318 0.2992 -0.0874 0.0391  -0.0189 144 ARG A O   
854  C CB  . ARG A 116 ? 0.5101 0.4327 0.3977 -0.0988 0.0920  -0.0296 144 ARG A CB  
855  C CG  . ARG A 116 ? 0.5611 0.4844 0.4396 -0.0984 0.1226  -0.0372 144 ARG A CG  
856  C CD  . ARG A 116 ? 0.6114 0.5386 0.4872 -0.1188 0.1498  -0.0341 144 ARG A CD  
857  N NE  . ARG A 116 ? 0.6485 0.5364 0.4738 -0.1356 0.1423  -0.0235 144 ARG A NE  
858  C CZ  . ARG A 116 ? 0.6861 0.5730 0.5097 -0.1573 0.1566  -0.0169 144 ARG A CZ  
859  N NH1 . ARG A 116 ? 0.6794 0.6081 0.5549 -0.1666 0.1803  -0.0195 144 ARG A NH1 
860  N NH2 . ARG A 116 ? 0.7403 0.5837 0.5118 -0.1700 0.1463  -0.0071 144 ARG A NH2 
861  N N   . ALA A 117 ? 0.3976 0.3288 0.3180 -0.0714 0.0276  -0.0241 145 ALA A N   
862  C CA  . ALA A 117 ? 0.3835 0.3001 0.2907 -0.0698 0.0072  -0.0180 145 ALA A CA  
863  C C   . ALA A 117 ? 0.3568 0.2817 0.2796 -0.0552 -0.0063 -0.0189 145 ALA A C   
864  O O   . ALA A 117 ? 0.3432 0.2882 0.2944 -0.0479 -0.0048 -0.0232 145 ALA A O   
865  C CB  . ALA A 117 ? 0.3853 0.3058 0.3024 -0.0810 0.0020  -0.0144 145 ALA A CB  
866  N N   . VAL A 118 ? 0.3584 0.2665 0.2622 -0.0510 -0.0187 -0.0144 146 VAL A N   
867  C CA  . VAL A 118 ? 0.3491 0.2611 0.2622 -0.0399 -0.0298 -0.0131 146 VAL A CA  
868  C C   . VAL A 118 ? 0.3394 0.2414 0.2422 -0.0398 -0.0395 -0.0086 146 VAL A C   
869  O O   . VAL A 118 ? 0.3396 0.2248 0.2219 -0.0443 -0.0404 -0.0061 146 VAL A O   
870  C CB  . VAL A 118 ? 0.3649 0.2676 0.2677 -0.0336 -0.0312 -0.0130 146 VAL A CB  
871  C CG1 . VAL A 118 ? 0.3768 0.2858 0.2890 -0.0303 -0.0233 -0.0191 146 VAL A CG1 
872  C CG2 . VAL A 118 ? 0.3896 0.2724 0.2656 -0.0380 -0.0328 -0.0105 146 VAL A CG2 
873  N N   . ASP A 119 ? 0.3101 0.2178 0.2228 -0.0343 -0.0470 -0.0080 147 ASP A N   
874  C CA  . ASP A 119 ? 0.3162 0.2096 0.2126 -0.0302 -0.0537 -0.0047 147 ASP A CA  
875  C C   . ASP A 119 ? 0.3013 0.1947 0.1974 -0.0211 -0.0530 -0.0020 147 ASP A C   
876  O O   . ASP A 119 ? 0.3134 0.2154 0.2215 -0.0179 -0.0533 -0.0022 147 ASP A O   
877  C CB  . ASP A 119 ? 0.3274 0.2192 0.2246 -0.0315 -0.0621 -0.0056 147 ASP A CB  
878  C CG  . ASP A 119 ? 0.3376 0.2313 0.2405 -0.0440 -0.0635 -0.0076 147 ASP A CG  
879  O OD1 . ASP A 119 ? 0.3423 0.2251 0.2323 -0.0514 -0.0579 -0.0066 147 ASP A OD1 
880  O OD2 . ASP A 119 ? 0.3238 0.2296 0.2456 -0.0476 -0.0710 -0.0096 147 ASP A OD2 
881  N N   . ILE A 120 ? 0.3057 0.1896 0.1910 -0.0171 -0.0528 0.0007  148 ILE A N   
882  C CA  . ILE A 120 ? 0.3063 0.1947 0.1985 -0.0112 -0.0507 0.0041  148 ILE A CA  
883  C C   . ILE A 120 ? 0.3060 0.1889 0.1918 -0.0037 -0.0479 0.0068  148 ILE A C   
884  O O   . ILE A 120 ? 0.3291 0.1992 0.2002 -0.0017 -0.0491 0.0051  148 ILE A O   
885  C CB  . ILE A 120 ? 0.3082 0.1964 0.2032 -0.0135 -0.0523 0.0046  148 ILE A CB  
886  C CG1 . ILE A 120 ? 0.3287 0.2043 0.2108 -0.0131 -0.0559 0.0052  148 ILE A CG1 
887  C CG2 . ILE A 120 ? 0.3161 0.2064 0.2120 -0.0194 -0.0510 0.0008  148 ILE A CG2 
888  C CD1 . ILE A 120 ? 0.3305 0.2012 0.2112 -0.0144 -0.0623 0.0066  148 ILE A CD1 
889  N N   . THR A 121 ? 0.3022 0.1929 0.1983 -0.0001 -0.0430 0.0106  149 THR A N   
890  C CA  . THR A 121 ? 0.3141 0.2054 0.2109 0.0072  -0.0344 0.0138  149 THR A CA  
891  C C   . THR A 121 ? 0.3173 0.2248 0.2396 0.0056  -0.0318 0.0183  149 THR A C   
892  O O   . THR A 121 ? 0.3289 0.2403 0.2598 -0.0008 -0.0387 0.0181  149 THR A O   
893  C CB  . THR A 121 ? 0.3283 0.2089 0.2059 0.0095  -0.0290 0.0149  149 THR A CB  
894  O OG1 . THR A 121 ? 0.3278 0.2138 0.2131 0.0057  -0.0267 0.0197  149 THR A OG1 
895  C CG2 . THR A 121 ? 0.3385 0.2047 0.1959 0.0069  -0.0383 0.0105  149 THR A CG2 
896  N N   . THR A 122 ? 0.3281 0.2443 0.2626 0.0111  -0.0214 0.0219  150 THR A N   
897  C CA  . THR A 122 ? 0.3221 0.2557 0.2841 0.0068  -0.0164 0.0278  150 THR A CA  
898  C C   . THR A 122 ? 0.3472 0.2730 0.2956 0.0021  -0.0082 0.0321  150 THR A C   
899  O O   . THR A 122 ? 0.3530 0.2616 0.2714 0.0060  -0.0044 0.0306  150 THR A O   
900  C CB  . THR A 122 ? 0.3316 0.2821 0.3190 0.0148  -0.0066 0.0300  150 THR A CB  
901  O OG1 . THR A 122 ? 0.3603 0.3011 0.3279 0.0248  0.0086  0.0283  150 THR A OG1 
902  C CG2 . THR A 122 ? 0.3232 0.2772 0.3234 0.0197  -0.0202 0.0268  150 THR A CG2 
903  N N   . SER A 123 ? 0.3375 0.2719 0.3049 -0.0063 -0.0074 0.0378  151 SER A N   
904  C CA  . SER A 123 ? 0.3553 0.2779 0.3091 -0.0124 -0.0014 0.0438  151 SER A CA  
905  C C   . SER A 123 ? 0.3804 0.2972 0.3173 -0.0082 0.0183  0.0482  151 SER A C   
906  O O   . SER A 123 ? 0.3968 0.2917 0.3028 -0.0100 0.0208  0.0517  151 SER A O   
907  C CB  . SER A 123 ? 0.3462 0.2770 0.3252 -0.0239 -0.0048 0.0492  151 SER A CB  
908  O OG  . SER A 123 ? 0.3458 0.3011 0.3601 -0.0264 0.0045  0.0538  151 SER A OG  
909  N N   . ASP A 124 ? 0.3880 0.3214 0.3425 -0.0017 0.0319  0.0480  152 ASP A N   
910  C CA  . ASP A 124 ? 0.4248 0.3530 0.3630 0.0036  0.0563  0.0512  152 ASP A CA  
911  C C   . ASP A 124 ? 0.4482 0.3514 0.3437 0.0155  0.0564  0.0436  152 ASP A C   
912  O O   . ASP A 124 ? 0.4710 0.3621 0.3421 0.0219  0.0767  0.0443  152 ASP A O   
913  C CB  . ASP A 124 ? 0.4224 0.3839 0.4075 0.0061  0.0729  0.0539  152 ASP A CB  
914  C CG  . ASP A 124 ? 0.4071 0.3846 0.4174 0.0179  0.0635  0.0465  152 ASP A CG  
915  O OD1 . ASP A 124 ? 0.4008 0.3618 0.3893 0.0218  0.0456  0.0398  152 ASP A OD1 
916  O OD2 . ASP A 124 ? 0.4117 0.4177 0.4642 0.0231  0.0746  0.0480  152 ASP A OD2 
917  N N   . ARG A 125 ? 0.4412 0.3356 0.3269 0.0176  0.0358  0.0366  153 ARG A N   
918  C CA  . ARG A 125 ? 0.4850 0.3549 0.3338 0.0259  0.0309  0.0291  153 ARG A CA  
919  C C   . ARG A 125 ? 0.5100 0.3793 0.3559 0.0389  0.0485  0.0255  153 ARG A C   
920  O O   . ARG A 125 ? 0.5314 0.3719 0.3345 0.0458  0.0541  0.0212  153 ARG A O   
921  C CB  . ARG A 125 ? 0.5364 0.3766 0.3410 0.0225  0.0269  0.0308  153 ARG A CB  
922  C CG  . ARG A 125 ? 0.5438 0.3849 0.3555 0.0138  0.0072  0.0323  153 ARG A CG  
923  C CD  . ARG A 125 ? 0.6045 0.4198 0.3821 0.0107  0.0023  0.0371  153 ARG A CD  
924  N NE  . ARG A 125 ? 0.6492 0.4421 0.3961 0.0136  -0.0140 0.0314  153 ARG A NE  
925  C CZ  . ARG A 125 ? 0.6900 0.4608 0.4115 0.0118  -0.0293 0.0337  153 ARG A CZ  
926  N NH1 . ARG A 125 ? 0.6840 0.4381 0.3845 0.0133  -0.0472 0.0281  153 ARG A NH1 
927  N NH2 . ARG A 125 ? 0.6807 0.4447 0.3989 0.0081  -0.0288 0.0420  153 ARG A NH2 
928  N N   . ASP A 126 ? 0.4955 0.3936 0.3853 0.0432  0.0548  0.0263  154 ASP A N   
929  C CA  . ASP A 126 ? 0.5113 0.4138 0.4099 0.0592  0.0697  0.0218  154 ASP A CA  
930  C C   . ASP A 126 ? 0.4952 0.3833 0.3843 0.0661  0.0511  0.0140  154 ASP A C   
931  O O   . ASP A 126 ? 0.4527 0.3578 0.3737 0.0647  0.0365  0.0146  154 ASP A O   
932  C CB  . ASP A 126 ? 0.5054 0.4486 0.4635 0.0610  0.0813  0.0268  154 ASP A CB  
933  C CG  . ASP A 126 ? 0.5276 0.4814 0.5061 0.0803  0.0962  0.0219  154 ASP A CG  
934  O OD1 . ASP A 126 ? 0.5630 0.4866 0.5014 0.0933  0.1006  0.0140  154 ASP A OD1 
935  O OD2 . ASP A 126 ? 0.5161 0.5077 0.5520 0.0826  0.1018  0.0256  154 ASP A OD2 
936  N N   . ARG A 127 ? 0.5160 0.3693 0.3585 0.0729  0.0512  0.0073  155 ARG A N   
937  C CA  . ARG A 127 ? 0.5092 0.3411 0.3352 0.0762  0.0330  0.0006  155 ARG A CA  
938  C C   . ARG A 127 ? 0.5059 0.3517 0.3650 0.0894  0.0329  -0.0011 155 ARG A C   
939  O O   . ARG A 127 ? 0.4984 0.3330 0.3544 0.0875  0.0139  -0.0031 155 ARG A O   
940  C CB  . ARG A 127 ? 0.5572 0.3460 0.3268 0.0813  0.0341  -0.0065 155 ARG A CB  
941  C CG  . ARG A 127 ? 0.5602 0.3311 0.2985 0.0666  0.0199  -0.0056 155 ARG A CG  
942  C CD  . ARG A 127 ? 0.6201 0.3454 0.2998 0.0708  0.0185  -0.0125 155 ARG A CD  
943  N NE  . ARG A 127 ? 0.6282 0.3383 0.2839 0.0569  -0.0003 -0.0115 155 ARG A NE  
944  C CZ  . ARG A 127 ? 0.6752 0.3452 0.2830 0.0551  -0.0131 -0.0174 155 ARG A CZ  
945  N NH1 . ARG A 127 ? 0.7052 0.3414 0.2775 0.0665  -0.0067 -0.0253 155 ARG A NH1 
946  N NH2 . ARG A 127 ? 0.6835 0.3457 0.2793 0.0428  -0.0332 -0.0157 155 ARG A NH2 
947  N N   . SER A 128 ? 0.5131 0.3810 0.4025 0.1024  0.0530  -0.0001 156 SER A N   
948  C CA  . SER A 128 ? 0.5120 0.3955 0.4395 0.1184  0.0510  -0.0020 156 SER A CA  
949  C C   . SER A 128 ? 0.4736 0.3829 0.4422 0.1085  0.0291  0.0039  156 SER A C   
950  O O   . SER A 128 ? 0.4753 0.3861 0.4637 0.1189  0.0159  0.0027  156 SER A O   
951  C CB  . SER A 128 ? 0.5373 0.4443 0.4955 0.1346  0.0794  -0.0026 156 SER A CB  
952  O OG  . SER A 128 ? 0.5274 0.4737 0.5265 0.1230  0.0906  0.0060  156 SER A OG  
953  N N   . LYS A 129 ? 0.4427 0.3647 0.4169 0.0897  0.0226  0.0097  157 LYS A N   
954  C CA  . LYS A 129 ? 0.4102 0.3500 0.4140 0.0790  0.0014  0.0143  157 LYS A CA  
955  C C   . LYS A 129 ? 0.4017 0.3134 0.3712 0.0702  -0.0195 0.0121  157 LYS A C   
956  O O   . LYS A 129 ? 0.4066 0.3234 0.3895 0.0639  -0.0372 0.0147  157 LYS A O   
957  C CB  . LYS A 129 ? 0.3946 0.3573 0.4186 0.0635  0.0062  0.0207  157 LYS A CB  
958  C CG  . LYS A 129 ? 0.3969 0.3929 0.4648 0.0673  0.0261  0.0253  157 LYS A CG  
959  C CD  . LYS A 129 ? 0.3837 0.3985 0.4730 0.0494  0.0257  0.0326  157 LYS A CD  
960  C CE  . LYS A 129 ? 0.3871 0.4394 0.5296 0.0497  0.0436  0.0385  157 LYS A CE  
961  N NZ  . LYS A 129 ? 0.4076 0.4552 0.5304 0.0509  0.0750  0.0405  157 LYS A NZ  
962  N N   . TYR A 130 ? 0.4117 0.2937 0.3377 0.0683  -0.0183 0.0077  158 TYR A N   
963  C CA  . TYR A 130 ? 0.4047 0.2673 0.3036 0.0545  -0.0334 0.0068  158 TYR A CA  
964  C C   . TYR A 130 ? 0.4136 0.2596 0.3067 0.0568  -0.0496 0.0065  158 TYR A C   
965  O O   . TYR A 130 ? 0.4147 0.2571 0.3017 0.0443  -0.0611 0.0085  158 TYR A O   
966  C CB  . TYR A 130 ? 0.4206 0.2601 0.2822 0.0502  -0.0296 0.0029  158 TYR A CB  
967  C CG  . TYR A 130 ? 0.4120 0.2612 0.2716 0.0444  -0.0200 0.0047  158 TYR A CG  
968  C CD1 . TYR A 130 ? 0.4012 0.2764 0.2889 0.0437  -0.0108 0.0097  158 TYR A CD1 
969  C CD2 . TYR A 130 ? 0.4297 0.2588 0.2575 0.0393  -0.0220 0.0018  158 TYR A CD2 
970  C CE1 . TYR A 130 ? 0.4010 0.2785 0.2815 0.0375  -0.0037 0.0126  158 TYR A CE1 
971  C CE2 . TYR A 130 ? 0.4307 0.2628 0.2517 0.0352  -0.0166 0.0042  158 TYR A CE2 
972  C CZ  . TYR A 130 ? 0.4159 0.2703 0.2607 0.0347  -0.0065 0.0099  158 TYR A CZ  
973  O OH  . TYR A 130 ? 0.4153 0.2668 0.2488 0.0303  -0.0020 0.0135  158 TYR A OH  
974  N N   . GLY A 131 ? 0.4372 0.2702 0.3291 0.0728  -0.0502 0.0041  159 GLY A N   
975  C CA  . GLY A 131 ? 0.4539 0.2655 0.3372 0.0766  -0.0680 0.0051  159 GLY A CA  
976  C C   . GLY A 131 ? 0.4405 0.2711 0.3511 0.0722  -0.0818 0.0106  159 GLY A C   
977  O O   . GLY A 131 ? 0.4494 0.2592 0.3374 0.0620  -0.0970 0.0130  159 GLY A O   
978  N N   . MET A 132 ? 0.4249 0.2909 0.3801 0.0786  -0.0767 0.0127  160 MET A N   
979  C CA  . MET A 132 ? 0.4198 0.3057 0.4054 0.0735  -0.0926 0.0177  160 MET A CA  
980  C C   . MET A 132 ? 0.4008 0.2861 0.3698 0.0527  -0.0948 0.0191  160 MET A C   
981  O O   . MET A 132 ? 0.3927 0.2679 0.3532 0.0448  -0.1126 0.0213  160 MET A O   
982  C CB  . MET A 132 ? 0.4178 0.3452 0.4603 0.0826  -0.0837 0.0196  160 MET A CB  
983  C CG  . MET A 132 ? 0.4278 0.3750 0.5049 0.0763  -0.1041 0.0246  160 MET A CG  
984  S SD  . MET A 132 ? 0.4899 0.4112 0.5591 0.0869  -0.1365 0.0261  160 MET A SD  
985  C CE  . MET A 132 ? 0.4993 0.4517 0.6287 0.1141  -0.1296 0.0251  160 MET A CE  
986  N N   . LEU A 133 ? 0.3750 0.2674 0.3364 0.0452  -0.0778 0.0174  161 LEU A N   
987  C CA  . LEU A 133 ? 0.3553 0.2455 0.3011 0.0286  -0.0780 0.0173  161 LEU A CA  
988  C C   . LEU A 133 ? 0.3778 0.2386 0.2861 0.0208  -0.0876 0.0158  161 LEU A C   
989  O O   . LEU A 133 ? 0.3848 0.2407 0.2845 0.0106  -0.0959 0.0165  161 LEU A O   
990  C CB  . LEU A 133 ? 0.3471 0.2435 0.2870 0.0253  -0.0611 0.0156  161 LEU A CB  
991  C CG  . LEU A 133 ? 0.3349 0.2290 0.2620 0.0120  -0.0611 0.0146  161 LEU A CG  
992  C CD1 . LEU A 133 ? 0.3329 0.2397 0.2790 0.0052  -0.0675 0.0169  161 LEU A CD1 
993  C CD2 . LEU A 133 ? 0.3342 0.2306 0.2545 0.0112  -0.0490 0.0136  161 LEU A CD2 
994  N N   . ALA A 134 ? 0.3888 0.2273 0.2731 0.0247  -0.0866 0.0140  162 ALA A N   
995  C CA  . ALA A 134 ? 0.4061 0.2146 0.2541 0.0150  -0.0934 0.0141  162 ALA A CA  
996  C C   . ALA A 134 ? 0.4356 0.2286 0.2752 0.0152  -0.1111 0.0179  162 ALA A C   
997  O O   . ALA A 134 ? 0.4502 0.2250 0.2619 0.0026  -0.1145 0.0188  162 ALA A O   
998  C CB  . ALA A 134 ? 0.4301 0.2144 0.2560 0.0191  -0.0918 0.0122  162 ALA A CB  
999  N N   . ARG A 135 ? 0.4502 0.2474 0.3109 0.0299  -0.1218 0.0198  163 ARG A N   
1000 C CA  . ARG A 135 ? 0.4782 0.2578 0.3316 0.0324  -0.1448 0.0241  163 ARG A CA  
1001 C C   . ARG A 135 ? 0.4728 0.2645 0.3328 0.0213  -0.1511 0.0250  163 ARG A C   
1002 O O   . ARG A 135 ? 0.5094 0.2728 0.3354 0.0131  -0.1649 0.0271  163 ARG A O   
1003 C CB  . ARG A 135 ? 0.4922 0.2815 0.3792 0.0532  -0.1551 0.0253  163 ARG A CB  
1004 C CG  . ARG A 135 ? 0.5371 0.3211 0.4345 0.0576  -0.1828 0.0299  163 ARG A CG  
1005 C CD  . ARG A 135 ? 0.5915 0.3239 0.4319 0.0508  -0.2010 0.0337  163 ARG A CD  
1006 N NE  . ARG A 135 ? 0.6304 0.3291 0.4401 0.0570  -0.1986 0.0337  163 ARG A NE  
1007 C CZ  . ARG A 135 ? 0.6888 0.3390 0.4419 0.0469  -0.2064 0.0374  163 ARG A CZ  
1008 N NH1 . ARG A 135 ? 0.7256 0.3556 0.4437 0.0308  -0.2144 0.0408  163 ARG A NH1 
1009 N NH2 . ARG A 135 ? 0.7128 0.3313 0.4410 0.0520  -0.2049 0.0376  163 ARG A NH2 
1010 N N   . LEU A 136 ? 0.4440 0.2710 0.3406 0.0204  -0.1415 0.0235  164 LEU A N   
1011 C CA  . LEU A 136 ? 0.4434 0.2781 0.3444 0.0091  -0.1474 0.0234  164 LEU A CA  
1012 C C   . LEU A 136 ? 0.4541 0.2656 0.3108 -0.0045 -0.1388 0.0203  164 LEU A C   
1013 O O   . LEU A 136 ? 0.4695 0.2621 0.3020 -0.0127 -0.1498 0.0199  164 LEU A O   
1014 C CB  . LEU A 136 ? 0.4132 0.2856 0.3594 0.0097  -0.1368 0.0233  164 LEU A CB  
1015 C CG  . LEU A 136 ? 0.4069 0.3082 0.4045 0.0215  -0.1421 0.0267  164 LEU A CG  
1016 C CD1 . LEU A 136 ? 0.3836 0.3179 0.4172 0.0190  -0.1242 0.0275  164 LEU A CD1 
1017 C CD2 . LEU A 136 ? 0.4312 0.3310 0.4447 0.0211  -0.1710 0.0300  164 LEU A CD2 
1018 N N   . ALA A 137 ? 0.4438 0.2546 0.2886 -0.0070 -0.1206 0.0177  165 ALA A N   
1019 C CA  . ALA A 137 ? 0.4587 0.2549 0.2717 -0.0195 -0.1095 0.0145  165 ALA A CA  
1020 C C   . ALA A 137 ? 0.5024 0.2606 0.2706 -0.0258 -0.1186 0.0169  165 ALA A C   
1021 O O   . ALA A 137 ? 0.5320 0.2745 0.2717 -0.0359 -0.1150 0.0147  165 ALA A O   
1022 C CB  . ALA A 137 ? 0.4498 0.2558 0.2665 -0.0212 -0.0923 0.0121  165 ALA A CB  
1023 N N   . VAL A 138 ? 0.5123 0.2521 0.2705 -0.0195 -0.1297 0.0211  166 VAL A N   
1024 C CA  . VAL A 138 ? 0.5701 0.2657 0.2790 -0.0256 -0.1413 0.0254  166 VAL A CA  
1025 C C   . VAL A 138 ? 0.5952 0.2775 0.2906 -0.0269 -0.1604 0.0265  166 VAL A C   
1026 O O   . VAL A 138 ? 0.6361 0.2881 0.2850 -0.0386 -0.1585 0.0263  166 VAL A O   
1027 C CB  . VAL A 138 ? 0.5840 0.2581 0.2855 -0.0159 -0.1538 0.0300  166 VAL A CB  
1028 C CG1 . VAL A 138 ? 0.6471 0.2700 0.2938 -0.0220 -0.1695 0.0360  166 VAL A CG1 
1029 C CG2 . VAL A 138 ? 0.5664 0.2448 0.2730 -0.0160 -0.1377 0.0281  166 VAL A CG2 
1030 N N   . GLU A 139 ? 0.5932 0.2960 0.3273 -0.0158 -0.1782 0.0276  167 GLU A N   
1031 C CA  . GLU A 139 ? 0.6203 0.3125 0.3494 -0.0171 -0.2031 0.0288  167 GLU A CA  
1032 C C   . GLU A 139 ? 0.6173 0.3086 0.3297 -0.0295 -0.1926 0.0231  167 GLU A C   
1033 O O   . GLU A 139 ? 0.6408 0.2992 0.3132 -0.0363 -0.2085 0.0228  167 GLU A O   
1034 C CB  . GLU A 139 ? 0.6139 0.3408 0.4042 -0.0041 -0.2197 0.0309  167 GLU A CB  
1035 C CG  . GLU A 139 ? 0.6407 0.3659 0.4477 0.0119  -0.2304 0.0352  167 GLU A CG  
1036 C CD  . GLU A 139 ? 0.7390 0.4116 0.4924 0.0125  -0.2520 0.0402  167 GLU A CD  
1037 O OE1 . GLU A 139 ? 0.7821 0.4308 0.5118 0.0076  -0.2770 0.0426  167 GLU A OE1 
1038 O OE2 . GLU A 139 ? 0.7781 0.4286 0.5087 0.0169  -0.2451 0.0421  167 GLU A OE2 
1039 N N   . ALA A 140 ? 0.5628 0.2846 0.3012 -0.0314 -0.1687 0.0183  168 ALA A N   
1040 C CA  . ALA A 140 ? 0.5676 0.2897 0.2948 -0.0399 -0.1565 0.0118  168 ALA A CA  
1041 C C   . ALA A 140 ? 0.6045 0.2947 0.2767 -0.0495 -0.1403 0.0085  168 ALA A C   
1042 O O   . ALA A 140 ? 0.6313 0.3130 0.2847 -0.0549 -0.1306 0.0020  168 ALA A O   
1043 C CB  . ALA A 140 ? 0.5100 0.2709 0.2801 -0.0371 -0.1371 0.0089  168 ALA A CB  
1044 N N   . GLY A 141 ? 0.6226 0.2952 0.2704 -0.0516 -0.1351 0.0127  169 GLY A N   
1045 C CA  . GLY A 141 ? 0.6578 0.2948 0.2490 -0.0630 -0.1210 0.0122  169 GLY A CA  
1046 C C   . GLY A 141 ? 0.6304 0.2875 0.2336 -0.0687 -0.0904 0.0091  169 GLY A C   
1047 O O   . GLY A 141 ? 0.6438 0.2814 0.2107 -0.0792 -0.0717 0.0072  169 GLY A O   
1048 N N   . PHE A 142 ? 0.5869 0.2816 0.2396 -0.0625 -0.0848 0.0088  170 PHE A N   
1049 C CA  . PHE A 142 ? 0.5678 0.2770 0.2304 -0.0693 -0.0621 0.0075  170 PHE A CA  
1050 C C   . PHE A 142 ? 0.6147 0.2872 0.2339 -0.0801 -0.0609 0.0140  170 PHE A C   
1051 O O   . PHE A 142 ? 0.6538 0.3000 0.2539 -0.0761 -0.0813 0.0204  170 PHE A O   
1052 C CB  . PHE A 142 ? 0.5110 0.2563 0.2233 -0.0609 -0.0621 0.0069  170 PHE A CB  
1053 C CG  . PHE A 142 ? 0.4696 0.2457 0.2155 -0.0554 -0.0557 0.0010  170 PHE A CG  
1054 C CD1 . PHE A 142 ? 0.4573 0.2495 0.2142 -0.0598 -0.0369 -0.0043 170 PHE A CD1 
1055 C CD2 . PHE A 142 ? 0.4535 0.2417 0.2218 -0.0462 -0.0687 0.0014  170 PHE A CD2 
1056 C CE1 . PHE A 142 ? 0.4316 0.2472 0.2175 -0.0531 -0.0333 -0.0093 170 PHE A CE1 
1057 C CE2 . PHE A 142 ? 0.4384 0.2487 0.2329 -0.0425 -0.0633 -0.0027 170 PHE A CE2 
1058 C CZ  . PHE A 142 ? 0.4190 0.2400 0.2194 -0.0452 -0.0468 -0.0081 170 PHE A CZ  
1059 N N   . ASP A 143 ? 0.6134 0.2855 0.2209 -0.0934 -0.0368 0.0124  171 ASP A N   
1060 C CA  . ASP A 143 ? 0.6632 0.3030 0.2310 -0.1092 -0.0277 0.0189  171 ASP A CA  
1061 C C   . ASP A 143 ? 0.6475 0.2922 0.2354 -0.1105 -0.0339 0.0234  171 ASP A C   
1062 O O   . ASP A 143 ? 0.6714 0.2788 0.2219 -0.1207 -0.0370 0.0308  171 ASP A O   
1063 C CB  . ASP A 143 ? 0.6871 0.3338 0.2467 -0.1226 0.0037  0.0147  171 ASP A CB  
1064 C CG  . ASP A 143 ? 0.7185 0.3483 0.2459 -0.1190 0.0073  0.0092  171 ASP A CG  
1065 O OD1 . ASP A 143 ? 0.7527 0.3380 0.2285 -0.1190 -0.0102 0.0137  171 ASP A OD1 
1066 O OD2 . ASP A 143 ? 0.6943 0.3535 0.2491 -0.1147 0.0241  0.0001  171 ASP A OD2 
1067 N N   . TRP A 144 ? 0.5926 0.2755 0.2310 -0.1013 -0.0360 0.0193  172 TRP A N   
1068 C CA  . TRP A 144 ? 0.5927 0.2756 0.2450 -0.1015 -0.0429 0.0218  172 TRP A CA  
1069 C C   . TRP A 144 ? 0.5388 0.2525 0.2322 -0.0843 -0.0522 0.0174  172 TRP A C   
1070 O O   . TRP A 144 ? 0.4968 0.2423 0.2186 -0.0802 -0.0446 0.0121  172 TRP A O   
1071 C CB  . TRP A 144 ? 0.6087 0.3033 0.2731 -0.1195 -0.0252 0.0216  172 TRP A CB  
1072 C CG  . TRP A 144 ? 0.6224 0.2954 0.2783 -0.1260 -0.0345 0.0259  172 TRP A CG  
1073 C CD1 . TRP A 144 ? 0.6724 0.2972 0.2839 -0.1332 -0.0430 0.0335  172 TRP A CD1 
1074 C CD2 . TRP A 144 ? 0.5990 0.2916 0.2870 -0.1263 -0.0381 0.0226  172 TRP A CD2 
1075 N NE1 . TRP A 144 ? 0.6851 0.2986 0.3006 -0.1374 -0.0509 0.0344  172 TRP A NE1 
1076 C CE2 . TRP A 144 ? 0.6393 0.2935 0.3000 -0.1337 -0.0483 0.0275  172 TRP A CE2 
1077 C CE3 . TRP A 144 ? 0.5636 0.2970 0.2956 -0.1197 -0.0366 0.0161  172 TRP A CE3 
1078 C CZ2 . TRP A 144 ? 0.6324 0.2874 0.3075 -0.1365 -0.0560 0.0251  172 TRP A CZ2 
1079 C CZ3 . TRP A 144 ? 0.5527 0.2878 0.2983 -0.1227 -0.0449 0.0145  172 TRP A CZ3 
1080 C CH2 . TRP A 144 ? 0.5984 0.2944 0.3151 -0.1313 -0.0544 0.0184  172 TRP A CH2 
1081 N N   . VAL A 145 ? 0.5494 0.2493 0.2408 -0.0734 -0.0679 0.0197  173 VAL A N   
1082 C CA  . VAL A 145 ? 0.5035 0.2280 0.2282 -0.0566 -0.0739 0.0161  173 VAL A CA  
1083 C C   . VAL A 145 ? 0.5093 0.2183 0.2293 -0.0540 -0.0792 0.0162  173 VAL A C   
1084 O O   . VAL A 145 ? 0.5476 0.2207 0.2392 -0.0534 -0.0889 0.0202  173 VAL A O   
1085 C CB  . VAL A 145 ? 0.5049 0.2304 0.2357 -0.0412 -0.0868 0.0174  173 VAL A CB  
1086 C CG1 . VAL A 145 ? 0.4698 0.2198 0.2338 -0.0259 -0.0879 0.0146  173 VAL A CG1 
1087 C CG2 . VAL A 145 ? 0.4995 0.2352 0.2310 -0.0448 -0.0843 0.0162  173 VAL A CG2 
1088 N N   . TYR A 146 ? 0.4703 0.2007 0.2133 -0.0511 -0.0751 0.0117  174 TYR A N   
1089 C CA  . TYR A 146 ? 0.4886 0.2009 0.2220 -0.0522 -0.0794 0.0101  174 TYR A CA  
1090 C C   . TYR A 146 ? 0.4671 0.1960 0.2185 -0.0363 -0.0797 0.0055  174 TYR A C   
1091 O O   . TYR A 146 ? 0.4461 0.2047 0.2204 -0.0373 -0.0736 0.0035  174 TYR A O   
1092 C CB  . TYR A 146 ? 0.4887 0.2050 0.2245 -0.0733 -0.0734 0.0098  174 TYR A CB  
1093 C CG  . TYR A 146 ? 0.5021 0.2026 0.2315 -0.0776 -0.0806 0.0071  174 TYR A CG  
1094 C CD1 . TYR A 146 ? 0.5332 0.1952 0.2344 -0.0696 -0.0908 0.0068  174 TYR A CD1 
1095 C CD2 . TYR A 146 ? 0.4904 0.2113 0.2408 -0.0904 -0.0789 0.0045  174 TYR A CD2 
1096 C CE1 . TYR A 146 ? 0.5536 0.1945 0.2424 -0.0740 -0.0988 0.0031  174 TYR A CE1 
1097 C CE2 . TYR A 146 ? 0.5128 0.2159 0.2548 -0.0962 -0.0895 0.0017  174 TYR A CE2 
1098 C CZ  . TYR A 146 ? 0.5424 0.2024 0.2498 -0.0893 -0.0993 0.0009  174 TYR A CZ  
1099 O OH  . TYR A 146 ? 0.5604 0.1965 0.2532 -0.0953 -0.1112 -0.0030 174 TYR A OH  
1100 N N   . TYR A 147 ? 0.4881 0.1968 0.2278 -0.0212 -0.0854 0.0043  175 TYR A N   
1101 C CA  . TYR A 147 ? 0.4845 0.2016 0.2328 -0.0052 -0.0820 0.0000  175 TYR A CA  
1102 C C   . TYR A 147 ? 0.5064 0.2097 0.2396 -0.0134 -0.0841 -0.0042 175 TYR A C   
1103 O O   . TYR A 147 ? 0.5436 0.2129 0.2506 -0.0090 -0.0897 -0.0074 175 TYR A O   
1104 C CB  . TYR A 147 ? 0.5045 0.2059 0.2482 0.0151  -0.0847 -0.0005 175 TYR A CB  
1105 C CG  . TYR A 147 ? 0.4995 0.2159 0.2568 0.0325  -0.0749 -0.0043 175 TYR A CG  
1106 C CD1 . TYR A 147 ? 0.5132 0.2323 0.2841 0.0525  -0.0729 -0.0045 175 TYR A CD1 
1107 C CD2 . TYR A 147 ? 0.4893 0.2172 0.2466 0.0294  -0.0673 -0.0072 175 TYR A CD2 
1108 C CE1 . TYR A 147 ? 0.5111 0.2456 0.2961 0.0680  -0.0591 -0.0076 175 TYR A CE1 
1109 C CE2 . TYR A 147 ? 0.4929 0.2296 0.2555 0.0443  -0.0554 -0.0096 175 TYR A CE2 
1110 C CZ  . TYR A 147 ? 0.5059 0.2470 0.2829 0.0632  -0.0489 -0.0099 175 TYR A CZ  
1111 O OH  . TYR A 147 ? 0.5131 0.2659 0.2984 0.0771  -0.0324 -0.0120 175 TYR A OH  
1112 N N   . GLU A 148 ? 0.4921 0.2195 0.2419 -0.0255 -0.0818 -0.0044 176 GLU A N   
1113 C CA  . GLU A 148 ? 0.5131 0.2336 0.2577 -0.0410 -0.0884 -0.0067 176 GLU A CA  
1114 C C   . GLU A 148 ? 0.5211 0.2269 0.2489 -0.0319 -0.0931 -0.0119 176 GLU A C   
1115 O O   . GLU A 148 ? 0.5405 0.2211 0.2490 -0.0407 -0.1035 -0.0148 176 GLU A O   
1116 C CB  . GLU A 148 ? 0.4978 0.2543 0.2738 -0.0529 -0.0846 -0.0055 176 GLU A CB  
1117 C CG  . GLU A 148 ? 0.5396 0.2974 0.3227 -0.0694 -0.0931 -0.0074 176 GLU A CG  
1118 C CD  . GLU A 148 ? 0.5242 0.3174 0.3433 -0.0826 -0.0873 -0.0061 176 GLU A CD  
1119 O OE1 . GLU A 148 ? 0.5544 0.3746 0.3945 -0.0746 -0.0800 -0.0062 176 GLU A OE1 
1120 O OE2 . GLU A 148 ? 0.5970 0.3904 0.4249 -0.1006 -0.0905 -0.0056 176 GLU A OE2 
1121 N N   . SER A 149 ? 0.5105 0.2293 0.2432 -0.0166 -0.0855 -0.0126 177 SER A N   
1122 C CA  . SER A 149 ? 0.5455 0.2461 0.2539 -0.0079 -0.0870 -0.0172 177 SER A CA  
1123 C C   . SER A 149 ? 0.5541 0.2594 0.2618 0.0120  -0.0722 -0.0171 177 SER A C   
1124 O O   . SER A 149 ? 0.5165 0.2476 0.2520 0.0161  -0.0644 -0.0129 177 SER A O   
1125 C CB  . SER A 149 ? 0.5414 0.2559 0.2577 -0.0164 -0.0945 -0.0172 177 SER A CB  
1126 O OG  . SER A 149 ? 0.5216 0.2619 0.2550 -0.0086 -0.0851 -0.0141 177 SER A OG  
1127 N N   . LYS A 150 ? 0.5912 0.2731 0.2686 0.0225  -0.0682 -0.0216 178 LYS A N   
1128 C CA  . LYS A 150 ? 0.6080 0.2980 0.2867 0.0402  -0.0493 -0.0212 178 LYS A CA  
1129 C C   . LYS A 150 ? 0.5441 0.2718 0.2538 0.0361  -0.0427 -0.0147 178 LYS A C   
1130 O O   . LYS A 150 ? 0.5361 0.2836 0.2652 0.0460  -0.0270 -0.0116 178 LYS A O   
1131 C CB  . LYS A 150 ? 0.6788 0.3343 0.3116 0.0489  -0.0442 -0.0270 178 LYS A CB  
1132 C CG  . LYS A 150 ? 0.7528 0.3607 0.3437 0.0513  -0.0541 -0.0351 178 LYS A CG  
1133 C CD  . LYS A 150 ? 0.7677 0.3638 0.3579 0.0696  -0.0426 -0.0388 178 LYS A CD  
1134 C CE  . LYS A 150 ? 0.8357 0.3760 0.3772 0.0719  -0.0538 -0.0476 178 LYS A CE  
1135 N NZ  . LYS A 150 ? 0.8895 0.3925 0.3786 0.0790  -0.0488 -0.0551 178 LYS A NZ  
1136 N N   . ALA A 151 ? 0.5116 0.2501 0.2298 0.0222  -0.0545 -0.0125 179 ALA A N   
1137 C CA  . ALA A 151 ? 0.4756 0.2391 0.2132 0.0196  -0.0505 -0.0072 179 ALA A CA  
1138 C C   . ALA A 151 ? 0.4264 0.2221 0.2042 0.0127  -0.0515 -0.0035 179 ALA A C   
1139 O O   . ALA A 151 ? 0.4095 0.2238 0.2044 0.0121  -0.0473 0.0005  179 ALA A O   
1140 C CB  . ALA A 151 ? 0.5030 0.2540 0.2217 0.0129  -0.0636 -0.0078 179 ALA A CB  
1141 N N   . HIS A 152 ? 0.4119 0.2092 0.1992 0.0068  -0.0572 -0.0047 180 HIS A N   
1142 C CA  . HIS A 152 ? 0.3798 0.2017 0.1963 0.0000  -0.0573 -0.0019 180 HIS A CA  
1143 C C   . HIS A 152 ? 0.3830 0.1981 0.1991 -0.0038 -0.0602 -0.0020 180 HIS A C   
1144 O O   . HIS A 152 ? 0.4180 0.2100 0.2142 -0.0057 -0.0653 -0.0042 180 HIS A O   
1145 C CB  . HIS A 152 ? 0.3619 0.1973 0.1917 -0.0102 -0.0636 -0.0022 180 HIS A CB  
1146 C CG  . HIS A 152 ? 0.3871 0.2153 0.2138 -0.0215 -0.0724 -0.0050 180 HIS A CG  
1147 N ND1 . HIS A 152 ? 0.4197 0.2272 0.2259 -0.0242 -0.0824 -0.0079 180 HIS A ND1 
1148 C CD2 . HIS A 152 ? 0.3862 0.2227 0.2256 -0.0326 -0.0722 -0.0053 180 HIS A CD2 
1149 C CE1 . HIS A 152 ? 0.4263 0.2334 0.2392 -0.0377 -0.0891 -0.0092 180 HIS A CE1 
1150 N NE2 . HIS A 152 ? 0.4054 0.2309 0.2386 -0.0431 -0.0808 -0.0073 180 HIS A NE2 
1151 N N   . ILE A 153 ? 0.3634 0.1946 0.1973 -0.0071 -0.0586 0.0004  181 ILE A N   
1152 C CA  . ILE A 153 ? 0.3690 0.1920 0.1981 -0.0134 -0.0619 0.0015  181 ILE A CA  
1153 C C   . ILE A 153 ? 0.3604 0.1948 0.1976 -0.0267 -0.0601 0.0007  181 ILE A C   
1154 O O   . ILE A 153 ? 0.3553 0.2096 0.2103 -0.0261 -0.0566 0.0000  181 ILE A O   
1155 C CB  . ILE A 153 ? 0.3669 0.1956 0.2058 -0.0058 -0.0625 0.0044  181 ILE A CB  
1156 C CG1 . ILE A 153 ? 0.3726 0.2001 0.2163 0.0093  -0.0606 0.0049  181 ILE A CG1 
1157 C CG2 . ILE A 153 ? 0.3890 0.2015 0.2137 -0.0119 -0.0688 0.0063  181 ILE A CG2 
1158 C CD1 . ILE A 153 ? 0.4025 0.2025 0.2231 0.0154  -0.0633 0.0024  181 ILE A CD1 
1159 N N   . HIS A 154 ? 0.3685 0.1902 0.1938 -0.0383 -0.0612 0.0006  182 HIS A N   
1160 C CA  . HIS A 154 ? 0.3616 0.1960 0.1972 -0.0514 -0.0549 -0.0003 182 HIS A CA  
1161 C C   . HIS A 154 ? 0.3762 0.2003 0.1972 -0.0549 -0.0510 0.0019  182 HIS A C   
1162 O O   . HIS A 154 ? 0.3875 0.1857 0.1844 -0.0560 -0.0562 0.0051  182 HIS A O   
1163 C CB  . HIS A 154 ? 0.3778 0.2054 0.2110 -0.0649 -0.0566 -0.0009 182 HIS A CB  
1164 C CG  . HIS A 154 ? 0.3877 0.2277 0.2325 -0.0801 -0.0463 -0.0011 182 HIS A CG  
1165 N ND1 . HIS A 154 ? 0.3714 0.2417 0.2497 -0.0836 -0.0419 -0.0045 182 HIS A ND1 
1166 C CD2 . HIS A 154 ? 0.4104 0.2365 0.2378 -0.0920 -0.0378 0.0016  182 HIS A CD2 
1167 C CE1 . HIS A 154 ? 0.3949 0.2735 0.2809 -0.0971 -0.0287 -0.0044 182 HIS A CE1 
1168 N NE2 . HIS A 154 ? 0.4052 0.2548 0.2564 -0.1037 -0.0249 -0.0003 182 HIS A NE2 
1169 N N   . CYS A 155 ? 0.3680 0.2068 0.1988 -0.0567 -0.0432 0.0000  183 CYS A N   
1170 C CA  . CYS A 155 ? 0.3956 0.2191 0.2044 -0.0599 -0.0405 0.0013  183 CYS A CA  
1171 C C   . CYS A 155 ? 0.4078 0.2398 0.2188 -0.0707 -0.0248 -0.0018 183 CYS A C   
1172 O O   . CYS A 155 ? 0.4230 0.2805 0.2622 -0.0678 -0.0186 -0.0063 183 CYS A O   
1173 C CB  . CYS A 155 ? 0.3906 0.2186 0.2046 -0.0492 -0.0467 0.0009  183 CYS A CB  
1174 S SG  . CYS A 155 ? 0.4166 0.2446 0.2403 -0.0355 -0.0600 0.0044  183 CYS A SG  
1175 N N   . SER A 156 ? 0.4372 0.2475 0.2186 -0.0818 -0.0173 0.0002  184 SER A N   
1176 C CA  . SER A 156 ? 0.4434 0.2642 0.2283 -0.0914 0.0033  -0.0035 184 SER A CA  
1177 C C   . SER A 156 ? 0.4856 0.2750 0.2249 -0.0958 0.0094  -0.0026 184 SER A C   
1178 O O   . SER A 156 ? 0.4861 0.2461 0.1945 -0.0927 -0.0068 0.0021  184 SER A O   
1179 C CB  . SER A 156 ? 0.4485 0.2796 0.2483 -0.1063 0.0135  -0.0020 184 SER A CB  
1180 O OG  . SER A 156 ? 0.4930 0.2906 0.2580 -0.1181 0.0095  0.0049  184 SER A OG  
1181 N N   . VAL A 157 ? 0.5045 0.3009 0.2423 -0.1014 0.0314  -0.0076 185 VAL A N   
1182 C CA  . VAL A 157 ? 0.5665 0.3301 0.2542 -0.1060 0.0421  -0.0088 185 VAL A CA  
1183 C C   . VAL A 157 ? 0.6086 0.3730 0.2877 -0.1218 0.0721  -0.0093 185 VAL A C   
1184 O O   . VAL A 157 ? 0.5819 0.3848 0.3091 -0.1251 0.0859  -0.0121 185 VAL A O   
1185 C CB  . VAL A 157 ? 0.5537 0.3206 0.2425 -0.0932 0.0420  -0.0172 185 VAL A CB  
1186 C CG1 . VAL A 157 ? 0.5314 0.2957 0.2272 -0.0812 0.0141  -0.0155 185 VAL A CG1 
1187 C CG2 . VAL A 157 ? 0.5248 0.3306 0.2597 -0.0873 0.0605  -0.0259 185 VAL A CG2 
1188 N N   . LYS A 158 ? 0.6890 0.4110 0.3074 -0.1309 0.0812  -0.0067 186 LYS A N   
1189 C CA  A LYS A 158 ? 0.7389 0.4544 0.3362 -0.1459 0.1163  -0.0079 186 LYS A CA  
1190 C CA  B LYS A 158 ? 0.7418 0.4571 0.3388 -0.1459 0.1162  -0.0079 186 LYS A CA  
1191 C C   . LYS A 158 ? 0.7294 0.4800 0.3624 -0.1357 0.1394  -0.0205 186 LYS A C   
1192 O O   . LYS A 158 ? 0.7080 0.4649 0.3529 -0.1182 0.1249  -0.0273 186 LYS A O   
1193 C CB  A LYS A 158 ? 0.8146 0.4682 0.3273 -0.1538 0.1175  -0.0035 186 LYS A CB  
1194 C CB  B LYS A 158 ? 0.8214 0.4747 0.3336 -0.1536 0.1174  -0.0036 186 LYS A CB  
1195 C CG  A LYS A 158 ? 0.8451 0.4571 0.3172 -0.1626 0.0939  0.0092  186 LYS A CG  
1196 C CG  B LYS A 158 ? 0.8490 0.4602 0.3211 -0.1572 0.0866  0.0079  186 LYS A CG  
1197 C CD  A LYS A 158 ? 0.9225 0.4681 0.3069 -0.1676 0.0877  0.0139  186 LYS A CD  
1198 C CD  B LYS A 158 ? 0.9381 0.4830 0.3217 -0.1674 0.0873  0.0139  186 LYS A CD  
1199 C CE  A LYS A 158 ? 0.9475 0.4512 0.2965 -0.1704 0.0563  0.0262  186 LYS A CE  
1200 C CE  B LYS A 158 ? 0.9688 0.4718 0.3168 -0.1710 0.0569  0.0264  186 LYS A CE  
1201 N NZ  A LYS A 158 ? 0.9564 0.4544 0.3057 -0.1888 0.0674  0.0357  186 LYS A NZ  
1202 N NZ  B LYS A 158 ? 0.9331 0.4398 0.3003 -0.1514 0.0180  0.0257  186 LYS A NZ  
1203 N N   . ALA A 159 ? 0.7551 0.5269 0.4060 -0.1464 0.1744  -0.0231 187 ALA A N   
1204 C CA  . ALA A 159 ? 0.7706 0.5726 0.4525 -0.1356 0.2021  -0.0360 187 ALA A CA  
1205 C C   . ALA A 159 ? 0.8404 0.5943 0.4509 -0.1295 0.2124  -0.0429 187 ALA A C   
1206 O O   . ALA A 159 ? 0.8643 0.5629 0.4003 -0.1396 0.2048  -0.0359 187 ALA A O   
1207 C CB  . ALA A 159 ? 0.7845 0.6225 0.5061 -0.1502 0.2383  -0.0361 187 ALA A CB  
1208 N N   . GLU A 160 ? 0.8674 0.6373 0.4972 -0.1127 0.2268  -0.0563 188 GLU A N   
1209 C CA  . GLU A 160 ? 0.9511 0.6742 0.5137 -0.1050 0.2385  -0.0661 188 GLU A CA  
1210 C C   . GLU A 160 ? 1.0702 0.7634 0.5767 -0.1231 0.2757  -0.0636 188 GLU A C   
1211 O O   . GLU A 160 ? 1.1460 0.7757 0.5652 -0.1295 0.2695  -0.0609 188 GLU A O   
1212 C CB  . GLU A 160 ? 0.9233 0.6722 0.5248 -0.0832 0.2509  -0.0817 188 GLU A CB  
1213 C CG  . GLU A 160 ? 0.8515 0.6277 0.5068 -0.0675 0.2156  -0.0823 188 GLU A CG  
1214 C CD  . GLU A 160 ? 0.8415 0.5789 0.4560 -0.0665 0.1751  -0.0768 188 GLU A CD  
1215 O OE1 . GLU A 160 ? 0.9158 0.6001 0.4597 -0.0669 0.1719  -0.0805 188 GLU A OE1 
1216 O OE2 . GLU A 160 ? 0.7550 0.5134 0.4061 -0.0659 0.1472  -0.0687 188 GLU A OE2 
1217 N N   . ASN A 161 ? 1.1137 0.8518 0.6712 -0.1322 0.3109  -0.0635 189 ASN A N   
1218 C CA  . ASN A 161 ? 1.2057 0.9290 0.7283 -0.1549 0.3509  -0.0579 189 ASN A CA  
1219 C C   . ASN A 161 ? 1.1862 0.9402 0.7551 -0.1755 0.3433  -0.0434 189 ASN A C   
1220 O O   . ASN A 161 ? 1.2307 0.9449 0.7491 -0.1950 0.3331  -0.0298 189 ASN A O   
1221 C CB  . ASN A 161 ? 1.2469 1.0021 0.7989 -0.1495 0.4038  -0.0709 189 ASN A CB  
1222 C CG  . ASN A 161 ? 1.3168 1.0245 0.7988 -0.1341 0.4212  -0.0852 189 ASN A CG  
1223 O OD1 . ASN A 161 ? 1.3095 1.0109 0.7946 -0.1119 0.3973  -0.0952 189 ASN A OD1 
1224 N ND2 . ASN A 161 ? 1.4112 1.0829 0.8279 -0.1465 0.4643  -0.0866 189 ASN A ND2 
1225 N N   . GLN B 1   ? 0.7937 0.6609 0.5620 0.0330  -0.0089 -0.1006 1   GLN H N   
1226 C CA  . GLN B 1   ? 0.7781 0.6118 0.5333 0.0325  -0.0277 -0.1064 1   GLN H CA  
1227 C C   . GLN B 1   ? 0.7023 0.5287 0.4615 0.0154  -0.0375 -0.0925 1   GLN H C   
1228 O O   . GLN B 1   ? 0.6840 0.4938 0.4518 0.0094  -0.0503 -0.0886 1   GLN H O   
1229 C CB  . GLN B 1   ? 0.8691 0.6903 0.5948 0.0428  -0.0306 -0.1219 1   GLN H CB  
1230 C CG  . GLN B 1   ? 0.9421 0.7259 0.6549 0.0471  -0.0501 -0.1324 1   GLN H CG  
1231 C CD  . GLN B 1   ? 1.0118 0.7766 0.6984 0.0416  -0.0613 -0.1359 1   GLN H CD  
1232 O OE1 . GLN B 1   ? 1.0186 0.7982 0.6995 0.0331  -0.0555 -0.1281 1   GLN H OE1 
1233 N NE2 . GLN B 1   ? 1.0520 0.7819 0.7215 0.0462  -0.0787 -0.1475 1   GLN H NE2 
1234 N N   . VAL B 2   ? 0.6255 0.4651 0.3795 0.0076  -0.0322 -0.0843 2   VAL H N   
1235 C CA  . VAL B 2   ? 0.5601 0.4027 0.3257 -0.0063 -0.0383 -0.0696 2   VAL H CA  
1236 C C   . VAL B 2   ? 0.5108 0.3686 0.3035 -0.0087 -0.0316 -0.0604 2   VAL H C   
1237 O O   . VAL B 2   ? 0.4945 0.3700 0.2936 -0.0046 -0.0178 -0.0594 2   VAL H O   
1238 C CB  . VAL B 2   ? 0.5416 0.3945 0.2959 -0.0117 -0.0346 -0.0629 2   VAL H CB  
1239 C CG1 . VAL B 2   ? 0.5090 0.3683 0.2777 -0.0226 -0.0405 -0.0492 2   VAL H CG1 
1240 C CG2 . VAL B 2   ? 0.5765 0.4145 0.3026 -0.0097 -0.0422 -0.0719 2   VAL H CG2 
1241 N N   . GLN B 3   ? 0.4966 0.3487 0.3036 -0.0160 -0.0412 -0.0536 3   GLN H N   
1242 C CA  A GLN B 3   ? 0.4667 0.3336 0.2977 -0.0192 -0.0361 -0.0442 3   GLN H CA  
1243 C CA  B GLN B 3   ? 0.4738 0.3401 0.3048 -0.0190 -0.0364 -0.0445 3   GLN H CA  
1244 C C   . GLN B 3   ? 0.4471 0.3177 0.2879 -0.0306 -0.0449 -0.0330 3   GLN H C   
1245 O O   . GLN B 3   ? 0.4590 0.3166 0.2934 -0.0372 -0.0580 -0.0329 3   GLN H O   
1246 C CB  A GLN B 3   ? 0.4721 0.3329 0.3145 -0.0140 -0.0373 -0.0479 3   GLN H CB  
1247 C CB  B GLN B 3   ? 0.4941 0.3519 0.3329 -0.0123 -0.0377 -0.0504 3   GLN H CB  
1248 C CG  A GLN B 3   ? 0.4481 0.3238 0.3128 -0.0184 -0.0335 -0.0377 3   GLN H CG  
1249 C CG  B GLN B 3   ? 0.5268 0.3831 0.3550 0.0013  -0.0305 -0.0638 3   GLN H CG  
1250 C CD  A GLN B 3   ? 0.4637 0.3342 0.3389 -0.0132 -0.0349 -0.0405 3   GLN H CD  
1251 C CD  B GLN B 3   ? 0.5495 0.4009 0.3871 0.0108  -0.0312 -0.0702 3   GLN H CD  
1252 O OE1 A GLN B 3   ? 0.4930 0.3453 0.3594 -0.0065 -0.0414 -0.0496 3   GLN H OE1 
1253 O OE1 B GLN B 3   ? 0.5471 0.3934 0.3982 0.0065  -0.0375 -0.0640 3   GLN H OE1 
1254 N NE2 A GLN B 3   ? 0.4315 0.3162 0.3244 -0.0155 -0.0303 -0.0331 3   GLN H NE2 
1255 N NE2 B GLN B 3   ? 0.5818 0.4360 0.4115 0.0247  -0.0249 -0.0829 3   GLN H NE2 
1256 N N   . LEU B 4   ? 0.4022 0.2912 0.2577 -0.0329 -0.0381 -0.0241 4   LEU H N   
1257 C CA  . LEU B 4   ? 0.3672 0.2666 0.2359 -0.0413 -0.0442 -0.0140 4   LEU H CA  
1258 C C   . LEU B 4   ? 0.3603 0.2679 0.2471 -0.0405 -0.0400 -0.0103 4   LEU H C   
1259 O O   . LEU B 4   ? 0.3476 0.2639 0.2400 -0.0350 -0.0294 -0.0107 4   LEU H O   
1260 C CB  . LEU B 4   ? 0.3621 0.2753 0.2302 -0.0418 -0.0408 -0.0082 4   LEU H CB  
1261 C CG  . LEU B 4   ? 0.3888 0.2951 0.2379 -0.0424 -0.0453 -0.0106 4   LEU H CG  
1262 C CD1 . LEU B 4   ? 0.3897 0.3082 0.2390 -0.0417 -0.0429 -0.0039 4   LEU H CD1 
1263 C CD2 . LEU B 4   ? 0.4172 0.3159 0.2623 -0.0500 -0.0594 -0.0108 4   LEU H CD2 
1264 N N   . GLN B 5   ? 0.3550 0.2588 0.2490 -0.0468 -0.0486 -0.0067 5   GLN H N   
1265 C CA  . GLN B 5   ? 0.3532 0.2627 0.2621 -0.0465 -0.0461 -0.0031 5   GLN H CA  
1266 C C   . GLN B 5   ? 0.3158 0.2454 0.2374 -0.0540 -0.0480 0.0073  5   GLN H C   
1267 O O   . GLN B 5   ? 0.3255 0.2563 0.2471 -0.0637 -0.0577 0.0125  5   GLN H O   
1268 C CB  . GLN B 5   ? 0.4081 0.2963 0.3130 -0.0470 -0.0546 -0.0069 5   GLN H CB  
1269 C CG  . GLN B 5   ? 0.4495 0.3412 0.3675 -0.0468 -0.0537 -0.0027 5   GLN H CG  
1270 C CD  . GLN B 5   ? 0.4521 0.3551 0.3781 -0.0369 -0.0413 -0.0062 5   GLN H CD  
1271 O OE1 . GLN B 5   ? 0.5288 0.4322 0.4492 -0.0293 -0.0339 -0.0135 5   GLN H OE1 
1272 N NE2 . GLN B 5   ? 0.4758 0.3892 0.4146 -0.0377 -0.0392 -0.0008 5   GLN H NE2 
1273 N N   . GLN B 6   ? 0.2924 0.2384 0.2243 -0.0497 -0.0393 0.0101  6   GLN H N   
1274 C CA  . GLN B 6   ? 0.2761 0.2444 0.2195 -0.0534 -0.0397 0.0181  6   GLN H CA  
1275 C C   . GLN B 6   ? 0.2678 0.2416 0.2215 -0.0564 -0.0402 0.0226  6   GLN H C   
1276 O O   . GLN B 6   ? 0.2662 0.2278 0.2200 -0.0529 -0.0383 0.0191  6   GLN H O   
1277 C CB  . GLN B 6   ? 0.2691 0.2491 0.2145 -0.0459 -0.0320 0.0177  6   GLN H CB  
1278 C CG  . GLN B 6   ? 0.2786 0.2539 0.2123 -0.0442 -0.0332 0.0156  6   GLN H CG  
1279 C CD  . GLN B 6   ? 0.2710 0.2543 0.2047 -0.0374 -0.0285 0.0166  6   GLN H CD  
1280 O OE1 . GLN B 6   ? 0.2933 0.2663 0.2181 -0.0334 -0.0235 0.0137  6   GLN H OE1 
1281 N NE2 . GLN B 6   ? 0.2713 0.2733 0.2144 -0.0359 -0.0304 0.0210  6   GLN H NE2 
1282 N N   . SER B 7   ? 0.2590 0.2531 0.2209 -0.0625 -0.0430 0.0303  7   SER H N   
1283 C CA  . SER B 7   ? 0.2475 0.2522 0.2181 -0.0674 -0.0439 0.0368  7   SER H CA  
1284 C C   . SER B 7   ? 0.2437 0.2567 0.2201 -0.0577 -0.0348 0.0343  7   SER H C   
1285 O O   . SER B 7   ? 0.2348 0.2467 0.2094 -0.0490 -0.0287 0.0289  7   SER H O   
1286 C CB  . SER B 7   ? 0.2491 0.2782 0.2262 -0.0775 -0.0488 0.0459  7   SER H CB  
1287 O OG  . SER B 7   ? 0.2353 0.2862 0.2164 -0.0716 -0.0451 0.0452  7   SER H OG  
1288 N N   . GLY B 8   ? 0.2389 0.2576 0.2206 -0.0604 -0.0351 0.0386  8   GLY H N   
1289 C CA  . GLY B 8   ? 0.2415 0.2645 0.2275 -0.0523 -0.0283 0.0358  8   GLY H CA  
1290 C C   . GLY B 8   ? 0.2307 0.2770 0.2213 -0.0467 -0.0234 0.0362  8   GLY H C   
1291 O O   . GLY B 8   ? 0.2185 0.2825 0.2108 -0.0480 -0.0246 0.0391  8   GLY H O   
1292 N N   . PRO B 9   ? 0.2266 0.2736 0.2191 -0.0393 -0.0185 0.0326  9   PRO H N   
1293 C CA  . PRO B 9   ? 0.2189 0.2827 0.2132 -0.0316 -0.0149 0.0308  9   PRO H CA  
1294 C C   . PRO B 9   ? 0.2204 0.3117 0.2191 -0.0347 -0.0161 0.0370  9   PRO H C   
1295 O O   . PRO B 9   ? 0.2347 0.3292 0.2349 -0.0438 -0.0189 0.0435  9   PRO H O   
1296 C CB  . PRO B 9   ? 0.2177 0.2716 0.2120 -0.0261 -0.0116 0.0261  9   PRO H CB  
1297 C CG  . PRO B 9   ? 0.2323 0.2761 0.2283 -0.0323 -0.0141 0.0287  9   PRO H CG  
1298 C CD  . PRO B 9   ? 0.2339 0.2652 0.2268 -0.0374 -0.0173 0.0293  9   PRO H CD  
1299 N N   . GLU B 10  ? 0.2139 0.3247 0.2138 -0.0268 -0.0141 0.0349  10  GLU H N   
1300 C CA  . GLU B 10  ? 0.2235 0.3688 0.2284 -0.0278 -0.0140 0.0399  10  GLU H CA  
1301 C C   . GLU B 10  ? 0.2055 0.3635 0.2090 -0.0142 -0.0102 0.0337  10  GLU H C   
1302 O O   . GLU B 10  ? 0.2296 0.3761 0.2292 -0.0027 -0.0099 0.0261  10  GLU H O   
1303 C CB  . GLU B 10  ? 0.2492 0.4105 0.2574 -0.0282 -0.0164 0.0416  10  GLU H CB  
1304 C CG  . GLU B 10  ? 0.2819 0.4311 0.2899 -0.0415 -0.0217 0.0469  10  GLU H CG  
1305 C CD  . GLU B 10  ? 0.3128 0.4748 0.3244 -0.0572 -0.0251 0.0573  10  GLU H CD  
1306 O OE1 . GLU B 10  ? 0.3144 0.5003 0.3293 -0.0583 -0.0223 0.0615  10  GLU H OE1 
1307 O OE2 . GLU B 10  ? 0.3490 0.4957 0.3584 -0.0689 -0.0312 0.0614  10  GLU H OE2 
1308 N N   . LEU B 11  ? 0.1743 0.3545 0.1792 -0.0153 -0.0083 0.0369  11  LEU H N   
1309 C CA  . LEU B 11  ? 0.1619 0.3640 0.1651 -0.0015 -0.0052 0.0309  11  LEU H CA  
1310 C C   . LEU B 11  ? 0.1714 0.4160 0.1813 -0.0019 -0.0041 0.0356  11  LEU H C   
1311 O O   . LEU B 11  ? 0.1754 0.4391 0.1900 -0.0163 -0.0043 0.0461  11  LEU H O   
1312 C CB  . LEU B 11  ? 0.1570 0.3600 0.1561 -0.0029 -0.0036 0.0315  11  LEU H CB  
1313 C CG  . LEU B 11  ? 0.1564 0.3838 0.1513 0.0107  -0.0006 0.0252  11  LEU H CG  
1314 C CD1 . LEU B 11  ? 0.1678 0.3757 0.1563 0.0276  -0.0020 0.0124  11  LEU H CD1 
1315 C CD2 . LEU B 11  ? 0.1606 0.3935 0.1506 0.0065  0.0005  0.0281  11  LEU H CD2 
1316 N N   . VAL B 12  ? 0.1737 0.4357 0.1841 0.0138  -0.0032 0.0281  12  VAL H N   
1317 C CA  . VAL B 12  ? 0.1842 0.4938 0.2035 0.0148  -0.0017 0.0321  12  VAL H CA  
1318 C C   . VAL B 12  ? 0.1970 0.5273 0.2132 0.0375  0.0005  0.0208  12  VAL H C   
1319 O O   . VAL B 12  ? 0.2125 0.5138 0.2207 0.0522  -0.0022 0.0103  12  VAL H O   
1320 C CB  . VAL B 12  ? 0.1864 0.4956 0.2126 0.0087  -0.0061 0.0360  12  VAL H CB  
1321 C CG1 . VAL B 12  ? 0.1968 0.4690 0.2164 0.0188  -0.0096 0.0279  12  VAL H CG1 
1322 C CG2 . VAL B 12  ? 0.1945 0.5540 0.2319 0.0120  -0.0055 0.0386  12  VAL H CG2 
1323 N N   . ARG B 13  ? 0.2083 0.5859 0.2291 0.0399  0.0050  0.0229  13  ARG H N   
1324 C CA  . ARG B 13  ? 0.2158 0.6217 0.2343 0.0640  0.0072  0.0111  13  ARG H CA  
1325 C C   . ARG B 13  ? 0.2233 0.6376 0.2478 0.0779  0.0032  0.0056  13  ARG H C   
1326 O O   . ARG B 13  ? 0.2096 0.6320 0.2443 0.0664  0.0007  0.0136  13  ARG H O   
1327 C CB  . ARG B 13  ? 0.2123 0.6760 0.2359 0.0627  0.0141  0.0157  13  ARG H CB  
1328 C CG  . ARG B 13  ? 0.2090 0.6691 0.2197 0.0678  0.0177  0.0109  13  ARG H CG  
1329 C CD  . ARG B 13  ? 0.2054 0.7267 0.2198 0.0670  0.0252  0.0156  13  ARG H CD  
1330 N NE  . ARG B 13  ? 0.2027 0.7245 0.2032 0.0712  0.0286  0.0118  13  ARG H NE  
1331 C CZ  . ARG B 13  ? 0.2147 0.7404 0.2040 0.0958  0.0296  -0.0041 13  ARG H CZ  
1332 N NH1 . ARG B 13  ? 0.2205 0.7467 0.2108 0.1191  0.0266  -0.0178 13  ARG H NH1 
1333 N NH2 . ARG B 13  ? 0.2151 0.7387 0.1905 0.0975  0.0318  -0.0070 13  ARG H NH2 
1334 N N   . PRO B 14  ? 0.2495 0.6608 0.2664 0.1037  0.0011  -0.0088 14  PRO H N   
1335 C CA  . PRO B 14  ? 0.2726 0.6984 0.2947 0.1210  -0.0033 -0.0150 14  PRO H CA  
1336 C C   . PRO B 14  ? 0.2687 0.7617 0.3085 0.1168  0.0012  -0.0078 14  PRO H C   
1337 O O   . PRO B 14  ? 0.2532 0.7854 0.2960 0.1115  0.0087  -0.0039 14  PRO H O   
1338 C CB  . PRO B 14  ? 0.2991 0.7168 0.3083 0.1503  -0.0060 -0.0321 14  PRO H CB  
1339 C CG  . PRO B 14  ? 0.3045 0.6850 0.2994 0.1454  -0.0050 -0.0348 14  PRO H CG  
1340 C CD  . PRO B 14  ? 0.2802 0.6730 0.2822 0.1182  0.0015  -0.0202 14  PRO H CD  
1341 N N   . GLY B 15  ? 0.2743 0.7800 0.3251 0.1166  -0.0034 -0.0047 15  GLY H N   
1342 C CA  . GLY B 15  ? 0.2749 0.8460 0.3447 0.1131  -0.0009 0.0019  15  GLY H CA  
1343 C C   . GLY B 15  ? 0.2696 0.8528 0.3497 0.0798  0.0008  0.0199  15  GLY H C   
1344 O O   . GLY B 15  ? 0.2879 0.9222 0.3843 0.0718  0.0015  0.0277  15  GLY H O   
1345 N N   . VAL B 16  ? 0.2741 0.8121 0.3445 0.0610  0.0007  0.0262  16  VAL H N   
1346 C CA  . VAL B 16  ? 0.2734 0.8087 0.3494 0.0296  -0.0002 0.0426  16  VAL H CA  
1347 C C   . VAL B 16  ? 0.2920 0.7870 0.3667 0.0237  -0.0086 0.0435  16  VAL H C   
1348 O O   . VAL B 16  ? 0.3202 0.7939 0.3899 0.0434  -0.0126 0.0326  16  VAL H O   
1349 C CB  . VAL B 16  ? 0.2984 0.8096 0.3637 0.0172  0.0036  0.0471  16  VAL H CB  
1350 C CG1 . VAL B 16  ? 0.3080 0.7988 0.3739 -0.0121 0.0001  0.0617  16  VAL H CG1 
1351 C CG2 . VAL B 16  ? 0.3046 0.8630 0.3706 0.0225  0.0118  0.0472  16  VAL H CG2 
1352 N N   . SER B 17  ? 0.2742 0.7660 0.3540 -0.0014 -0.0123 0.0560  17  SER H N   
1353 C CA  A SER B 17  ? 0.2606 0.7137 0.3371 -0.0090 -0.0203 0.0571  17  SER H CA  
1354 C CA  B SER B 17  ? 0.2614 0.7152 0.3381 -0.0097 -0.0204 0.0575  17  SER H CA  
1355 C C   . SER B 17  ? 0.2618 0.6651 0.3267 -0.0250 -0.0213 0.0612  17  SER H C   
1356 O O   . SER B 17  ? 0.2460 0.6520 0.3088 -0.0342 -0.0172 0.0664  17  SER H O   
1357 C CB  A SER B 17  ? 0.2647 0.7514 0.3549 -0.0224 -0.0261 0.0658  17  SER H CB  
1358 C CB  B SER B 17  ? 0.2666 0.7535 0.3569 -0.0254 -0.0259 0.0673  17  SER H CB  
1359 O OG  A SER B 17  ? 0.2603 0.7914 0.3617 -0.0039 -0.0260 0.0602  17  SER H OG  
1360 O OG  B SER B 17  ? 0.2663 0.7455 0.3563 -0.0529 -0.0281 0.0801  17  SER H OG  
1361 N N   . VAL B 18  ? 0.2464 0.6071 0.3035 -0.0268 -0.0266 0.0586  18  VAL H N   
1362 C CA  . VAL B 18  ? 0.2411 0.5567 0.2882 -0.0405 -0.0282 0.0614  18  VAL H CA  
1363 C C   . VAL B 18  ? 0.2299 0.5230 0.2741 -0.0496 -0.0361 0.0631  18  VAL H C   
1364 O O   . VAL B 18  ? 0.2219 0.5177 0.2665 -0.0395 -0.0390 0.0584  18  VAL H O   
1365 C CB  . VAL B 18  ? 0.2456 0.5251 0.2813 -0.0272 -0.0237 0.0522  18  VAL H CB  
1366 C CG1 . VAL B 18  ? 0.2546 0.5081 0.2830 -0.0129 -0.0258 0.0432  18  VAL H CG1 
1367 C CG2 . VAL B 18  ? 0.2550 0.5010 0.2838 -0.0403 -0.0241 0.0557  18  VAL H CG2 
1368 N N   . LYS B 19  ? 0.2407 0.5112 0.2806 -0.0678 -0.0404 0.0694  19  LYS H N   
1369 C CA  . LYS B 19  ? 0.2448 0.4912 0.2793 -0.0773 -0.0489 0.0702  19  LYS H CA  
1370 C C   . LYS B 19  ? 0.2490 0.4462 0.2699 -0.0791 -0.0489 0.0662  19  LYS H C   
1371 O O   . LYS B 19  ? 0.2565 0.4441 0.2758 -0.0881 -0.0487 0.0705  19  LYS H O   
1372 C CB  . LYS B 19  ? 0.2526 0.5218 0.2949 -0.0988 -0.0564 0.0818  19  LYS H CB  
1373 C CG  . LYS B 19  ? 0.2635 0.5139 0.3007 -0.1084 -0.0668 0.0823  19  LYS H CG  
1374 C CD  . LYS B 19  ? 0.2755 0.5555 0.3226 -0.1300 -0.0752 0.0943  19  LYS H CD  
1375 C CE  . LYS B 19  ? 0.2940 0.5585 0.3361 -0.1393 -0.0870 0.0942  19  LYS H CE  
1376 N NZ  . LYS B 19  ? 0.3070 0.6045 0.3605 -0.1621 -0.0961 0.1068  19  LYS H NZ  
1377 N N   . ILE B 20  ? 0.2470 0.4164 0.2584 -0.0704 -0.0495 0.0585  20  ILE H N   
1378 C CA  . ILE B 20  ? 0.2583 0.3854 0.2573 -0.0694 -0.0482 0.0531  20  ILE H CA  
1379 C C   . ILE B 20  ? 0.2728 0.3783 0.2628 -0.0775 -0.0564 0.0523  20  ILE H C   
1380 O O   . ILE B 20  ? 0.2682 0.3895 0.2606 -0.0802 -0.0621 0.0543  20  ILE H O   
1381 C CB  . ILE B 20  ? 0.2549 0.3696 0.2490 -0.0526 -0.0407 0.0448  20  ILE H CB  
1382 C CG1 . ILE B 20  ? 0.2675 0.3831 0.2575 -0.0432 -0.0424 0.0409  20  ILE H CG1 
1383 C CG2 . ILE B 20  ? 0.2441 0.3787 0.2455 -0.0451 -0.0344 0.0448  20  ILE H CG2 
1384 C CD1 . ILE B 20  ? 0.2755 0.3744 0.2584 -0.0291 -0.0366 0.0343  20  ILE H CD1 
1385 N N   . SER B 21  ? 0.2721 0.3439 0.2517 -0.0803 -0.0574 0.0487  21  SER H N   
1386 C CA  . SER B 21  ? 0.2833 0.3304 0.2516 -0.0884 -0.0662 0.0469  21  SER H CA  
1387 C C   . SER B 21  ? 0.2818 0.2985 0.2365 -0.0787 -0.0623 0.0371  21  SER H C   
1388 O O   . SER B 21  ? 0.2541 0.2641 0.2090 -0.0698 -0.0539 0.0333  21  SER H O   
1389 C CB  . SER B 21  ? 0.2919 0.3288 0.2598 -0.1032 -0.0743 0.0528  21  SER H CB  
1390 O OG  . SER B 21  ? 0.2949 0.3084 0.2583 -0.0997 -0.0714 0.0495  21  SER H OG  
1391 N N   . CYS B 22  ? 0.3006 0.3009 0.2433 -0.0817 -0.0690 0.0336  22  CYS H N   
1392 C CA  . CYS B 22  ? 0.3257 0.3005 0.2532 -0.0737 -0.0659 0.0244  22  CYS H CA  
1393 C C   . CYS B 22  ? 0.3541 0.3052 0.2683 -0.0814 -0.0768 0.0210  22  CYS H C   
1394 O O   . CYS B 22  ? 0.3729 0.3285 0.2836 -0.0886 -0.0857 0.0232  22  CYS H O   
1395 C CB  . CYS B 22  ? 0.3258 0.3093 0.2490 -0.0658 -0.0623 0.0229  22  CYS H CB  
1396 S SG  . CYS B 22  ? 0.3557 0.3128 0.2572 -0.0593 -0.0596 0.0136  22  CYS H SG  
1397 N N   . LYS B 23  ? 0.3758 0.3023 0.2824 -0.0791 -0.0770 0.0151  23  LYS H N   
1398 C CA  . LYS B 23  ? 0.4182 0.3172 0.3099 -0.0847 -0.0891 0.0103  23  LYS H CA  
1399 C C   . LYS B 23  ? 0.4230 0.3038 0.2971 -0.0736 -0.0852 -0.0016 23  LYS H C   
1400 O O   . LYS B 23  ? 0.4059 0.2843 0.2798 -0.0627 -0.0746 -0.0072 23  LYS H O   
1401 C CB  . LYS B 23  ? 0.4616 0.3440 0.3555 -0.0890 -0.0948 0.0117  23  LYS H CB  
1402 C CG  . LYS B 23  ? 0.5312 0.3792 0.4080 -0.0937 -0.1093 0.0060  23  LYS H CG  
1403 C CD  . LYS B 23  ? 0.5734 0.4090 0.4540 -0.1050 -0.1200 0.0136  23  LYS H CD  
1404 C CE  . LYS B 23  ? 0.6336 0.4267 0.4962 -0.1027 -0.1325 0.0049  23  LYS H CE  
1405 N NZ  . LYS B 23  ? 0.6762 0.4501 0.5220 -0.1092 -0.1457 0.0002  23  LYS H NZ  
1406 N N   . GLY B 24  ? 0.4460 0.3160 0.3051 -0.0770 -0.0938 -0.0053 24  GLY H N   
1407 C CA  . GLY B 24  ? 0.4686 0.3231 0.3079 -0.0668 -0.0903 -0.0168 24  GLY H CA  
1408 C C   . GLY B 24  ? 0.4972 0.3200 0.3207 -0.0643 -0.0990 -0.0272 24  GLY H C   
1409 O O   . GLY B 24  ? 0.5420 0.3493 0.3629 -0.0752 -0.1142 -0.0248 24  GLY H O   
1410 N N   . SER B 25  ? 0.4989 0.3126 0.3114 -0.0504 -0.0904 -0.0385 25  SER H N   
1411 C CA  . SER B 25  ? 0.5437 0.3269 0.3378 -0.0432 -0.0983 -0.0518 25  SER H CA  
1412 C C   . SER B 25  ? 0.5583 0.3412 0.3339 -0.0300 -0.0891 -0.0640 25  SER H C   
1413 O O   . SER B 25  ? 0.5404 0.3466 0.3204 -0.0268 -0.0749 -0.0606 25  SER H O   
1414 C CB  . SER B 25  ? 0.5447 0.3176 0.3482 -0.0378 -0.0985 -0.0536 25  SER H CB  
1415 O OG  . SER B 25  ? 0.5375 0.3318 0.3534 -0.0276 -0.0814 -0.0541 25  SER H OG  
1416 N N   . GLY B 26  ? 0.5900 0.3463 0.3436 -0.0232 -0.0980 -0.0775 26  GLY H N   
1417 C CA  . GLY B 26  ? 0.6121 0.3679 0.3454 -0.0088 -0.0895 -0.0913 26  GLY H CA  
1418 C C   . GLY B 26  ? 0.6246 0.3845 0.3408 -0.0141 -0.0911 -0.0905 26  GLY H C   
1419 O O   . GLY B 26  ? 0.6495 0.4167 0.3494 -0.0043 -0.0810 -0.0985 26  GLY H O   
1420 N N   . TYR B 27  ? 0.6121 0.3688 0.3318 -0.0292 -0.1040 -0.0809 27  TYR H N   
1421 C CA  . TYR B 27  ? 0.6257 0.3827 0.3293 -0.0358 -0.1110 -0.0796 27  TYR H CA  
1422 C C   . TYR B 27  ? 0.6404 0.3874 0.3497 -0.0525 -0.1302 -0.0718 27  TYR H C   
1423 O O   . TYR B 27  ? 0.6333 0.3790 0.3614 -0.0601 -0.1351 -0.0645 27  TYR H O   
1424 C CB  . TYR B 27  ? 0.5814 0.3678 0.2919 -0.0364 -0.0974 -0.0698 27  TYR H CB  
1425 C CG  . TYR B 27  ? 0.5421 0.3494 0.2795 -0.0464 -0.0967 -0.0541 27  TYR H CG  
1426 C CD1 . TYR B 27  ? 0.5348 0.3511 0.2751 -0.0567 -0.1061 -0.0453 27  TYR H CD1 
1427 C CD2 . TYR B 27  ? 0.5091 0.3291 0.2692 -0.0444 -0.0867 -0.0486 27  TYR H CD2 
1428 C CE1 . TYR B 27  ? 0.4997 0.3389 0.2643 -0.0631 -0.1046 -0.0323 27  TYR H CE1 
1429 C CE2 . TYR B 27  ? 0.4764 0.3167 0.2591 -0.0516 -0.0853 -0.0356 27  TYR H CE2 
1430 C CZ  . TYR B 27  ? 0.4802 0.3309 0.2655 -0.0604 -0.0941 -0.0277 27  TYR H CZ  
1431 O OH  . TYR B 27  ? 0.4370 0.3102 0.2443 -0.0654 -0.0930 -0.0163 27  TYR H OH  
1432 N N   . THR B 28  ? 0.6635 0.4045 0.3561 -0.0588 -0.1414 -0.0731 28  THR H N   
1433 C CA  . THR B 28  ? 0.6819 0.4185 0.3798 -0.0767 -0.1604 -0.0650 28  THR H CA  
1434 C C   . THR B 28  ? 0.6544 0.4272 0.3777 -0.0850 -0.1549 -0.0487 28  THR H C   
1435 O O   . THR B 28  ? 0.6715 0.4616 0.3906 -0.0809 -0.1480 -0.0463 28  THR H O   
1436 C CB  . THR B 28  ? 0.7207 0.4373 0.3904 -0.0796 -0.1755 -0.0738 28  THR H CB  
1437 O OG1 . THR B 28  ? 0.7578 0.4432 0.4039 -0.0665 -0.1768 -0.0912 28  THR H OG1 
1438 C CG2 . THR B 28  ? 0.7356 0.4460 0.4109 -0.0997 -0.1969 -0.0661 28  THR H CG2 
1439 N N   . PHE B 29  ? 0.6514 0.4347 0.3990 -0.0950 -0.1574 -0.0381 29  PHE H N   
1440 C CA  . PHE B 29  ? 0.6163 0.4362 0.3909 -0.0997 -0.1499 -0.0238 29  PHE H CA  
1441 C C   . PHE B 29  ? 0.6219 0.4613 0.3955 -0.1045 -0.1557 -0.0184 29  PHE H C   
1442 O O   . PHE B 29  ? 0.6026 0.4662 0.3863 -0.0980 -0.1449 -0.0128 29  PHE H O   
1443 C CB  . PHE B 29  ? 0.6190 0.4434 0.4137 -0.1125 -0.1563 -0.0144 29  PHE H CB  
1444 C CG  . PHE B 29  ? 0.5793 0.4413 0.4014 -0.1144 -0.1467 -0.0019 29  PHE H CG  
1445 C CD1 . PHE B 29  ? 0.5411 0.4142 0.3721 -0.1016 -0.1293 -0.0020 29  PHE H CD1 
1446 C CD2 . PHE B 29  ? 0.5761 0.4640 0.4144 -0.1285 -0.1553 0.0094  29  PHE H CD2 
1447 C CE1 . PHE B 29  ? 0.5104 0.4156 0.3638 -0.1018 -0.1216 0.0078  29  PHE H CE1 
1448 C CE2 . PHE B 29  ? 0.5494 0.4736 0.4115 -0.1275 -0.1461 0.0192  29  PHE H CE2 
1449 C CZ  . PHE B 29  ? 0.5049 0.4357 0.3734 -0.1136 -0.1297 0.0178  29  PHE H CZ  
1450 N N   . ILE B 30  ? 0.6435 0.4726 0.4052 -0.1152 -0.1733 -0.0198 30  ILE H N   
1451 C CA  . ILE B 30  ? 0.6515 0.5033 0.4156 -0.1205 -0.1807 -0.0135 30  ILE H CA  
1452 C C   . ILE B 30  ? 0.6640 0.5091 0.4042 -0.1076 -0.1752 -0.0209 30  ILE H C   
1453 O O   . ILE B 30  ? 0.6635 0.5267 0.4034 -0.1081 -0.1795 -0.0159 30  ILE H O   
1454 C CB  . ILE B 30  ? 0.6970 0.5434 0.4596 -0.1393 -0.2029 -0.0109 30  ILE H CB  
1455 C CG1 . ILE B 30  ? 0.7367 0.5417 0.4667 -0.1400 -0.2158 -0.0245 30  ILE H CG1 
1456 C CG2 . ILE B 30  ? 0.6932 0.5492 0.4792 -0.1539 -0.2074 -0.0011 30  ILE H CG2 
1457 C CD1 . ILE B 30  ? 0.7695 0.5730 0.4780 -0.1367 -0.2224 -0.0296 30  ILE H CD1 
1458 N N   . ASP B 31  ? 0.6734 0.4954 0.3936 -0.0959 -0.1658 -0.0321 31  ASP H N   
1459 C CA  . ASP B 31  ? 0.6761 0.4939 0.3723 -0.0844 -0.1582 -0.0382 31  ASP H CA  
1460 C C   . ASP B 31  ? 0.6354 0.4781 0.3440 -0.0772 -0.1437 -0.0290 31  ASP H C   
1461 O O   . ASP B 31  ? 0.6338 0.4775 0.3248 -0.0719 -0.1417 -0.0292 31  ASP H O   
1462 C CB  . ASP B 31  ? 0.6996 0.4931 0.3733 -0.0731 -0.1497 -0.0523 31  ASP H CB  
1463 C CG  . ASP B 31  ? 0.7477 0.5114 0.3932 -0.0751 -0.1654 -0.0652 31  ASP H CG  
1464 O OD1 . ASP B 31  ? 0.7560 0.5185 0.3993 -0.0868 -0.1826 -0.0618 31  ASP H OD1 
1465 O OD2 . ASP B 31  ? 0.7745 0.5179 0.4011 -0.0646 -0.1607 -0.0786 31  ASP H OD2 
1466 N N   . GLU B 32  ? 0.5738 0.4332 0.3087 -0.0764 -0.1343 -0.0216 32  GLU H N   
1467 C CA  . GLU B 32  ? 0.5503 0.4278 0.2934 -0.0684 -0.1217 -0.0143 32  GLU H CA  
1468 C C   . GLU B 32  ? 0.5143 0.4181 0.2873 -0.0718 -0.1229 -0.0035 32  GLU H C   
1469 O O   . GLU B 32  ? 0.5082 0.4175 0.2994 -0.0787 -0.1254 -0.0015 32  GLU H O   
1470 C CB  . GLU B 32  ? 0.5387 0.4092 0.2770 -0.0591 -0.1043 -0.0186 32  GLU H CB  
1471 C CG  . GLU B 32  ? 0.5653 0.4139 0.2771 -0.0544 -0.1016 -0.0313 32  GLU H CG  
1472 C CD  . GLU B 32  ? 0.6022 0.4442 0.2843 -0.0515 -0.1035 -0.0345 32  GLU H CD  
1473 O OE1 . GLU B 32  ? 0.6127 0.4651 0.2939 -0.0530 -0.1070 -0.0258 32  GLU H OE1 
1474 O OE2 . GLU B 32  ? 0.6400 0.4662 0.2988 -0.0469 -0.1018 -0.0461 32  GLU H OE2 
1475 N N   . ALA B 33  ? 0.5008 0.4197 0.2771 -0.0657 -0.1200 0.0030  33  ALA H N   
1476 C CA  . ALA B 33  ? 0.4630 0.4083 0.2654 -0.0638 -0.1186 0.0118  33  ALA H CA  
1477 C C   . ALA B 33  ? 0.4441 0.3900 0.2590 -0.0588 -0.1040 0.0121  33  ALA H C   
1478 O O   . ALA B 33  ? 0.4538 0.3829 0.2558 -0.0542 -0.0937 0.0074  33  ALA H O   
1479 C CB  . ALA B 33  ? 0.4723 0.4270 0.2696 -0.0565 -0.1220 0.0169  33  ALA H CB  
1480 N N   . LEU B 34  ? 0.4086 0.3761 0.2478 -0.0594 -0.1031 0.0175  34  LEU H N   
1481 C CA  . LEU B 34  ? 0.3936 0.3645 0.2465 -0.0549 -0.0908 0.0183  34  LEU H CA  
1482 C C   . LEU B 34  ? 0.3591 0.3500 0.2246 -0.0462 -0.0889 0.0238  34  LEU H C   
1483 O O   . LEU B 34  ? 0.3791 0.3937 0.2576 -0.0470 -0.0968 0.0281  34  LEU H O   
1484 C CB  . LEU B 34  ? 0.4083 0.3848 0.2766 -0.0636 -0.0921 0.0189  34  LEU H CB  
1485 C CG  . LEU B 34  ? 0.4561 0.4066 0.3122 -0.0673 -0.0907 0.0117  34  LEU H CG  
1486 C CD1 . LEU B 34  ? 0.4650 0.4184 0.3345 -0.0777 -0.0963 0.0142  34  LEU H CD1 
1487 C CD2 . LEU B 34  ? 0.4481 0.3868 0.2990 -0.0582 -0.0766 0.0074  34  LEU H CD2 
1488 N N   . HIS B 35  ? 0.3376 0.3192 0.1993 -0.0380 -0.0786 0.0234  35  HIS H N   
1489 C CA  . HIS B 35  ? 0.3152 0.3078 0.1845 -0.0278 -0.0773 0.0272  35  HIS H CA  
1490 C C   . HIS B 35  ? 0.2957 0.2953 0.1809 -0.0255 -0.0686 0.0270  35  HIS H C   
1491 O O   . HIS B 35  ? 0.2983 0.2872 0.1832 -0.0305 -0.0616 0.0240  35  HIS H O   
1492 C CB  . HIS B 35  ? 0.3229 0.2956 0.1722 -0.0216 -0.0753 0.0279  35  HIS H CB  
1493 C CG  . HIS B 35  ? 0.3348 0.2989 0.1650 -0.0238 -0.0838 0.0282  35  HIS H CG  
1494 N ND1 . HIS B 35  ? 0.3424 0.3082 0.1656 -0.0168 -0.0922 0.0322  35  HIS H ND1 
1495 C CD2 . HIS B 35  ? 0.3492 0.3017 0.1644 -0.0311 -0.0855 0.0245  35  HIS H CD2 
1496 C CE1 . HIS B 35  ? 0.3651 0.3209 0.1689 -0.0207 -0.0987 0.0318  35  HIS H CE1 
1497 N NE2 . HIS B 35  ? 0.3629 0.3104 0.1609 -0.0295 -0.0945 0.0266  35  HIS H NE2 
1498 N N   . TRP B 36  ? 0.2842 0.3014 0.1819 -0.0172 -0.0697 0.0293  36  TRP H N   
1499 C CA  . TRP B 36  ? 0.2715 0.2949 0.1817 -0.0129 -0.0620 0.0286  36  TRP H CA  
1500 C C   . TRP B 36  ? 0.2780 0.2882 0.1799 -0.0015 -0.0602 0.0284  36  TRP H C   
1501 O O   . TRP B 36  ? 0.2904 0.3014 0.1863 0.0062  -0.0677 0.0299  36  TRP H O   
1502 C CB  . TRP B 36  ? 0.2655 0.3220 0.1964 -0.0128 -0.0647 0.0306  36  TRP H CB  
1503 C CG  . TRP B 36  ? 0.2682 0.3325 0.2060 -0.0269 -0.0665 0.0323  36  TRP H CG  
1504 C CD1 . TRP B 36  ? 0.2810 0.3553 0.2197 -0.0355 -0.0757 0.0346  36  TRP H CD1 
1505 C CD2 . TRP B 36  ? 0.2657 0.3261 0.2094 -0.0346 -0.0609 0.0320  36  TRP H CD2 
1506 N NE1 . TRP B 36  ? 0.2831 0.3561 0.2262 -0.0487 -0.0764 0.0359  36  TRP H NE1 
1507 C CE2 . TRP B 36  ? 0.2697 0.3355 0.2165 -0.0478 -0.0676 0.0347  36  TRP H CE2 
1508 C CE3 . TRP B 36  ? 0.2595 0.3117 0.2058 -0.0318 -0.0521 0.0302  36  TRP H CE3 
1509 C CZ2 . TRP B 36  ? 0.2737 0.3338 0.2245 -0.0577 -0.0664 0.0358  36  TRP H CZ2 
1510 C CZ3 . TRP B 36  ? 0.2582 0.3085 0.2101 -0.0408 -0.0502 0.0310  36  TRP H CZ3 
1511 C CH2 . TRP B 36  ? 0.2660 0.3187 0.2193 -0.0534 -0.0575 0.0340  36  TRP H CH2 
1512 N N   . VAL B 37  ? 0.2715 0.2680 0.1721 -0.0012 -0.0521 0.0268  37  VAL H N   
1513 C CA  . VAL B 37  ? 0.2833 0.2615 0.1741 0.0062  -0.0510 0.0271  37  VAL H CA  
1514 C C   . VAL B 37  ? 0.2852 0.2689 0.1881 0.0102  -0.0458 0.0247  37  VAL H C   
1515 O O   . VAL B 37  ? 0.2754 0.2619 0.1857 0.0030  -0.0390 0.0234  37  VAL H O   
1516 C CB  . VAL B 37  ? 0.3001 0.2528 0.1729 -0.0008 -0.0464 0.0283  37  VAL H CB  
1517 C CG1 . VAL B 37  ? 0.3173 0.2495 0.1791 0.0032  -0.0463 0.0304  37  VAL H CG1 
1518 C CG2 . VAL B 37  ? 0.3166 0.2635 0.1744 -0.0045 -0.0515 0.0301  37  VAL H CG2 
1519 N N   . LYS B 38  ? 0.2998 0.2832 0.2029 0.0222  -0.0499 0.0237  38  LYS H N   
1520 C CA  . LYS B 38  ? 0.3077 0.2940 0.2189 0.0279  -0.0465 0.0203  38  LYS H CA  
1521 C C   . LYS B 38  ? 0.3205 0.2756 0.2179 0.0261  -0.0449 0.0207  38  LYS H C   
1522 O O   . LYS B 38  ? 0.3384 0.2723 0.2197 0.0278  -0.0504 0.0237  38  LYS H O   
1523 C CB  . LYS B 38  ? 0.3203 0.3244 0.2376 0.0436  -0.0533 0.0175  38  LYS H CB  
1524 C CG  . LYS B 38  ? 0.3307 0.3369 0.2526 0.0529  -0.0516 0.0125  38  LYS H CG  
1525 C CD  . LYS B 38  ? 0.3436 0.3691 0.2701 0.0710  -0.0583 0.0082  38  LYS H CD  
1526 C CE  . LYS B 38  ? 0.3457 0.3734 0.2746 0.0817  -0.0569 0.0017  38  LYS H CE  
1527 N NZ  . LYS B 38  ? 0.3595 0.4112 0.2932 0.1017  -0.0631 -0.0037 38  LYS H NZ  
1528 N N   . GLN B 39  ? 0.3215 0.2738 0.2245 0.0219  -0.0385 0.0188  39  GLN H N   
1529 C CA  . GLN B 39  ? 0.3465 0.2726 0.2391 0.0193  -0.0380 0.0194  39  GLN H CA  
1530 C C   . GLN B 39  ? 0.3636 0.2929 0.2631 0.0273  -0.0390 0.0144  39  GLN H C   
1531 O O   . GLN B 39  ? 0.3330 0.2780 0.2453 0.0238  -0.0329 0.0123  39  GLN H O   
1532 C CB  . GLN B 39  ? 0.3488 0.2685 0.2401 0.0050  -0.0295 0.0218  39  GLN H CB  
1533 C CG  . GLN B 39  ? 0.3867 0.2819 0.2665 -0.0006 -0.0296 0.0245  39  GLN H CG  
1534 C CD  . GLN B 39  ? 0.3939 0.2873 0.2714 -0.0141 -0.0211 0.0275  39  GLN H CD  
1535 O OE1 . GLN B 39  ? 0.4062 0.3157 0.2951 -0.0179 -0.0139 0.0249  39  GLN H OE1 
1536 N NE2 . GLN B 39  ? 0.4196 0.2936 0.2816 -0.0213 -0.0222 0.0331  39  GLN H NE2 
1537 N N   . SER B 40  ? 0.4306 0.3427 0.3200 0.0380  -0.0474 0.0124  40  SER H N   
1538 C CA  . SER B 40  ? 0.4881 0.3974 0.3795 0.0472  -0.0500 0.0061  40  SER H CA  
1539 C C   . SER B 40  ? 0.5839 0.4560 0.4592 0.0437  -0.0558 0.0074  40  SER H C   
1540 O O   . SER B 40  ? 0.6167 0.4657 0.4769 0.0401  -0.0610 0.0131  40  SER H O   
1541 C CB  . SER B 40  ? 0.4941 0.4188 0.3879 0.0661  -0.0566 0.0005  40  SER H CB  
1542 O OG  . SER B 40  ? 0.5218 0.4278 0.4015 0.0744  -0.0666 0.0022  40  SER H OG  
1543 N N   . HIS B 41  ? 0.6700 0.5338 0.5459 0.0448  -0.0568 0.0029  41  HIS H N   
1544 C CA  . HIS B 41  ? 0.7438 0.5694 0.6031 0.0410  -0.0651 0.0042  41  HIS H CA  
1545 C C   . HIS B 41  ? 0.7716 0.5720 0.6130 0.0545  -0.0787 0.0037  41  HIS H C   
1546 O O   . HIS B 41  ? 0.8087 0.5781 0.6336 0.0458  -0.0847 0.0110  41  HIS H O   
1547 C CB  . HIS B 41  ? 0.8623 0.6832 0.7242 0.0427  -0.0667 -0.0023 41  HIS H CB  
1548 C CG  . HIS B 41  ? 0.9987 0.7814 0.8452 0.0331  -0.0748 0.0006  41  HIS H CG  
1549 N ND1 . HIS B 41  ? 1.0852 0.8367 0.9156 0.0444  -0.0890 -0.0049 41  HIS H ND1 
1550 C CD2 . HIS B 41  ? 1.0613 0.8314 0.9050 0.0128  -0.0717 0.0091  41  HIS H CD2 
1551 C CE1 . HIS B 41  ? 1.1368 0.8558 0.9549 0.0295  -0.0950 0.0008  41  HIS H CE1 
1552 N NE2 . HIS B 41  ? 1.1300 0.8625 0.9569 0.0095  -0.0839 0.0099  41  HIS H NE2 
1553 N N   . ALA B 42  ? 0.7300 0.5451 0.5746 0.0751  -0.0835 -0.0040 42  ALA H N   
1554 C CA  . ALA B 42  ? 0.7527 0.5468 0.5820 0.0941  -0.0980 -0.0077 42  ALA H CA  
1555 C C   . ALA B 42  ? 0.7504 0.5350 0.5703 0.0916  -0.1022 0.0006  42  ALA H C   
1556 O O   . ALA B 42  ? 0.7629 0.5132 0.5633 0.1000  -0.1162 0.0016  42  ALA H O   
1557 C CB  . ALA B 42  ? 0.7524 0.5777 0.5922 0.1167  -0.0989 -0.0183 42  ALA H CB  
1558 N N   . GLU B 43  ? 0.7153 0.5282 0.5471 0.0825  -0.0924 0.0058  43  GLU H N   
1559 C CA  . GLU B 43  ? 0.7218 0.5327 0.5459 0.0837  -0.0972 0.0119  43  GLU H CA  
1560 C C   . GLU B 43  ? 0.6801 0.4903 0.5020 0.0619  -0.0882 0.0216  43  GLU H C   
1561 O O   . GLU B 43  ? 0.6798 0.4911 0.4950 0.0620  -0.0915 0.0264  43  GLU H O   
1562 C CB  . GLU B 43  ? 0.7537 0.6041 0.5934 0.0985  -0.0968 0.0069  43  GLU H CB  
1563 C CG  . GLU B 43  ? 0.7995 0.6595 0.6428 0.1224  -0.1040 -0.0037 43  GLU H CG  
1564 C CD  . GLU B 43  ? 0.8728 0.7070 0.6990 0.1421  -0.1208 -0.0061 43  GLU H CD  
1565 O OE1 . GLU B 43  ? 0.9385 0.7471 0.7492 0.1368  -0.1280 0.0019  43  GLU H OE1 
1566 O OE2 . GLU B 43  ? 0.9357 0.7753 0.7630 0.1637  -0.1273 -0.0165 43  GLU H OE2 
1567 N N   . SER B 44  ? 0.6210 0.4302 0.4473 0.0452  -0.0783 0.0238  44  SER H N   
1568 C CA  . SER B 44  ? 0.5827 0.3942 0.4072 0.0261  -0.0688 0.0313  44  SER H CA  
1569 C C   . SER B 44  ? 0.5187 0.3610 0.3544 0.0275  -0.0635 0.0305  44  SER H C   
1570 O O   . SER B 44  ? 0.4987 0.3685 0.3522 0.0351  -0.0605 0.0243  44  SER H O   
1571 C CB  . SER B 44  ? 0.6497 0.4268 0.4502 0.0176  -0.0756 0.0405  44  SER H CB  
1572 O OG  . SER B 44  ? 0.6839 0.4667 0.4785 0.0043  -0.0686 0.0475  44  SER H OG  
1573 N N   . LEU B 45  ? 0.4584 0.2971 0.2835 0.0204  -0.0632 0.0364  45  LEU H N   
1574 C CA  . LEU B 45  ? 0.4173 0.2821 0.2513 0.0194  -0.0592 0.0354  45  LEU H CA  
1575 C C   . LEU B 45  ? 0.4136 0.2838 0.2447 0.0329  -0.0702 0.0351  45  LEU H C   
1576 O O   . LEU B 45  ? 0.4190 0.2653 0.2317 0.0377  -0.0803 0.0393  45  LEU H O   
1577 C CB  . LEU B 45  ? 0.4265 0.2867 0.2503 0.0046  -0.0522 0.0404  45  LEU H CB  
1578 C CG  . LEU B 45  ? 0.4135 0.2785 0.2448 -0.0072 -0.0401 0.0394  45  LEU H CG  
1579 C CD1 . LEU B 45  ? 0.4414 0.2969 0.2570 -0.0198 -0.0346 0.0449  45  LEU H CD1 
1580 C CD2 . LEU B 45  ? 0.3801 0.2715 0.2310 -0.0071 -0.0335 0.0335  45  LEU H CD2 
1581 N N   . GLU B 46  ? 0.3789 0.2800 0.2272 0.0382  -0.0693 0.0309  46  GLU H N   
1582 C CA  . GLU B 46  ? 0.3950 0.3104 0.2453 0.0508  -0.0794 0.0302  46  GLU H CA  
1583 C C   . GLU B 46  ? 0.3609 0.3024 0.2213 0.0430  -0.0763 0.0307  46  GLU H C   
1584 O O   . GLU B 46  ? 0.3316 0.2925 0.2076 0.0362  -0.0683 0.0283  46  GLU H O   
1585 C CB  . GLU B 46  ? 0.4088 0.3423 0.2726 0.0680  -0.0837 0.0239  46  GLU H CB  
1586 C CG  . GLU B 46  ? 0.4517 0.3576 0.3042 0.0794  -0.0901 0.0213  46  GLU H CG  
1587 C CD  . GLU B 46  ? 0.4724 0.4002 0.3377 0.0989  -0.0939 0.0130  46  GLU H CD  
1588 O OE1 . GLU B 46  ? 0.4758 0.4206 0.3544 0.0970  -0.0857 0.0088  46  GLU H OE1 
1589 O OE2 . GLU B 46  ? 0.5077 0.4383 0.3697 0.1165  -0.1051 0.0106  46  GLU H OE2 
1590 N N   . TRP B 47  ? 0.3622 0.3029 0.2131 0.0440  -0.0841 0.0339  47  TRP H N   
1591 C CA  . TRP B 47  ? 0.3490 0.3125 0.2080 0.0364  -0.0841 0.0342  47  TRP H CA  
1592 C C   . TRP B 47  ? 0.3377 0.3379 0.2184 0.0453  -0.0884 0.0313  47  TRP H C   
1593 O O   . TRP B 47  ? 0.3478 0.3541 0.2289 0.0605  -0.0976 0.0306  47  TRP H O   
1594 C CB  . TRP B 47  ? 0.3653 0.3139 0.2044 0.0337  -0.0916 0.0385  47  TRP H CB  
1595 C CG  . TRP B 47  ? 0.3603 0.3261 0.2031 0.0251  -0.0934 0.0383  47  TRP H CG  
1596 C CD1 . TRP B 47  ? 0.3598 0.3192 0.1957 0.0115  -0.0874 0.0378  47  TRP H CD1 
1597 C CD2 . TRP B 47  ? 0.3636 0.3530 0.2143 0.0305  -0.1044 0.0388  47  TRP H CD2 
1598 N NE1 . TRP B 47  ? 0.3655 0.3405 0.2043 0.0072  -0.0944 0.0374  47  TRP H NE1 
1599 C CE2 . TRP B 47  ? 0.3663 0.3606 0.2143 0.0176  -0.1049 0.0388  47  TRP H CE2 
1600 C CE3 . TRP B 47  ? 0.3683 0.3766 0.2287 0.0455  -0.1143 0.0386  47  TRP H CE3 
1601 C CZ2 . TRP B 47  ? 0.3667 0.3838 0.2218 0.0169  -0.1154 0.0395  47  TRP H CZ2 
1602 C CZ3 . TRP B 47  ? 0.3760 0.4101 0.2443 0.0461  -0.1240 0.0395  47  TRP H CZ3 
1603 C CH2 . TRP B 47  ? 0.3672 0.4052 0.2329 0.0308  -0.1248 0.0404  47  TRP H CH2 
1604 N N   . ILE B 48  ? 0.3092 0.3339 0.2070 0.0363  -0.0824 0.0301  48  ILE H N   
1605 C CA  . ILE B 48  ? 0.3055 0.3713 0.2253 0.0412  -0.0854 0.0291  48  ILE H CA  
1606 C C   . ILE B 48  ? 0.3088 0.3926 0.2311 0.0366  -0.0943 0.0319  48  ILE H C   
1607 O O   . ILE B 48  ? 0.3206 0.4345 0.2551 0.0471  -0.1017 0.0318  48  ILE H O   
1608 C CB  . ILE B 48  ? 0.2859 0.3685 0.2215 0.0319  -0.0760 0.0283  48  ILE H CB  
1609 C CG1 . ILE B 48  ? 0.2940 0.3618 0.2277 0.0385  -0.0690 0.0249  48  ILE H CG1 
1610 C CG2 . ILE B 48  ? 0.2783 0.4060 0.2353 0.0326  -0.0786 0.0293  48  ILE H CG2 
1611 C CD1 . ILE B 48  ? 0.2688 0.3435 0.2129 0.0288  -0.0595 0.0244  48  ILE H CD1 
1612 N N   . GLY B 49  ? 0.3096 0.3790 0.2222 0.0218  -0.0939 0.0338  49  GLY H N   
1613 C CA  . GLY B 49  ? 0.3145 0.3984 0.2282 0.0146  -0.1031 0.0361  49  GLY H CA  
1614 C C   . GLY B 49  ? 0.3224 0.3883 0.2255 -0.0021 -0.1011 0.0360  49  GLY H C   
1615 O O   . GLY B 49  ? 0.3110 0.3538 0.2059 -0.0074 -0.0918 0.0340  49  GLY H O   
1616 N N   . VAL B 50  ? 0.3286 0.4059 0.2319 -0.0099 -0.1106 0.0375  50  VAL H N   
1617 C CA  . VAL B 50  ? 0.3423 0.4008 0.2325 -0.0244 -0.1120 0.0361  50  VAL H CA  
1618 C C   . VAL B 50  ? 0.3432 0.4281 0.2485 -0.0364 -0.1209 0.0384  50  VAL H C   
1619 O O   . VAL B 50  ? 0.3470 0.4637 0.2661 -0.0328 -0.1297 0.0417  50  VAL H O   
1620 C CB  . VAL B 50  ? 0.3626 0.3953 0.2262 -0.0223 -0.1170 0.0353  50  VAL H CB  
1621 C CG1 . VAL B 50  ? 0.3776 0.4262 0.2412 -0.0154 -0.1301 0.0384  50  VAL H CG1 
1622 C CG2 . VAL B 50  ? 0.3728 0.3860 0.2210 -0.0350 -0.1179 0.0317  50  VAL H CG2 
1623 N N   . ILE B 51  ? 0.3528 0.4236 0.2540 -0.0502 -0.1199 0.0367  51  ILE H N   
1624 C CA  . ILE B 51  ? 0.3727 0.4575 0.2818 -0.0660 -0.1306 0.0391  51  ILE H CA  
1625 C C   . ILE B 51  ? 0.4070 0.4581 0.2915 -0.0741 -0.1364 0.0340  51  ILE H C   
1626 O O   . ILE B 51  ? 0.3967 0.4175 0.2653 -0.0716 -0.1278 0.0285  51  ILE H O   
1627 C CB  . ILE B 51  ? 0.3598 0.4606 0.2882 -0.0755 -0.1263 0.0424  51  ILE H CB  
1628 C CG1 . ILE B 51  ? 0.3683 0.4910 0.3083 -0.0931 -0.1389 0.0478  51  ILE H CG1 
1629 C CG2 . ILE B 51  ? 0.3565 0.4246 0.2743 -0.0777 -0.1172 0.0380  51  ILE H CG2 
1630 C CD1 . ILE B 51  ? 0.3590 0.5139 0.3231 -0.1009 -0.1355 0.0547  51  ILE H CD1 
1631 N N   . ARG B 52  ? 0.4322 0.4907 0.3135 -0.0825 -0.1508 0.0353  52  ARG H N   
1632 C CA  . ARG B 52  ? 0.4827 0.5101 0.3390 -0.0902 -0.1587 0.0294  52  ARG H CA  
1633 C C   . ARG B 52  ? 0.4969 0.5254 0.3615 -0.1084 -0.1676 0.0308  52  ARG H C   
1634 O O   . ARG B 52  ? 0.5006 0.5560 0.3799 -0.1190 -0.1793 0.0368  52  ARG H O   
1635 C CB  . ARG B 52  ? 0.5193 0.5499 0.3628 -0.0859 -0.1694 0.0297  52  ARG H CB  
1636 C CG  . ARG B 52  ? 0.5371 0.5725 0.3781 -0.0686 -0.1627 0.0316  52  ARG H CG  
1637 C CD  . ARG B 52  ? 0.5878 0.6230 0.4134 -0.0620 -0.1734 0.0328  52  ARG H CD  
1638 N NE  . ARG B 52  ? 0.6266 0.6608 0.4497 -0.0455 -0.1664 0.0354  52  ARG H NE  
1639 C CZ  . ARG B 52  ? 0.6600 0.6660 0.4641 -0.0391 -0.1551 0.0334  52  ARG H CZ  
1640 N NH1 . ARG B 52  ? 0.7029 0.6832 0.4895 -0.0457 -0.1483 0.0279  52  ARG H NH1 
1641 N NH2 . ARG B 52  ? 0.6666 0.6700 0.4686 -0.0260 -0.1512 0.0368  52  ARG H NH2 
1642 N N   . PRO B 53  ? 0.5081 0.5086 0.3642 -0.1131 -0.1634 0.0260  53  PRO H N   
1643 C CA  . PRO B 53  ? 0.5281 0.5261 0.3917 -0.1309 -0.1728 0.0288  53  PRO H CA  
1644 C C   . PRO B 53  ? 0.5786 0.5636 0.4281 -0.1444 -0.1918 0.0266  53  PRO H C   
1645 O O   . PRO B 53  ? 0.5955 0.5863 0.4544 -0.1619 -0.2031 0.0320  53  PRO H O   
1646 C CB  . PRO B 53  ? 0.5272 0.4924 0.3807 -0.1279 -0.1640 0.0223  53  PRO H CB  
1647 C CG  . PRO B 53  ? 0.5151 0.4780 0.3645 -0.1093 -0.1471 0.0185  53  PRO H CG  
1648 C CD  . PRO B 53  ? 0.5098 0.4811 0.3498 -0.1021 -0.1501 0.0184  53  PRO H CD  
1649 N N   . TYR B 54  ? 0.5982 0.5658 0.4244 -0.1370 -0.1955 0.0195  54  TYR H N   
1650 C CA  . TYR B 54  ? 0.6450 0.5986 0.4542 -0.1483 -0.2144 0.0160  54  TYR H CA  
1651 C C   . TYR B 54  ? 0.6496 0.6426 0.4794 -0.1599 -0.2276 0.0260  54  TYR H C   
1652 O O   . TYR B 54  ? 0.6824 0.6690 0.5067 -0.1761 -0.2454 0.0262  54  TYR H O   
1653 C CB  . TYR B 54  ? 0.6600 0.5898 0.4384 -0.1360 -0.2136 0.0064  54  TYR H CB  
1654 C CG  . TYR B 54  ? 0.6557 0.5997 0.4333 -0.1191 -0.2016 0.0084  54  TYR H CG  
1655 C CD1 . TYR B 54  ? 0.6623 0.6265 0.4402 -0.1167 -0.2102 0.0128  54  TYR H CD1 
1656 C CD2 . TYR B 54  ? 0.6458 0.5791 0.4189 -0.1056 -0.1833 0.0054  54  TYR H CD2 
1657 C CE1 . TYR B 54  ? 0.6626 0.6331 0.4355 -0.1012 -0.2014 0.0148  54  TYR H CE1 
1658 C CE2 . TYR B 54  ? 0.6506 0.5910 0.4190 -0.0920 -0.1741 0.0077  54  TYR H CE2 
1659 C CZ  . TYR B 54  ? 0.6524 0.6087 0.4189 -0.0896 -0.1836 0.0123  54  TYR H CZ  
1660 O OH  . TYR B 54  ? 0.6640 0.6225 0.4236 -0.0764 -0.1764 0.0153  54  TYR H OH  
1661 N N   . SER B 55  ? 0.6301 0.6618 0.4812 -0.1506 -0.2201 0.0330  55  SER H N   
1662 C CA  . SER B 55  ? 0.6291 0.7056 0.5014 -0.1560 -0.2308 0.0415  55  SER H CA  
1663 C C   . SER B 55  ? 0.6016 0.7216 0.5080 -0.1569 -0.2223 0.0510  55  SER H C   
1664 O O   . SER B 55  ? 0.6430 0.8072 0.5714 -0.1625 -0.2303 0.0585  55  SER H O   
1665 C CB  . SER B 55  ? 0.6293 0.7117 0.4921 -0.1392 -0.2308 0.0395  55  SER H CB  
1666 O OG  . SER B 55  ? 0.6031 0.6853 0.4684 -0.1204 -0.2129 0.0388  55  SER H OG  
1667 N N   . GLY B 56  ? 0.5579 0.6692 0.4683 -0.1496 -0.2062 0.0502  56  GLY H N   
1668 C CA  . GLY B 56  ? 0.5163 0.6664 0.4551 -0.1466 -0.1956 0.0575  56  GLY H CA  
1669 C C   . GLY B 56  ? 0.4833 0.6657 0.4343 -0.1267 -0.1896 0.0585  56  GLY H C   
1670 O O   . GLY B 56  ? 0.4842 0.7002 0.4574 -0.1215 -0.1808 0.0630  56  GLY H O   
1671 N N   . GLU B 57  ? 0.4663 0.6375 0.4016 -0.1145 -0.1939 0.0541  57  GLU H N   
1672 C CA  A GLU B 57  ? 0.4562 0.6507 0.3990 -0.0936 -0.1907 0.0546  57  GLU H CA  
1673 C CA  B GLU B 57  ? 0.4534 0.6504 0.3979 -0.0940 -0.1906 0.0550  57  GLU H CA  
1674 C C   . GLU B 57  ? 0.4275 0.6104 0.3698 -0.0773 -0.1734 0.0520  57  GLU H C   
1675 O O   . GLU B 57  ? 0.4151 0.5594 0.3399 -0.0782 -0.1649 0.0475  57  GLU H O   
1676 C CB  A GLU B 57  ? 0.4868 0.6602 0.4060 -0.0861 -0.2000 0.0509  57  GLU H CB  
1677 C CB  B GLU B 57  ? 0.4798 0.6658 0.4060 -0.0863 -0.2018 0.0525  57  GLU H CB  
1678 C CG  A GLU B 57  ? 0.4926 0.6618 0.4049 -0.0629 -0.1943 0.0494  57  GLU H CG  
1679 C CG  B GLU B 57  ? 0.5063 0.6398 0.3975 -0.0845 -0.2000 0.0456  57  GLU H CG  
1680 C CD  A GLU B 57  ? 0.5253 0.6662 0.4086 -0.0578 -0.2028 0.0467  57  GLU H CD  
1681 C CD  B GLU B 57  ? 0.5330 0.6558 0.4054 -0.0911 -0.2165 0.0439  57  GLU H CD  
1682 O OE1 A GLU B 57  ? 0.5464 0.6845 0.4211 -0.0703 -0.2160 0.0462  57  GLU H OE1 
1683 O OE1 B GLU B 57  ? 0.5478 0.6333 0.3949 -0.0988 -0.2185 0.0381  57  GLU H OE1 
1684 O OE2 A GLU B 57  ? 0.5389 0.6587 0.4066 -0.0427 -0.1966 0.0453  57  GLU H OE2 
1685 O OE2 B GLU B 57  ? 0.5380 0.6911 0.4211 -0.0879 -0.2280 0.0478  57  GLU H OE2 
1686 N N   . THR B 58  ? 0.3965 0.6114 0.3563 -0.0621 -0.1694 0.0539  58  THR H N   
1687 C CA  . THR B 58  ? 0.3822 0.5877 0.3416 -0.0454 -0.1553 0.0511  58  THR H CA  
1688 C C   . THR B 58  ? 0.3918 0.5995 0.3458 -0.0240 -0.1587 0.0496  58  THR H C   
1689 O O   . THR B 58  ? 0.4008 0.6375 0.3639 -0.0203 -0.1706 0.0518  58  THR H O   
1690 C CB  . THR B 58  ? 0.3543 0.5945 0.3392 -0.0472 -0.1471 0.0542  58  THR H CB  
1691 O OG1 . THR B 58  ? 0.3567 0.6494 0.3650 -0.0473 -0.1550 0.0587  58  THR H OG1 
1692 C CG2 . THR B 58  ? 0.3497 0.5769 0.3348 -0.0670 -0.1432 0.0562  58  THR H CG2 
1693 N N   . ASN B 59  ? 0.3942 0.5717 0.3336 -0.0109 -0.1499 0.0463  59  ASN H N   
1694 C CA  . ASN B 59  ? 0.4127 0.5869 0.3463 0.0106  -0.1527 0.0451  59  ASN H CA  
1695 C C   . ASN B 59  ? 0.3895 0.5581 0.3280 0.0213  -0.1403 0.0426  59  ASN H C   
1696 O O   . ASN B 59  ? 0.3693 0.5072 0.2962 0.0144  -0.1302 0.0411  59  ASN H O   
1697 C CB  . ASN B 59  ? 0.4541 0.5874 0.3571 0.0131  -0.1577 0.0448  59  ASN H CB  
1698 C CG  . ASN B 59  ? 0.5057 0.6416 0.4006 0.0023  -0.1705 0.0464  59  ASN H CG  
1699 O OD1 . ASN B 59  ? 0.5572 0.7166 0.4587 0.0094  -0.1831 0.0484  59  ASN H OD1 
1700 N ND2 . ASN B 59  ? 0.5329 0.6441 0.4122 -0.0134 -0.1686 0.0449  59  ASN H ND2 
1701 N N   . TYR B 60  ? 0.3806 0.5788 0.3356 0.0378  -0.1411 0.0413  60  TYR H N   
1702 C CA  . TYR B 60  ? 0.3728 0.5657 0.3313 0.0491  -0.1306 0.0377  60  TYR H CA  
1703 C C   . TYR B 60  ? 0.3941 0.5614 0.3366 0.0698  -0.1355 0.0352  60  TYR H C   
1704 O O   . TYR B 60  ? 0.3986 0.5794 0.3422 0.0822  -0.1472 0.0354  60  TYR H O   
1705 C CB  . TYR B 60  ? 0.3557 0.5990 0.3420 0.0541  -0.1272 0.0369  60  TYR H CB  
1706 C CG  . TYR B 60  ? 0.3383 0.6054 0.3399 0.0324  -0.1222 0.0410  60  TYR H CG  
1707 C CD1 . TYR B 60  ? 0.3420 0.6386 0.3551 0.0193  -0.1309 0.0458  60  TYR H CD1 
1708 C CD2 . TYR B 60  ? 0.3225 0.5826 0.3269 0.0246  -0.1104 0.0407  60  TYR H CD2 
1709 C CE1 . TYR B 60  ? 0.3285 0.6437 0.3540 -0.0023 -0.1282 0.0508  60  TYR H CE1 
1710 C CE2 . TYR B 60  ? 0.3119 0.5906 0.3284 0.0045  -0.1075 0.0456  60  TYR H CE2 
1711 C CZ  . TYR B 60  ? 0.3139 0.6201 0.3410 -0.0093 -0.1166 0.0510  60  TYR H CZ  
1712 O OH  . TYR B 60  ? 0.3079 0.6273 0.3445 -0.0316 -0.1159 0.0570  60  TYR H OH  
1713 N N   . ASN B 61  ? 0.3956 0.5279 0.3246 0.0728  -0.1277 0.0331  61  ASN H N   
1714 C CA  . ASN B 61  ? 0.4233 0.5345 0.3414 0.0935  -0.1316 0.0300  61  ASN H CA  
1715 C C   . ASN B 61  ? 0.4292 0.5824 0.3688 0.1126  -0.1347 0.0251  61  ASN H C   
1716 O O   . ASN B 61  ? 0.4017 0.5863 0.3607 0.1080  -0.1258 0.0234  61  ASN H O   
1717 C CB  . ASN B 61  ? 0.4127 0.4888 0.3192 0.0900  -0.1213 0.0285  61  ASN H CB  
1718 C CG  . ASN B 61  ? 0.4334 0.4772 0.3233 0.1075  -0.1274 0.0264  61  ASN H CG  
1719 O OD1 . ASN B 61  ? 0.4550 0.5110 0.3485 0.1276  -0.1374 0.0232  61  ASN H OD1 
1720 N ND2 . ASN B 61  ? 0.4368 0.4398 0.3086 0.0998  -0.1222 0.0282  61  ASN H ND2 
1721 N N   . GLN B 62  ? 0.4716 0.6258 0.4071 0.1340  -0.1469 0.0228  62  GLN H N   
1722 C CA  . GLN B 62  ? 0.4899 0.6902 0.4466 0.1554  -0.1510 0.0168  62  GLN H CA  
1723 C C   . GLN B 62  ? 0.4774 0.6756 0.4375 0.1652  -0.1417 0.0100  62  GLN H C   
1724 O O   . GLN B 62  ? 0.4541 0.6995 0.4356 0.1751  -0.1386 0.0054  62  GLN H O   
1725 C CB  . GLN B 62  ? 0.5547 0.7506 0.5035 0.1788  -0.1677 0.0149  62  GLN H CB  
1726 C CG  . GLN B 62  ? 0.6134 0.8313 0.5672 0.1720  -0.1779 0.0204  62  GLN H CG  
1727 C CD  . GLN B 62  ? 0.6518 0.9391 0.6371 0.1796  -0.1811 0.0184  62  GLN H CD  
1728 O OE1 . GLN B 62  ? 0.6772 0.9900 0.6715 0.1689  -0.1877 0.0234  62  GLN H OE1 
1729 N NE2 . GLN B 62  ? 0.6835 1.0040 0.6857 0.1979  -0.1767 0.0110  62  GLN H NE2 
1730 N N   . LYS B 63  ? 0.4764 0.6255 0.4168 0.1604  -0.1368 0.0098  63  LYS H N   
1731 C CA  . LYS B 63  ? 0.4875 0.6309 0.4291 0.1687  -0.1291 0.0030  63  LYS H CA  
1732 C C   . LYS B 63  ? 0.4518 0.6299 0.4132 0.1527  -0.1148 0.0038  63  LYS H C   
1733 O O   . LYS B 63  ? 0.4388 0.6239 0.4047 0.1607  -0.1085 -0.0021 63  LYS H O   
1734 C CB  . LYS B 63  ? 0.5244 0.6071 0.4406 0.1642  -0.1285 0.0038  63  LYS H CB  
1735 C CG  . LYS B 63  ? 0.5947 0.6366 0.4879 0.1802  -0.1435 0.0035  63  LYS H CG  
1736 C CD  . LYS B 63  ? 0.6274 0.6119 0.4961 0.1738  -0.1434 0.0055  63  LYS H CD  
1737 C CE  . LYS B 63  ? 0.6869 0.6273 0.5302 0.1865  -0.1599 0.0076  63  LYS H CE  
1738 N NZ  . LYS B 63  ? 0.7168 0.6041 0.5375 0.1770  -0.1594 0.0107  63  LYS H NZ  
1739 N N   . PHE B 64  ? 0.4271 0.6205 0.3968 0.1305  -0.1108 0.0110  64  PHE H N   
1740 C CA  . PHE B 64  ? 0.4008 0.6203 0.3864 0.1119  -0.0991 0.0139  64  PHE H CA  
1741 C C   . PHE B 64  ? 0.4052 0.6800 0.4134 0.1055  -0.1011 0.0178  64  PHE H C   
1742 O O   . PHE B 64  ? 0.3998 0.6974 0.4208 0.0889  -0.0933 0.0217  64  PHE H O   
1743 C CB  . PHE B 64  ? 0.3853 0.5677 0.3583 0.0894  -0.0935 0.0190  64  PHE H CB  
1744 C CG  . PHE B 64  ? 0.3826 0.5204 0.3383 0.0917  -0.0890 0.0161  64  PHE H CG  
1745 C CD1 . PHE B 64  ? 0.3719 0.5135 0.3333 0.0922  -0.0802 0.0127  64  PHE H CD1 
1746 C CD2 . PHE B 64  ? 0.3969 0.4909 0.3305 0.0930  -0.0942 0.0174  64  PHE H CD2 
1747 C CE1 . PHE B 64  ? 0.3856 0.4883 0.3326 0.0928  -0.0769 0.0103  64  PHE H CE1 
1748 C CE2 . PHE B 64  ? 0.4001 0.4562 0.3192 0.0933  -0.0906 0.0158  64  PHE H CE2 
1749 C CZ  . PHE B 64  ? 0.4034 0.4641 0.3299 0.0932  -0.0822 0.0119  64  PHE H CZ  
1750 N N   . LYS B 65  ? 0.4498 0.7465 0.4633 0.1175  -0.1119 0.0175  65  LYS H N   
1751 C CA  . LYS B 65  ? 0.4934 0.8424 0.5284 0.1081  -0.1158 0.0226  65  LYS H CA  
1752 C C   . LYS B 65  ? 0.4906 0.8945 0.5494 0.1061  -0.1068 0.0226  65  LYS H C   
1753 O O   . LYS B 65  ? 0.4993 0.9305 0.5716 0.0839  -0.1048 0.0303  65  LYS H O   
1754 C CB  . LYS B 65  ? 0.5458 0.9100 0.5825 0.1261  -0.1297 0.0208  65  LYS H CB  
1755 C CG  . LYS B 65  ? 0.5742 0.9932 0.6333 0.1171  -0.1359 0.0261  65  LYS H CG  
1756 C CD  . LYS B 65  ? 0.6256 1.0643 0.6885 0.1386  -0.1504 0.0233  65  LYS H CD  
1757 C CE  . LYS B 65  ? 0.6648 1.1040 0.7250 0.1726  -0.1529 0.0133  65  LYS H CE  
1758 N NZ  . LYS B 65  ? 0.6791 1.1581 0.7564 0.1808  -0.1414 0.0080  65  LYS H NZ  
1759 N N   . ASP B 66  ? 0.4909 0.9073 0.5525 0.1266  -0.1018 0.0148  66  ASP H N   
1760 C CA  . ASP B 66  ? 0.4920 0.9649 0.5745 0.1279  -0.0928 0.0141  66  ASP H CA  
1761 C C   . ASP B 66  ? 0.4863 0.9409 0.5638 0.1118  -0.0807 0.0164  66  ASP H C   
1762 O O   . ASP B 66  ? 0.5424 1.0400 0.6343 0.1084  -0.0723 0.0177  66  ASP H O   
1763 C CB  . ASP B 66  ? 0.5222 1.0195 0.6084 0.1615  -0.0945 0.0026  66  ASP H CB  
1764 C CG  . ASP B 66  ? 0.5502 1.0753 0.6452 0.1798  -0.1071 0.0001  66  ASP H CG  
1765 O OD1 . ASP B 66  ? 0.5550 1.0968 0.6592 0.1635  -0.1129 0.0084  66  ASP H OD1 
1766 O OD2 . ASP B 66  ? 0.5859 1.1140 0.6774 0.2109  -0.1123 -0.0106 66  ASP H OD2 
1767 N N   . LYS B 67  ? 0.4527 0.8477 0.5102 0.1029  -0.0796 0.0169  67  LYS H N   
1768 C CA  . LYS B 67  ? 0.4182 0.7882 0.4685 0.0911  -0.0695 0.0177  67  LYS H CA  
1769 C C   . LYS B 67  ? 0.3705 0.7333 0.4229 0.0615  -0.0677 0.0278  67  LYS H C   
1770 O O   . LYS B 67  ? 0.3511 0.7266 0.4098 0.0480  -0.0602 0.0319  67  LYS H O   
1771 C CB  . LYS B 67  ? 0.4603 0.7712 0.4878 0.1015  -0.0709 0.0115  67  LYS H CB  
1772 C CG  . LYS B 67  ? 0.4646 0.7466 0.4835 0.0937  -0.0620 0.0105  67  LYS H CG  
1773 C CD  . LYS B 67  ? 0.4870 0.7997 0.5142 0.1036  -0.0551 0.0057  67  LYS H CD  
1774 C CE  . LYS B 67  ? 0.5018 0.8224 0.5257 0.1330  -0.0595 -0.0051 67  LYS H CE  
1775 N NZ  . LYS B 67  ? 0.5161 0.8623 0.5445 0.1414  -0.0517 -0.0107 67  LYS H NZ  
1776 N N   . ALA B 68  ? 0.3260 0.6655 0.3708 0.0524  -0.0752 0.0312  68  ALA H N   
1777 C CA  . ALA B 68  ? 0.3034 0.6128 0.3402 0.0288  -0.0746 0.0370  68  ALA H CA  
1778 C C   . ALA B 68  ? 0.2805 0.6160 0.3280 0.0119  -0.0820 0.0445  68  ALA H C   
1779 O O   . ALA B 68  ? 0.2794 0.6311 0.3304 0.0199  -0.0904 0.0439  68  ALA H O   
1780 C CB  . ALA B 68  ? 0.3138 0.5682 0.3284 0.0316  -0.0766 0.0338  68  ALA H CB  
1781 N N   . THR B 69  ? 0.2602 0.5945 0.3106 -0.0107 -0.0803 0.0511  69  THR H N   
1782 C CA  . THR B 69  ? 0.2709 0.6132 0.3253 -0.0316 -0.0891 0.0583  69  THR H CA  
1783 C C   . THR B 69  ? 0.2632 0.5548 0.2998 -0.0466 -0.0898 0.0587  69  THR H C   
1784 O O   . THR B 69  ? 0.2543 0.5331 0.2894 -0.0548 -0.0836 0.0603  69  THR H O   
1785 C CB  . THR B 69  ? 0.2632 0.6575 0.3389 -0.0460 -0.0888 0.0670  69  THR H CB  
1786 O OG1 . THR B 69  ? 0.2586 0.7015 0.3499 -0.0279 -0.0860 0.0644  69  THR H OG1 
1787 C CG2 . THR B 69  ? 0.2717 0.6797 0.3534 -0.0669 -0.1003 0.0746  69  THR H CG2 
1788 N N   . MET B 70  ? 0.2710 0.5400 0.2958 -0.0510 -0.0986 0.0577  70  MET H N   
1789 C CA  . MET B 70  ? 0.2770 0.5011 0.2840 -0.0641 -0.1009 0.0567  70  MET H CA  
1790 C C   . MET B 70  ? 0.2870 0.5204 0.2986 -0.0867 -0.1115 0.0633  70  MET H C   
1791 O O   . MET B 70  ? 0.2971 0.5570 0.3165 -0.0897 -0.1210 0.0663  70  MET H O   
1792 C CB  . MET B 70  ? 0.2954 0.4876 0.2830 -0.0537 -0.1040 0.0508  70  MET H CB  
1793 C CG  . MET B 70  ? 0.2897 0.4630 0.2687 -0.0350 -0.0950 0.0453  70  MET H CG  
1794 S SD  . MET B 70  ? 0.3178 0.4554 0.2720 -0.0266 -0.0999 0.0412  70  MET H SD  
1795 C CE  . MET B 70  ? 0.3314 0.5035 0.2949 -0.0193 -0.1125 0.0437  70  MET H CE  
1796 N N   . THR B 71  ? 0.2960 0.5043 0.3009 -0.1017 -0.1115 0.0651  71  THR H N   
1797 C CA  . THR B 71  ? 0.3159 0.5178 0.3190 -0.1247 -0.1236 0.0706  71  THR H CA  
1798 C C   . THR B 71  ? 0.3337 0.4817 0.3148 -0.1291 -0.1250 0.0648  71  THR H C   
1799 O O   . THR B 71  ? 0.3108 0.4349 0.2828 -0.1162 -0.1149 0.0584  71  THR H O   
1800 C CB  . THR B 71  ? 0.3122 0.5472 0.3334 -0.1408 -0.1238 0.0812  71  THR H CB  
1801 O OG1 . THR B 71  ? 0.2990 0.5254 0.3203 -0.1347 -0.1120 0.0805  71  THR H OG1 
1802 C CG2 . THR B 71  ? 0.3070 0.6017 0.3506 -0.1389 -0.1246 0.0870  71  THR H CG2 
1803 N N   . VAL B 72  ? 0.3708 0.5011 0.3430 -0.1459 -0.1383 0.0663  72  VAL H N   
1804 C CA  . VAL B 72  ? 0.4101 0.4897 0.3608 -0.1502 -0.1421 0.0599  72  VAL H CA  
1805 C C   . VAL B 72  ? 0.4414 0.5147 0.3934 -0.1737 -0.1551 0.0674  72  VAL H C   
1806 O O   . VAL B 72  ? 0.4508 0.5543 0.4148 -0.1882 -0.1648 0.0759  72  VAL H O   
1807 C CB  . VAL B 72  ? 0.4335 0.4837 0.3623 -0.1433 -0.1473 0.0502  72  VAL H CB  
1808 C CG1 . VAL B 72  ? 0.4362 0.4880 0.3609 -0.1223 -0.1352 0.0444  72  VAL H CG1 
1809 C CG2 . VAL B 72  ? 0.4618 0.5242 0.3903 -0.1558 -0.1631 0.0534  72  VAL H CG2 
1810 N N   . ASP B 73  ? 0.4694 0.5036 0.4083 -0.1765 -0.1560 0.0641  73  ASP H N   
1811 C CA  . ASP B 73  ? 0.5334 0.5399 0.4630 -0.1967 -0.1717 0.0678  73  ASP H CA  
1812 C C   . ASP B 73  ? 0.5597 0.5142 0.4622 -0.1902 -0.1784 0.0543  73  ASP H C   
1813 O O   . ASP B 73  ? 0.5389 0.4646 0.4311 -0.1777 -0.1709 0.0464  73  ASP H O   
1814 C CB  . ASP B 73  ? 0.5558 0.5590 0.4920 -0.2037 -0.1685 0.0753  73  ASP H CB  
1815 C CG  . ASP B 73  ? 0.6307 0.6066 0.5577 -0.2269 -0.1871 0.0817  73  ASP H CG  
1816 O OD1 . ASP B 73  ? 0.6821 0.6141 0.5935 -0.2250 -0.1910 0.0768  73  ASP H OD1 
1817 O OD2 . ASP B 73  ? 0.6746 0.6728 0.6096 -0.2463 -0.1984 0.0914  73  ASP H OD2 
1818 N N   . ILE B 74  ? 0.5899 0.5331 0.4805 -0.1987 -0.1930 0.0515  74  ILE H N   
1819 C CA  . ILE B 74  ? 0.6363 0.5341 0.4988 -0.1891 -0.1981 0.0366  74  ILE H CA  
1820 C C   . ILE B 74  ? 0.6711 0.5238 0.5188 -0.1927 -0.2056 0.0322  74  ILE H C   
1821 O O   . ILE B 74  ? 0.6870 0.5082 0.5169 -0.1757 -0.2000 0.0187  74  ILE H O   
1822 C CB  . ILE B 74  ? 0.6735 0.5695 0.5253 -0.1977 -0.2133 0.0344  74  ILE H CB  
1823 C CG1 . ILE B 74  ? 0.6574 0.5938 0.5211 -0.1879 -0.2046 0.0364  74  ILE H CG1 
1824 C CG2 . ILE B 74  ? 0.7107 0.5569 0.5306 -0.1903 -0.2211 0.0189  74  ILE H CG2 
1825 C CD1 . ILE B 74  ? 0.6742 0.6381 0.5468 -0.2038 -0.2193 0.0441  74  ILE H CD1 
1826 N N   . SER B 75  ? 0.6937 0.5452 0.5489 -0.2135 -0.2173 0.0438  75  SER H N   
1827 C CA  . SER B 75  ? 0.7460 0.5491 0.5847 -0.2205 -0.2304 0.0414  75  SER H CA  
1828 C C   . SER B 75  ? 0.7251 0.5150 0.5630 -0.2007 -0.2154 0.0347  75  SER H C   
1829 O O   . SER B 75  ? 0.7641 0.5100 0.5816 -0.1904 -0.2203 0.0224  75  SER H O   
1830 C CB  . SER B 75  ? 0.7754 0.5842 0.6235 -0.2491 -0.2456 0.0583  75  SER H CB  
1831 O OG  . SER B 75  ? 0.7604 0.6046 0.6312 -0.2516 -0.2327 0.0710  75  SER H OG  
1832 N N   . SER B 76  ? 0.6715 0.4998 0.5304 -0.1932 -0.1972 0.0409  76  SER H N   
1833 C CA  . SER B 76  ? 0.6210 0.4442 0.4831 -0.1763 -0.1825 0.0367  76  SER H CA  
1834 C C   . SER B 76  ? 0.5763 0.4098 0.4369 -0.1534 -0.1652 0.0252  76  SER H C   
1835 O O   . SER B 76  ? 0.5468 0.3848 0.4138 -0.1401 -0.1514 0.0228  76  SER H O   
1836 C CB  . SER B 76  ? 0.6014 0.4576 0.4855 -0.1848 -0.1756 0.0514  76  SER H CB  
1837 O OG  . SER B 76  ? 0.5705 0.4755 0.4730 -0.1833 -0.1646 0.0571  76  SER H OG  
1838 N N   . SER B 77  ? 0.5575 0.3952 0.4097 -0.1500 -0.1663 0.0194  77  SER H N   
1839 C CA  . SER B 77  ? 0.5390 0.3859 0.3875 -0.1308 -0.1510 0.0105  77  SER H CA  
1840 C C   . SER B 77  ? 0.4890 0.3690 0.3583 -0.1231 -0.1340 0.0168  77  SER H C   
1841 O O   . SER B 77  ? 0.4783 0.3547 0.3449 -0.1076 -0.1210 0.0097  77  SER H O   
1842 C CB  . SER B 77  ? 0.5590 0.3710 0.3869 -0.1163 -0.1490 -0.0044 77  SER H CB  
1843 O OG  . SER B 77  ? 0.6181 0.3995 0.4239 -0.1213 -0.1651 -0.0121 77  SER H OG  
1844 N N   . THR B 78  ? 0.4627 0.3755 0.3516 -0.1336 -0.1344 0.0293  78  THR H N   
1845 C CA  . THR B 78  ? 0.4308 0.3755 0.3386 -0.1264 -0.1201 0.0349  78  THR H CA  
1846 C C   . THR B 78  ? 0.4147 0.3973 0.3348 -0.1262 -0.1180 0.0405  78  THR H C   
1847 O O   . THR B 78  ? 0.4220 0.4212 0.3479 -0.1400 -0.1289 0.0475  78  THR H O   
1848 C CB  . THR B 78  ? 0.4337 0.3832 0.3529 -0.1357 -0.1210 0.0437  78  THR H CB  
1849 O OG1 . THR B 78  ? 0.4491 0.3601 0.3552 -0.1334 -0.1247 0.0374  78  THR H OG1 
1850 C CG2 . THR B 78  ? 0.4007 0.3796 0.3361 -0.1269 -0.1066 0.0475  78  THR H CG2 
1851 N N   . ALA B 79  ? 0.3832 0.3797 0.3077 -0.1110 -0.1052 0.0378  79  ALA H N   
1852 C CA  . ALA B 79  ? 0.3623 0.3946 0.2997 -0.1060 -0.1020 0.0423  79  ALA H CA  
1853 C C   . ALA B 79  ? 0.3389 0.3959 0.2934 -0.1020 -0.0924 0.0472  79  ALA H C   
1854 O O   . ALA B 79  ? 0.3379 0.3784 0.2900 -0.0965 -0.0845 0.0440  79  ALA H O   
1855 C CB  . ALA B 79  ? 0.3602 0.3841 0.2862 -0.0914 -0.0966 0.0354  79  ALA H CB  
1856 N N   . TYR B 80  ? 0.3206 0.4166 0.2910 -0.1033 -0.0931 0.0538  80  TYR H N   
1857 C CA  . TYR B 80  ? 0.3103 0.4366 0.2968 -0.0988 -0.0848 0.0582  80  TYR H CA  
1858 C C   . TYR B 80  ? 0.2895 0.4401 0.2822 -0.0826 -0.0802 0.0557  80  TYR H C   
1859 O O   . TYR B 80  ? 0.2786 0.4404 0.2713 -0.0809 -0.0868 0.0556  80  TYR H O   
1860 C CB  . TYR B 80  ? 0.3339 0.4889 0.3341 -0.1159 -0.0901 0.0690  80  TYR H CB  
1861 C CG  . TYR B 80  ? 0.3727 0.4996 0.3650 -0.1326 -0.0971 0.0726  80  TYR H CG  
1862 C CD1 . TYR B 80  ? 0.3746 0.4910 0.3670 -0.1343 -0.0922 0.0747  80  TYR H CD1 
1863 C CD2 . TYR B 80  ? 0.4099 0.5185 0.3933 -0.1463 -0.1104 0.0735  80  TYR H CD2 
1864 C CE1 . TYR B 80  ? 0.4114 0.4976 0.3947 -0.1478 -0.1006 0.0777  80  TYR H CE1 
1865 C CE2 . TYR B 80  ? 0.4439 0.5213 0.4176 -0.1605 -0.1192 0.0760  80  TYR H CE2 
1866 C CZ  . TYR B 80  ? 0.4634 0.5286 0.4369 -0.1605 -0.1143 0.0780  80  TYR H CZ  
1867 O OH  . TYR B 80  ? 0.5152 0.5463 0.4776 -0.1730 -0.1249 0.0802  80  TYR H OH  
1868 N N   . LEU B 81  ? 0.2605 0.4164 0.2571 -0.0701 -0.0702 0.0531  81  LEU H N   
1869 C CA  . LEU B 81  ? 0.2583 0.4379 0.2615 -0.0535 -0.0665 0.0507  81  LEU H CA  
1870 C C   . LEU B 81  ? 0.2569 0.4723 0.2755 -0.0525 -0.0613 0.0545  81  LEU H C   
1871 O O   . LEU B 81  ? 0.2439 0.4494 0.2615 -0.0531 -0.0548 0.0542  81  LEU H O   
1872 C CB  . LEU B 81  ? 0.2569 0.4059 0.2470 -0.0387 -0.0606 0.0431  81  LEU H CB  
1873 C CG  . LEU B 81  ? 0.2572 0.4201 0.2495 -0.0202 -0.0591 0.0395  81  LEU H CG  
1874 C CD1 . LEU B 81  ? 0.2834 0.4573 0.2749 -0.0158 -0.0677 0.0399  81  LEU H CD1 
1875 C CD2 . LEU B 81  ? 0.2605 0.3908 0.2399 -0.0097 -0.0534 0.0338  81  LEU H CD2 
1876 N N   . GLU B 82  ? 0.2611 0.5190 0.2932 -0.0494 -0.0639 0.0574  82  GLU H N   
1877 C CA  . GLU B 82  ? 0.2720 0.5724 0.3189 -0.0465 -0.0583 0.0605  82  GLU H CA  
1878 C C   . GLU B 82  ? 0.2645 0.5772 0.3123 -0.0217 -0.0550 0.0523  82  GLU H C   
1879 O O   . GLU B 82  ? 0.2788 0.5977 0.3270 -0.0127 -0.0609 0.0497  82  GLU H O   
1880 C CB  . GLU B 82  ? 0.2807 0.6257 0.3434 -0.0630 -0.0636 0.0706  82  GLU H CB  
1881 C CG  . GLU B 82  ? 0.2900 0.6824 0.3667 -0.0611 -0.0564 0.0744  82  GLU H CG  
1882 C CD  . GLU B 82  ? 0.3094 0.7499 0.4022 -0.0812 -0.0596 0.0868  82  GLU H CD  
1883 O OE1 . GLU B 82  ? 0.3235 0.7693 0.4202 -0.0948 -0.0692 0.0920  82  GLU H OE1 
1884 O OE2 . GLU B 82  ? 0.3373 0.8077 0.4370 -0.0851 -0.0529 0.0919  82  GLU H OE2 
1885 N N   . LEU B 83  ? 0.2719 0.5847 0.3186 -0.0106 -0.0472 0.0479  83  LEU H N   
1886 C CA  . LEU B 83  ? 0.2881 0.6084 0.3334 0.0140  -0.0451 0.0390  83  LEU H CA  
1887 C C   . LEU B 83  ? 0.2861 0.6571 0.3452 0.0193  -0.0399 0.0398  83  LEU H C   
1888 O O   . LEU B 83  ? 0.2644 0.6413 0.3254 0.0076  -0.0342 0.0445  83  LEU H O   
1889 C CB  . LEU B 83  ? 0.3069 0.5820 0.3368 0.0220  -0.0410 0.0322  83  LEU H CB  
1890 C CG  . LEU B 83  ? 0.3273 0.5543 0.3426 0.0164  -0.0439 0.0315  83  LEU H CG  
1891 C CD1 . LEU B 83  ? 0.3515 0.5433 0.3557 0.0198  -0.0384 0.0269  83  LEU H CD1 
1892 C CD2 . LEU B 83  ? 0.3478 0.5663 0.3567 0.0276  -0.0511 0.0285  83  LEU H CD2 
1893 N N   . ALA B 84  ? 0.3150 0.7230 0.3832 0.0360  -0.0421 0.0357  84  ALA H N   
1894 C CA  . ALA B 84  ? 0.3241 0.7916 0.4074 0.0424  -0.0372 0.0362  84  ALA H CA  
1895 C C   . ALA B 84  ? 0.3469 0.8165 0.4247 0.0726  -0.0352 0.0229  84  ALA H C   
1896 O O   . ALA B 84  ? 0.3647 0.7939 0.4294 0.0877  -0.0409 0.0151  84  ALA H O   
1897 C CB  . ALA B 84  ? 0.3409 0.8584 0.4422 0.0368  -0.0423 0.0423  84  ALA H CB  
1898 N N   . ARG B 85  ? 0.3564 0.8700 0.4420 0.0795  -0.0279 0.0212  85  ARG H N   
1899 C CA  . ARG B 85  ? 0.3970 0.9250 0.4789 0.1092  -0.0257 0.0077  85  ARG H CA  
1900 C C   . ARG B 85  ? 0.4005 0.8633 0.4608 0.1204  -0.0283 -0.0014 85  ARG H C   
1901 O O   . ARG B 85  ? 0.4250 0.8679 0.4770 0.1425  -0.0352 -0.0112 85  ARG H O   
1902 C CB  . ARG B 85  ? 0.4318 1.0013 0.5260 0.1282  -0.0314 0.0030  85  ARG H CB  
1903 C CG  . ARG B 85  ? 0.4470 1.0828 0.5643 0.1120  -0.0291 0.0142  85  ARG H CG  
1904 C CD  . ARG B 85  ? 0.4718 1.1607 0.6051 0.1321  -0.0337 0.0092  85  ARG H CD  
1905 N NE  . ARG B 85  ? 0.5093 1.1621 0.6357 0.1445  -0.0456 0.0042  85  ARG H NE  
1906 C CZ  . ARG B 85  ? 0.5204 1.1540 0.6482 0.1267  -0.0532 0.0128  85  ARG H CZ  
1907 N NH1 . ARG B 85  ? 0.5195 1.1630 0.6553 0.0950  -0.0513 0.0265  85  ARG H NH1 
1908 N NH2 . ARG B 85  ? 0.5553 1.1584 0.6746 0.1412  -0.0639 0.0075  85  ARG H NH2 
1909 N N   . LEU B 86  ? 0.3775 0.8075 0.4291 0.1040  -0.0238 0.0027  86  LEU H N   
1910 C CA  . LEU B 86  ? 0.3690 0.7372 0.4020 0.1076  -0.0260 -0.0030 86  LEU H CA  
1911 C C   . LEU B 86  ? 0.3518 0.7163 0.3747 0.1319  -0.0255 -0.0163 86  LEU H C   
1912 O O   . LEU B 86  ? 0.3442 0.7496 0.3727 0.1383  -0.0196 -0.0189 86  LEU H O   
1913 C CB  . LEU B 86  ? 0.3753 0.7201 0.4053 0.0838  -0.0211 0.0051  86  LEU H CB  
1914 C CG  . LEU B 86  ? 0.3830 0.7223 0.4191 0.0600  -0.0229 0.0167  86  LEU H CG  
1915 C CD1 . LEU B 86  ? 0.3934 0.7227 0.4289 0.0395  -0.0182 0.0245  86  LEU H CD1 
1916 C CD2 . LEU B 86  ? 0.3993 0.6953 0.4258 0.0604  -0.0293 0.0152  86  LEU H CD2 
1917 N N   . THR B 87  ? 0.3440 0.6587 0.3510 0.1432  -0.0320 -0.0238 87  THR H N   
1918 C CA  . THR B 87  ? 0.3529 0.6431 0.3446 0.1614  -0.0340 -0.0360 87  THR H CA  
1919 C C   . THR B 87  ? 0.3541 0.5880 0.3329 0.1475  -0.0351 -0.0337 87  THR H C   
1920 O O   . THR B 87  ? 0.3187 0.5364 0.3005 0.1280  -0.0343 -0.0240 87  THR H O   
1921 C CB  . THR B 87  ? 0.3821 0.6639 0.3658 0.1893  -0.0439 -0.0474 87  THR H CB  
1922 O OG1 . THR B 87  ? 0.3709 0.6109 0.3472 0.1836  -0.0518 -0.0430 87  THR H OG1 
1923 C CG2 . THR B 87  ? 0.3880 0.7291 0.3869 0.2045  -0.0436 -0.0499 87  THR H CG2 
1924 N N   . SER B 88  ? 0.3903 0.5960 0.3550 0.1578  -0.0375 -0.0427 88  SER H N   
1925 C CA  . SER B 88  ? 0.4250 0.5790 0.3775 0.1459  -0.0394 -0.0414 88  SER H CA  
1926 C C   . SER B 88  ? 0.4423 0.5567 0.3865 0.1431  -0.0470 -0.0383 88  SER H C   
1927 O O   . SER B 88  ? 0.4673 0.5510 0.4077 0.1258  -0.0457 -0.0323 88  SER H O   
1928 C CB  . SER B 88  ? 0.4620 0.5973 0.4009 0.1587  -0.0425 -0.0525 88  SER H CB  
1929 O OG  . SER B 88  ? 0.5250 0.6404 0.4511 0.1812  -0.0531 -0.0628 88  SER H OG  
1930 N N   . GLU B 89  ? 0.4594 0.5780 0.4019 0.1583  -0.0543 -0.0412 89  GLU H N   
1931 C CA  . GLU B 89  ? 0.5021 0.5868 0.4361 0.1544  -0.0617 -0.0364 89  GLU H CA  
1932 C C   . GLU B 89  ? 0.4248 0.5175 0.3690 0.1308  -0.0553 -0.0243 89  GLU H C   
1933 O O   . GLU B 89  ? 0.4466 0.5095 0.3825 0.1223  -0.0590 -0.0190 89  GLU H O   
1934 C CB  . GLU B 89  ? 0.5668 0.6600 0.4988 0.1751  -0.0714 -0.0405 89  GLU H CB  
1935 C CG  . GLU B 89  ? 0.6693 0.7785 0.5982 0.2040  -0.0768 -0.0540 89  GLU H CG  
1936 C CD  . GLU B 89  ? 0.7574 0.8362 0.6701 0.2157  -0.0809 -0.0648 89  GLU H CD  
1937 O OE1 . GLU B 89  ? 0.8174 0.8608 0.7215 0.1994  -0.0793 -0.0615 89  GLU H OE1 
1938 O OE2 . GLU B 89  ? 0.8109 0.9029 0.7194 0.2424  -0.0864 -0.0775 89  GLU H OE2 
1939 N N   . ASP B 90  ? 0.3617 0.4937 0.3219 0.1211  -0.0470 -0.0200 90  ASP H N   
1940 C CA  . ASP B 90  ? 0.3218 0.4602 0.2905 0.0998  -0.0427 -0.0097 90  ASP H CA  
1941 C C   . ASP B 90  ? 0.2876 0.4019 0.2534 0.0825  -0.0368 -0.0061 90  ASP H C   
1942 O O   . ASP B 90  ? 0.2649 0.3758 0.2341 0.0665  -0.0344 0.0008  90  ASP H O   
1943 C CB  . ASP B 90  ? 0.3023 0.4916 0.2885 0.0962  -0.0394 -0.0054 90  ASP H CB  
1944 C CG  . ASP B 90  ? 0.3226 0.5395 0.3141 0.1128  -0.0457 -0.0084 90  ASP H CG  
1945 O OD1 . ASP B 90  ? 0.3338 0.5324 0.3194 0.1149  -0.0530 -0.0069 90  ASP H OD1 
1946 O OD2 . ASP B 90  ? 0.3163 0.5749 0.3177 0.1239  -0.0435 -0.0121 90  ASP H OD2 
1947 N N   . SER B 91  ? 0.2898 0.3906 0.2501 0.0858  -0.0350 -0.0111 91  SER H N   
1948 C CA  . SER B 91  ? 0.2856 0.3645 0.2442 0.0702  -0.0303 -0.0079 91  SER H CA  
1949 C C   . SER B 91  ? 0.3032 0.3469 0.2525 0.0621  -0.0328 -0.0046 91  SER H C   
1950 O O   . SER B 91  ? 0.3401 0.3597 0.2772 0.0710  -0.0394 -0.0078 91  SER H O   
1951 C CB  . SER B 91  ? 0.3062 0.3752 0.2597 0.0753  -0.0298 -0.0141 91  SER H CB  
1952 O OG  . SER B 91  ? 0.2880 0.3917 0.2482 0.0828  -0.0268 -0.0170 91  SER H OG  
1953 N N   . ALA B 92  ? 0.2844 0.3247 0.2377 0.0463  -0.0283 0.0013  92  ALA H N   
1954 C CA  . ALA B 92  ? 0.2948 0.3084 0.2394 0.0380  -0.0291 0.0048  92  ALA H CA  
1955 C C   . ALA B 92  ? 0.2735 0.2900 0.2243 0.0230  -0.0233 0.0092  92  ALA H C   
1956 O O   . ALA B 92  ? 0.2519 0.2902 0.2136 0.0187  -0.0204 0.0108  92  ALA H O   
1957 C CB  . ALA B 92  ? 0.3037 0.3166 0.2425 0.0443  -0.0351 0.0061  92  ALA H CB  
1958 N N   . ILE B 93  ? 0.2746 0.2698 0.2176 0.0155  -0.0221 0.0112  93  ILE H N   
1959 C CA  . ILE B 93  ? 0.2772 0.2726 0.2221 0.0044  -0.0185 0.0142  93  ILE H CA  
1960 C C   . ILE B 93  ? 0.2630 0.2641 0.2042 0.0048  -0.0229 0.0166  93  ILE H C   
1961 O O   . ILE B 93  ? 0.2683 0.2585 0.1991 0.0105  -0.0275 0.0170  93  ILE H O   
1962 C CB  . ILE B 93  ? 0.3237 0.2987 0.2616 -0.0027 -0.0143 0.0144  93  ILE H CB  
1963 C CG1 . ILE B 93  ? 0.3600 0.3324 0.3037 -0.0045 -0.0106 0.0124  93  ILE H CG1 
1964 C CG2 . ILE B 93  ? 0.3329 0.3091 0.2708 -0.0105 -0.0115 0.0155  93  ILE H CG2 
1965 C CD1 . ILE B 93  ? 0.3963 0.3551 0.3358 -0.0123 -0.0060 0.0130  93  ILE H CD1 
1966 N N   . TYR B 94  ? 0.2375 0.2539 0.1862 -0.0011 -0.0231 0.0184  94  TYR H N   
1967 C CA  . TYR B 94  ? 0.2448 0.2667 0.1905 -0.0032 -0.0282 0.0208  94  TYR H CA  
1968 C C   . TYR B 94  ? 0.2413 0.2484 0.1801 -0.0128 -0.0264 0.0208  94  TYR H C   
1969 O O   . TYR B 94  ? 0.2257 0.2331 0.1700 -0.0191 -0.0236 0.0203  94  TYR H O   
1970 C CB  . TYR B 94  ? 0.2295 0.2810 0.1877 -0.0035 -0.0317 0.0231  94  TYR H CB  
1971 C CG  . TYR B 94  ? 0.2333 0.3019 0.1964 0.0089  -0.0333 0.0215  94  TYR H CG  
1972 C CD1 . TYR B 94  ? 0.2274 0.3021 0.1956 0.0139  -0.0294 0.0190  94  TYR H CD1 
1973 C CD2 . TYR B 94  ? 0.2477 0.3253 0.2089 0.0176  -0.0396 0.0214  94  TYR H CD2 
1974 C CE1 . TYR B 94  ? 0.2332 0.3228 0.2036 0.0280  -0.0315 0.0156  94  TYR H CE1 
1975 C CE2 . TYR B 94  ? 0.2508 0.3435 0.2154 0.0325  -0.0419 0.0181  94  TYR H CE2 
1976 C CZ  . TYR B 94  ? 0.2410 0.3397 0.2098 0.0382  -0.0377 0.0147  94  TYR H CZ  
1977 O OH  . TYR B 94  ? 0.2439 0.3584 0.2147 0.0550  -0.0405 0.0099  94  TYR H OH  
1978 N N   . TYR B 95  ? 0.2475 0.2419 0.1733 -0.0130 -0.0287 0.0211  95  TYR H N   
1979 C CA  . TYR B 95  ? 0.2598 0.2417 0.1766 -0.0203 -0.0274 0.0197  95  TYR H CA  
1980 C C   . TYR B 95  ? 0.2620 0.2499 0.1753 -0.0235 -0.0353 0.0211  95  TYR H C   
1981 O O   . TYR B 95  ? 0.2615 0.2588 0.1747 -0.0188 -0.0412 0.0234  95  TYR H O   
1982 C CB  . TYR B 95  ? 0.2897 0.2531 0.1906 -0.0200 -0.0240 0.0192  95  TYR H CB  
1983 C CG  . TYR B 95  ? 0.2890 0.2446 0.1909 -0.0196 -0.0168 0.0186  95  TYR H CG  
1984 C CD1 . TYR B 95  ? 0.2920 0.2468 0.1987 -0.0235 -0.0102 0.0156  95  TYR H CD1 
1985 C CD2 . TYR B 95  ? 0.3022 0.2510 0.2004 -0.0151 -0.0180 0.0208  95  TYR H CD2 
1986 C CE1 . TYR B 95  ? 0.2958 0.2469 0.2052 -0.0241 -0.0043 0.0153  95  TYR H CE1 
1987 C CE2 . TYR B 95  ? 0.3107 0.2515 0.2093 -0.0169 -0.0129 0.0208  95  TYR H CE2 
1988 C CZ  . TYR B 95  ? 0.3046 0.2488 0.2102 -0.0220 -0.0057 0.0182  95  TYR H CZ  
1989 O OH  . TYR B 95  ? 0.3229 0.2626 0.2309 -0.0246 -0.0013 0.0184  95  TYR H OH  
1990 N N   . CYS B 96  ? 0.2592 0.2412 0.1695 -0.0307 -0.0364 0.0191  96  CYS H N   
1991 C CA  . CYS B 96  ? 0.2814 0.2598 0.1813 -0.0348 -0.0440 0.0188  96  CYS H CA  
1992 C C   . CYS B 96  ? 0.2888 0.2475 0.1697 -0.0340 -0.0401 0.0151  96  CYS H C   
1993 O O   . CYS B 96  ? 0.2770 0.2277 0.1566 -0.0329 -0.0316 0.0123  96  CYS H O   
1994 C CB  . CYS B 96  ? 0.3000 0.2816 0.2056 -0.0435 -0.0498 0.0187  96  CYS H CB  
1995 S SG  . CYS B 96  ? 0.3312 0.2944 0.2341 -0.0462 -0.0450 0.0131  96  CYS H SG  
1996 N N   . ALA B 97  ? 0.3014 0.2548 0.1678 -0.0347 -0.0461 0.0153  97  ALA H N   
1997 C CA  . ALA B 97  ? 0.3230 0.2605 0.1688 -0.0341 -0.0421 0.0125  97  ALA H CA  
1998 C C   . ALA B 97  ? 0.3315 0.2642 0.1628 -0.0373 -0.0514 0.0110  97  ALA H C   
1999 O O   . ALA B 97  ? 0.3361 0.2795 0.1732 -0.0380 -0.0608 0.0147  97  ALA H O   
2000 C CB  . ALA B 97  ? 0.3302 0.2636 0.1689 -0.0298 -0.0383 0.0170  97  ALA H CB  
2001 N N   . ARG B 98  ? 0.3457 0.2653 0.1607 -0.0387 -0.0491 0.0049  98  ARG H N   
2002 C CA  . ARG B 98  ? 0.3784 0.2898 0.1758 -0.0416 -0.0582 0.0015  98  ARG H CA  
2003 C C   . ARG B 98  ? 0.3983 0.3039 0.1744 -0.0392 -0.0575 0.0040  98  ARG H C   
2004 O O   . ARG B 98  ? 0.3979 0.2996 0.1662 -0.0370 -0.0471 0.0045  98  ARG H O   
2005 C CB  . ARG B 98  ? 0.4041 0.3027 0.1925 -0.0421 -0.0558 -0.0081 98  ARG H CB  
2006 C CG  . ARG B 98  ? 0.4492 0.3375 0.2257 -0.0466 -0.0685 -0.0133 98  ARG H CG  
2007 C CD  . ARG B 98  ? 0.4789 0.3511 0.2420 -0.0432 -0.0652 -0.0248 98  ARG H CD  
2008 N NE  . ARG B 98  ? 0.5095 0.3780 0.2506 -0.0375 -0.0565 -0.0292 98  ARG H NE  
2009 C CZ  . ARG B 98  ? 0.5558 0.4113 0.2751 -0.0337 -0.0571 -0.0403 98  ARG H CZ  
2010 N NH1 . ARG B 98  ? 0.5696 0.4100 0.2860 -0.0345 -0.0676 -0.0484 98  ARG H NH1 
2011 N NH2 . ARG B 98  ? 0.5814 0.4385 0.2802 -0.0293 -0.0484 -0.0430 98  ARG H NH2 
2012 N N   . ASP B 99  ? 0.4065 0.3112 0.1715 -0.0409 -0.0688 0.0055  99  ASP H N   
2013 C CA  . ASP B 99  ? 0.4428 0.3378 0.1811 -0.0396 -0.0693 0.0067  99  ASP H CA  
2014 C C   . ASP B 99  ? 0.4609 0.3444 0.1789 -0.0417 -0.0716 -0.0027 99  ASP H C   
2015 O O   . ASP B 99  ? 0.4597 0.3401 0.1850 -0.0437 -0.0736 -0.0099 99  ASP H O   
2016 C CB  . ASP B 99  ? 0.4551 0.3552 0.1916 -0.0377 -0.0800 0.0147  99  ASP H CB  
2017 C CG  . ASP B 99  ? 0.4817 0.3876 0.2186 -0.0410 -0.0953 0.0137  99  ASP H CG  
2018 O OD1 . ASP B 99  ? 0.5188 0.4138 0.2349 -0.0443 -0.1000 0.0081  99  ASP H OD1 
2019 O OD2 . ASP B 99  ? 0.4895 0.4113 0.2447 -0.0397 -0.1028 0.0185  99  ASP H OD2 
2020 N N   . TRP B 100 ? 0.4709 0.3462 0.1619 -0.0409 -0.0708 -0.0032 100 TRP H N   
2021 C CA  . TRP B 100 ? 0.5036 0.3678 0.1710 -0.0408 -0.0717 -0.0138 100 TRP H CA  
2022 C C   . TRP B 100 ? 0.5091 0.3674 0.1518 -0.0424 -0.0829 -0.0119 100 TRP H C   
2023 O O   . TRP B 100 ? 0.5323 0.3817 0.1475 -0.0412 -0.0813 -0.0186 100 TRP H O   
2024 C CB  . TRP B 100 ? 0.5287 0.3925 0.1867 -0.0371 -0.0551 -0.0188 100 TRP H CB  
2025 C CG  . TRP B 100 ? 0.5547 0.4242 0.2075 -0.0375 -0.0441 -0.0092 100 TRP H CG  
2026 C CD1 . TRP B 100 ? 0.5470 0.4225 0.2180 -0.0386 -0.0403 0.0007  100 TRP H CD1 
2027 C CD2 . TRP B 100 ? 0.5909 0.4600 0.2168 -0.0377 -0.0350 -0.0095 100 TRP H CD2 
2028 N NE1 . TRP B 100 ? 0.5691 0.4447 0.2256 -0.0408 -0.0312 0.0076  100 TRP H NE1 
2029 C CE2 . TRP B 100 ? 0.5911 0.4646 0.2201 -0.0410 -0.0273 0.0024  100 TRP H CE2 
2030 C CE3 . TRP B 100 ? 0.6207 0.4860 0.2181 -0.0356 -0.0336 -0.0184 100 TRP H CE3 
2031 C CZ2 . TRP B 100 ? 0.6089 0.4848 0.2150 -0.0444 -0.0175 0.0070  100 TRP H CZ2 
2032 C CZ3 . TRP B 100 ? 0.6533 0.5241 0.2283 -0.0372 -0.0224 -0.0148 100 TRP H CZ3 
2033 C CH2 . TRP B 100 ? 0.6486 0.5251 0.2281 -0.0427 -0.0146 -0.0012 100 TRP H CH2 
2034 N N   . GLU B 101 ? 0.4922 0.3572 0.1458 -0.0442 -0.0946 -0.0038 101 GLU H N   
2035 C CA  . GLU B 101 ? 0.5246 0.3868 0.1607 -0.0458 -0.1092 -0.0015 101 GLU H CA  
2036 C C   . GLU B 101 ? 0.5459 0.4007 0.1534 -0.0435 -0.1041 0.0035  101 GLU H C   
2037 O O   . GLU B 101 ? 0.5648 0.4114 0.1448 -0.0445 -0.1118 0.0012  101 GLU H O   
2038 C CB  . GLU B 101 ? 0.5444 0.3977 0.1696 -0.0500 -0.1201 -0.0122 101 GLU H CB  
2039 C CG  . GLU B 101 ? 0.5582 0.4169 0.1838 -0.0541 -0.1387 -0.0084 101 GLU H CG  
2040 C CD  . GLU B 101 ? 0.5749 0.4259 0.1969 -0.0613 -0.1530 -0.0173 101 GLU H CD  
2041 O OE1 . GLU B 101 ? 0.5819 0.4409 0.2030 -0.0657 -0.1703 -0.0127 101 GLU H OE1 
2042 O OE2 . GLU B 101 ? 0.5890 0.4279 0.2105 -0.0625 -0.1492 -0.0271 101 GLU H OE2 
2043 N N   . ARG B 102 ? 0.5462 0.4030 0.1589 -0.0415 -0.0925 0.0110  102 ARG H N   
2044 C CA  . ARG B 102 ? 0.5879 0.4372 0.1753 -0.0416 -0.0881 0.0195  102 ARG H CA  
2045 C C   . ARG B 102 ? 0.5769 0.4259 0.1734 -0.0390 -0.0949 0.0322  102 ARG H C   
2046 O O   . ARG B 102 ? 0.6158 0.4552 0.1924 -0.0399 -0.0934 0.0412  102 ARG H O   
2047 C CB  . ARG B 102 ? 0.6038 0.4538 0.1878 -0.0431 -0.0693 0.0194  102 ARG H CB  
2048 C CG  . ARG B 102 ? 0.6263 0.4782 0.2010 -0.0426 -0.0600 0.0063  102 ARG H CG  
2049 C CD  . ARG B 102 ? 0.6587 0.5032 0.2022 -0.0424 -0.0676 -0.0005 102 ARG H CD  
2050 N NE  . ARG B 102 ? 0.6991 0.5399 0.2098 -0.0449 -0.0643 0.0060  102 ARG H NE  
2051 C CZ  . ARG B 102 ? 0.7317 0.5662 0.2101 -0.0447 -0.0704 0.0010  102 ARG H CZ  
2052 N NH1 . ARG B 102 ? 0.7232 0.5523 0.1986 -0.0423 -0.0813 -0.0113 102 ARG H NH1 
2053 N NH2 . ARG B 102 ? 0.7438 0.5765 0.1918 -0.0480 -0.0660 0.0090  102 ARG H NH2 
2054 N N   . GLY B 103 ? 0.5377 0.3975 0.1647 -0.0356 -0.1012 0.0327  103 GLY H N   
2055 C CA  . GLY B 103 ? 0.5292 0.3905 0.1700 -0.0300 -0.1054 0.0420  103 GLY H CA  
2056 C C   . GLY B 103 ? 0.4950 0.3684 0.1686 -0.0280 -0.0986 0.0395  103 GLY H C   
2057 O O   . GLY B 103 ? 0.4771 0.3561 0.1609 -0.0317 -0.0910 0.0318  103 GLY H O   
2058 N N   . ASP B 104 ? 0.4911 0.3685 0.1803 -0.0211 -0.1029 0.0451  104 ASP H N   
2059 C CA  . ASP B 104 ? 0.4704 0.3624 0.1909 -0.0180 -0.0985 0.0426  104 ASP H CA  
2060 C C   . ASP B 104 ? 0.4682 0.3502 0.1896 -0.0195 -0.0847 0.0441  104 ASP H C   
2061 O O   . ASP B 104 ? 0.4615 0.3399 0.1905 -0.0137 -0.0855 0.0485  104 ASP H O   
2062 C CB  . ASP B 104 ? 0.4861 0.3920 0.2231 -0.0083 -0.1106 0.0457  104 ASP H CB  
2063 C CG  . ASP B 104 ? 0.5070 0.4283 0.2466 -0.0093 -0.1236 0.0440  104 ASP H CG  
2064 O OD1 . ASP B 104 ? 0.5276 0.4626 0.2809 -0.0159 -0.1227 0.0387  104 ASP H OD1 
2065 O OD2 . ASP B 104 ? 0.5333 0.4512 0.2599 -0.0046 -0.1352 0.0481  104 ASP H OD2 
2066 N N   . PHE B 105 ? 0.4570 0.3348 0.1695 -0.0267 -0.0736 0.0399  105 PHE H N   
2067 C CA  . PHE B 105 ? 0.4398 0.3141 0.1564 -0.0300 -0.0595 0.0400  105 PHE H CA  
2068 C C   . PHE B 105 ? 0.4324 0.3146 0.1553 -0.0338 -0.0506 0.0304  105 PHE H C   
2069 O O   . PHE B 105 ? 0.4337 0.3170 0.1483 -0.0351 -0.0553 0.0246  105 PHE H O   
2070 C CB  . PHE B 105 ? 0.4579 0.3163 0.1492 -0.0342 -0.0559 0.0479  105 PHE H CB  
2071 C CG  . PHE B 105 ? 0.4839 0.3377 0.1475 -0.0388 -0.0556 0.0472  105 PHE H CG  
2072 C CD1 . PHE B 105 ? 0.4865 0.3453 0.1424 -0.0437 -0.0431 0.0411  105 PHE H CD1 
2073 C CD2 . PHE B 105 ? 0.5042 0.3494 0.1479 -0.0371 -0.0681 0.0520  105 PHE H CD2 
2074 C CE1 . PHE B 105 ? 0.5130 0.3689 0.1415 -0.0466 -0.0424 0.0393  105 PHE H CE1 
2075 C CE2 . PHE B 105 ? 0.5355 0.3764 0.1512 -0.0412 -0.0680 0.0510  105 PHE H CE2 
2076 C CZ  . PHE B 105 ? 0.5372 0.3835 0.1444 -0.0460 -0.0546 0.0444  105 PHE H CZ  
2077 N N   . PHE B 106 ? 0.4232 0.3089 0.1583 -0.0353 -0.0392 0.0284  106 PHE H N   
2078 C CA  . PHE B 106 ? 0.4188 0.3139 0.1718 -0.0353 -0.0344 0.0197  106 PHE H CA  
2079 C C   . PHE B 106 ? 0.4374 0.3335 0.1855 -0.0376 -0.0210 0.0148  106 PHE H C   
2080 O O   . PHE B 106 ? 0.4523 0.3505 0.2063 -0.0393 -0.0125 0.0186  106 PHE H O   
2081 C CB  . PHE B 106 ? 0.3828 0.2863 0.1619 -0.0324 -0.0357 0.0215  106 PHE H CB  
2082 C CG  . PHE B 106 ? 0.3910 0.2971 0.1744 -0.0279 -0.0470 0.0270  106 PHE H CG  
2083 C CD1 . PHE B 106 ? 0.3876 0.2915 0.1772 -0.0235 -0.0475 0.0323  106 PHE H CD1 
2084 C CD2 . PHE B 106 ? 0.4002 0.3108 0.1800 -0.0275 -0.0581 0.0263  106 PHE H CD2 
2085 C CE1 . PHE B 106 ? 0.4013 0.3084 0.1939 -0.0164 -0.0585 0.0360  106 PHE H CE1 
2086 C CE2 . PHE B 106 ? 0.4024 0.3199 0.1877 -0.0220 -0.0687 0.0308  106 PHE H CE2 
2087 C CZ  . PHE B 106 ? 0.4111 0.3267 0.2018 -0.0153 -0.0687 0.0354  106 PHE H CZ  
2088 N N   . ASP B 107 ? 0.4468 0.3429 0.1875 -0.0369 -0.0201 0.0056  107 ASP H N   
2089 C CA  . ASP B 107 ? 0.4662 0.3665 0.2014 -0.0361 -0.0080 -0.0015 107 ASP H CA  
2090 C C   . ASP B 107 ? 0.4491 0.3555 0.2083 -0.0333 -0.0046 -0.0072 107 ASP H C   
2091 O O   . ASP B 107 ? 0.4835 0.3974 0.2457 -0.0318 0.0059  -0.0109 107 ASP H O   
2092 C CB  . ASP B 107 ? 0.5032 0.3984 0.2144 -0.0343 -0.0097 -0.0099 107 ASP H CB  
2093 C CG  . ASP B 107 ? 0.5094 0.3961 0.2212 -0.0326 -0.0225 -0.0172 107 ASP H CG  
2094 O OD1 . ASP B 107 ? 0.5005 0.3879 0.2319 -0.0341 -0.0305 -0.0140 107 ASP H OD1 
2095 O OD2 . ASP B 107 ? 0.5478 0.4279 0.2404 -0.0301 -0.0244 -0.0263 107 ASP H OD2 
2096 N N   . TYR B 108 ? 0.4205 0.3255 0.1957 -0.0328 -0.0135 -0.0076 108 TYR H N   
2097 C CA  . TYR B 108 ? 0.4016 0.3103 0.1971 -0.0308 -0.0116 -0.0122 108 TYR H CA  
2098 C C   . TYR B 108 ? 0.3711 0.2855 0.1870 -0.0325 -0.0160 -0.0049 108 TYR H C   
2099 O O   . TYR B 108 ? 0.3662 0.2808 0.1825 -0.0342 -0.0255 -0.0009 108 TYR H O   
2100 C CB  . TYR B 108 ? 0.4231 0.3226 0.2140 -0.0288 -0.0185 -0.0219 108 TYR H CB  
2101 C CG  . TYR B 108 ? 0.4584 0.3542 0.2312 -0.0236 -0.0123 -0.0320 108 TYR H CG  
2102 C CD1 . TYR B 108 ? 0.4641 0.3676 0.2440 -0.0181 -0.0017 -0.0376 108 TYR H CD1 
2103 C CD2 . TYR B 108 ? 0.4864 0.3747 0.2343 -0.0234 -0.0160 -0.0356 108 TYR H CD2 
2104 C CE1 . TYR B 108 ? 0.4889 0.3947 0.2528 -0.0116 0.0053  -0.0474 108 TYR H CE1 
2105 C CE2 . TYR B 108 ? 0.5179 0.4056 0.2475 -0.0172 -0.0094 -0.0458 108 TYR H CE2 
2106 C CZ  . TYR B 108 ? 0.5159 0.4138 0.2539 -0.0109 0.0017  -0.0518 108 TYR H CZ  
2107 O OH  . TYR B 108 ? 0.5609 0.4633 0.2813 -0.0032 0.0091  -0.0625 108 TYR H OH  
2108 N N   . TRP B 109 ? 0.3399 0.2610 0.1727 -0.0314 -0.0095 -0.0041 109 TRP H N   
2109 C CA  . TRP B 109 ? 0.3141 0.2423 0.1652 -0.0318 -0.0118 0.0018  109 TRP H CA  
2110 C C   . TRP B 109 ? 0.3092 0.2409 0.1768 -0.0312 -0.0116 -0.0016 109 TRP H C   
2111 O O   . TRP B 109 ? 0.3082 0.2381 0.1754 -0.0290 -0.0057 -0.0076 109 TRP H O   
2112 C CB  . TRP B 109 ? 0.3096 0.2398 0.1624 -0.0317 -0.0051 0.0070  109 TRP H CB  
2113 C CG  . TRP B 109 ? 0.3161 0.2397 0.1529 -0.0328 -0.0067 0.0128  109 TRP H CG  
2114 C CD1 . TRP B 109 ? 0.3366 0.2543 0.1528 -0.0350 -0.0043 0.0129  109 TRP H CD1 
2115 C CD2 . TRP B 109 ? 0.3150 0.2360 0.1532 -0.0310 -0.0119 0.0194  109 TRP H CD2 
2116 N NE1 . TRP B 109 ? 0.3469 0.2570 0.1512 -0.0361 -0.0082 0.0204  109 TRP H NE1 
2117 C CE2 . TRP B 109 ? 0.3451 0.2558 0.1626 -0.0327 -0.0138 0.0240  109 TRP H CE2 
2118 C CE3 . TRP B 109 ? 0.3049 0.2313 0.1583 -0.0270 -0.0160 0.0213  109 TRP H CE3 
2119 C CZ2 . TRP B 109 ? 0.3470 0.2493 0.1590 -0.0302 -0.0205 0.0306  109 TRP H CZ2 
2120 C CZ3 . TRP B 109 ? 0.3147 0.2349 0.1630 -0.0231 -0.0219 0.0263  109 TRP H CZ3 
2121 C CH2 . TRP B 109 ? 0.3391 0.2459 0.1671 -0.0244 -0.0248 0.0309  109 TRP H CH2 
2122 N N   . GLY B 110 ? 0.2888 0.2263 0.1690 -0.0329 -0.0183 0.0017  110 GLY H N   
2123 C CA  . GLY B 110 ? 0.2823 0.2246 0.1788 -0.0332 -0.0179 0.0015  110 GLY H CA  
2124 C C   . GLY B 110 ? 0.2749 0.2223 0.1800 -0.0303 -0.0092 0.0022  110 GLY H C   
2125 O O   . GLY B 110 ? 0.2751 0.2227 0.1751 -0.0294 -0.0051 0.0046  110 GLY H O   
2126 N N   . GLN B 111 ? 0.2708 0.2211 0.1881 -0.0297 -0.0080 0.0009  111 GLN H N   
2127 C CA  . GLN B 111 ? 0.2749 0.2310 0.2021 -0.0276 -0.0011 0.0012  111 GLN H CA  
2128 C C   . GLN B 111 ? 0.2604 0.2243 0.1950 -0.0274 -0.0026 0.0065  111 GLN H C   
2129 O O   . GLN B 111 ? 0.2560 0.2226 0.1963 -0.0262 0.0016  0.0071  111 GLN H O   
2130 C CB  . GLN B 111 ? 0.2792 0.2347 0.2152 -0.0260 -0.0009 -0.0026 111 GLN H CB  
2131 C CG  . GLN B 111 ? 0.2870 0.2464 0.2338 -0.0279 -0.0066 0.0011  111 GLN H CG  
2132 C CD  . GLN B 111 ? 0.3087 0.2623 0.2522 -0.0323 -0.0157 0.0026  111 GLN H CD  
2133 O OE1 . GLN B 111 ? 0.3100 0.2571 0.2429 -0.0342 -0.0194 0.0014  111 GLN H OE1 
2134 N NE2 . GLN B 111 ? 0.3012 0.2572 0.2531 -0.0353 -0.0203 0.0063  111 GLN H NE2 
2135 N N   . GLY B 112 ? 0.2492 0.2183 0.1846 -0.0282 -0.0089 0.0099  112 GLY H N   
2136 C CA  . GLY B 112 ? 0.2489 0.2278 0.1903 -0.0252 -0.0103 0.0135  112 GLY H CA  
2137 C C   . GLY B 112 ? 0.2393 0.2305 0.1934 -0.0259 -0.0118 0.0152  112 GLY H C   
2138 O O   . GLY B 112 ? 0.2327 0.2207 0.1914 -0.0281 -0.0104 0.0137  112 GLY H O   
2139 N N   . THR B 113 ? 0.2255 0.2316 0.1842 -0.0241 -0.0156 0.0183  113 THR H N   
2140 C CA  . THR B 113 ? 0.2198 0.2426 0.1892 -0.0247 -0.0164 0.0210  113 THR H CA  
2141 C C   . THR B 113 ? 0.2105 0.2409 0.1818 -0.0161 -0.0145 0.0196  113 THR H C   
2142 O O   . THR B 113 ? 0.2188 0.2546 0.1871 -0.0099 -0.0170 0.0193  113 THR H O   
2143 C CB  . THR B 113 ? 0.2159 0.2555 0.1896 -0.0305 -0.0221 0.0259  113 THR H CB  
2144 O OG1 . THR B 113 ? 0.2293 0.2561 0.1990 -0.0388 -0.0258 0.0264  113 THR H OG1 
2145 C CG2 . THR B 113 ? 0.2103 0.2711 0.1939 -0.0321 -0.0221 0.0299  113 THR H CG2 
2146 N N   . LEU B 114 ? 0.2135 0.2447 0.1892 -0.0147 -0.0116 0.0183  114 LEU H N   
2147 C CA  . LEU B 114 ? 0.2159 0.2521 0.1917 -0.0060 -0.0111 0.0156  114 LEU H CA  
2148 C C   . LEU B 114 ? 0.2106 0.2732 0.1929 -0.0034 -0.0126 0.0178  114 LEU H C   
2149 O O   . LEU B 114 ? 0.2164 0.2890 0.2044 -0.0093 -0.0118 0.0210  114 LEU H O   
2150 C CB  . LEU B 114 ? 0.2268 0.2531 0.2037 -0.0062 -0.0082 0.0130  114 LEU H CB  
2151 C CG  . LEU B 114 ? 0.2327 0.2589 0.2068 0.0024  -0.0093 0.0091  114 LEU H CG  
2152 C CD1 . LEU B 114 ? 0.2509 0.2606 0.2151 0.0072  -0.0117 0.0071  114 LEU H CD1 
2153 C CD2 . LEU B 114 ? 0.2558 0.2748 0.2322 0.0005  -0.0077 0.0069  114 LEU H CD2 
2154 N N   . VAL B 115 ? 0.2061 0.2801 0.1869 0.0056  -0.0148 0.0161  115 VAL H N   
2155 C CA  . VAL B 115 ? 0.2099 0.3154 0.1973 0.0107  -0.0153 0.0170  115 VAL H CA  
2156 C C   . VAL B 115 ? 0.2189 0.3246 0.2022 0.0243  -0.0150 0.0102  115 VAL H C   
2157 O O   . VAL B 115 ? 0.2326 0.3221 0.2079 0.0340  -0.0181 0.0054  115 VAL H O   
2158 C CB  . VAL B 115 ? 0.2146 0.3394 0.2052 0.0128  -0.0188 0.0193  115 VAL H CB  
2159 C CG1 . VAL B 115 ? 0.2149 0.3780 0.2138 0.0183  -0.0181 0.0201  115 VAL H CG1 
2160 C CG2 . VAL B 115 ? 0.2172 0.3375 0.2093 -0.0007 -0.0210 0.0251  115 VAL H CG2 
2161 N N   . THR B 116 ? 0.1990 0.3195 0.1855 0.0244  -0.0124 0.0101  116 THR H N   
2162 C CA  . THR B 116 ? 0.2094 0.3335 0.1909 0.0379  -0.0126 0.0026  116 THR H CA  
2163 C C   . THR B 116 ? 0.2115 0.3760 0.1982 0.0460  -0.0115 0.0023  116 THR H C   
2164 O O   . THR B 116 ? 0.2071 0.3970 0.2005 0.0371  -0.0082 0.0087  116 THR H O   
2165 C CB  . THR B 116 ? 0.2107 0.3228 0.1903 0.0331  -0.0108 0.0016  116 THR H CB  
2166 O OG1 . THR B 116 ? 0.2050 0.2864 0.1824 0.0254  -0.0112 0.0023  116 THR H OG1 
2167 C CG2 . THR B 116 ? 0.2318 0.3417 0.2036 0.0463  -0.0125 -0.0070 116 THR H CG2 
2168 N N   . VAL B 117 ? 0.2077 0.3784 0.1906 0.0628  -0.0146 -0.0047 117 VAL H N   
2169 C CA  . VAL B 117 ? 0.2183 0.4316 0.2063 0.0745  -0.0132 -0.0071 117 VAL H CA  
2170 C C   . VAL B 117 ? 0.2268 0.4414 0.2062 0.0885  -0.0127 -0.0167 117 VAL H C   
2171 O O   . VAL B 117 ? 0.2565 0.4425 0.2246 0.1017  -0.0181 -0.0259 117 VAL H O   
2172 C CB  . VAL B 117 ? 0.2280 0.4499 0.2175 0.0869  -0.0179 -0.0102 117 VAL H CB  
2173 C CG1 . VAL B 117 ? 0.2381 0.5107 0.2353 0.1001  -0.0158 -0.0133 117 VAL H CG1 
2174 C CG2 . VAL B 117 ? 0.2230 0.4396 0.2187 0.0719  -0.0194 -0.0011 117 VAL H CG2 
2175 N N   . SER B 118 ? 0.2068 0.4506 0.1895 0.0846  -0.0074 -0.0141 118 SER H N   
2176 C CA  . SER B 118 ? 0.2140 0.4564 0.1863 0.0956  -0.0070 -0.0229 118 SER H CA  
2177 C C   . SER B 118 ? 0.2174 0.5066 0.1945 0.0928  -0.0004 -0.0186 118 SER H C   
2178 O O   . SER B 118 ? 0.2011 0.5094 0.1884 0.0745  0.0031  -0.0057 118 SER H O   
2179 C CB  . SER B 118 ? 0.2099 0.4111 0.1756 0.0851  -0.0088 -0.0223 118 SER H CB  
2180 O OG  . SER B 118 ? 0.2172 0.4207 0.1744 0.0902  -0.0083 -0.0280 118 SER H OG  
2181 N N   . SER B 119 ? 0.2310 0.5330 0.1986 0.1088  0.0003  -0.0287 119 SER H N   
2182 C CA  . SER B 119 ? 0.2391 0.5876 0.2077 0.1077  0.0072  -0.0256 119 SER H CA  
2183 C C   . SER B 119 ? 0.2208 0.5533 0.1826 0.0944  0.0081  -0.0209 119 SER H C   
2184 O O   . SER B 119 ? 0.2171 0.5842 0.1784 0.0885  0.0135  -0.0149 119 SER H O   
2185 C CB  . SER B 119 ? 0.2773 0.6536 0.2392 0.1339  0.0077  -0.0396 119 SER H CB  
2186 O OG  . SER B 119 ? 0.3229 0.6649 0.2677 0.1476  0.0025  -0.0530 119 SER H OG  
2187 N N   . ALA B 120 ? 0.2101 0.4942 0.1672 0.0885  0.0030  -0.0222 120 ALA H N   
2188 C CA  . ALA B 120 ? 0.2133 0.4801 0.1643 0.0781  0.0023  -0.0193 120 ALA H CA  
2189 C C   . ALA B 120 ? 0.1938 0.4686 0.1544 0.0551  0.0050  -0.0026 120 ALA H C   
2190 O O   . ALA B 120 ? 0.1733 0.4448 0.1444 0.0450  0.0049  0.0050  120 ALA H O   
2191 C CB  . ALA B 120 ? 0.2222 0.4391 0.1672 0.0796  -0.0044 -0.0262 120 ALA H CB  
2192 N N   . SER B 121 ? 0.1949 0.4763 0.1501 0.0474  0.0059  0.0023  121 SER H N   
2193 C CA  . SER B 121 ? 0.1901 0.4728 0.1506 0.0262  0.0060  0.0179  121 SER H CA  
2194 C C   . SER B 121 ? 0.1840 0.4232 0.1483 0.0172  0.0009  0.0198  121 SER H C   
2195 O O   . SER B 121 ? 0.1811 0.3925 0.1408 0.0239  -0.0024 0.0109  121 SER H O   
2196 C CB  . SER B 121 ? 0.1961 0.4989 0.1472 0.0225  0.0076  0.0225  121 SER H CB  
2197 O OG  . SER B 121 ? 0.2071 0.4873 0.1474 0.0317  0.0040  0.0123  121 SER H OG  
2198 N N   . THR B 122 ? 0.1798 0.4141 0.1518 0.0014  -0.0001 0.0316  122 THR H N   
2199 C CA  . THR B 122 ? 0.1907 0.3888 0.1658 -0.0067 -0.0047 0.0338  122 THR H CA  
2200 C C   . THR B 122 ? 0.1936 0.3838 0.1621 -0.0090 -0.0077 0.0352  122 THR H C   
2201 O O   . THR B 122 ? 0.1839 0.3974 0.1458 -0.0113 -0.0065 0.0403  122 THR H O   
2202 C CB  . THR B 122 ? 0.2201 0.4136 0.2027 -0.0210 -0.0065 0.0447  122 THR H CB  
2203 O OG1 . THR B 122 ? 0.2709 0.4296 0.2567 -0.0227 -0.0099 0.0418  122 THR H OG1 
2204 C CG2 . THR B 122 ? 0.2289 0.4339 0.2093 -0.0354 -0.0088 0.0582  122 THR H CG2 
2205 N N   . LYS B 123 ? 0.2005 0.3606 0.1710 -0.0082 -0.0114 0.0306  123 LYS H N   
2206 C CA  . LYS B 123 ? 0.2141 0.3634 0.1809 -0.0106 -0.0159 0.0317  123 LYS H CA  
2207 C C   . LYS B 123 ? 0.2042 0.3253 0.1795 -0.0147 -0.0195 0.0315  123 LYS H C   
2208 O O   . LYS B 123 ? 0.1962 0.3035 0.1764 -0.0106 -0.0182 0.0245  123 LYS H O   
2209 C CB  . LYS B 123 ? 0.2272 0.3762 0.1857 0.0002  -0.0168 0.0210  123 LYS H CB  
2210 C CG  . LYS B 123 ? 0.2464 0.3902 0.2003 -0.0031 -0.0222 0.0237  123 LYS H CG  
2211 C CD  . LYS B 123 ? 0.2784 0.4194 0.2230 0.0064  -0.0249 0.0128  123 LYS H CD  
2212 C CE  . LYS B 123 ? 0.3049 0.4371 0.2474 0.0022  -0.0317 0.0155  123 LYS H CE  
2213 N NZ  . LYS B 123 ? 0.3063 0.4155 0.2625 -0.0024 -0.0354 0.0159  123 LYS H NZ  
2214 N N   . GLY B 124 ? 0.2063 0.3203 0.1827 -0.0229 -0.0242 0.0399  124 GLY H N   
2215 C CA  . GLY B 124 ? 0.2091 0.2993 0.1936 -0.0247 -0.0281 0.0390  124 GLY H CA  
2216 C C   . GLY B 124 ? 0.2192 0.3013 0.2054 -0.0189 -0.0308 0.0315  124 GLY H C   
2217 O O   . GLY B 124 ? 0.2240 0.3153 0.2025 -0.0163 -0.0325 0.0302  124 GLY H O   
2218 N N   . PRO B 125 ? 0.2157 0.2823 0.2115 -0.0176 -0.0316 0.0268  125 PRO H N   
2219 C CA  . PRO B 125 ? 0.2258 0.2872 0.2256 -0.0141 -0.0347 0.0204  125 PRO H CA  
2220 C C   . PRO B 125 ? 0.2301 0.2905 0.2303 -0.0153 -0.0422 0.0248  125 PRO H C   
2221 O O   . PRO B 125 ? 0.2415 0.2982 0.2410 -0.0188 -0.0452 0.0324  125 PRO H O   
2222 C CB  . PRO B 125 ? 0.2181 0.2685 0.2292 -0.0140 -0.0325 0.0162  125 PRO H CB  
2223 C CG  . PRO B 125 ? 0.2151 0.2605 0.2277 -0.0171 -0.0318 0.0220  125 PRO H CG  
2224 C CD  . PRO B 125 ? 0.2144 0.2700 0.2173 -0.0198 -0.0297 0.0272  125 PRO H CD  
2225 N N   . SER B 126 ? 0.2360 0.2977 0.2367 -0.0125 -0.0461 0.0198  126 SER H N   
2226 C CA  . SER B 126 ? 0.2502 0.3091 0.2565 -0.0120 -0.0542 0.0213  126 SER H CA  
2227 C C   . SER B 126 ? 0.2420 0.2957 0.2646 -0.0105 -0.0533 0.0156  126 SER H C   
2228 O O   . SER B 126 ? 0.2539 0.3074 0.2799 -0.0108 -0.0481 0.0093  126 SER H O   
2229 C CB  . SER B 126 ? 0.2760 0.3413 0.2748 -0.0103 -0.0594 0.0182  126 SER H CB  
2230 O OG  . SER B 126 ? 0.3045 0.3784 0.2873 -0.0113 -0.0597 0.0238  126 SER H OG  
2231 N N   . VAL B 127 ? 0.2279 0.2784 0.2597 -0.0085 -0.0585 0.0177  127 VAL H N   
2232 C CA  . VAL B 127 ? 0.2215 0.2728 0.2700 -0.0059 -0.0568 0.0120  127 VAL H CA  
2233 C C   . VAL B 127 ? 0.2228 0.2812 0.2809 -0.0028 -0.0650 0.0101  127 VAL H C   
2234 O O   . VAL B 127 ? 0.2265 0.2812 0.2814 0.0001  -0.0733 0.0153  127 VAL H O   
2235 C CB  . VAL B 127 ? 0.2199 0.2628 0.2721 -0.0034 -0.0550 0.0137  127 VAL H CB  
2236 C CG1 . VAL B 127 ? 0.2193 0.2677 0.2879 0.0008  -0.0525 0.0071  127 VAL H CG1 
2237 C CG2 . VAL B 127 ? 0.2257 0.2628 0.2686 -0.0073 -0.0482 0.0159  127 VAL H CG2 
2238 N N   . PHE B 128 ? 0.2114 0.2792 0.2799 -0.0045 -0.0638 0.0039  128 PHE H N   
2239 C CA  . PHE B 128 ? 0.2179 0.2965 0.2973 -0.0028 -0.0723 0.0018  128 PHE H CA  
2240 C C   . PHE B 128 ? 0.2029 0.2943 0.3032 -0.0015 -0.0694 -0.0030 128 PHE H C   
2241 O O   . PHE B 128 ? 0.1928 0.2855 0.2966 -0.0055 -0.0605 -0.0056 128 PHE H O   
2242 C CB  . PHE B 128 ? 0.2309 0.3120 0.3030 -0.0078 -0.0759 -0.0009 128 PHE H CB  
2243 C CG  . PHE B 128 ? 0.2507 0.3239 0.3012 -0.0080 -0.0775 0.0024  128 PHE H CG  
2244 C CD1 . PHE B 128 ? 0.2677 0.3398 0.3095 -0.0051 -0.0847 0.0087  128 PHE H CD1 
2245 C CD2 . PHE B 128 ? 0.2579 0.3262 0.2961 -0.0105 -0.0722 -0.0006 128 PHE H CD2 
2246 C CE1 . PHE B 128 ? 0.2807 0.3507 0.3023 -0.0062 -0.0849 0.0123  128 PHE H CE1 
2247 C CE2 . PHE B 128 ? 0.2791 0.3459 0.2981 -0.0092 -0.0731 0.0012  128 PHE H CE2 
2248 C CZ  . PHE B 128 ? 0.2819 0.3515 0.2928 -0.0076 -0.0787 0.0079  128 PHE H CZ  
2249 N N   . PRO B 129 ? 0.1983 0.3012 0.3126 0.0044  -0.0769 -0.0039 129 PRO H N   
2250 C CA  . PRO B 129 ? 0.1926 0.3152 0.3292 0.0068  -0.0741 -0.0089 129 PRO H CA  
2251 C C   . PRO B 129 ? 0.1912 0.3288 0.3373 -0.0037 -0.0722 -0.0121 129 PRO H C   
2252 O O   . PRO B 129 ? 0.1953 0.3318 0.3361 -0.0086 -0.0797 -0.0118 129 PRO H O   
2253 C CB  . PRO B 129 ? 0.2048 0.3356 0.3516 0.0171  -0.0854 -0.0088 129 PRO H CB  
2254 C CG  . PRO B 129 ? 0.2104 0.3301 0.3417 0.0150  -0.0951 -0.0039 129 PRO H CG  
2255 C CD  . PRO B 129 ? 0.2110 0.3108 0.3203 0.0095  -0.0889 0.0000  129 PRO H CD  
2256 N N   . LEU B 130 ? 0.1822 0.3327 0.3405 -0.0077 -0.0630 -0.0148 130 LEU H N   
2257 C CA  . LEU B 130 ? 0.1901 0.3620 0.3641 -0.0181 -0.0626 -0.0169 130 LEU H CA  
2258 C C   . LEU B 130 ? 0.1915 0.3948 0.3912 -0.0110 -0.0636 -0.0199 130 LEU H C   
2259 O O   . LEU B 130 ? 0.1726 0.3891 0.3819 -0.0077 -0.0544 -0.0220 130 LEU H O   
2260 C CB  . LEU B 130 ? 0.1934 0.3600 0.3621 -0.0289 -0.0523 -0.0163 130 LEU H CB  
2261 C CG  . LEU B 130 ? 0.1943 0.3310 0.3383 -0.0329 -0.0514 -0.0145 130 LEU H CG  
2262 C CD1 . LEU B 130 ? 0.1956 0.3260 0.3345 -0.0396 -0.0411 -0.0136 130 LEU H CD1 
2263 C CD2 . LEU B 130 ? 0.2099 0.3383 0.3455 -0.0407 -0.0607 -0.0152 130 LEU H CD2 
2264 N N   . ALA B 131 ? 0.2090 0.4244 0.4184 -0.0074 -0.0751 -0.0204 131 ALA H N   
2265 C CA  . ALA B 131 ? 0.2348 0.4775 0.4669 0.0050  -0.0792 -0.0237 131 ALA H CA  
2266 C C   . ALA B 131 ? 0.2430 0.5231 0.4996 -0.0028 -0.0729 -0.0262 131 ALA H C   
2267 O O   . ALA B 131 ? 0.2509 0.5365 0.5094 -0.0191 -0.0743 -0.0242 131 ALA H O   
2268 C CB  . ALA B 131 ? 0.2482 0.4922 0.4818 0.0095  -0.0945 -0.0227 131 ALA H CB  
2269 N N   . PRO B 132 ? 0.2690 0.5768 0.5446 0.0077  -0.0667 -0.0305 132 PRO H N   
2270 C CA  . PRO B 132 ? 0.2927 0.6445 0.5943 -0.0004 -0.0611 -0.0320 132 PRO H CA  
2271 C C   . PRO B 132 ? 0.3217 0.7009 0.6431 -0.0054 -0.0733 -0.0318 132 PRO H C   
2272 O O   . PRO B 132 ? 0.3264 0.6996 0.6478 0.0071  -0.0859 -0.0330 132 PRO H O   
2273 C CB  . PRO B 132 ? 0.2958 0.6723 0.6124 0.0184  -0.0544 -0.0386 132 PRO H CB  
2274 C CG  . PRO B 132 ? 0.2947 0.6396 0.5967 0.0384  -0.0633 -0.0406 132 PRO H CG  
2275 C CD  . PRO B 132 ? 0.2851 0.5848 0.5579 0.0282  -0.0656 -0.0344 132 PRO H CD  
2276 N N   . SER B 133 ? 0.3614 0.7696 0.6986 -0.0240 -0.0703 -0.0295 133 SER H N   
2277 C CA  . SER B 133 ? 0.3830 0.8389 0.7512 -0.0279 -0.0774 -0.0305 133 SER H CA  
2278 C C   . SER B 133 ? 0.3969 0.8419 0.7626 -0.0260 -0.0957 -0.0301 133 SER H C   
2279 O O   . SER B 133 ? 0.4017 0.8852 0.7935 -0.0206 -0.1037 -0.0325 133 SER H O   
2280 C CB  . SER B 133 ? 0.3777 0.8767 0.7718 -0.0084 -0.0724 -0.0368 133 SER H CB  
2281 O OG  . SER B 133 ? 0.3994 0.9217 0.8006 -0.0131 -0.0553 -0.0373 133 SER H OG  
2282 N N   . GLY B 139 ? 0.3700 1.3395 0.9684 0.0261  0.0185  -0.0677 139 GLY H N   
2283 C CA  . GLY B 139 ? 0.3604 1.3143 0.9357 0.0291  0.0361  -0.0698 139 GLY H CA  
2284 C C   . GLY B 139 ? 0.3687 1.2567 0.9088 0.0029  0.0366  -0.0580 139 GLY H C   
2285 O O   . GLY B 139 ? 0.3946 1.2332 0.9214 -0.0057 0.0212  -0.0528 139 GLY H O   
2286 N N   . GLY B 140 ? 0.3396 1.2269 0.8638 -0.0079 0.0532  -0.0545 140 GLY H N   
2287 C CA  . GLY B 140 ? 0.3078 1.1455 0.8027 -0.0367 0.0553  -0.0418 140 GLY H CA  
2288 C C   . GLY B 140 ? 0.2847 1.0430 0.7450 -0.0247 0.0474  -0.0445 140 GLY H C   
2289 O O   . GLY B 140 ? 0.2785 1.0208 0.7325 0.0055  0.0453  -0.0562 140 GLY H O   
2290 N N   . THR B 141 ? 0.2576 0.9679 0.6961 -0.0481 0.0419  -0.0339 141 THR H N   
2291 C CA  . THR B 141 ? 0.2399 0.8795 0.6426 -0.0435 0.0390  -0.0337 141 THR H CA  
2292 C C   . THR B 141 ? 0.2117 0.8086 0.6063 -0.0441 0.0211  -0.0320 141 THR H C   
2293 O O   . THR B 141 ? 0.2170 0.8230 0.6219 -0.0641 0.0129  -0.0251 141 THR H O   
2294 C CB  . THR B 141 ? 0.2562 0.8766 0.6380 -0.0688 0.0482  -0.0231 141 THR H CB  
2295 O OG1 . THR B 141 ? 0.2833 0.9469 0.6718 -0.0667 0.0651  -0.0250 141 THR H OG1 
2296 C CG2 . THR B 141 ? 0.2487 0.8015 0.5957 -0.0655 0.0453  -0.0224 141 THR H CG2 
2297 N N   . ALA B 142 ? 0.1934 0.7436 0.5678 -0.0247 0.0152  -0.0373 142 ALA H N   
2298 C CA  . ALA B 142 ? 0.1731 0.6784 0.5337 -0.0258 -0.0001 -0.0349 142 ALA H CA  
2299 C C   . ALA B 142 ? 0.1579 0.6071 0.4849 -0.0277 0.0019  -0.0322 142 ALA H C   
2300 O O   . ALA B 142 ? 0.1536 0.5957 0.4703 -0.0161 0.0112  -0.0363 142 ALA H O   
2301 C CB  . ALA B 142 ? 0.1735 0.6792 0.5429 -0.0013 -0.0114 -0.0425 142 ALA H CB  
2302 N N   . ALA B 143 ? 0.1452 0.5586 0.4563 -0.0414 -0.0066 -0.0263 143 ALA H N   
2303 C CA  . ALA B 143 ? 0.1386 0.5000 0.4188 -0.0420 -0.0063 -0.0239 143 ALA H CA  
2304 C C   . ALA B 143 ? 0.1371 0.4681 0.4069 -0.0290 -0.0186 -0.0261 143 ALA H C   
2305 O O   . ALA B 143 ? 0.1337 0.4724 0.4134 -0.0298 -0.0296 -0.0260 143 ALA H O   
2306 C CB  . ALA B 143 ? 0.1427 0.4858 0.4099 -0.0658 -0.0062 -0.0161 143 ALA H CB  
2307 N N   . LEU B 144 ? 0.1462 0.4418 0.3941 -0.0199 -0.0169 -0.0269 144 LEU H N   
2308 C CA  . LEU B 144 ? 0.1509 0.4151 0.3847 -0.0098 -0.0274 -0.0270 144 LEU H CA  
2309 C C   . LEU B 144 ? 0.1446 0.3722 0.3527 -0.0120 -0.0229 -0.0244 144 LEU H C   
2310 O O   . LEU B 144 ? 0.1392 0.3669 0.3420 -0.0187 -0.0126 -0.0234 144 LEU H O   
2311 C CB  . LEU B 144 ? 0.1655 0.4396 0.4095 0.0112  -0.0320 -0.0327 144 LEU H CB  
2312 C CG  . LEU B 144 ? 0.1750 0.4526 0.4182 0.0245  -0.0230 -0.0382 144 LEU H CG  
2313 C CD1 . LEU B 144 ? 0.1863 0.4228 0.4054 0.0318  -0.0252 -0.0374 144 LEU H CD1 
2314 C CD2 . LEU B 144 ? 0.1842 0.4922 0.4488 0.0428  -0.0264 -0.0457 144 LEU H CD2 
2315 N N   . GLY B 145 ? 0.1524 0.3520 0.3449 -0.0082 -0.0307 -0.0225 145 GLY H N   
2316 C CA  . GLY B 145 ? 0.1503 0.3191 0.3198 -0.0116 -0.0271 -0.0195 145 GLY H CA  
2317 C C   . GLY B 145 ? 0.1632 0.3078 0.3175 -0.0063 -0.0354 -0.0171 145 GLY H C   
2318 O O   . GLY B 145 ? 0.1691 0.3175 0.3290 0.0012  -0.0442 -0.0175 145 GLY H O   
2319 N N   . CYS B 146 ? 0.1733 0.2953 0.3087 -0.0102 -0.0323 -0.0143 146 CYS H N   
2320 C CA  . CYS B 146 ? 0.1907 0.2921 0.3092 -0.0080 -0.0380 -0.0109 146 CYS H CA  
2321 C C   . CYS B 146 ? 0.1805 0.2699 0.2850 -0.0167 -0.0360 -0.0095 146 CYS H C   
2322 O O   . CYS B 146 ? 0.1755 0.2624 0.2777 -0.0220 -0.0286 -0.0099 146 CYS H O   
2323 C CB  . CYS B 146 ? 0.2170 0.3040 0.3260 -0.0011 -0.0362 -0.0092 146 CYS H CB  
2324 S SG  . CYS B 146 ? 0.2685 0.3591 0.3874 0.0119  -0.0438 -0.0108 146 CYS H SG  
2325 N N   . LEU B 147 ? 0.1747 0.2584 0.2707 -0.0175 -0.0432 -0.0084 147 LEU H N   
2326 C CA  . LEU B 147 ? 0.1779 0.2488 0.2578 -0.0219 -0.0435 -0.0085 147 LEU H CA  
2327 C C   . LEU B 147 ? 0.1780 0.2386 0.2432 -0.0170 -0.0422 -0.0050 147 LEU H C   
2328 O O   . LEU B 147 ? 0.1910 0.2527 0.2539 -0.0129 -0.0473 -0.0019 147 LEU H O   
2329 C CB  . LEU B 147 ? 0.1813 0.2544 0.2595 -0.0245 -0.0525 -0.0105 147 LEU H CB  
2330 C CG  . LEU B 147 ? 0.1900 0.2496 0.2496 -0.0257 -0.0548 -0.0126 147 LEU H CG  
2331 C CD1 . LEU B 147 ? 0.2025 0.2517 0.2580 -0.0315 -0.0504 -0.0146 147 LEU H CD1 
2332 C CD2 . LEU B 147 ? 0.2048 0.2660 0.2612 -0.0271 -0.0651 -0.0155 147 LEU H CD2 
2333 N N   . VAL B 148 ? 0.1777 0.2298 0.2338 -0.0182 -0.0361 -0.0048 148 VAL H N   
2334 C CA  . VAL B 148 ? 0.1829 0.2291 0.2268 -0.0152 -0.0339 -0.0011 148 VAL H CA  
2335 C C   . VAL B 148 ? 0.1867 0.2291 0.2167 -0.0148 -0.0348 -0.0031 148 VAL H C   
2336 O O   . VAL B 148 ? 0.1933 0.2289 0.2193 -0.0161 -0.0317 -0.0060 148 VAL H O   
2337 C CB  . VAL B 148 ? 0.1737 0.2156 0.2188 -0.0156 -0.0268 -0.0002 148 VAL H CB  
2338 C CG1 . VAL B 148 ? 0.1700 0.2085 0.2051 -0.0141 -0.0259 0.0043  148 VAL H CG1 
2339 C CG2 . VAL B 148 ? 0.1775 0.2240 0.2357 -0.0142 -0.0260 -0.0010 148 VAL H CG2 
2340 N N   . LYS B 149 ? 0.2032 0.2496 0.2259 -0.0126 -0.0400 -0.0024 149 LYS H N   
2341 C CA  A LYS B 149 ? 0.2230 0.2673 0.2321 -0.0101 -0.0424 -0.0070 149 LYS H CA  
2342 C CA  B LYS B 149 ? 0.2159 0.2604 0.2250 -0.0101 -0.0426 -0.0069 149 LYS H CA  
2343 C C   . LYS B 149 ? 0.2202 0.2712 0.2165 -0.0059 -0.0398 -0.0041 149 LYS H C   
2344 O O   . LYS B 149 ? 0.2294 0.2883 0.2249 -0.0068 -0.0403 0.0028  149 LYS H O   
2345 C CB  A LYS B 149 ? 0.2402 0.2865 0.2484 -0.0105 -0.0507 -0.0101 149 LYS H CB  
2346 C CB  B LYS B 149 ? 0.2223 0.2702 0.2307 -0.0103 -0.0509 -0.0089 149 LYS H CB  
2347 C CG  A LYS B 149 ? 0.2604 0.2975 0.2580 -0.0095 -0.0546 -0.0180 149 LYS H CG  
2348 C CG  B LYS B 149 ? 0.2339 0.2789 0.2262 -0.0064 -0.0550 -0.0151 149 LYS H CG  
2349 C CD  A LYS B 149 ? 0.2864 0.3245 0.2798 -0.0097 -0.0639 -0.0218 149 LYS H CD  
2350 C CD  B LYS B 149 ? 0.2465 0.2865 0.2404 -0.0095 -0.0635 -0.0207 149 LYS H CD  
2351 C CE  A LYS B 149 ? 0.3091 0.3369 0.2840 -0.0050 -0.0685 -0.0303 149 LYS H CE  
2352 C CE  B LYS B 149 ? 0.2591 0.2942 0.2339 -0.0042 -0.0693 -0.0280 149 LYS H CE  
2353 N NZ  A LYS B 149 ? 0.3270 0.3647 0.2860 0.0029  -0.0686 -0.0308 149 LYS H NZ  
2354 N NZ  B LYS B 149 ? 0.2638 0.2842 0.2285 -0.0010 -0.0682 -0.0347 149 LYS H NZ  
2355 N N   . ASP B 150 ? 0.2240 0.2723 0.2100 -0.0014 -0.0379 -0.0091 150 ASP H N   
2356 C CA  . ASP B 150 ? 0.2297 0.2894 0.2019 0.0049  -0.0365 -0.0097 150 ASP H CA  
2357 C C   . ASP B 150 ? 0.2230 0.2934 0.1973 0.0035  -0.0303 -0.0023 150 ASP H C   
2358 O O   . ASP B 150 ? 0.2157 0.3006 0.1866 0.0016  -0.0299 0.0044  150 ASP H O   
2359 C CB  . ASP B 150 ? 0.2448 0.3141 0.2093 0.0060  -0.0414 -0.0089 150 ASP H CB  
2360 C CG  . ASP B 150 ? 0.2685 0.3286 0.2251 0.0096  -0.0482 -0.0186 150 ASP H CG  
2361 O OD1 . ASP B 150 ? 0.2859 0.3319 0.2405 0.0119  -0.0491 -0.0257 150 ASP H OD1 
2362 O OD2 . ASP B 150 ? 0.2764 0.3419 0.2272 0.0098  -0.0534 -0.0186 150 ASP H OD2 
2363 N N   . TYR B 151 ? 0.2043 0.2678 0.1837 0.0029  -0.0264 -0.0026 151 TYR H N   
2364 C CA  . TYR B 151 ? 0.2128 0.2859 0.1944 0.0006  -0.0217 0.0041  151 TYR H CA  
2365 C C   . TYR B 151 ? 0.2127 0.2889 0.1891 0.0073  -0.0185 -0.0001 151 TYR H C   
2366 O O   . TYR B 151 ? 0.2095 0.2729 0.1818 0.0128  -0.0201 -0.0078 151 TYR H O   
2367 C CB  . TYR B 151 ? 0.1990 0.2621 0.1913 -0.0061 -0.0208 0.0087  151 TYR H CB  
2368 C CG  . TYR B 151 ? 0.2037 0.2521 0.2008 -0.0062 -0.0191 0.0039  151 TYR H CG  
2369 C CD1 . TYR B 151 ? 0.1985 0.2379 0.2013 -0.0080 -0.0215 0.0004  151 TYR H CD1 
2370 C CD2 . TYR B 151 ? 0.1983 0.2435 0.1946 -0.0057 -0.0155 0.0040  151 TYR H CD2 
2371 C CE1 . TYR B 151 ? 0.2073 0.2361 0.2138 -0.0102 -0.0196 -0.0024 151 TYR H CE1 
2372 C CE2 . TYR B 151 ? 0.2062 0.2380 0.2046 -0.0069 -0.0140 0.0009  151 TYR H CE2 
2373 C CZ  . TYR B 151 ? 0.2061 0.2302 0.2097 -0.0099 -0.0156 -0.0017 151 TYR H CZ  
2374 O OH  . TYR B 151 ? 0.2184 0.2322 0.2235 -0.0130 -0.0138 -0.0033 151 TYR H OH  
2375 N N   . PHE B 152 ? 0.2032 0.2950 0.1803 0.0061  -0.0151 0.0055  152 PHE H N   
2376 C CA  . PHE B 152 ? 0.2041 0.3025 0.1788 0.0127  -0.0125 0.0025  152 PHE H CA  
2377 C C   . PHE B 152 ? 0.1990 0.3120 0.1793 0.0060  -0.0097 0.0113  152 PHE H C   
2378 O O   . PHE B 152 ? 0.1822 0.3092 0.1633 -0.0010 -0.0097 0.0192  152 PHE H O   
2379 C CB  . PHE B 152 ? 0.2195 0.3339 0.1842 0.0242  -0.0126 -0.0039 152 PHE H CB  
2380 C CG  . PHE B 152 ? 0.2302 0.3498 0.1924 0.0344  -0.0114 -0.0090 152 PHE H CG  
2381 C CD1 . PHE B 152 ? 0.2412 0.3366 0.1984 0.0416  -0.0151 -0.0172 152 PHE H CD1 
2382 C CD2 . PHE B 152 ? 0.2307 0.3784 0.1960 0.0355  -0.0077 -0.0044 152 PHE H CD2 
2383 C CE1 . PHE B 152 ? 0.2593 0.3562 0.2130 0.0521  -0.0157 -0.0217 152 PHE H CE1 
2384 C CE2 . PHE B 152 ? 0.2361 0.3890 0.2006 0.0457  -0.0076 -0.0092 152 PHE H CE2 
2385 C CZ  . PHE B 152 ? 0.2458 0.3726 0.2039 0.0552  -0.0118 -0.0181 152 PHE H CZ  
2386 N N   . PRO B 153 ? 0.1984 0.3078 0.1816 0.0066  -0.0084 0.0111  153 PRO H N   
2387 C CA  . PRO B 153 ? 0.2072 0.2967 0.1880 0.0126  -0.0093 0.0041  153 PRO H CA  
2388 C C   . PRO B 153 ? 0.2061 0.2723 0.1914 0.0050  -0.0097 0.0051  153 PRO H C   
2389 O O   . PRO B 153 ? 0.1976 0.2629 0.1878 -0.0020 -0.0099 0.0095  153 PRO H O   
2390 C CB  . PRO B 153 ? 0.1997 0.2997 0.1819 0.0148  -0.0080 0.0059  153 PRO H CB  
2391 C CG  . PRO B 153 ? 0.1973 0.3089 0.1861 0.0030  -0.0070 0.0156  153 PRO H CG  
2392 C CD  . PRO B 153 ? 0.1947 0.3183 0.1827 -0.0002 -0.0071 0.0190  153 PRO H CD  
2393 N N   . GLU B 154 ? 0.2054 0.2547 0.1883 0.0070  -0.0100 0.0015  154 GLU H N   
2394 C CA  . GLU B 154 ? 0.2264 0.2602 0.2134 -0.0001 -0.0086 0.0033  154 GLU H CA  
2395 C C   . GLU B 154 ? 0.1998 0.2407 0.1901 -0.0048 -0.0071 0.0088  154 GLU H C   
2396 O O   . GLU B 154 ? 0.2052 0.2615 0.1945 -0.0025 -0.0074 0.0110  154 GLU H O   
2397 C CB  . GLU B 154 ? 0.2586 0.2746 0.2394 0.0020  -0.0095 -0.0002 154 GLU H CB  
2398 C CG  . GLU B 154 ? 0.2923 0.2958 0.2703 0.0024  -0.0124 -0.0046 154 GLU H CG  
2399 C CD  . GLU B 154 ? 0.3411 0.3372 0.3261 -0.0067 -0.0104 -0.0031 154 GLU H CD  
2400 O OE1 . GLU B 154 ? 0.3536 0.3354 0.3346 -0.0099 -0.0110 -0.0036 154 GLU H OE1 
2401 O OE2 . GLU B 154 ? 0.2970 0.3023 0.2914 -0.0106 -0.0086 -0.0010 154 GLU H OE2 
2402 N N   . PRO B 155 ? 0.1944 0.2262 0.1883 -0.0110 -0.0060 0.0107  155 PRO H N   
2403 C CA  . PRO B 155 ? 0.2048 0.2255 0.2025 -0.0136 -0.0050 0.0084  155 PRO H CA  
2404 C C   . PRO B 155 ? 0.2172 0.2412 0.2212 -0.0163 -0.0066 0.0105  155 PRO H C   
2405 O O   . PRO B 155 ? 0.2316 0.2631 0.2355 -0.0180 -0.0089 0.0148  155 PRO H O   
2406 C CB  . PRO B 155 ? 0.2141 0.2259 0.2106 -0.0165 -0.0026 0.0086  155 PRO H CB  
2407 C CG  . PRO B 155 ? 0.2109 0.2286 0.2062 -0.0184 -0.0044 0.0126  155 PRO H CG  
2408 C CD  . PRO B 155 ? 0.2096 0.2420 0.2039 -0.0155 -0.0062 0.0145  155 PRO H CD  
2409 N N   . VAL B 156 ? 0.2357 0.2540 0.2451 -0.0172 -0.0058 0.0078  156 VAL H N   
2410 C CA  A VAL B 156 ? 0.2422 0.2609 0.2583 -0.0180 -0.0082 0.0088  156 VAL H CA  
2411 C CA  B VAL B 156 ? 0.2368 0.2555 0.2531 -0.0180 -0.0082 0.0087  156 VAL H CA  
2412 C C   . VAL B 156 ? 0.2394 0.2528 0.2601 -0.0180 -0.0051 0.0054  156 VAL H C   
2413 O O   . VAL B 156 ? 0.2525 0.2644 0.2722 -0.0191 -0.0008 0.0029  156 VAL H O   
2414 C CB  A VAL B 156 ? 0.2536 0.2776 0.2733 -0.0168 -0.0112 0.0079  156 VAL H CB  
2415 C CB  B VAL B 156 ? 0.2390 0.2627 0.2593 -0.0168 -0.0110 0.0074  156 VAL H CB  
2416 C CG1 A VAL B 156 ? 0.2620 0.2846 0.2864 -0.0172 -0.0095 0.0033  156 VAL H CG1 
2417 C CG1 B VAL B 156 ? 0.2383 0.2695 0.2535 -0.0163 -0.0145 0.0112  156 VAL H CG1 
2418 C CG2 A VAL B 156 ? 0.2535 0.2782 0.2774 -0.0167 -0.0160 0.0107  156 VAL H CG2 
2419 C CG2 B VAL B 156 ? 0.2401 0.2618 0.2601 -0.0169 -0.0093 0.0032  156 VAL H CG2 
2420 N N   . THR B 157 ? 0.2390 0.2491 0.2626 -0.0166 -0.0076 0.0055  157 THR H N   
2421 C CA  . THR B 157 ? 0.2513 0.2598 0.2795 -0.0139 -0.0046 0.0007  157 THR H CA  
2422 C C   . THR B 157 ? 0.2317 0.2458 0.2703 -0.0099 -0.0075 -0.0014 157 THR H C   
2423 O O   . THR B 157 ? 0.2273 0.2393 0.2662 -0.0091 -0.0139 0.0017  157 THR H O   
2424 C CB  . THR B 157 ? 0.2791 0.2775 0.3007 -0.0127 -0.0057 0.0000  157 THR H CB  
2425 O OG1 . THR B 157 ? 0.2847 0.2760 0.3047 -0.0127 -0.0136 0.0035  157 THR H OG1 
2426 C CG2 . THR B 157 ? 0.2973 0.2925 0.3096 -0.0164 -0.0030 0.0016  157 THR H CG2 
2427 N N   . VAL B 158 ? 0.2300 0.2527 0.2767 -0.0079 -0.0030 -0.0062 158 VAL H N   
2428 C CA  . VAL B 158 ? 0.2390 0.2709 0.2980 -0.0025 -0.0058 -0.0094 158 VAL H CA  
2429 C C   . VAL B 158 ? 0.2584 0.2955 0.3216 0.0038  -0.0016 -0.0157 158 VAL H C   
2430 O O   . VAL B 158 ? 0.2799 0.3235 0.3415 0.0006  0.0063  -0.0175 158 VAL H O   
2431 C CB  . VAL B 158 ? 0.2357 0.2812 0.3041 -0.0063 -0.0051 -0.0093 158 VAL H CB  
2432 C CG1 . VAL B 158 ? 0.2397 0.2967 0.3218 0.0000  -0.0092 -0.0123 158 VAL H CG1 
2433 C CG2 . VAL B 158 ? 0.2402 0.2802 0.3017 -0.0111 -0.0088 -0.0049 158 VAL H CG2 
2434 N N   . SER B 159 ? 0.2604 0.2932 0.3265 0.0130  -0.0076 -0.0189 159 SER H N   
2435 C CA  . SER B 159 ? 0.2809 0.3222 0.3529 0.0231  -0.0047 -0.0273 159 SER H CA  
2436 C C   . SER B 159 ? 0.2619 0.3168 0.3492 0.0312  -0.0095 -0.0303 159 SER H C   
2437 O O   . SER B 159 ? 0.2645 0.3161 0.3544 0.0289  -0.0168 -0.0253 159 SER H O   
2438 C CB  . SER B 159 ? 0.2974 0.3176 0.3563 0.0295  -0.0088 -0.0307 159 SER H CB  
2439 O OG  . SER B 159 ? 0.3265 0.3282 0.3817 0.0326  -0.0209 -0.0275 159 SER H OG  
2440 N N   . TRP B 160 ? 0.2621 0.3338 0.3590 0.0413  -0.0057 -0.0385 160 TRP H N   
2441 C CA  . TRP B 160 ? 0.2572 0.3454 0.3705 0.0521  -0.0109 -0.0429 160 TRP H CA  
2442 C C   . TRP B 160 ? 0.2660 0.3444 0.3767 0.0702  -0.0169 -0.0518 160 TRP H C   
2443 O O   . TRP B 160 ? 0.2739 0.3543 0.3790 0.0760  -0.0105 -0.0589 160 TRP H O   
2444 C CB  . TRP B 160 ? 0.2421 0.3670 0.3734 0.0479  -0.0015 -0.0448 160 TRP H CB  
2445 C CG  . TRP B 160 ? 0.2154 0.3439 0.3493 0.0323  -0.0013 -0.0366 160 TRP H CG  
2446 C CD1 . TRP B 160 ? 0.2021 0.3252 0.3270 0.0182  0.0047  -0.0312 160 TRP H CD1 
2447 C CD2 . TRP B 160 ? 0.2046 0.3394 0.3486 0.0307  -0.0094 -0.0335 160 TRP H CD2 
2448 N NE1 . TRP B 160 ? 0.1931 0.3177 0.3215 0.0085  0.0009  -0.0259 160 TRP H NE1 
2449 C CE2 . TRP B 160 ? 0.1950 0.3272 0.3348 0.0154  -0.0074 -0.0272 160 TRP H CE2 
2450 C CE3 . TRP B 160 ? 0.2039 0.3441 0.3585 0.0413  -0.0192 -0.0357 160 TRP H CE3 
2451 C CZ2 . TRP B 160 ? 0.1862 0.3225 0.3318 0.0102  -0.0144 -0.0239 160 TRP H CZ2 
2452 C CZ3 . TRP B 160 ? 0.1972 0.3425 0.3580 0.0354  -0.0260 -0.0314 160 TRP H CZ3 
2453 C CH2 . TRP B 160 ? 0.1902 0.3332 0.3459 0.0199  -0.0235 -0.0258 160 TRP H CH2 
2454 N N   . ASN B 161 ? 0.2759 0.3425 0.3888 0.0793  -0.0297 -0.0516 161 ASN H N   
2455 C CA  . ASN B 161 ? 0.3143 0.3662 0.4236 0.0985  -0.0391 -0.0604 161 ASN H CA  
2456 C C   . ASN B 161 ? 0.3372 0.3594 0.4254 0.0984  -0.0400 -0.0625 161 ASN H C   
2457 O O   . ASN B 161 ? 0.3552 0.3769 0.4399 0.1127  -0.0388 -0.0739 161 ASN H O   
2458 C CB  . ASN B 161 ? 0.3142 0.4008 0.4421 0.1145  -0.0339 -0.0721 161 ASN H CB  
2459 C CG  . ASN B 161 ? 0.3077 0.4208 0.4566 0.1151  -0.0369 -0.0697 161 ASN H CG  
2460 O OD1 . ASN B 161 ? 0.3096 0.4089 0.4563 0.1072  -0.0457 -0.0606 161 ASN H OD1 
2461 N ND2 . ASN B 161 ? 0.2923 0.4452 0.4615 0.1250  -0.0304 -0.0780 161 ASN H ND2 
2462 N N   . SER B 162 ? 0.3430 0.3441 0.4176 0.0828  -0.0416 -0.0523 162 SER H N   
2463 C CA  . SER B 162 ? 0.3669 0.3382 0.4211 0.0784  -0.0447 -0.0513 162 SER H CA  
2464 C C   . SER B 162 ? 0.3788 0.3618 0.4296 0.0808  -0.0327 -0.0597 162 SER H C   
2465 O O   . SER B 162 ? 0.3870 0.3474 0.4226 0.0861  -0.0372 -0.0651 162 SER H O   
2466 C CB  . SER B 162 ? 0.3939 0.3316 0.4364 0.0889  -0.0609 -0.0540 162 SER H CB  
2467 O OG  . SER B 162 ? 0.4109 0.3383 0.4556 0.0872  -0.0726 -0.0457 162 SER H OG  
2468 N N   . GLY B 163 ? 0.3565 0.3722 0.4192 0.0762  -0.0188 -0.0603 163 GLY H N   
2469 C CA  . GLY B 163 ? 0.3551 0.3842 0.4130 0.0747  -0.0062 -0.0653 163 GLY H CA  
2470 C C   . GLY B 163 ? 0.3669 0.4230 0.4347 0.0904  0.0003  -0.0777 163 GLY H C   
2471 O O   . GLY B 163 ? 0.3896 0.4620 0.4539 0.0886  0.0119  -0.0813 163 GLY H O   
2472 N N   . ALA B 164 ? 0.3670 0.4291 0.4463 0.1056  -0.0068 -0.0838 164 ALA H N   
2473 C CA  . ALA B 164 ? 0.3865 0.4795 0.4780 0.1237  -0.0012 -0.0968 164 ALA H CA  
2474 C C   . ALA B 164 ? 0.3762 0.5163 0.4888 0.1150  0.0123  -0.0936 164 ALA H C   
2475 O O   . ALA B 164 ? 0.3956 0.5702 0.5183 0.1258  0.0213  -0.1030 164 ALA H O   
2476 C CB  . ALA B 164 ? 0.3990 0.4826 0.4969 0.1428  -0.0152 -0.1033 164 ALA H CB  
2477 N N   . LEU B 165 ? 0.3498 0.4927 0.4693 0.0970  0.0126  -0.0814 165 LEU H N   
2478 C CA  . LEU B 165 ? 0.3173 0.5006 0.4561 0.0861  0.0228  -0.0772 165 LEU H CA  
2479 C C   . LEU B 165 ? 0.3063 0.4837 0.4345 0.0647  0.0309  -0.0672 165 LEU H C   
2480 O O   . LEU B 165 ? 0.3008 0.4517 0.4203 0.0540  0.0246  -0.0586 165 LEU H O   
2481 C CB  . LEU B 165 ? 0.3096 0.4993 0.4649 0.0854  0.0136  -0.0728 165 LEU H CB  
2482 C CG  . LEU B 165 ? 0.2884 0.5148 0.4632 0.0717  0.0206  -0.0673 165 LEU H CG  
2483 C CD1 . LEU B 165 ? 0.3012 0.5738 0.4919 0.0779  0.0320  -0.0748 165 LEU H CD1 
2484 C CD2 . LEU B 165 ? 0.2862 0.5145 0.4745 0.0724  0.0092  -0.0640 165 LEU H CD2 
2485 N N   . THR B 166 ? 0.2942 0.4947 0.4213 0.0596  0.0439  -0.0686 166 THR H N   
2486 C CA  . THR B 166 ? 0.2869 0.4808 0.4017 0.0406  0.0512  -0.0595 166 THR H CA  
2487 C C   . THR B 166 ? 0.2767 0.5087 0.4055 0.0276  0.0615  -0.0549 166 THR H C   
2488 O O   . THR B 166 ? 0.2870 0.5104 0.4105 0.0096  0.0626  -0.0448 166 THR H O   
2489 C CB  . THR B 166 ? 0.3091 0.4865 0.4022 0.0447  0.0553  -0.0638 166 THR H CB  
2490 O OG1 . THR B 166 ? 0.3167 0.5210 0.4149 0.0599  0.0618  -0.0753 166 THR H OG1 
2491 C CG2 . THR B 166 ? 0.3197 0.4557 0.3972 0.0512  0.0437  -0.0651 166 THR H CG2 
2492 N N   . SER B 167 ? 0.2807 0.5532 0.4260 0.0362  0.0683  -0.0618 167 SER H N   
2493 C CA  A SER B 167 ? 0.2746 0.5901 0.4349 0.0223  0.0788  -0.0568 167 SER H CA  
2494 C CA  B SER B 167 ? 0.2722 0.5868 0.4320 0.0217  0.0788  -0.0565 167 SER H CA  
2495 C C   . SER B 167 ? 0.2586 0.5765 0.4338 0.0082  0.0717  -0.0481 167 SER H C   
2496 O O   . SER B 167 ? 0.2510 0.5659 0.4379 0.0187  0.0619  -0.0517 167 SER H O   
2497 C CB  A SER B 167 ? 0.2841 0.6455 0.4608 0.0374  0.0865  -0.0674 167 SER H CB  
2498 C CB  B SER B 167 ? 0.2790 0.6398 0.4539 0.0356  0.0875  -0.0666 167 SER H CB  
2499 O OG  A SER B 167 ? 0.2884 0.6946 0.4779 0.0217  0.0982  -0.0614 167 SER H OG  
2500 O OG  B SER B 167 ? 0.2910 0.6527 0.4481 0.0416  0.0969  -0.0721 167 SER H OG  
2501 N N   . GLY B 168 ? 0.2597 0.5782 0.4317 -0.0143 0.0750  -0.0370 168 GLY H N   
2502 C CA  . GLY B 168 ? 0.2531 0.5749 0.4378 -0.0293 0.0680  -0.0292 168 GLY H CA  
2503 C C   . GLY B 168 ? 0.2396 0.5172 0.4127 -0.0304 0.0556  -0.0260 168 GLY H C   
2504 O O   . GLY B 168 ? 0.2377 0.5144 0.4194 -0.0399 0.0480  -0.0214 168 GLY H O   
2505 N N   . VAL B 169 ? 0.2289 0.4720 0.3826 -0.0219 0.0531  -0.0280 169 VAL H N   
2506 C CA  . VAL B 169 ? 0.2161 0.4220 0.3586 -0.0233 0.0425  -0.0245 169 VAL H CA  
2507 C C   . VAL B 169 ? 0.2176 0.4050 0.3462 -0.0409 0.0428  -0.0157 169 VAL H C   
2508 O O   . VAL B 169 ? 0.2297 0.4149 0.3465 -0.0470 0.0501  -0.0130 169 VAL H O   
2509 C CB  . VAL B 169 ? 0.2227 0.4018 0.3510 -0.0088 0.0390  -0.0292 169 VAL H CB  
2510 C CG1 . VAL B 169 ? 0.2193 0.3640 0.3337 -0.0125 0.0306  -0.0242 169 VAL H CG1 
2511 C CG2 . VAL B 169 ? 0.2202 0.4096 0.3600 0.0091  0.0350  -0.0377 169 VAL H CG2 
2512 N N   . HIS B 170 ? 0.2084 0.3810 0.3366 -0.0481 0.0341  -0.0117 170 HIS H N   
2513 C CA  . HIS B 170 ? 0.2056 0.3516 0.3170 -0.0603 0.0311  -0.0051 170 HIS H CA  
2514 C C   . HIS B 170 ? 0.2036 0.3235 0.3065 -0.0534 0.0218  -0.0062 170 HIS H C   
2515 O O   . HIS B 170 ? 0.1895 0.3136 0.3020 -0.0520 0.0146  -0.0074 170 HIS H O   
2516 C CB  . HIS B 170 ? 0.2116 0.3662 0.3288 -0.0781 0.0290  0.0006  170 HIS H CB  
2517 C CG  . HIS B 170 ? 0.2180 0.4000 0.3422 -0.0891 0.0383  0.0042  170 HIS H CG  
2518 N ND1 . HIS B 170 ? 0.2246 0.3993 0.3333 -0.0951 0.0455  0.0085  170 HIS H ND1 
2519 C CD2 . HIS B 170 ? 0.2119 0.4307 0.3565 -0.0965 0.0414  0.0051  170 HIS H CD2 
2520 C CE1 . HIS B 170 ? 0.2338 0.4401 0.3521 -0.1064 0.0534  0.0122  170 HIS H CE1 
2521 N NE2 . HIS B 170 ? 0.2221 0.4575 0.3635 -0.1074 0.0514  0.0101  170 HIS H NE2 
2522 N N   . THR B 171 ? 0.2064 0.3030 0.2921 -0.0497 0.0220  -0.0054 171 THR H N   
2523 C CA  . THR B 171 ? 0.2032 0.2776 0.2789 -0.0449 0.0144  -0.0052 171 THR H CA  
2524 C C   . THR B 171 ? 0.2073 0.2629 0.2693 -0.0536 0.0117  -0.0013 171 THR H C   
2525 O O   . THR B 171 ? 0.2160 0.2634 0.2673 -0.0575 0.0159  0.0013  171 THR H O   
2526 C CB  . THR B 171 ? 0.2098 0.2752 0.2783 -0.0343 0.0153  -0.0072 171 THR H CB  
2527 O OG1 . THR B 171 ? 0.2191 0.2990 0.3001 -0.0261 0.0154  -0.0114 171 THR H OG1 
2528 C CG2 . THR B 171 ? 0.2148 0.2628 0.2733 -0.0310 0.0089  -0.0057 171 THR H CG2 
2529 N N   . PHE B 172 ? 0.1949 0.2435 0.2565 -0.0566 0.0041  -0.0012 172 PHE H N   
2530 C CA  . PHE B 172 ? 0.2126 0.2413 0.2612 -0.0645 -0.0007 0.0012  172 PHE H CA  
2531 C C   . PHE B 172 ? 0.2288 0.2377 0.2612 -0.0562 -0.0028 0.0005  172 PHE H C   
2532 O O   . PHE B 172 ? 0.2183 0.2300 0.2513 -0.0465 -0.0030 -0.0015 172 PHE H O   
2533 C CB  . PHE B 172 ? 0.2103 0.2382 0.2634 -0.0694 -0.0095 -0.0001 172 PHE H CB  
2534 C CG  . PHE B 172 ? 0.2169 0.2642 0.2851 -0.0816 -0.0085 0.0020  172 PHE H CG  
2535 C CD1 . PHE B 172 ? 0.2320 0.2729 0.2955 -0.0964 -0.0090 0.0071  172 PHE H CD1 
2536 C CD2 . PHE B 172 ? 0.2052 0.2791 0.2928 -0.0783 -0.0069 -0.0001 172 PHE H CD2 
2537 C CE1 . PHE B 172 ? 0.2383 0.3021 0.3170 -0.1099 -0.0074 0.0105  172 PHE H CE1 
2538 C CE2 . PHE B 172 ? 0.2055 0.3037 0.3095 -0.0891 -0.0053 0.0018  172 PHE H CE2 
2539 C CZ  . PHE B 172 ? 0.2226 0.3177 0.3228 -0.1058 -0.0050 0.0074  172 PHE H CZ  
2540 N N   . PRO B 173 ? 0.2605 0.2500 0.2783 -0.0601 -0.0049 0.0028  173 PRO H N   
2541 C CA  . PRO B 173 ? 0.2842 0.2565 0.2874 -0.0514 -0.0089 0.0013  173 PRO H CA  
2542 C C   . PRO B 173 ? 0.2911 0.2615 0.2935 -0.0447 -0.0159 -0.0033 173 PRO H C   
2543 O O   . PRO B 173 ? 0.2876 0.2573 0.2936 -0.0498 -0.0213 -0.0048 173 PRO H O   
2544 C CB  . PRO B 173 ? 0.3064 0.2565 0.2948 -0.0579 -0.0126 0.0045  173 PRO H CB  
2545 C CG  . PRO B 173 ? 0.3103 0.2698 0.3048 -0.0708 -0.0067 0.0097  173 PRO H CG  
2546 C CD  . PRO B 173 ? 0.2885 0.2723 0.3024 -0.0732 -0.0042 0.0077  173 PRO H CD  
2547 N N   . ALA B 174 ? 0.2907 0.2624 0.2882 -0.0341 -0.0158 -0.0051 174 ALA H N   
2548 C CA  . ALA B 174 ? 0.3154 0.2878 0.3091 -0.0266 -0.0214 -0.0094 174 ALA H CA  
2549 C C   . ALA B 174 ? 0.3434 0.2949 0.3235 -0.0258 -0.0296 -0.0131 174 ALA H C   
2550 O O   . ALA B 174 ? 0.3503 0.2851 0.3207 -0.0273 -0.0309 -0.0118 174 ALA H O   
2551 C CB  . ALA B 174 ? 0.3079 0.2890 0.2986 -0.0172 -0.0187 -0.0092 174 ALA H CB  
2552 N N   . VAL B 175 ? 0.3475 0.2980 0.3253 -0.0233 -0.0360 -0.0178 175 VAL H N   
2553 C CA  . VAL B 175 ? 0.3895 0.3191 0.3514 -0.0185 -0.0458 -0.0241 175 VAL H CA  
2554 C C   . VAL B 175 ? 0.3587 0.2979 0.3136 -0.0041 -0.0465 -0.0295 175 VAL H C   
2555 O O   . VAL B 175 ? 0.3329 0.2926 0.2960 -0.0031 -0.0431 -0.0284 175 VAL H O   
2556 C CB  . VAL B 175 ? 0.4423 0.3621 0.4050 -0.0283 -0.0541 -0.0261 175 VAL H CB  
2557 C CG1 . VAL B 175 ? 0.4551 0.3740 0.4278 -0.0444 -0.0517 -0.0192 175 VAL H CG1 
2558 C CG2 . VAL B 175 ? 0.4642 0.4018 0.4349 -0.0267 -0.0553 -0.0286 175 VAL H CG2 
2559 N N   . LEU B 176 ? 0.3664 0.2925 0.3062 0.0067  -0.0507 -0.0348 176 LEU H N   
2560 C CA  . LEU B 176 ? 0.3755 0.3124 0.3063 0.0219  -0.0518 -0.0415 176 LEU H CA  
2561 C C   . LEU B 176 ? 0.3845 0.3120 0.3063 0.0239  -0.0607 -0.0492 176 LEU H C   
2562 O O   . LEU B 176 ? 0.3946 0.2941 0.3052 0.0227  -0.0706 -0.0541 176 LEU H O   
2563 C CB  . LEU B 176 ? 0.3996 0.3275 0.3186 0.0346  -0.0535 -0.0453 176 LEU H CB  
2564 C CG  . LEU B 176 ? 0.4262 0.3721 0.3373 0.0520  -0.0531 -0.0524 176 LEU H CG  
2565 C CD1 . LEU B 176 ? 0.3975 0.3790 0.3211 0.0503  -0.0430 -0.0460 176 LEU H CD1 
2566 C CD2 . LEU B 176 ? 0.4537 0.3910 0.3547 0.0658  -0.0559 -0.0567 176 LEU H CD2 
2567 N N   . GLN B 177 ? 0.3691 0.3178 0.2939 0.0265  -0.0586 -0.0501 177 GLN H N   
2568 C CA  . GLN B 177 ? 0.3869 0.3303 0.3009 0.0303  -0.0671 -0.0583 177 GLN H CA  
2569 C C   . GLN B 177 ? 0.4154 0.3549 0.3097 0.0488  -0.0715 -0.0694 177 GLN H C   
2570 O O   . GLN B 177 ? 0.3921 0.3448 0.2848 0.0595  -0.0655 -0.0695 177 GLN H O   
2571 C CB  . GLN B 177 ? 0.3816 0.3501 0.3050 0.0262  -0.0634 -0.0539 177 GLN H CB  
2572 C CG  . GLN B 177 ? 0.3791 0.3509 0.3216 0.0108  -0.0610 -0.0452 177 GLN H CG  
2573 C CD  . GLN B 177 ? 0.3808 0.3761 0.3330 0.0084  -0.0571 -0.0394 177 GLN H CD  
2574 O OE1 . GLN B 177 ? 0.4121 0.4094 0.3709 0.0018  -0.0619 -0.0387 177 GLN H OE1 
2575 N NE2 . GLN B 177 ? 0.3397 0.3524 0.2939 0.0124  -0.0494 -0.0342 177 GLN H NE2 
2576 N N   . SER B 178 ? 0.4473 0.3724 0.3270 0.0534  -0.0817 -0.0792 178 SER H N   
2577 C CA  . SER B 178 ? 0.4888 0.4107 0.3472 0.0736  -0.0869 -0.0925 178 SER H CA  
2578 C C   . SER B 178 ? 0.4750 0.4373 0.3352 0.0840  -0.0760 -0.0912 178 SER H C   
2579 O O   . SER B 178 ? 0.4760 0.4470 0.3247 0.1020  -0.0751 -0.0994 178 SER H O   
2580 C CB  . SER B 178 ? 0.5143 0.4142 0.3562 0.0754  -0.1003 -0.1034 178 SER H CB  
2581 O OG  . SER B 178 ? 0.5140 0.4378 0.3582 0.0727  -0.0979 -0.1023 178 SER H OG  
2582 N N   . SER B 179 ? 0.4485 0.4359 0.3231 0.0729  -0.0683 -0.0807 179 SER H N   
2583 C CA  . SER B 179 ? 0.4260 0.4520 0.3038 0.0773  -0.0581 -0.0755 179 SER H CA  
2584 C C   . SER B 179 ? 0.3998 0.4409 0.2867 0.0802  -0.0494 -0.0698 179 SER H C   
2585 O O   . SER B 179 ? 0.4032 0.4766 0.2915 0.0839  -0.0418 -0.0659 179 SER H O   
2586 C CB  . SER B 179 ? 0.4049 0.4447 0.2945 0.0630  -0.0551 -0.0648 179 SER H CB  
2587 O OG  . SER B 179 ? 0.3830 0.4137 0.2906 0.0495  -0.0524 -0.0553 179 SER H OG  
2588 N N   . GLY B 180 ? 0.3783 0.3988 0.2714 0.0767  -0.0504 -0.0678 180 GLY H N   
2589 C CA  . GLY B 180 ? 0.3477 0.3817 0.2511 0.0765  -0.0428 -0.0608 180 GLY H CA  
2590 C C   . GLY B 180 ? 0.3236 0.3721 0.2445 0.0605  -0.0353 -0.0470 180 GLY H C   
2591 O O   . GLY B 180 ? 0.3148 0.3780 0.2439 0.0591  -0.0292 -0.0405 180 GLY H O   
2592 N N   . LEU B 181 ? 0.3020 0.3445 0.2284 0.0490  -0.0370 -0.0430 181 LEU H N   
2593 C CA  . LEU B 181 ? 0.2701 0.3182 0.2123 0.0350  -0.0325 -0.0316 181 LEU H CA  
2594 C C   . LEU B 181 ? 0.2681 0.2920 0.2179 0.0259  -0.0351 -0.0308 181 LEU H C   
2595 O O   . LEU B 181 ? 0.2869 0.2913 0.2306 0.0258  -0.0422 -0.0372 181 LEU H O   
2596 C CB  . LEU B 181 ? 0.2603 0.3222 0.2033 0.0305  -0.0332 -0.0278 181 LEU H CB  
2597 C CG  . LEU B 181 ? 0.2669 0.3563 0.2013 0.0370  -0.0300 -0.0268 181 LEU H CG  
2598 C CD1 . LEU B 181 ? 0.2702 0.3680 0.2007 0.0330  -0.0330 -0.0239 181 LEU H CD1 
2599 C CD2 . LEU B 181 ? 0.2577 0.3661 0.2004 0.0326  -0.0229 -0.0170 181 LEU H CD2 
2600 N N   . TYR B 182 ? 0.2441 0.2700 0.2059 0.0178  -0.0301 -0.0231 182 TYR H N   
2601 C CA  . TYR B 182 ? 0.2419 0.2521 0.2124 0.0085  -0.0303 -0.0210 182 TYR H CA  
2602 C C   . TYR B 182 ? 0.2313 0.2456 0.2119 0.0008  -0.0318 -0.0182 182 TYR H C   
2603 O O   . TYR B 182 ? 0.2315 0.2596 0.2140 0.0013  -0.0318 -0.0153 182 TYR H O   
2604 C CB  . TYR B 182 ? 0.2349 0.2468 0.2122 0.0050  -0.0242 -0.0151 182 TYR H CB  
2605 C CG  . TYR B 182 ? 0.2702 0.2761 0.2389 0.0120  -0.0240 -0.0176 182 TYR H CG  
2606 C CD1 . TYR B 182 ? 0.2973 0.2813 0.2599 0.0113  -0.0274 -0.0205 182 TYR H CD1 
2607 C CD2 . TYR B 182 ? 0.2660 0.2889 0.2318 0.0193  -0.0214 -0.0168 182 TYR H CD2 
2608 C CE1 . TYR B 182 ? 0.3180 0.2944 0.2715 0.0192  -0.0288 -0.0226 182 TYR H CE1 
2609 C CE2 . TYR B 182 ? 0.2876 0.3075 0.2464 0.0277  -0.0221 -0.0197 182 TYR H CE2 
2610 C CZ  . TYR B 182 ? 0.3113 0.3063 0.2633 0.0287  -0.0263 -0.0230 182 TYR H CZ  
2611 O OH  . TYR B 182 ? 0.3372 0.3275 0.2817 0.0380  -0.0284 -0.0255 182 TYR H OH  
2612 N N   . SER B 183 ? 0.2382 0.2414 0.2253 -0.0064 -0.0334 -0.0186 183 SER H N   
2613 C CA  A SER B 183 ? 0.2323 0.2418 0.2326 -0.0135 -0.0348 -0.0164 183 SER H CA  
2614 C CA  B SER B 183 ? 0.2436 0.2528 0.2438 -0.0136 -0.0349 -0.0165 183 SER H CA  
2615 C C   . SER B 183 ? 0.2350 0.2400 0.2452 -0.0216 -0.0314 -0.0142 183 SER H C   
2616 O O   . SER B 183 ? 0.2364 0.2271 0.2399 -0.0242 -0.0320 -0.0155 183 SER H O   
2617 C CB  A SER B 183 ? 0.2408 0.2470 0.2371 -0.0141 -0.0432 -0.0213 183 SER H CB  
2618 C CB  B SER B 183 ? 0.2647 0.2700 0.2612 -0.0145 -0.0432 -0.0213 183 SER H CB  
2619 O OG  A SER B 183 ? 0.2218 0.2381 0.2318 -0.0195 -0.0454 -0.0190 183 SER H OG  
2620 O OG  B SER B 183 ? 0.2814 0.2978 0.2733 -0.0091 -0.0454 -0.0214 183 SER H OG  
2621 N N   . LEU B 184 ? 0.2308 0.2476 0.2552 -0.0248 -0.0283 -0.0109 184 LEU H N   
2622 C CA  . LEU B 184 ? 0.2410 0.2598 0.2761 -0.0325 -0.0249 -0.0097 184 LEU H CA  
2623 C C   . LEU B 184 ? 0.2226 0.2578 0.2742 -0.0339 -0.0256 -0.0092 184 LEU H C   
2624 O O   . LEU B 184 ? 0.2142 0.2554 0.2675 -0.0282 -0.0281 -0.0086 184 LEU H O   
2625 C CB  . LEU B 184 ? 0.2447 0.2608 0.2778 -0.0320 -0.0173 -0.0071 184 LEU H CB  
2626 C CG  . LEU B 184 ? 0.2409 0.2644 0.2774 -0.0266 -0.0134 -0.0049 184 LEU H CG  
2627 C CD1 . LEU B 184 ? 0.2359 0.2721 0.2873 -0.0269 -0.0116 -0.0049 184 LEU H CD1 
2628 C CD2 . LEU B 184 ? 0.2640 0.2805 0.2931 -0.0262 -0.0083 -0.0033 184 LEU H CD2 
2629 N N   . SER B 185 ? 0.2267 0.2699 0.2896 -0.0413 -0.0236 -0.0089 185 SER H N   
2630 C CA  . SER B 185 ? 0.2055 0.2690 0.2867 -0.0409 -0.0225 -0.0090 185 SER H CA  
2631 C C   . SER B 185 ? 0.1913 0.2620 0.2778 -0.0402 -0.0134 -0.0081 185 SER H C   
2632 O O   . SER B 185 ? 0.1986 0.2614 0.2775 -0.0457 -0.0085 -0.0065 185 SER H O   
2633 C CB  . SER B 185 ? 0.2412 0.3151 0.3332 -0.0497 -0.0274 -0.0098 185 SER H CB  
2634 O OG  . SER B 185 ? 0.2753 0.3480 0.3655 -0.0467 -0.0366 -0.0117 185 SER H OG  
2635 N N   . SER B 186 ? 0.1700 0.2553 0.2687 -0.0334 -0.0122 -0.0095 186 SER H N   
2636 C CA  . SER B 186 ? 0.1601 0.2590 0.2676 -0.0311 -0.0044 -0.0110 186 SER H CA  
2637 C C   . SER B 186 ? 0.1549 0.2802 0.2830 -0.0305 -0.0056 -0.0134 186 SER H C   
2638 O O   . SER B 186 ? 0.1537 0.2832 0.2886 -0.0233 -0.0129 -0.0149 186 SER H O   
2639 C CB  . SER B 186 ? 0.1636 0.2543 0.2655 -0.0203 -0.0033 -0.0122 186 SER H CB  
2640 O OG  . SER B 186 ? 0.1597 0.2593 0.2647 -0.0177 0.0045  -0.0148 186 SER H OG  
2641 N N   . VAL B 187 ? 0.1517 0.2958 0.2891 -0.0375 0.0010  -0.0133 187 VAL H N   
2642 C CA  . VAL B 187 ? 0.1443 0.3213 0.3044 -0.0371 0.0010  -0.0157 187 VAL H CA  
2643 C C   . VAL B 187 ? 0.1474 0.3465 0.3163 -0.0301 0.0107  -0.0195 187 VAL H C   
2644 O O   . VAL B 187 ? 0.1634 0.3545 0.3204 -0.0314 0.0188  -0.0188 187 VAL H O   
2645 C CB  . VAL B 187 ? 0.1508 0.3380 0.3174 -0.0544 -0.0010 -0.0118 187 VAL H CB  
2646 C CG1 . VAL B 187 ? 0.1525 0.3170 0.3090 -0.0582 -0.0119 -0.0105 187 VAL H CG1 
2647 C CG2 . VAL B 187 ? 0.1555 0.3398 0.3136 -0.0676 0.0071  -0.0073 187 VAL H CG2 
2648 N N   . VAL B 188 ? 0.1478 0.3795 0.3383 -0.0245 0.0105  -0.0233 188 VAL H N   
2649 C CA  . VAL B 188 ? 0.1426 0.4027 0.3432 -0.0170 0.0206  -0.0282 188 VAL H CA  
2650 C C   . VAL B 188 ? 0.1385 0.4421 0.3660 -0.0194 0.0204  -0.0296 188 VAL H C   
2651 O O   . VAL B 188 ? 0.1306 0.4372 0.3682 -0.0182 0.0101  -0.0295 188 VAL H O   
2652 C CB  . VAL B 188 ? 0.1425 0.3900 0.3371 0.0038  0.0191  -0.0354 188 VAL H CB  
2653 C CG1 . VAL B 188 ? 0.1421 0.3863 0.3450 0.0167  0.0070  -0.0384 188 VAL H CG1 
2654 C CG2 . VAL B 188 ? 0.1540 0.4272 0.3547 0.0137  0.0294  -0.0424 188 VAL H CG2 
2655 N N   . THR B 189 ? 0.1483 0.4855 0.3858 -0.0239 0.0315  -0.0301 189 THR H N   
2656 C CA  . THR B 189 ? 0.1539 0.5423 0.4202 -0.0249 0.0332  -0.0320 189 THR H CA  
2657 C C   . THR B 189 ? 0.1666 0.5808 0.4432 -0.0015 0.0387  -0.0428 189 THR H C   
2658 O O   . THR B 189 ? 0.1788 0.5848 0.4412 0.0051  0.0474  -0.0462 189 THR H O   
2659 C CB  . THR B 189 ? 0.1601 0.5751 0.4328 -0.0490 0.0413  -0.0239 189 THR H CB  
2660 O OG1 . THR B 189 ? 0.1604 0.5702 0.4169 -0.0518 0.0535  -0.0226 189 THR H OG1 
2661 C CG2 . THR B 189 ? 0.1621 0.5530 0.4276 -0.0707 0.0323  -0.0147 189 THR H CG2 
2662 N N   . VAL B 190 ? 0.1783 0.6233 0.4785 0.0105  0.0329  -0.0483 190 VAL H N   
2663 C CA  . VAL B 190 ? 0.1905 0.6569 0.5014 0.0377  0.0340  -0.0605 190 VAL H CA  
2664 C C   . VAL B 190 ? 0.1959 0.7227 0.5405 0.0390  0.0349  -0.0630 190 VAL H C   
2665 O O   . VAL B 190 ? 0.1897 0.7307 0.5469 0.0203  0.0303  -0.0552 190 VAL H O   
2666 C CB  . VAL B 190 ? 0.1936 0.6193 0.4935 0.0570  0.0199  -0.0652 190 VAL H CB  
2667 C CG1 . VAL B 190 ? 0.1968 0.5677 0.4653 0.0536  0.0192  -0.0617 190 VAL H CG1 
2668 C CG2 . VAL B 190 ? 0.1902 0.6128 0.5008 0.0537  0.0055  -0.0611 190 VAL H CG2 
2669 N N   . PRO B 191 ? 0.2146 0.7787 0.5742 0.0613  0.0399  -0.0743 191 PRO H N   
2670 C CA  . PRO B 191 ? 0.2263 0.8508 0.6206 0.0668  0.0389  -0.0781 191 PRO H CA  
2671 C C   . PRO B 191 ? 0.2389 0.8526 0.6442 0.0732  0.0203  -0.0776 191 PRO H C   
2672 O O   . PRO B 191 ? 0.2486 0.8206 0.6397 0.0908  0.0088  -0.0818 191 PRO H O   
2673 C CB  . PRO B 191 ? 0.2356 0.8886 0.6365 0.0966  0.0458  -0.0931 191 PRO H CB  
2674 C CG  . PRO B 191 ? 0.2403 0.8599 0.6112 0.0962  0.0559  -0.0942 191 PRO H CG  
2675 C CD  . PRO B 191 ? 0.2324 0.7843 0.5767 0.0830  0.0461  -0.0850 191 PRO H CD  
2676 N N   . SER B 192 ? 0.2492 0.9013 0.6793 0.0577  0.0167  -0.0719 192 SER H N   
2677 C CA  . SER B 192 ? 0.2641 0.9109 0.7057 0.0617  -0.0014 -0.0709 192 SER H CA  
2678 C C   . SER B 192 ? 0.2807 0.9390 0.7341 0.0971  -0.0098 -0.0836 192 SER H C   
2679 O O   . SER B 192 ? 0.2824 0.9109 0.7311 0.1071  -0.0268 -0.0836 192 SER H O   
2680 C CB  . SER B 192 ? 0.2694 0.9620 0.7376 0.0389  -0.0035 -0.0636 192 SER H CB  
2681 O OG  . SER B 192 ? 0.2689 0.9544 0.7268 0.0070  0.0046  -0.0525 192 SER H OG  
2682 N N   . SER B 193 ? 0.3070 1.0076 0.7742 0.1155  0.0010  -0.0941 193 SER H N   
2683 C CA  . SER B 193 ? 0.3324 1.0460 0.8095 0.1529  -0.0054 -0.1089 193 SER H CA  
2684 C C   . SER B 193 ? 0.3554 0.9981 0.8000 0.1712  -0.0154 -0.1130 193 SER H C   
2685 O O   . SER B 193 ? 0.3785 1.0123 0.8266 0.1983  -0.0294 -0.1214 193 SER H O   
2686 C CB  . SER B 193 ? 0.3422 1.1114 0.8343 0.1662  0.0111  -0.1193 193 SER H CB  
2687 O OG  . SER B 193 ? 0.3492 1.0886 0.8134 0.1622  0.0240  -0.1199 193 SER H OG  
2688 N N   . SER B 194 ? 0.3560 0.9510 0.7703 0.1568  -0.0093 -0.1071 194 SER H N   
2689 C CA  . SER B 194 ? 0.3810 0.9101 0.7632 0.1696  -0.0170 -0.1096 194 SER H CA  
2690 C C   . SER B 194 ? 0.3915 0.8740 0.7615 0.1645  -0.0351 -0.1010 194 SER H C   
2691 O O   . SER B 194 ? 0.4154 0.8458 0.7610 0.1752  -0.0442 -0.1019 194 SER H O   
2692 C CB  . SER B 194 ? 0.3713 0.8734 0.7282 0.1551  -0.0036 -0.1060 194 SER H CB  
2693 O OG  . SER B 194 ? 0.3514 0.8245 0.6949 0.1268  -0.0041 -0.0921 194 SER H OG  
2694 N N   . LEU B 195 ? 0.3787 0.8780 0.7629 0.1474  -0.0405 -0.0925 195 LEU H N   
2695 C CA  . LEU B 195 ? 0.3854 0.8415 0.7541 0.1374  -0.0551 -0.0829 195 LEU H CA  
2696 C C   . LEU B 195 ? 0.4227 0.8605 0.7909 0.1622  -0.0739 -0.0872 195 LEU H C   
2697 O O   . LEU B 195 ? 0.4302 0.8176 0.7745 0.1609  -0.0847 -0.0813 195 LEU H O   
2698 C CB  . LEU B 195 ? 0.3622 0.8442 0.7461 0.1131  -0.0557 -0.0743 195 LEU H CB  
2699 C CG  . LEU B 195 ? 0.3465 0.8312 0.7239 0.0851  -0.0413 -0.0671 195 LEU H CG  
2700 C CD1 . LEU B 195 ? 0.3405 0.8350 0.7261 0.0618  -0.0474 -0.0586 195 LEU H CD1 
2701 C CD2 . LEU B 195 ? 0.3263 0.7570 0.6701 0.0793  -0.0368 -0.0633 195 LEU H CD2 
2702 N N   . GLY B 196 ? 0.4701 0.9484 0.8637 0.1838  -0.0785 -0.0967 196 GLY H N   
2703 C CA  . GLY B 196 ? 0.5194 0.9795 0.9122 0.2106  -0.0979 -0.1018 196 GLY H CA  
2704 C C   . GLY B 196 ? 0.5628 0.9711 0.9277 0.2281  -0.1019 -0.1069 196 GLY H C   
2705 O O   . GLY B 196 ? 0.5833 0.9453 0.9299 0.2364  -0.1195 -0.1030 196 GLY H O   
2706 N N   . THR B 197 ? 0.5604 0.9749 0.9203 0.2313  -0.0866 -0.1142 197 THR H N   
2707 C CA  . THR B 197 ? 0.5750 0.9575 0.9165 0.2551  -0.0894 -0.1249 197 THR H CA  
2708 C C   . THR B 197 ? 0.5417 0.8687 0.8493 0.2382  -0.0856 -0.1172 197 THR H C   
2709 O O   . THR B 197 ? 0.5739 0.8475 0.8583 0.2458  -0.1001 -0.1152 197 THR H O   
2710 C CB  . THR B 197 ? 0.5884 1.0237 0.9498 0.2735  -0.0761 -0.1403 197 THR H CB  
2711 O OG1 . THR B 197 ? 0.6583 1.0635 1.0038 0.3028  -0.0839 -0.1533 197 THR H OG1 
2712 C CG2 . THR B 197 ? 0.5639 1.0252 0.9256 0.2529  -0.0528 -0.1384 197 THR H CG2 
2713 N N   . GLN B 198 ? 0.4777 0.8167 0.7828 0.2147  -0.0680 -0.1118 198 GLN H N   
2714 C CA  . GLN B 198 ? 0.4489 0.7462 0.7253 0.2019  -0.0611 -0.1076 198 GLN H CA  
2715 C C   . GLN B 198 ? 0.4164 0.6720 0.6745 0.1811  -0.0690 -0.0927 198 GLN H C   
2716 O O   . GLN B 198 ? 0.4098 0.6825 0.6781 0.1636  -0.0679 -0.0841 198 GLN H O   
2717 C CB  . GLN B 198 ? 0.4304 0.7618 0.7128 0.1876  -0.0397 -0.1086 198 GLN H CB  
2718 C CG  . GLN B 198 ? 0.4339 0.7273 0.6886 0.1744  -0.0323 -0.1044 198 GLN H CG  
2719 C CD  . GLN B 198 ? 0.4617 0.7219 0.6971 0.1952  -0.0378 -0.1146 198 GLN H CD  
2720 O OE1 . GLN B 198 ? 0.4684 0.7515 0.7119 0.2175  -0.0353 -0.1284 198 GLN H OE1 
2721 N NE2 . GLN B 198 ? 0.4493 0.6559 0.6586 0.1881  -0.0459 -0.1080 198 GLN H NE2 
2722 N N   . THR B 199 ? 0.4040 0.6073 0.6351 0.1829  -0.0773 -0.0900 199 THR H N   
2723 C CA  . THR B 199 ? 0.3802 0.5452 0.5913 0.1633  -0.0830 -0.0759 199 THR H CA  
2724 C C   . THR B 199 ? 0.3384 0.5058 0.5418 0.1414  -0.0666 -0.0708 199 THR H C   
2725 O O   . THR B 199 ? 0.3256 0.4955 0.5239 0.1444  -0.0560 -0.0775 199 THR H O   
2726 C CB  . THR B 199 ? 0.4039 0.5161 0.5909 0.1721  -0.0990 -0.0736 199 THR H CB  
2727 O OG1 . THR B 199 ? 0.4211 0.5336 0.6167 0.1882  -0.1154 -0.0750 199 THR H OG1 
2728 C CG2 . THR B 199 ? 0.4090 0.4870 0.5746 0.1508  -0.1016 -0.0593 199 THR H CG2 
2729 N N   . TYR B 200 ? 0.3059 0.4735 0.5080 0.1212  -0.0651 -0.0603 200 TYR H N   
2730 C CA  . TYR B 200 ? 0.2857 0.4503 0.4782 0.1006  -0.0522 -0.0544 200 TYR H CA  
2731 C C   . TYR B 200 ? 0.2757 0.4033 0.4469 0.0884  -0.0589 -0.0437 200 TYR H C   
2732 O O   . TYR B 200 ? 0.2671 0.3923 0.4388 0.0831  -0.0674 -0.0373 200 TYR H O   
2733 C CB  . TYR B 200 ? 0.2634 0.4675 0.4752 0.0881  -0.0430 -0.0533 200 TYR H CB  
2734 C CG  . TYR B 200 ? 0.2574 0.5031 0.4897 0.0968  -0.0336 -0.0625 200 TYR H CG  
2735 C CD1 . TYR B 200 ? 0.2608 0.5110 0.4870 0.0966  -0.0207 -0.0669 200 TYR H CD1 
2736 C CD2 . TYR B 200 ? 0.2513 0.5347 0.5088 0.1054  -0.0374 -0.0669 200 TYR H CD2 
2737 C CE1 . TYR B 200 ? 0.2555 0.5480 0.4993 0.1043  -0.0107 -0.0751 200 TYR H CE1 
2738 C CE2 . TYR B 200 ? 0.2450 0.5730 0.5226 0.1132  -0.0276 -0.0751 200 TYR H CE2 
2739 C CZ  . TYR B 200 ? 0.2524 0.5854 0.5226 0.1126  -0.0136 -0.0793 200 TYR H CZ  
2740 O OH  . TYR B 200 ? 0.2511 0.6307 0.5389 0.1201  -0.0023 -0.0873 200 TYR H OH  
2741 N N   . ILE B 201 ? 0.2844 0.3854 0.4366 0.0846  -0.0556 -0.0421 201 ILE H N   
2742 C CA  . ILE B 201 ? 0.2902 0.3595 0.4218 0.0728  -0.0604 -0.0319 201 ILE H CA  
2743 C C   . ILE B 201 ? 0.2716 0.3393 0.3943 0.0589  -0.0480 -0.0295 201 ILE H C   
2744 O O   . ILE B 201 ? 0.2739 0.3414 0.3936 0.0620  -0.0405 -0.0350 201 ILE H O   
2745 C CB  . ILE B 201 ? 0.3285 0.3632 0.4445 0.0819  -0.0727 -0.0309 201 ILE H CB  
2746 C CG1 . ILE B 201 ? 0.3485 0.3809 0.4711 0.0954  -0.0874 -0.0318 201 ILE H CG1 
2747 C CG2 . ILE B 201 ? 0.3287 0.3368 0.4246 0.0676  -0.0754 -0.0200 201 ILE H CG2 
2748 C CD1 . ILE B 201 ? 0.3880 0.3845 0.4958 0.1065  -0.1016 -0.0320 201 ILE H CD1 
2749 N N   . CYS B 202 ? 0.2623 0.3284 0.3795 0.0450  -0.0465 -0.0219 202 CYS H N   
2750 C CA  . CYS B 202 ? 0.2527 0.3123 0.3588 0.0330  -0.0374 -0.0186 202 CYS H CA  
2751 C C   . CYS B 202 ? 0.2653 0.2972 0.3527 0.0298  -0.0431 -0.0121 202 CYS H C   
2752 O O   . CYS B 202 ? 0.2720 0.2944 0.3542 0.0288  -0.0527 -0.0060 202 CYS H O   
2753 C CB  . CYS B 202 ? 0.2491 0.3211 0.3580 0.0212  -0.0329 -0.0154 202 CYS H CB  
2754 S SG  . CYS B 202 ? 0.2578 0.3214 0.3590 0.0164  -0.0428 -0.0080 202 CYS H SG  
2755 N N   . ASN B 203 ? 0.2493 0.2707 0.3275 0.0280  -0.0381 -0.0133 203 ASN H N   
2756 C CA  . ASN B 203 ? 0.2659 0.2635 0.3274 0.0231  -0.0430 -0.0071 203 ASN H CA  
2757 C C   . ASN B 203 ? 0.2412 0.2425 0.2961 0.0115  -0.0357 -0.0024 203 ASN H C   
2758 O O   . ASN B 203 ? 0.2430 0.2496 0.2976 0.0094  -0.0268 -0.0059 203 ASN H O   
2759 C CB  . ASN B 203 ? 0.2799 0.2609 0.3344 0.0298  -0.0451 -0.0122 203 ASN H CB  
2760 C CG  . ASN B 203 ? 0.2838 0.2682 0.3475 0.0453  -0.0487 -0.0214 203 ASN H CG  
2761 O OD1 . ASN B 203 ? 0.2955 0.2934 0.3651 0.0512  -0.0404 -0.0298 203 ASN H OD1 
2762 N ND2 . ASN B 203 ? 0.2892 0.2634 0.3537 0.0521  -0.0609 -0.0196 203 ASN H ND2 
2763 N N   . VAL B 204 ? 0.2291 0.2295 0.2787 0.0050  -0.0394 0.0049  204 VAL H N   
2764 C CA  . VAL B 204 ? 0.2209 0.2280 0.2651 -0.0032 -0.0333 0.0082  204 VAL H CA  
2765 C C   . VAL B 204 ? 0.2278 0.2242 0.2596 -0.0092 -0.0362 0.0152  204 VAL H C   
2766 O O   . VAL B 204 ? 0.2233 0.2109 0.2497 -0.0110 -0.0446 0.0215  204 VAL H O   
2767 C CB  . VAL B 204 ? 0.2259 0.2442 0.2725 -0.0052 -0.0347 0.0101  204 VAL H CB  
2768 C CG1 . VAL B 204 ? 0.2204 0.2434 0.2592 -0.0109 -0.0300 0.0122  204 VAL H CG1 
2769 C CG2 . VAL B 204 ? 0.2237 0.2542 0.2837 -0.0018 -0.0328 0.0039  204 VAL H CG2 
2770 N N   . ASN B 205 ? 0.2191 0.2170 0.2465 -0.0130 -0.0300 0.0148  205 ASN H N   
2771 C CA  . ASN B 205 ? 0.2445 0.2380 0.2622 -0.0200 -0.0322 0.0217  205 ASN H CA  
2772 C C   . ASN B 205 ? 0.2303 0.2375 0.2457 -0.0230 -0.0261 0.0228  205 ASN H C   
2773 O O   . ASN B 205 ? 0.2588 0.2677 0.2754 -0.0212 -0.0199 0.0177  205 ASN H O   
2774 C CB  . ASN B 205 ? 0.2593 0.2388 0.2726 -0.0202 -0.0337 0.0200  205 ASN H CB  
2775 C CG  . ASN B 205 ? 0.2933 0.2675 0.2978 -0.0292 -0.0387 0.0281  205 ASN H CG  
2776 O OD1 . ASN B 205 ? 0.2883 0.2719 0.2903 -0.0355 -0.0406 0.0360  205 ASN H OD1 
2777 N ND2 . ASN B 205 ? 0.3174 0.2777 0.3166 -0.0304 -0.0414 0.0263  205 ASN H ND2 
2778 N N   . HIS B 206 ? 0.2179 0.2340 0.2287 -0.0273 -0.0284 0.0295  206 HIS H N   
2779 C CA  . HIS B 206 ? 0.1988 0.2297 0.2060 -0.0286 -0.0237 0.0305  206 HIS H CA  
2780 C C   . HIS B 206 ? 0.1999 0.2354 0.2022 -0.0362 -0.0261 0.0384  206 HIS H C   
2781 O O   . HIS B 206 ? 0.1952 0.2391 0.1940 -0.0417 -0.0296 0.0462  206 HIS H O   
2782 C CB  . HIS B 206 ? 0.1874 0.2305 0.1934 -0.0258 -0.0232 0.0299  206 HIS H CB  
2783 C CG  . HIS B 206 ? 0.1807 0.2382 0.1824 -0.0235 -0.0189 0.0283  206 HIS H CG  
2784 N ND1 . HIS B 206 ? 0.1816 0.2569 0.1780 -0.0249 -0.0192 0.0331  206 HIS H ND1 
2785 C CD2 . HIS B 206 ? 0.1875 0.2446 0.1888 -0.0189 -0.0148 0.0224  206 HIS H CD2 
2786 C CE1 . HIS B 206 ? 0.1865 0.2731 0.1802 -0.0194 -0.0152 0.0288  206 HIS H CE1 
2787 N NE2 . HIS B 206 ? 0.1870 0.2605 0.1831 -0.0154 -0.0133 0.0223  206 HIS H NE2 
2788 N N   . LYS B 207 ? 0.2076 0.2388 0.2094 -0.0375 -0.0245 0.0370  207 LYS H N   
2789 C CA  . LYS B 207 ? 0.2333 0.2671 0.2314 -0.0466 -0.0285 0.0447  207 LYS H CA  
2790 C C   . LYS B 207 ? 0.2217 0.2819 0.2189 -0.0502 -0.0264 0.0506  207 LYS H C   
2791 O O   . LYS B 207 ? 0.2357 0.3030 0.2307 -0.0602 -0.0307 0.0601  207 LYS H O   
2792 C CB  . LYS B 207 ? 0.2612 0.2852 0.2583 -0.0466 -0.0277 0.0408  207 LYS H CB  
2793 C CG  . LYS B 207 ? 0.3046 0.3045 0.3004 -0.0445 -0.0313 0.0364  207 LYS H CG  
2794 C CD  . LYS B 207 ? 0.3595 0.3498 0.3518 -0.0435 -0.0302 0.0314  207 LYS H CD  
2795 C CE  . LYS B 207 ? 0.4119 0.3815 0.4021 -0.0384 -0.0324 0.0247  207 LYS H CE  
2796 N NZ  . LYS B 207 ? 0.4680 0.4279 0.4512 -0.0393 -0.0331 0.0210  207 LYS H NZ  
2797 N N   . PRO B 208 ? 0.2159 0.2927 0.2142 -0.0426 -0.0203 0.0458  208 PRO H N   
2798 C CA  . PRO B 208 ? 0.2200 0.3259 0.2176 -0.0441 -0.0182 0.0505  208 PRO H CA  
2799 C C   . PRO B 208 ? 0.2146 0.3336 0.2090 -0.0493 -0.0201 0.0580  208 PRO H C   
2800 O O   . PRO B 208 ? 0.2034 0.3487 0.1969 -0.0551 -0.0192 0.0653  208 PRO H O   
2801 C CB  . PRO B 208 ? 0.2187 0.3316 0.2160 -0.0311 -0.0130 0.0408  208 PRO H CB  
2802 C CG  . PRO B 208 ? 0.2291 0.3183 0.2276 -0.0279 -0.0126 0.0345  208 PRO H CG  
2803 C CD  . PRO B 208 ? 0.2224 0.2919 0.2219 -0.0325 -0.0159 0.0359  208 PRO H CD  
2804 N N   . SER B 209 ? 0.1980 0.3010 0.1905 -0.0480 -0.0229 0.0570  209 SER H N   
2805 C CA  . SER B 209 ? 0.2042 0.3158 0.1914 -0.0534 -0.0261 0.0650  209 SER H CA  
2806 C C   . SER B 209 ? 0.2260 0.3173 0.2106 -0.0641 -0.0349 0.0743  209 SER H C   
2807 O O   . SER B 209 ? 0.2329 0.3265 0.2115 -0.0694 -0.0393 0.0822  209 SER H O   
2808 C CB  . SER B 209 ? 0.1968 0.3079 0.1819 -0.0440 -0.0247 0.0581  209 SER H CB  
2809 O OG  . SER B 209 ? 0.1828 0.2682 0.1720 -0.0402 -0.0279 0.0526  209 SER H OG  
2810 N N   . ASN B 210 ? 0.2451 0.3149 0.2322 -0.0665 -0.0385 0.0730  210 ASN H N   
2811 C CA  . ASN B 210 ? 0.2960 0.3386 0.2793 -0.0729 -0.0487 0.0785  210 ASN H CA  
2812 C C   . ASN B 210 ? 0.3002 0.3304 0.2831 -0.0657 -0.0522 0.0756  210 ASN H C   
2813 O O   . ASN B 210 ? 0.3206 0.3409 0.2970 -0.0721 -0.0608 0.0846  210 ASN H O   
2814 C CB  . ASN B 210 ? 0.3503 0.3976 0.3270 -0.0894 -0.0555 0.0934  210 ASN H CB  
2815 C CG  . ASN B 210 ? 0.3896 0.4508 0.3690 -0.0964 -0.0529 0.0954  210 ASN H CG  
2816 O OD1 . ASN B 210 ? 0.4897 0.5818 0.4697 -0.1033 -0.0491 0.1025  210 ASN H OD1 
2817 N ND2 . ASN B 210 ? 0.4037 0.4462 0.3853 -0.0936 -0.0544 0.0886  210 ASN H ND2 
2818 N N   . THR B 211 ? 0.2923 0.3245 0.2814 -0.0539 -0.0463 0.0645  211 THR H N   
2819 C CA  . THR B 211 ? 0.2923 0.3164 0.2837 -0.0465 -0.0494 0.0604  211 THR H CA  
2820 C C   . THR B 211 ? 0.2960 0.3007 0.2944 -0.0389 -0.0507 0.0518  211 THR H C   
2821 O O   . THR B 211 ? 0.2841 0.2923 0.2887 -0.0333 -0.0432 0.0427  211 THR H O   
2822 C CB  . THR B 211 ? 0.2789 0.3205 0.2721 -0.0399 -0.0431 0.0543  211 THR H CB  
2823 O OG1 . THR B 211 ? 0.2665 0.3288 0.2520 -0.0449 -0.0413 0.0611  211 THR H OG1 
2824 C CG2 . THR B 211 ? 0.2991 0.3339 0.2953 -0.0340 -0.0478 0.0509  211 THR H CG2 
2825 N N   . LYS B 212 ? 0.3066 0.2921 0.3033 -0.0380 -0.0603 0.0543  212 LYS H N   
2826 C CA  . LYS B 212 ? 0.3205 0.2913 0.3244 -0.0280 -0.0622 0.0450  212 LYS H CA  
2827 C C   . LYS B 212 ? 0.3118 0.2796 0.3190 -0.0215 -0.0690 0.0446  212 LYS H C   
2828 O O   . LYS B 212 ? 0.3094 0.2691 0.3082 -0.0263 -0.0785 0.0543  212 LYS H O   
2829 C CB  . LYS B 212 ? 0.3677 0.3145 0.3661 -0.0290 -0.0694 0.0456  212 LYS H CB  
2830 C CG  . LYS B 212 ? 0.4113 0.3587 0.4064 -0.0351 -0.0647 0.0453  212 LYS H CG  
2831 C CD  . LYS B 212 ? 0.4604 0.3827 0.4505 -0.0327 -0.0714 0.0415  212 LYS H CD  
2832 C CE  . LYS B 212 ? 0.5112 0.4105 0.4903 -0.0403 -0.0860 0.0513  212 LYS H CE  
2833 N NZ  . LYS B 212 ? 0.5771 0.4507 0.5476 -0.0418 -0.0936 0.0488  212 LYS H NZ  
2834 N N   . VAL B 213 ? 0.3022 0.2777 0.3212 -0.0121 -0.0645 0.0347  213 VAL H N   
2835 C CA  . VAL B 213 ? 0.3162 0.2945 0.3418 -0.0049 -0.0704 0.0328  213 VAL H CA  
2836 C C   . VAL B 213 ? 0.3165 0.2939 0.3545 0.0064  -0.0696 0.0222  213 VAL H C   
2837 O O   . VAL B 213 ? 0.2863 0.2732 0.3309 0.0076  -0.0598 0.0153  213 VAL H O   
2838 C CB  . VAL B 213 ? 0.3126 0.3106 0.3406 -0.0070 -0.0659 0.0324  213 VAL H CB  
2839 C CG1 . VAL B 213 ? 0.3153 0.3169 0.3501 -0.0005 -0.0733 0.0308  213 VAL H CG1 
2840 C CG2 . VAL B 213 ? 0.3165 0.3196 0.3313 -0.0164 -0.0657 0.0417  213 VAL H CG2 
2841 N N   . ASP B 214 ? 0.3581 0.3238 0.3977 0.0148  -0.0803 0.0217  214 ASP H N   
2842 C CA  . ASP B 214 ? 0.4051 0.3772 0.4592 0.0286  -0.0808 0.0112  214 ASP H CA  
2843 C C   . ASP B 214 ? 0.4256 0.4153 0.4896 0.0308  -0.0837 0.0115  214 ASP H C   
2844 O O   . ASP B 214 ? 0.5229 0.5052 0.5786 0.0278  -0.0934 0.0199  214 ASP H O   
2845 C CB  . ASP B 214 ? 0.4692 0.4168 0.5183 0.0388  -0.0920 0.0091  214 ASP H CB  
2846 C CG  . ASP B 214 ? 0.4907 0.4192 0.5286 0.0359  -0.0907 0.0081  214 ASP H CG  
2847 O OD1 . ASP B 214 ? 0.4672 0.4068 0.5066 0.0308  -0.0785 0.0048  214 ASP H OD1 
2848 O OD2 . ASP B 214 ? 0.5964 0.4969 0.6231 0.0387  -0.1031 0.0106  214 ASP H OD2 
2849 N N   . LYS B 215 ? 0.3523 0.3656 0.4314 0.0326  -0.0754 0.0042  215 LYS H N   
2850 C CA  . LYS B 215 ? 0.3263 0.3561 0.4154 0.0344  -0.0800 0.0039  215 LYS H CA  
2851 C C   . LYS B 215 ? 0.2954 0.3415 0.4041 0.0469  -0.0806 -0.0053 215 LYS H C   
2852 O O   . LYS B 215 ? 0.2609 0.3216 0.3792 0.0472  -0.0700 -0.0120 215 LYS H O   
2853 C CB  . LYS B 215 ? 0.3249 0.3691 0.4141 0.0236  -0.0723 0.0047  215 LYS H CB  
2854 C CG  . LYS B 215 ? 0.3340 0.3950 0.4327 0.0236  -0.0771 0.0034  215 LYS H CG  
2855 C CD  . LYS B 215 ? 0.3715 0.4256 0.4640 0.0268  -0.0904 0.0092  215 LYS H CD  
2856 C CE  . LYS B 215 ? 0.3815 0.4237 0.4534 0.0183  -0.0923 0.0180  215 LYS H CE  
2857 N NZ  . LYS B 215 ? 0.4174 0.4579 0.4837 0.0202  -0.1049 0.0235  215 LYS H NZ  
2858 N N   . LYS B 216 ? 0.2867 0.3303 0.3997 0.0571  -0.0931 -0.0051 216 LYS H N   
2859 C CA  . LYS B 216 ? 0.2912 0.3564 0.4253 0.0710  -0.0951 -0.0142 216 LYS H CA  
2860 C C   . LYS B 216 ? 0.2757 0.3710 0.4252 0.0643  -0.0915 -0.0154 216 LYS H C   
2861 O O   . LYS B 216 ? 0.2799 0.3720 0.4224 0.0569  -0.0975 -0.0091 216 LYS H O   
2862 C CB  . LYS B 216 ? 0.3128 0.3636 0.4458 0.0859  -0.1114 -0.0139 216 LYS H CB  
2863 C CG  . LYS B 216 ? 0.3125 0.3887 0.4684 0.1033  -0.1137 -0.0245 216 LYS H CG  
2864 C CD  . LYS B 216 ? 0.3440 0.4019 0.4972 0.1211  -0.1312 -0.0254 216 LYS H CD  
2865 C CE  . LYS B 216 ? 0.3493 0.4392 0.5280 0.1398  -0.1336 -0.0366 216 LYS H CE  
2866 N NZ  . LYS B 216 ? 0.3860 0.4545 0.5606 0.1598  -0.1524 -0.0382 216 LYS H NZ  
2867 N N   . VAL B 217 ? 0.2662 0.3898 0.4344 0.0657  -0.0821 -0.0230 217 VAL H N   
2868 C CA  . VAL B 217 ? 0.2526 0.4064 0.4371 0.0569  -0.0786 -0.0242 217 VAL H CA  
2869 C C   . VAL B 217 ? 0.2720 0.4555 0.4808 0.0700  -0.0836 -0.0308 217 VAL H C   
2870 O O   . VAL B 217 ? 0.2610 0.4596 0.4807 0.0794  -0.0768 -0.0380 217 VAL H O   
2871 C CB  . VAL B 217 ? 0.2357 0.3994 0.4214 0.0446  -0.0635 -0.0257 217 VAL H CB  
2872 C CG1 . VAL B 217 ? 0.2250 0.4124 0.4231 0.0319  -0.0620 -0.0252 217 VAL H CG1 
2873 C CG2 . VAL B 217 ? 0.2340 0.3687 0.3964 0.0359  -0.0588 -0.0206 217 VAL H CG2 
2874 N N   . GLU B 218 ? 0.2979 0.4905 0.5141 0.0716  -0.0953 -0.0288 218 GLU H N   
2875 C CA  . GLU B 218 ? 0.3479 0.5730 0.5895 0.0849  -0.1017 -0.0351 218 GLU H CA  
2876 C C   . GLU B 218 ? 0.3366 0.5904 0.5940 0.0735  -0.1048 -0.0337 218 GLU H C   
2877 O O   . GLU B 218 ? 0.3231 0.5638 0.5677 0.0592  -0.1072 -0.0280 218 GLU H O   
2878 C CB  . GLU B 218 ? 0.4072 0.6123 0.6426 0.1029  -0.1176 -0.0345 218 GLU H CB  
2879 C CG  . GLU B 218 ? 0.4497 0.6236 0.6628 0.0960  -0.1291 -0.0245 218 GLU H CG  
2880 C CD  . GLU B 218 ? 0.5045 0.6484 0.7045 0.1114  -0.1438 -0.0219 218 GLU H CD  
2881 O OE1 . GLU B 218 ? 0.5608 0.6712 0.7360 0.1044  -0.1486 -0.0128 218 GLU H OE1 
2882 O OE2 . GLU B 218 ? 0.5361 0.6907 0.7506 0.1305  -0.1507 -0.0289 218 GLU H OE2 
2883 N N   . PRO B 219 ? 0.3658 0.6615 0.6519 0.0799  -0.1056 -0.0396 219 PRO H N   
2884 C CA  . PRO B 219 ? 0.3673 0.6917 0.6700 0.0689  -0.1114 -0.0382 219 PRO H CA  
2885 C C   . PRO B 219 ? 0.3861 0.6890 0.6746 0.0661  -0.1273 -0.0323 219 PRO H C   
2886 O O   . PRO B 219 ? 0.4249 0.7031 0.7005 0.0800  -0.1370 -0.0305 219 PRO H O   
2887 C CB  . PRO B 219 ? 0.3756 0.7447 0.7099 0.0845  -0.1141 -0.0456 219 PRO H CB  
2888 C CG  . PRO B 219 ? 0.3787 0.7518 0.7147 0.0955  -0.1007 -0.0519 219 PRO H CG  
2889 C CD  . PRO B 219 ? 0.3758 0.6954 0.6795 0.0981  -0.1011 -0.0484 219 PRO H CD  
2890 N N   . GLY C 1   ? 0.7594 0.8060 0.6333 0.1355  -0.1711 -0.0985 0   GLY L N   
2891 C CA  . GLY C 1   ? 0.7348 0.7478 0.5971 0.1279  -0.1694 -0.0915 0   GLY L CA  
2892 C C   . GLY C 1   ? 0.6991 0.6994 0.5647 0.1051  -0.1547 -0.0738 0   GLY L C   
2893 O O   . GLY C 1   ? 0.7419 0.7150 0.5992 0.0974  -0.1554 -0.0673 0   GLY L O   
2894 N N   . ASP C 2   ? 0.6486 0.6696 0.5258 0.0955  -0.1423 -0.0670 1   ASP L N   
2895 C CA  . ASP C 2   ? 0.6102 0.6171 0.4894 0.0758  -0.1299 -0.0518 1   ASP L CA  
2896 C C   . ASP C 2   ? 0.5972 0.5558 0.4565 0.0720  -0.1352 -0.0483 1   ASP L C   
2897 O O   . ASP C 2   ? 0.6457 0.5864 0.4920 0.0835  -0.1473 -0.0568 1   ASP L O   
2898 C CB  . ASP C 2   ? 0.5870 0.6229 0.4799 0.0694  -0.1191 -0.0476 1   ASP L CB  
2899 C CG  . ASP C 2   ? 0.5779 0.6619 0.4895 0.0679  -0.1130 -0.0477 1   ASP L CG  
2900 O OD1 . ASP C 2   ? 0.5797 0.6767 0.4943 0.0736  -0.1176 -0.0526 1   ASP L OD1 
2901 O OD2 . ASP C 2   ? 0.5614 0.6697 0.4838 0.0603  -0.1043 -0.0425 1   ASP L OD2 
2902 N N   . ILE C 3   ? 0.5324 0.4719 0.3892 0.0562  -0.1272 -0.0367 2   ILE L N   
2903 C CA  . ILE C 3   ? 0.5138 0.4113 0.3517 0.0492  -0.1309 -0.0319 2   ILE L CA  
2904 C C   . ILE C 3   ? 0.4968 0.3940 0.3360 0.0438  -0.1255 -0.0286 2   ILE L C   
2905 O O   . ILE C 3   ? 0.4717 0.3940 0.3267 0.0373  -0.1139 -0.0240 2   ILE L O   
2906 C CB  . ILE C 3   ? 0.5025 0.3843 0.3368 0.0361  -0.1253 -0.0228 2   ILE L CB  
2907 C CG1 . ILE C 3   ? 0.5017 0.3828 0.3339 0.0426  -0.1319 -0.0268 2   ILE L CG1 
2908 C CG2 . ILE C 3   ? 0.5149 0.3601 0.3305 0.0265  -0.1275 -0.0171 2   ILE L CG2 
2909 C CD1 . ILE C 3   ? 0.5002 0.3654 0.3275 0.0312  -0.1276 -0.0189 2   ILE L CD1 
2910 N N   . VAL C 4   ? 0.5027 0.3711 0.3250 0.0464  -0.1352 -0.0311 3   VAL L N   
2911 C CA  . VAL C 4   ? 0.4815 0.3457 0.3027 0.0415  -0.1321 -0.0284 3   VAL L CA  
2912 C C   . VAL C 4   ? 0.4783 0.3136 0.2874 0.0254  -0.1290 -0.0185 3   VAL L C   
2913 O O   . VAL C 4   ? 0.5022 0.3068 0.2928 0.0231  -0.1384 -0.0175 3   VAL L O   
2914 C CB  . VAL C 4   ? 0.5087 0.3634 0.3198 0.0561  -0.1463 -0.0388 3   VAL L CB  
2915 C CG1 . VAL C 4   ? 0.5067 0.3525 0.3147 0.0498  -0.1441 -0.0353 3   VAL L CG1 
2916 C CG2 . VAL C 4   ? 0.5022 0.3923 0.3263 0.0728  -0.1486 -0.0500 3   VAL L CG2 
2917 N N   . MET C 5   ? 0.4521 0.2988 0.2712 0.0142  -0.1164 -0.0115 4   MET L N   
2918 C CA  . MET C 5   ? 0.4612 0.2882 0.2713 -0.0013 -0.1120 -0.0030 4   MET L CA  
2919 C C   . MET C 5   ? 0.4713 0.2882 0.2751 -0.0027 -0.1155 -0.0033 4   MET L C   
2920 O O   . MET C 5   ? 0.4643 0.3034 0.2820 0.0012  -0.1100 -0.0054 4   MET L O   
2921 C CB  . MET C 5   ? 0.4427 0.2901 0.2687 -0.0112 -0.0970 0.0033  4   MET L CB  
2922 C CG  . MET C 5   ? 0.4298 0.2904 0.2644 -0.0090 -0.0939 0.0032  4   MET L CG  
2923 S SD  . MET C 5   ? 0.4621 0.2940 0.2773 -0.0107 -0.1025 0.0038  4   MET L SD  
2924 C CE  . MET C 5   ? 0.4532 0.2678 0.2571 -0.0278 -0.0972 0.0117  4   MET L CE  
2925 N N   . THR C 6   ? 0.5016 0.2861 0.2843 -0.0085 -0.1254 -0.0012 5   THR L N   
2926 C CA  . THR C 6   ? 0.5180 0.2888 0.2923 -0.0124 -0.1301 -0.0003 5   THR L CA  
2927 C C   . THR C 6   ? 0.5216 0.2876 0.2929 -0.0315 -0.1212 0.0093  5   THR L C   
2928 O O   . THR C 6   ? 0.5375 0.2845 0.2940 -0.0419 -0.1242 0.0144  5   THR L O   
2929 C CB  . THR C 6   ? 0.5536 0.2907 0.3052 -0.0057 -0.1502 -0.0049 5   THR L CB  
2930 O OG1 . THR C 6   ? 0.5617 0.3092 0.3184 0.0137  -0.1575 -0.0156 5   THR L OG1 
2931 C CG2 . THR C 6   ? 0.5790 0.3025 0.3227 -0.0085 -0.1563 -0.0046 5   THR L CG2 
2932 N N   . GLN C 7   ? 0.4891 0.2739 0.2741 -0.0359 -0.1109 0.0112  6   GLN L N   
2933 C CA  . GLN C 7   ? 0.4978 0.2853 0.2833 -0.0527 -0.1014 0.0187  6   GLN L CA  
2934 C C   . GLN C 7   ? 0.5421 0.3133 0.3160 -0.0598 -0.1079 0.0208  6   GLN L C   
2935 O O   . GLN C 7   ? 0.5439 0.3194 0.3232 -0.0510 -0.1110 0.0163  6   GLN L O   
2936 C CB  . GLN C 7   ? 0.4840 0.3036 0.2931 -0.0519 -0.0866 0.0188  6   GLN L CB  
2937 C CG  . GLN C 7   ? 0.4861 0.3147 0.2992 -0.0659 -0.0761 0.0241  6   GLN L CG  
2938 C CD  . GLN C 7   ? 0.4370 0.2930 0.2713 -0.0638 -0.0643 0.0235  6   GLN L CD  
2939 O OE1 . GLN C 7   ? 0.4275 0.2955 0.2727 -0.0545 -0.0630 0.0209  6   GLN L OE1 
2940 N NE2 . GLN C 7   ? 0.4089 0.2750 0.2485 -0.0731 -0.0565 0.0258  6   GLN L NE2 
2941 N N   . THR C 8   ? 0.5645 0.3215 0.3244 -0.0763 -0.1087 0.0276  7   THR L N   
2942 C CA  . THR C 8   ? 0.5986 0.3410 0.3466 -0.0877 -0.1143 0.0316  7   THR L CA  
2943 C C   . THR C 8   ? 0.5927 0.3477 0.3420 -0.1065 -0.1033 0.0387  7   THR L C   
2944 O O   . THR C 8   ? 0.5801 0.3431 0.3297 -0.1124 -0.0966 0.0411  7   THR L O   
2945 C CB  . THR C 8   ? 0.6417 0.3447 0.3621 -0.0900 -0.1339 0.0331  7   THR L CB  
2946 O OG1 . THR C 8   ? 0.6406 0.3311 0.3474 -0.0976 -0.1363 0.0373  7   THR L OG1 
2947 C CG2 . THR C 8   ? 0.6530 0.3438 0.3710 -0.0698 -0.1471 0.0240  7   THR L CG2 
2948 N N   . PRO C 9   ? 0.5997 0.3589 0.3499 -0.1161 -0.1013 0.0414  8   PRO L N   
2949 C CA  . PRO C 9   ? 0.6150 0.3676 0.3669 -0.1083 -0.1082 0.0379  8   PRO L CA  
2950 C C   . PRO C 9   ? 0.6092 0.3902 0.3864 -0.0937 -0.0977 0.0316  8   PRO L C   
2951 O O   . PRO C 9   ? 0.6120 0.4130 0.4025 -0.0916 -0.0870 0.0310  8   PRO L O   
2952 C CB  . PRO C 9   ? 0.6082 0.3605 0.3543 -0.1265 -0.1072 0.0440  8   PRO L CB  
2953 C CG  . PRO C 9   ? 0.5951 0.3732 0.3502 -0.1385 -0.0923 0.0474  8   PRO L CG  
2954 C CD  . PRO C 9   ? 0.5899 0.3632 0.3400 -0.1349 -0.0923 0.0473  8   PRO L CD  
2955 N N   . LYS C 10  ? 0.6069 0.3892 0.3895 -0.0850 -0.1012 0.0275  9   LYS L N   
2956 C CA  . LYS C 10  ? 0.5872 0.3980 0.3928 -0.0742 -0.0910 0.0230  9   LYS L CA  
2957 C C   . LYS C 10  ? 0.5417 0.3732 0.3604 -0.0846 -0.0788 0.0262  9   LYS L C   
2958 O O   . LYS C 10  ? 0.4964 0.3520 0.3336 -0.0791 -0.0687 0.0242  9   LYS L O   
2959 C CB  . LYS C 10  ? 0.6400 0.4478 0.4465 -0.0610 -0.0988 0.0170  9   LYS L CB  
2960 C CG  . LYS C 10  ? 0.7196 0.5092 0.5139 -0.0473 -0.1129 0.0111  9   LYS L CG  
2961 C CD  . LYS C 10  ? 0.7458 0.5511 0.5497 -0.0357 -0.1091 0.0070  9   LYS L CD  
2962 C CE  . LYS C 10  ? 0.7617 0.5985 0.5860 -0.0253 -0.1004 0.0028  9   LYS L CE  
2963 N NZ  . LYS C 10  ? 0.7368 0.5904 0.5704 -0.0183 -0.0959 0.0009  9   LYS L NZ  
2964 N N   . PHE C 11  ? 0.5562 0.3792 0.3652 -0.0991 -0.0807 0.0307  10  PHE L N   
2965 C CA  . PHE C 11  ? 0.5710 0.4144 0.3917 -0.1086 -0.0709 0.0324  10  PHE L CA  
2966 C C   . PHE C 11  ? 0.5408 0.3792 0.3486 -0.1276 -0.0710 0.0385  10  PHE L C   
2967 O O   . PHE C 11  ? 0.5634 0.3754 0.3504 -0.1343 -0.0824 0.0422  10  PHE L O   
2968 C CB  . PHE C 11  ? 0.6376 0.4791 0.4604 -0.1072 -0.0748 0.0310  10  PHE L CB  
2969 C CG  . PHE C 11  ? 0.7296 0.5810 0.5655 -0.0904 -0.0738 0.0253  10  PHE L CG  
2970 C CD1 . PHE C 11  ? 0.7708 0.6464 0.6254 -0.0877 -0.0641 0.0236  10  PHE L CD1 
2971 C CD2 . PHE C 11  ? 0.8318 0.6697 0.6608 -0.0771 -0.0833 0.0211  10  PHE L CD2 
2972 C CE1 . PHE C 11  ? 0.7663 0.6520 0.6314 -0.0742 -0.0635 0.0193  10  PHE L CE1 
2973 C CE2 . PHE C 11  ? 0.8267 0.6787 0.6676 -0.0626 -0.0819 0.0158  10  PHE L CE2 
2974 C CZ  . PHE C 11  ? 0.8057 0.6813 0.6640 -0.0622 -0.0718 0.0156  10  PHE L CZ  
2975 N N   . LEU C 12  ? 0.5027 0.3664 0.3221 -0.1359 -0.0596 0.0390  11  LEU L N   
2976 C CA  . LEU C 12  ? 0.5244 0.3935 0.3343 -0.1555 -0.0574 0.0441  11  LEU L CA  
2977 C C   . LEU C 12  ? 0.4975 0.3941 0.3233 -0.1598 -0.0485 0.0419  11  LEU L C   
2978 O O   . LEU C 12  ? 0.4786 0.3963 0.3236 -0.1493 -0.0399 0.0365  11  LEU L O   
2979 C CB  . LEU C 12  ? 0.5407 0.4204 0.3497 -0.1592 -0.0509 0.0446  11  LEU L CB  
2980 C CG  . LEU C 12  ? 0.5782 0.4320 0.3662 -0.1633 -0.0598 0.0490  11  LEU L CG  
2981 C CD1 . LEU C 12  ? 0.5691 0.4388 0.3599 -0.1654 -0.0515 0.0483  11  LEU L CD1 
2982 C CD2 . LEU C 12  ? 0.6179 0.4510 0.3826 -0.1819 -0.0700 0.0568  11  LEU L CD2 
2983 N N   . LEU C 13  ? 0.4991 0.3944 0.3163 -0.1751 -0.0517 0.0461  12  LEU L N   
2984 C CA  . LEU C 13  ? 0.4916 0.4165 0.3222 -0.1824 -0.0431 0.0441  12  LEU L CA  
2985 C C   . LEU C 13  ? 0.4964 0.4388 0.3198 -0.2009 -0.0382 0.0475  12  LEU L C   
2986 O O   . LEU C 13  ? 0.5158 0.4400 0.3175 -0.2173 -0.0463 0.0555  12  LEU L O   
2987 C CB  . LEU C 13  ? 0.5161 0.4298 0.3429 -0.1869 -0.0505 0.0461  12  LEU L CB  
2988 C CG  . LEU C 13  ? 0.5182 0.4615 0.3593 -0.1935 -0.0430 0.0436  12  LEU L CG  
2989 C CD1 . LEU C 13  ? 0.4906 0.4558 0.3555 -0.1761 -0.0339 0.0352  12  LEU L CD1 
2990 C CD2 . LEU C 13  ? 0.5343 0.4628 0.3681 -0.2006 -0.0520 0.0470  12  LEU L CD2 
2991 N N   . VAL C 14  ? 0.4657 0.4421 0.3053 -0.1985 -0.0266 0.0417  13  VAL L N   
2992 C CA  . VAL C 14  ? 0.4706 0.4696 0.3047 -0.2134 -0.0207 0.0429  13  VAL L CA  
2993 C C   . VAL C 14  ? 0.4434 0.4850 0.2966 -0.2141 -0.0103 0.0353  13  VAL L C   
2994 O O   . VAL C 14  ? 0.4150 0.4673 0.2875 -0.1977 -0.0064 0.0275  13  VAL L O   
2995 C CB  . VAL C 14  ? 0.4717 0.4641 0.3018 -0.2059 -0.0192 0.0419  13  VAL L CB  
2996 C CG1 . VAL C 14  ? 0.4430 0.4468 0.2941 -0.1845 -0.0132 0.0329  13  VAL L CG1 
2997 C CG2 . VAL C 14  ? 0.4960 0.5084 0.3169 -0.2219 -0.0145 0.0440  13  VAL L CG2 
2998 N N   . SER C 15  ? 0.4533 0.5190 0.3003 -0.2333 -0.0068 0.0376  14  SER L N   
2999 C CA  . SER C 15  ? 0.4542 0.5662 0.3182 -0.2353 0.0027  0.0292  14  SER L CA  
3000 C C   . SER C 15  ? 0.4635 0.5991 0.3338 -0.2280 0.0103  0.0217  14  SER L C   
3001 O O   . SER C 15  ? 0.4813 0.6020 0.3365 -0.2327 0.0084  0.0268  14  SER L O   
3002 C CB  . SER C 15  ? 0.4887 0.6202 0.3431 -0.2603 0.0029  0.0348  14  SER L CB  
3003 O OG  . SER C 15  ? 0.4984 0.6034 0.3442 -0.2681 -0.0060 0.0425  14  SER L OG  
3004 N N   . ALA C 16  ? 0.4473 0.6182 0.3379 -0.2173 0.0174  0.0096  15  ALA L N   
3005 C CA  . ALA C 16  ? 0.4377 0.6334 0.3351 -0.2087 0.0234  0.0004  15  ALA L CA  
3006 C C   . ALA C 16  ? 0.4604 0.6738 0.3411 -0.2298 0.0265  0.0055  15  ALA L C   
3007 O O   . ALA C 16  ? 0.4829 0.7066 0.3551 -0.2499 0.0262  0.0119  15  ALA L O   
3008 C CB  . ALA C 16  ? 0.4284 0.6605 0.3485 -0.1956 0.0283  -0.0139 15  ALA L CB  
3009 N N   . GLY C 17  ? 0.4487 0.6637 0.3232 -0.2267 0.0286  0.0037  16  GLY L N   
3010 C CA  . GLY C 17  ? 0.4789 0.7114 0.3362 -0.2467 0.0316  0.0087  16  GLY L CA  
3011 C C   . GLY C 17  ? 0.5063 0.6960 0.3383 -0.2599 0.0237  0.0237  16  GLY L C   
3012 O O   . GLY C 17  ? 0.5274 0.7232 0.3440 -0.2720 0.0249  0.0277  16  GLY L O   
3013 N N   . ASP C 18  ? 0.5133 0.6616 0.3405 -0.2571 0.0151  0.0312  17  ASP L N   
3014 C CA  . ASP C 18  ? 0.5505 0.6547 0.3527 -0.2681 0.0049  0.0445  17  ASP L CA  
3015 C C   . ASP C 18  ? 0.5326 0.6079 0.3323 -0.2513 0.0016  0.0435  17  ASP L C   
3016 O O   . ASP C 18  ? 0.4959 0.5772 0.3139 -0.2304 0.0055  0.0341  17  ASP L O   
3017 C CB  . ASP C 18  ? 0.5808 0.6551 0.3784 -0.2714 -0.0042 0.0513  17  ASP L CB  
3018 C CG  . ASP C 18  ? 0.6122 0.7065 0.4047 -0.2939 -0.0041 0.0562  17  ASP L CG  
3019 O OD1 . ASP C 18  ? 0.6467 0.7735 0.4333 -0.3111 0.0016  0.0574  17  ASP L OD1 
3020 O OD2 . ASP C 18  ? 0.6542 0.7340 0.4493 -0.2937 -0.0095 0.0585  17  ASP L OD2 
3021 N N   . LYS C 19  ? 0.5543 0.5963 0.3305 -0.2611 -0.0070 0.0535  18  LYS L N   
3022 C CA  . LYS C 19  ? 0.5548 0.5674 0.3249 -0.2481 -0.0116 0.0539  18  LYS L CA  
3023 C C   . LYS C 19  ? 0.5324 0.5100 0.3067 -0.2324 -0.0199 0.0543  18  LYS L C   
3024 O O   . LYS C 19  ? 0.5274 0.4881 0.2951 -0.2392 -0.0270 0.0595  18  LYS L O   
3025 C CB  . LYS C 19  ? 0.6042 0.5950 0.3453 -0.2666 -0.0193 0.0648  18  LYS L CB  
3026 C CG  . LYS C 19  ? 0.6304 0.6021 0.3643 -0.2569 -0.0220 0.0643  18  LYS L CG  
3027 C CD  . LYS C 19  ? 0.6634 0.6414 0.3749 -0.2780 -0.0223 0.0714  18  LYS L CD  
3028 C CE  . LYS C 19  ? 0.7076 0.6643 0.4067 -0.2727 -0.0265 0.0728  18  LYS L CE  
3029 N NZ  . LYS C 19  ? 0.7418 0.6913 0.4117 -0.2979 -0.0319 0.0838  18  LYS L NZ  
3030 N N   . VAL C 20  ? 0.4926 0.4611 0.2767 -0.2126 -0.0193 0.0488  19  VAL L N   
3031 C CA  . VAL C 20  ? 0.4825 0.4196 0.2686 -0.1972 -0.0273 0.0489  19  VAL L CA  
3032 C C   . VAL C 20  ? 0.4961 0.4068 0.2666 -0.1948 -0.0342 0.0523  19  VAL L C   
3033 O O   . VAL C 20  ? 0.4755 0.3985 0.2492 -0.1908 -0.0287 0.0489  19  VAL L O   
3034 C CB  . VAL C 20  ? 0.4572 0.4092 0.2687 -0.1772 -0.0211 0.0400  19  VAL L CB  
3035 C CG1 . VAL C 20  ? 0.4467 0.3730 0.2603 -0.1613 -0.0278 0.0395  19  VAL L CG1 
3036 C CG2 . VAL C 20  ? 0.4402 0.4127 0.2661 -0.1781 -0.0166 0.0367  19  VAL L CG2 
3037 N N   . THR C 21  ? 0.5126 0.3880 0.2673 -0.1950 -0.0467 0.0575  20  THR L N   
3038 C CA  . THR C 21  ? 0.5325 0.3807 0.2731 -0.1897 -0.0550 0.0594  20  THR L CA  
3039 C C   . THR C 21  ? 0.5184 0.3455 0.2647 -0.1713 -0.0627 0.0559  20  THR L C   
3040 O O   . THR C 21  ? 0.5375 0.3467 0.2767 -0.1727 -0.0716 0.0579  20  THR L O   
3041 C CB  . THR C 21  ? 0.5736 0.3980 0.2847 -0.2089 -0.0654 0.0688  20  THR L CB  
3042 O OG1 . THR C 21  ? 0.5666 0.4169 0.2731 -0.2270 -0.0570 0.0719  20  THR L OG1 
3043 C CG2 . THR C 21  ? 0.6004 0.3969 0.2973 -0.2023 -0.0746 0.0699  20  THR L CG2 
3044 N N   . ILE C 22  ? 0.4887 0.3182 0.2457 -0.1556 -0.0603 0.0508  21  ILE L N   
3045 C CA  . ILE C 22  ? 0.4943 0.3122 0.2592 -0.1375 -0.0658 0.0464  21  ILE L CA  
3046 C C   . ILE C 22  ? 0.5176 0.3138 0.2699 -0.1316 -0.0744 0.0466  21  ILE L C   
3047 O O   . ILE C 22  ? 0.5189 0.3209 0.2691 -0.1343 -0.0702 0.0471  21  ILE L O   
3048 C CB  . ILE C 22  ? 0.4906 0.3354 0.2821 -0.1247 -0.0552 0.0402  21  ILE L CB  
3049 C CG1 . ILE C 22  ? 0.4784 0.3427 0.2811 -0.1302 -0.0483 0.0396  21  ILE L CG1 
3050 C CG2 . ILE C 22  ? 0.4771 0.3156 0.2771 -0.1076 -0.0599 0.0361  21  ILE L CG2 
3051 C CD1 . ILE C 22  ? 0.4579 0.3466 0.2843 -0.1197 -0.0394 0.0342  21  ILE L CD1 
3052 N N   . THR C 23  ? 0.5249 0.2986 0.2700 -0.1221 -0.0863 0.0449  22  THR L N   
3053 C CA  . THR C 23  ? 0.5485 0.2991 0.2798 -0.1155 -0.0969 0.0442  22  THR L CA  
3054 C C   . THR C 23  ? 0.5320 0.2903 0.2792 -0.0952 -0.0973 0.0367  22  THR L C   
3055 O O   . THR C 23  ? 0.5052 0.2690 0.2621 -0.0864 -0.0984 0.0329  22  THR L O   
3056 C CB  . THR C 23  ? 0.5788 0.2932 0.2826 -0.1234 -0.1139 0.0486  22  THR L CB  
3057 O OG1 . THR C 23  ? 0.5905 0.3057 0.2816 -0.1449 -0.1106 0.0566  22  THR L OG1 
3058 C CG2 . THR C 23  ? 0.6041 0.2931 0.2934 -0.1146 -0.1269 0.0465  22  THR L CG2 
3059 N N   . CYS C 24  ? 0.5201 0.2795 0.2689 -0.0888 -0.0970 0.0348  23  CYS L N   
3060 C CA  A CYS C 24  ? 0.5135 0.2794 0.2740 -0.0712 -0.0993 0.0282  23  CYS L CA  
3061 C CA  B CYS C 24  ? 0.5111 0.2761 0.2711 -0.0709 -0.0999 0.0281  23  CYS L CA  
3062 C C   . CYS C 24  ? 0.5450 0.2846 0.2872 -0.0659 -0.1133 0.0267  23  CYS L C   
3063 O O   . CYS C 24  ? 0.5512 0.2819 0.2823 -0.0741 -0.1134 0.0306  23  CYS L O   
3064 C CB  A CYS C 24  ? 0.4928 0.2868 0.2737 -0.0695 -0.0856 0.0275  23  CYS L CB  
3065 C CB  B CYS C 24  ? 0.4872 0.2813 0.2697 -0.0660 -0.0872 0.0262  23  CYS L CB  
3066 S SG  A CYS C 24  ? 0.4926 0.3023 0.2906 -0.0519 -0.0859 0.0212  23  CYS L SG  
3067 S SG  B CYS C 24  ? 0.4675 0.2872 0.2725 -0.0598 -0.0792 0.0234  23  CYS L SG  
3068 N N   . LYS C 25  ? 0.5507 0.2797 0.2898 -0.0523 -0.1250 0.0206  24  LYS L N   
3069 C CA  . LYS C 25  ? 0.6050 0.3095 0.3276 -0.0440 -0.1403 0.0170  24  LYS L CA  
3070 C C   . LYS C 25  ? 0.5833 0.3075 0.3225 -0.0252 -0.1404 0.0081  24  LYS L C   
3071 O O   . LYS C 25  ? 0.5707 0.3112 0.3225 -0.0153 -0.1393 0.0027  24  LYS L O   
3072 C CB  . LYS C 25  ? 0.6655 0.3356 0.3649 -0.0446 -0.1583 0.0167  24  LYS L CB  
3073 C CG  . LYS C 25  ? 0.7264 0.3710 0.4027 -0.0651 -0.1625 0.0267  24  LYS L CG  
3074 C CD  . LYS C 25  ? 0.7848 0.3903 0.4348 -0.0682 -0.1829 0.0280  24  LYS L CD  
3075 C CE  . LYS C 25  ? 0.8361 0.4223 0.4644 -0.0927 -0.1848 0.0400  24  LYS L CE  
3076 N NZ  . LYS C 25  ? 0.8921 0.4403 0.4948 -0.0994 -0.2047 0.0431  24  LYS L NZ  
3077 N N   . ALA C 26  ? 0.5480 0.2743 0.2881 -0.0216 -0.1404 0.0069  25  ALA L N   
3078 C CA  . ALA C 26  ? 0.5403 0.2859 0.2944 -0.0050 -0.1417 -0.0013 25  ALA L CA  
3079 C C   . ALA C 26  ? 0.5777 0.3016 0.3167 0.0091  -0.1610 -0.0097 25  ALA L C   
3080 O O   . ALA C 26  ? 0.6065 0.2956 0.3218 0.0048  -0.1736 -0.0074 25  ALA L O   
3081 C CB  . ALA C 26  ? 0.5251 0.2830 0.2874 -0.0075 -0.1339 0.0009  25  ALA L CB  
3082 N N   . SER C 27  ? 0.5703 0.3161 0.3225 0.0259  -0.1635 -0.0194 26  SER L N   
3083 C CA  . SER C 27  ? 0.6098 0.3429 0.3515 0.0440  -0.1821 -0.0309 26  SER L CA  
3084 C C   . SER C 27  ? 0.6141 0.3333 0.3465 0.0471  -0.1898 -0.0323 26  SER L C   
3085 O O   . SER C 27  ? 0.6254 0.3222 0.3423 0.0592  -0.2082 -0.0402 26  SER L O   
3086 C CB  . SER C 27  ? 0.5961 0.3658 0.3575 0.0598  -0.1797 -0.0410 26  SER L CB  
3087 O OG  . SER C 27  ? 0.5826 0.3864 0.3643 0.0592  -0.1668 -0.0399 26  SER L OG  
3088 N N   . GLN C 28  ? 0.5950 0.3268 0.3364 0.0374  -0.1772 -0.0255 27  GLN L N   
3089 C CA  . GLN C 28  ? 0.6131 0.3289 0.3440 0.0373  -0.1834 -0.0250 27  GLN L CA  
3090 C C   . GLN C 28  ? 0.5880 0.3085 0.3230 0.0203  -0.1686 -0.0141 27  GLN L C   
3091 O O   . GLN C 28  ? 0.5551 0.2963 0.3047 0.0120  -0.1540 -0.0092 27  GLN L O   
3092 C CB  . GLN C 28  ? 0.6196 0.3597 0.3640 0.0540  -0.1867 -0.0352 27  GLN L CB  
3093 C CG  . GLN C 28  ? 0.6089 0.3911 0.3802 0.0510  -0.1691 -0.0328 27  GLN L CG  
3094 C CD  . GLN C 28  ? 0.6302 0.4422 0.4154 0.0683  -0.1736 -0.0443 27  GLN L CD  
3095 O OE1 . GLN C 28  ? 0.6826 0.5074 0.4718 0.0798  -0.1784 -0.0526 27  GLN L OE1 
3096 N NE2 . GLN C 28  ? 0.6282 0.4523 0.4204 0.0703  -0.1726 -0.0453 27  GLN L NE2 
3097 N N   . SER C 29  ? 0.5747 0.2768 0.2969 0.0159  -0.1729 -0.0112 28  SER L N   
3098 C CA  A SER C 29  ? 0.5647 0.2681 0.2869 -0.0004 -0.1604 -0.0015 28  SER L CA  
3099 C CA  B SER C 29  ? 0.5728 0.2766 0.2953 0.0000  -0.1605 -0.0017 28  SER L CA  
3100 C C   . SER C 29  ? 0.5392 0.2805 0.2888 0.0004  -0.1448 -0.0015 28  SER L C   
3101 O O   . SER C 29  ? 0.5403 0.3019 0.3041 0.0126  -0.1462 -0.0080 28  SER L O   
3102 C CB  A SER C 29  ? 0.5838 0.2588 0.2845 -0.0050 -0.1695 0.0012  28  SER L CB  
3103 C CB  B SER C 29  ? 0.5931 0.2751 0.2991 -0.0029 -0.1676 0.0001  28  SER L CB  
3104 O OG  A SER C 29  ? 0.5996 0.2373 0.2722 -0.0132 -0.1820 0.0053  28  SER L OG  
3105 O OG  B SER C 29  ? 0.5791 0.2793 0.2968 -0.0110 -0.1536 0.0049  28  SER L OG  
3106 N N   . VAL C 30  ? 0.5180 0.2688 0.2738 -0.0122 -0.1317 0.0054  29  VAL L N   
3107 C CA  . VAL C 30  ? 0.4929 0.2741 0.2717 -0.0140 -0.1181 0.0068  29  VAL L CA  
3108 C C   . VAL C 30  ? 0.4891 0.2658 0.2633 -0.0249 -0.1116 0.0123  29  VAL L C   
3109 O O   . VAL C 30  ? 0.4389 0.2336 0.2267 -0.0301 -0.1007 0.0148  29  VAL L O   
3110 C CB  . VAL C 30  ? 0.4728 0.2729 0.2658 -0.0158 -0.1097 0.0078  29  VAL L CB  
3111 C CG1 . VAL C 30  ? 0.4747 0.2842 0.2736 -0.0033 -0.1160 0.0011  29  VAL L CG1 
3112 C CG2 . VAL C 30  ? 0.4775 0.2647 0.2598 -0.0274 -0.1065 0.0128  29  VAL L CG2 
3113 N N   . SER C 31  ? 0.5028 0.2554 0.2570 -0.0278 -0.1192 0.0135  30  SER L N   
3114 C CA  . SER C 31  ? 0.5235 0.2725 0.2712 -0.0376 -0.1139 0.0179  30  SER L CA  
3115 C C   . SER C 31  ? 0.4962 0.2557 0.2473 -0.0492 -0.1026 0.0222  30  SER L C   
3116 O O   . SER C 31  ? 0.4918 0.2420 0.2335 -0.0550 -0.1043 0.0245  30  SER L O   
3117 C CB  . SER C 31  ? 0.5154 0.2789 0.2768 -0.0315 -0.1115 0.0154  30  SER L CB  
3118 O OG  . SER C 31  ? 0.5412 0.3049 0.2988 -0.0396 -0.1056 0.0184  30  SER L OG  
3119 N N   . ASN C 32  ? 0.4671 0.2458 0.2319 -0.0516 -0.0925 0.0225  31  ASN L N   
3120 C CA  . ASN C 32  ? 0.4683 0.2617 0.2400 -0.0598 -0.0821 0.0245  31  ASN L CA  
3121 C C   . ASN C 32  ? 0.4469 0.2632 0.2426 -0.0541 -0.0759 0.0223  31  ASN L C   
3122 O O   . ASN C 32  ? 0.4401 0.2698 0.2435 -0.0588 -0.0680 0.0226  31  ASN L O   
3123 C CB  . ASN C 32  ? 0.4849 0.2811 0.2496 -0.0680 -0.0769 0.0257  31  ASN L CB  
3124 C CG  . ASN C 32  ? 0.4857 0.2901 0.2604 -0.0617 -0.0759 0.0228  31  ASN L CG  
3125 O OD1 . ASN C 32  ? 0.4822 0.2865 0.2654 -0.0527 -0.0807 0.0209  31  ASN L OD1 
3126 N ND2 . ASN C 32  ? 0.4979 0.3117 0.2724 -0.0663 -0.0699 0.0219  31  ASN L ND2 
3127 N N   . ASP C 33  ? 0.4360 0.2580 0.2426 -0.0447 -0.0798 0.0201  32  ASP L N   
3128 C CA  . ASP C 33  ? 0.4090 0.2529 0.2371 -0.0407 -0.0752 0.0192  32  ASP L CA  
3129 C C   . ASP C 33  ? 0.4005 0.2505 0.2330 -0.0419 -0.0722 0.0198  32  ASP L C   
3130 O O   . ASP C 33  ? 0.3914 0.2486 0.2308 -0.0356 -0.0749 0.0181  32  ASP L O   
3131 C CB  . ASP C 33  ? 0.4195 0.2701 0.2555 -0.0319 -0.0808 0.0170  32  ASP L CB  
3132 C CG  . ASP C 33  ? 0.4321 0.2820 0.2692 -0.0310 -0.0827 0.0168  32  ASP L CG  
3133 O OD1 . ASP C 33  ? 0.4381 0.2887 0.2762 -0.0359 -0.0784 0.0180  32  ASP L OD1 
3134 O OD2 . ASP C 33  ? 0.4794 0.3301 0.3174 -0.0247 -0.0888 0.0146  32  ASP L OD2 
3135 N N   . LEU C 34  ? 0.3923 0.2409 0.2203 -0.0499 -0.0669 0.0215  33  LEU L N   
3136 C CA  . LEU C 34  ? 0.3944 0.2455 0.2232 -0.0529 -0.0643 0.0224  33  LEU L CA  
3137 C C   . LEU C 34  ? 0.3747 0.2410 0.2141 -0.0579 -0.0558 0.0227  33  LEU L C   
3138 O O   . LEU C 34  ? 0.3757 0.2421 0.2099 -0.0633 -0.0526 0.0226  33  LEU L O   
3139 C CB  . LEU C 34  ? 0.4193 0.2497 0.2274 -0.0589 -0.0693 0.0242  33  LEU L CB  
3140 C CG  . LEU C 34  ? 0.4275 0.2539 0.2327 -0.0604 -0.0710 0.0247  33  LEU L CG  
3141 C CD1 . LEU C 34  ? 0.4241 0.2628 0.2350 -0.0688 -0.0624 0.0265  33  LEU L CD1 
3142 C CD2 . LEU C 34  ? 0.4118 0.2461 0.2283 -0.0492 -0.0742 0.0214  33  LEU L CD2 
3143 N N   . THR C 35  ? 0.3461 0.2259 0.1999 -0.0553 -0.0529 0.0224  34  THR L N   
3144 C CA  . THR C 35  ? 0.3459 0.2402 0.2118 -0.0576 -0.0468 0.0218  34  THR L CA  
3145 C C   . THR C 35  ? 0.3402 0.2380 0.2071 -0.0609 -0.0439 0.0223  34  THR L C   
3146 O O   . THR C 35  ? 0.3459 0.2390 0.2105 -0.0582 -0.0472 0.0229  34  THR L O   
3147 C CB  . THR C 35  ? 0.3412 0.2467 0.2226 -0.0524 -0.0478 0.0218  34  THR L CB  
3148 O OG1 . THR C 35  ? 0.3376 0.2391 0.2174 -0.0499 -0.0514 0.0216  34  THR L OG1 
3149 C CG2 . THR C 35  ? 0.3273 0.2442 0.2202 -0.0536 -0.0444 0.0209  34  THR L CG2 
3150 N N   . TRP C 36  ? 0.3361 0.2413 0.2045 -0.0662 -0.0387 0.0212  35  TRP L N   
3151 C CA  . TRP C 36  ? 0.3314 0.2423 0.2022 -0.0700 -0.0355 0.0214  35  TRP L CA  
3152 C C   . TRP C 36  ? 0.3146 0.2411 0.2018 -0.0671 -0.0323 0.0192  35  TRP L C   
3153 O O   . TRP C 36  ? 0.3045 0.2383 0.1963 -0.0663 -0.0307 0.0162  35  TRP L O   
3154 C CB  . TRP C 36  ? 0.3459 0.2551 0.2043 -0.0798 -0.0328 0.0217  35  TRP L CB  
3155 C CG  . TRP C 36  ? 0.3631 0.2532 0.2029 -0.0846 -0.0380 0.0251  35  TRP L CG  
3156 C CD1 . TRP C 36  ? 0.3806 0.2600 0.2064 -0.0883 -0.0405 0.0264  35  TRP L CD1 
3157 C CD2 . TRP C 36  ? 0.3721 0.2492 0.2035 -0.0864 -0.0429 0.0276  35  TRP L CD2 
3158 N NE1 . TRP C 36  ? 0.3916 0.2507 0.2002 -0.0927 -0.0475 0.0299  35  TRP L NE1 
3159 C CE2 . TRP C 36  ? 0.3990 0.2559 0.2107 -0.0913 -0.0495 0.0304  35  TRP L CE2 
3160 C CE3 . TRP C 36  ? 0.3696 0.2494 0.2075 -0.0843 -0.0433 0.0274  35  TRP L CE3 
3161 C CZ2 . TRP C 36  ? 0.4201 0.2572 0.2180 -0.0932 -0.0579 0.0327  35  TRP L CZ2 
3162 C CZ3 . TRP C 36  ? 0.3876 0.2497 0.2124 -0.0860 -0.0506 0.0293  35  TRP L CZ3 
3163 C CH2 . TRP C 36  ? 0.4254 0.2657 0.2304 -0.0902 -0.0584 0.0318  35  TRP L CH2 
3164 N N   . TYR C 37  ? 0.3055 0.2365 0.2005 -0.0649 -0.0324 0.0201  36  TYR L N   
3165 C CA  . TYR C 37  ? 0.3005 0.2438 0.2094 -0.0627 -0.0307 0.0187  36  TYR L CA  
3166 C C   . TYR C 37  ? 0.3079 0.2568 0.2180 -0.0664 -0.0274 0.0178  36  TYR L C   
3167 O O   . TYR C 37  ? 0.2995 0.2414 0.2011 -0.0696 -0.0278 0.0197  36  TYR L O   
3168 C CB  . TYR C 37  ? 0.2980 0.2441 0.2154 -0.0580 -0.0340 0.0213  36  TYR L CB  
3169 C CG  . TYR C 37  ? 0.2934 0.2370 0.2116 -0.0549 -0.0378 0.0228  36  TYR L CG  
3170 C CD1 . TYR C 37  ? 0.3072 0.2455 0.2193 -0.0526 -0.0405 0.0240  36  TYR L CD1 
3171 C CD2 . TYR C 37  ? 0.2965 0.2429 0.2215 -0.0539 -0.0401 0.0224  36  TYR L CD2 
3172 C CE1 . TYR C 37  ? 0.3081 0.2466 0.2217 -0.0501 -0.0441 0.0251  36  TYR L CE1 
3173 C CE2 . TYR C 37  ? 0.2934 0.2379 0.2195 -0.0523 -0.0443 0.0244  36  TYR L CE2 
3174 C CZ  . TYR C 37  ? 0.3001 0.2419 0.2208 -0.0507 -0.0457 0.0258  36  TYR L CZ  
3175 O OH  . TYR C 37  ? 0.3089 0.2513 0.2316 -0.0495 -0.0498 0.0275  36  TYR L OH  
3176 N N   . GLN C 38  ? 0.3067 0.2667 0.2268 -0.0655 -0.0256 0.0147  37  GLN L N   
3177 C CA  . GLN C 38  ? 0.3045 0.2729 0.2288 -0.0680 -0.0227 0.0131  37  GLN L CA  
3178 C C   . GLN C 38  ? 0.2863 0.2587 0.2221 -0.0632 -0.0252 0.0140  37  GLN L C   
3179 O O   . GLN C 38  ? 0.2843 0.2593 0.2273 -0.0595 -0.0280 0.0124  37  GLN L O   
3180 C CB  . GLN C 38  ? 0.3137 0.2940 0.2398 -0.0699 -0.0196 0.0073  37  GLN L CB  
3181 C CG  . GLN C 38  ? 0.3216 0.3142 0.2539 -0.0719 -0.0168 0.0043  37  GLN L CG  
3182 C CD  . GLN C 38  ? 0.3301 0.3392 0.2667 -0.0711 -0.0146 -0.0034 37  GLN L CD  
3183 O OE1 . GLN C 38  ? 0.3480 0.3604 0.2920 -0.0637 -0.0180 -0.0081 37  GLN L OE1 
3184 N NE2 . GLN C 38  ? 0.3411 0.3618 0.2727 -0.0789 -0.0098 -0.0052 37  GLN L NE2 
3185 N N   . GLN C 39  ? 0.2984 0.2708 0.2351 -0.0638 -0.0250 0.0162  38  GLN L N   
3186 C CA  . GLN C 39  ? 0.2927 0.2703 0.2393 -0.0605 -0.0271 0.0174  38  GLN L CA  
3187 C C   . GLN C 39  ? 0.2871 0.2716 0.2381 -0.0621 -0.0249 0.0149  38  GLN L C   
3188 O O   . GLN C 39  ? 0.3042 0.2867 0.2507 -0.0645 -0.0236 0.0162  38  GLN L O   
3189 C CB  . GLN C 39  ? 0.3023 0.2775 0.2473 -0.0586 -0.0291 0.0217  38  GLN L CB  
3190 C CG  . GLN C 39  ? 0.3035 0.2861 0.2575 -0.0568 -0.0315 0.0240  38  GLN L CG  
3191 C CD  . GLN C 39  ? 0.3115 0.2975 0.2647 -0.0549 -0.0335 0.0277  38  GLN L CD  
3192 O OE1 . GLN C 39  ? 0.3433 0.3269 0.2901 -0.0530 -0.0331 0.0269  38  GLN L OE1 
3193 N NE2 . GLN C 39  ? 0.3148 0.3075 0.2742 -0.0554 -0.0366 0.0313  38  GLN L NE2 
3194 N N   . LYS C 40  ? 0.2963 0.2880 0.2551 -0.0604 -0.0257 0.0108  39  LYS L N   
3195 C CA  . LYS C 40  ? 0.3127 0.3131 0.2768 -0.0611 -0.0241 0.0073  39  LYS L CA  
3196 C C   . LYS C 40  ? 0.3239 0.3232 0.2930 -0.0590 -0.0271 0.0108  39  LYS L C   
3197 O O   . LYS C 40  ? 0.2942 0.2895 0.2644 -0.0571 -0.0308 0.0151  39  LYS L O   
3198 C CB  . LYS C 40  ? 0.3138 0.3234 0.2842 -0.0580 -0.0252 0.0000  39  LYS L CB  
3199 C CG  . LYS C 40  ? 0.3311 0.3469 0.2961 -0.0609 -0.0211 -0.0042 39  LYS L CG  
3200 C CD  . LYS C 40  ? 0.3397 0.3690 0.3111 -0.0563 -0.0223 -0.0136 39  LYS L CD  
3201 C CE  . LYS C 40  ? 0.3556 0.3937 0.3203 -0.0598 -0.0177 -0.0174 39  LYS L CE  
3202 N NZ  . LYS C 40  ? 0.3668 0.4252 0.3381 -0.0554 -0.0176 -0.0285 39  LYS L NZ  
3203 N N   . PRO C 41  ? 0.3508 0.3552 0.3227 -0.0602 -0.0256 0.0094  40  PRO L N   
3204 C CA  . PRO C 41  ? 0.3703 0.3744 0.3459 -0.0585 -0.0283 0.0128  40  PRO L CA  
3205 C C   . PRO C 41  ? 0.3604 0.3637 0.3421 -0.0553 -0.0344 0.0141  40  PRO L C   
3206 O O   . PRO C 41  ? 0.3687 0.3733 0.3551 -0.0528 -0.0377 0.0095  40  PRO L O   
3207 C CB  . PRO C 41  ? 0.3687 0.3790 0.3470 -0.0600 -0.0262 0.0096  40  PRO L CB  
3208 C CG  . PRO C 41  ? 0.3586 0.3731 0.3331 -0.0644 -0.0218 0.0056  40  PRO L CG  
3209 C CD  . PRO C 41  ? 0.3595 0.3716 0.3307 -0.0640 -0.0215 0.0049  40  PRO L CD  
3210 N N   . GLY C 42  ? 0.3617 0.3632 0.3424 -0.0558 -0.0369 0.0204  41  GLY L N   
3211 C CA  . GLY C 42  ? 0.3785 0.3781 0.3624 -0.0559 -0.0440 0.0244  41  GLY L CA  
3212 C C   . GLY C 42  ? 0.3839 0.3775 0.3671 -0.0557 -0.0483 0.0251  41  GLY L C   
3213 O O   . GLY C 42  ? 0.3802 0.3695 0.3649 -0.0567 -0.0560 0.0285  41  GLY L O   
3214 N N   . GLN C 43  ? 0.3731 0.3651 0.3530 -0.0549 -0.0445 0.0223  42  GLN L N   
3215 C CA  . GLN C 43  ? 0.3818 0.3676 0.3607 -0.0541 -0.0490 0.0222  42  GLN L CA  
3216 C C   . GLN C 43  ? 0.3489 0.3341 0.3230 -0.0563 -0.0470 0.0271  42  GLN L C   
3217 O O   . GLN C 43  ? 0.3213 0.3106 0.2921 -0.0570 -0.0421 0.0288  42  GLN L O   
3218 C CB  . GLN C 43  ? 0.4196 0.4056 0.3984 -0.0509 -0.0471 0.0140  42  GLN L CB  
3219 C CG  . GLN C 43  ? 0.4375 0.4283 0.4217 -0.0474 -0.0487 0.0067  42  GLN L CG  
3220 C CD  . GLN C 43  ? 0.4944 0.4895 0.4788 -0.0435 -0.0481 -0.0021 42  GLN L CD  
3221 O OE1 . GLN C 43  ? 0.5419 0.5359 0.5214 -0.0444 -0.0451 -0.0024 42  GLN L OE1 
3222 N NE2 . GLN C 43  ? 0.5124 0.5142 0.5024 -0.0386 -0.0510 -0.0104 42  GLN L NE2 
3223 N N   . SER C 44  ? 0.3405 0.3202 0.3139 -0.0565 -0.0520 0.0285  43  SER L N   
3224 C CA  . SER C 44  ? 0.3233 0.3024 0.2926 -0.0578 -0.0509 0.0317  43  SER L CA  
3225 C C   . SER C 44  ? 0.3136 0.2898 0.2781 -0.0555 -0.0456 0.0263  43  SER L C   
3226 O O   . SER C 44  ? 0.3010 0.2767 0.2659 -0.0537 -0.0441 0.0203  43  SER L O   
3227 C CB  . SER C 44  ? 0.3246 0.2986 0.2951 -0.0600 -0.0594 0.0359  43  SER L CB  
3228 O OG  . SER C 44  ? 0.3542 0.3305 0.3274 -0.0642 -0.0650 0.0417  43  SER L OG  
3229 N N   . PRO C 45  ? 0.2953 0.2710 0.2545 -0.0559 -0.0429 0.0280  44  PRO L N   
3230 C CA  . PRO C 45  ? 0.3085 0.2791 0.2607 -0.0552 -0.0393 0.0241  44  PRO L CA  
3231 C C   . PRO C 45  ? 0.3104 0.2768 0.2631 -0.0538 -0.0423 0.0207  44  PRO L C   
3232 O O   . PRO C 45  ? 0.3285 0.2923 0.2851 -0.0533 -0.0487 0.0228  44  PRO L O   
3233 C CB  . PRO C 45  ? 0.3072 0.2762 0.2541 -0.0549 -0.0393 0.0271  44  PRO L CB  
3234 C CG  . PRO C 45  ? 0.3084 0.2861 0.2594 -0.0548 -0.0403 0.0309  44  PRO L CG  
3235 C CD  . PRO C 45  ? 0.3048 0.2858 0.2635 -0.0568 -0.0438 0.0330  44  PRO L CD  
3236 N N   . LYS C 46  ? 0.3171 0.2833 0.2648 -0.0538 -0.0383 0.0157  45  LYS L N   
3237 C CA  . LYS C 46  ? 0.3250 0.2903 0.2719 -0.0514 -0.0401 0.0103  45  LYS L CA  
3238 C C   . LYS C 46  ? 0.2978 0.2591 0.2346 -0.0533 -0.0367 0.0100  45  LYS L C   
3239 O O   . LYS C 46  ? 0.2839 0.2456 0.2138 -0.0572 -0.0317 0.0106  45  LYS L O   
3240 C CB  . LYS C 46  ? 0.3636 0.3381 0.3144 -0.0498 -0.0383 0.0032  45  LYS L CB  
3241 C CG  . LYS C 46  ? 0.4129 0.3902 0.3637 -0.0452 -0.0410 -0.0045 45  LYS L CG  
3242 C CD  . LYS C 46  ? 0.4577 0.4494 0.4131 -0.0423 -0.0393 -0.0137 45  LYS L CD  
3243 C CE  . LYS C 46  ? 0.5076 0.5094 0.4582 -0.0410 -0.0362 -0.0215 45  LYS L CE  
3244 N NZ  . LYS C 46  ? 0.5403 0.5624 0.4952 -0.0393 -0.0330 -0.0308 45  LYS L NZ  
3245 N N   . LEU C 47  ? 0.2865 0.2426 0.2212 -0.0512 -0.0403 0.0091  46  LEU L N   
3246 C CA  A LEU C 47  ? 0.2951 0.2457 0.2193 -0.0529 -0.0383 0.0093  46  LEU L CA  
3247 C CA  B LEU C 47  ? 0.2956 0.2463 0.2197 -0.0531 -0.0380 0.0094  46  LEU L CA  
3248 C C   . LEU C 47  ? 0.3045 0.2625 0.2232 -0.0549 -0.0334 0.0033  46  LEU L C   
3249 O O   . LEU C 47  ? 0.3114 0.2767 0.2350 -0.0508 -0.0352 -0.0031 46  LEU L O   
3250 C CB  A LEU C 47  ? 0.2928 0.2367 0.2177 -0.0497 -0.0444 0.0098  46  LEU L CB  
3251 C CB  B LEU C 47  ? 0.2944 0.2376 0.2181 -0.0504 -0.0437 0.0107  46  LEU L CB  
3252 C CG  A LEU C 47  ? 0.2970 0.2348 0.2116 -0.0503 -0.0436 0.0088  46  LEU L CG  
3253 C CG  B LEU C 47  ? 0.2985 0.2341 0.2114 -0.0520 -0.0426 0.0125  46  LEU L CG  
3254 C CD1 A LEU C 47  ? 0.2955 0.2267 0.2027 -0.0530 -0.0423 0.0138  46  LEU L CD1 
3255 C CD1 B LEU C 47  ? 0.2993 0.2289 0.2140 -0.0499 -0.0484 0.0160  46  LEU L CD1 
3256 C CD2 A LEU C 47  ? 0.3006 0.2328 0.2175 -0.0465 -0.0505 0.0081  46  LEU L CD2 
3257 C CD2 B LEU C 47  ? 0.3067 0.2433 0.2114 -0.0528 -0.0401 0.0074  46  LEU L CD2 
3258 N N   . LEU C 48  ? 0.3081 0.2646 0.2162 -0.0609 -0.0289 0.0052  47  LEU L N   
3259 C CA  . LEU C 48  ? 0.3123 0.2783 0.2131 -0.0655 -0.0242 0.0008  47  LEU L CA  
3260 C C   . LEU C 48  ? 0.3110 0.2687 0.1992 -0.0678 -0.0248 0.0020  47  LEU L C   
3261 O O   . LEU C 48  ? 0.3330 0.2995 0.2185 -0.0676 -0.0234 -0.0030 47  LEU L O   
3262 C CB  . LEU C 48  ? 0.3130 0.2837 0.2088 -0.0736 -0.0195 0.0029  47  LEU L CB  
3263 C CG  . LEU C 48  ? 0.3146 0.2942 0.2217 -0.0722 -0.0184 0.0015  47  LEU L CG  
3264 C CD1 . LEU C 48  ? 0.3249 0.3096 0.2255 -0.0816 -0.0141 0.0034  47  LEU L CD1 
3265 C CD2 . LEU C 48  ? 0.3163 0.3108 0.2346 -0.0658 -0.0189 -0.0064 47  LEU L CD2 
3266 N N   . ILE C 49  ? 0.3257 0.2679 0.2056 -0.0698 -0.0273 0.0079  48  ILE L N   
3267 C CA  . ILE C 49  ? 0.3388 0.2708 0.2034 -0.0737 -0.0283 0.0098  48  ILE L CA  
3268 C C   . ILE C 49  ? 0.3423 0.2600 0.2072 -0.0682 -0.0341 0.0129  48  ILE L C   
3269 O O   . ILE C 49  ? 0.3273 0.2406 0.1971 -0.0656 -0.0364 0.0159  48  ILE L O   
3270 C CB  . ILE C 49  ? 0.3582 0.2837 0.2074 -0.0841 -0.0268 0.0140  48  ILE L CB  
3271 C CG1 . ILE C 49  ? 0.3745 0.3167 0.2233 -0.0920 -0.0209 0.0121  48  ILE L CG1 
3272 C CG2 . ILE C 49  ? 0.3724 0.2848 0.2043 -0.0885 -0.0296 0.0165  48  ILE L CG2 
3273 C CD1 . ILE C 49  ? 0.3832 0.3433 0.2304 -0.0943 -0.0166 0.0065  48  ILE L CD1 
3274 N N   . TYR C 50  ? 0.3322 0.2441 0.1913 -0.0664 -0.0366 0.0120  49  TYR L N   
3275 C CA  . TYR C 50  ? 0.3294 0.2294 0.1883 -0.0616 -0.0424 0.0146  49  TYR L CA  
3276 C C   . TYR C 50  ? 0.3415 0.2301 0.1841 -0.0646 -0.0443 0.0152  49  TYR L C   
3277 O O   . TYR C 50  ? 0.3402 0.2331 0.1737 -0.0705 -0.0407 0.0136  49  TYR L O   
3278 C CB  . TYR C 50  ? 0.3320 0.2371 0.2048 -0.0551 -0.0455 0.0130  49  TYR L CB  
3279 C CG  . TYR C 50  ? 0.3460 0.2545 0.2184 -0.0532 -0.0461 0.0081  49  TYR L CG  
3280 C CD1 . TYR C 50  ? 0.3473 0.2682 0.2248 -0.0525 -0.0432 0.0027  49  TYR L CD1 
3281 C CD2 . TYR C 50  ? 0.3613 0.2614 0.2271 -0.0513 -0.0499 0.0077  49  TYR L CD2 
3282 C CE1 . TYR C 50  ? 0.3668 0.2925 0.2432 -0.0490 -0.0445 -0.0036 49  TYR L CE1 
3283 C CE2 . TYR C 50  ? 0.3782 0.2817 0.2428 -0.0486 -0.0509 0.0022  49  TYR L CE2 
3284 C CZ  . TYR C 50  ? 0.3873 0.3041 0.2571 -0.0470 -0.0483 -0.0038 49  TYR L CZ  
3285 O OH  . TYR C 50  ? 0.4077 0.3294 0.2761 -0.0424 -0.0504 -0.0111 49  TYR L OH  
3286 N N   . TYR C 51  ? 0.3476 0.2237 0.1859 -0.0613 -0.0499 0.0175  50  TYR L N   
3287 C CA  . TYR C 51  ? 0.3702 0.2314 0.1912 -0.0639 -0.0536 0.0187  50  TYR L CA  
3288 C C   . TYR C 51  ? 0.3895 0.2436 0.1939 -0.0736 -0.0523 0.0214  50  TYR L C   
3289 O O   . TYR C 51  ? 0.3966 0.2456 0.1858 -0.0802 -0.0521 0.0221  50  TYR L O   
3290 C CB  . TYR C 51  ? 0.3799 0.2440 0.1997 -0.0626 -0.0533 0.0156  50  TYR L CB  
3291 C CG  . TYR C 51  ? 0.3816 0.2491 0.2149 -0.0547 -0.0568 0.0138  50  TYR L CG  
3292 C CD1 . TYR C 51  ? 0.3784 0.2456 0.2218 -0.0500 -0.0606 0.0159  50  TYR L CD1 
3293 C CD2 . TYR C 51  ? 0.3890 0.2598 0.2231 -0.0525 -0.0573 0.0100  50  TYR L CD2 
3294 C CE1 . TYR C 51  ? 0.3820 0.2531 0.2368 -0.0454 -0.0645 0.0155  50  TYR L CE1 
3295 C CE2 . TYR C 51  ? 0.3946 0.2663 0.2400 -0.0466 -0.0621 0.0090  50  TYR L CE2 
3296 C CZ  . TYR C 51  ? 0.3885 0.2595 0.2434 -0.0440 -0.0660 0.0125  50  TYR L CZ  
3297 O OH  . TYR C 51  ? 0.3978 0.2703 0.2626 -0.0407 -0.0713 0.0126  50  TYR L OH  
3298 N N   . ALA C 52  ? 0.3951 0.2495 0.2018 -0.0755 -0.0516 0.0231  51  ALA L N   
3299 C CA  . ALA C 52  ? 0.4127 0.2593 0.2048 -0.0854 -0.0519 0.0266  51  ALA L CA  
3300 C C   . ALA C 52  ? 0.4194 0.2814 0.2088 -0.0954 -0.0443 0.0261  51  ALA L C   
3301 O O   . ALA C 52  ? 0.4222 0.2852 0.2068 -0.1035 -0.0429 0.0286  51  ALA L O   
3302 C CB  . ALA C 52  ? 0.4438 0.2661 0.2148 -0.0886 -0.0605 0.0299  51  ALA L CB  
3303 N N   . SER C 53  ? 0.4188 0.2927 0.2093 -0.0956 -0.0403 0.0227  52  SER L N   
3304 C CA  . SER C 53  ? 0.4298 0.3216 0.2150 -0.1055 -0.0336 0.0213  52  SER L CA  
3305 C C   . SER C 53  ? 0.4284 0.3441 0.2288 -0.0989 -0.0280 0.0133  52  SER L C   
3306 O O   . SER C 53  ? 0.4368 0.3732 0.2358 -0.1054 -0.0220 0.0101  52  SER L O   
3307 C CB  . SER C 53  ? 0.4529 0.3347 0.2151 -0.1162 -0.0359 0.0252  52  SER L CB  
3308 O OG  . SER C 53  ? 0.4561 0.3346 0.2172 -0.1097 -0.0378 0.0223  52  SER L OG  
3309 N N   . ASN C 54  ? 0.4390 0.3530 0.2528 -0.0867 -0.0307 0.0098  53  ASN L N   
3310 C CA  . ASN C 54  ? 0.4350 0.3667 0.2613 -0.0792 -0.0286 0.0017  53  ASN L CA  
3311 C C   . ASN C 54  ? 0.4142 0.3593 0.2562 -0.0761 -0.0260 -0.0011 53  ASN L C   
3312 O O   . ASN C 54  ? 0.3923 0.3289 0.2437 -0.0717 -0.0290 0.0018  53  ASN L O   
3313 C CB  . ASN C 54  ? 0.4455 0.3675 0.2783 -0.0690 -0.0346 0.0000  53  ASN L CB  
3314 C CG  . ASN C 54  ? 0.4905 0.4032 0.3100 -0.0696 -0.0374 0.0001  53  ASN L CG  
3315 O OD1 . ASN C 54  ? 0.5596 0.4747 0.3638 -0.0778 -0.0346 0.0008  53  ASN L OD1 
3316 N ND2 . ASN C 54  ? 0.5086 0.4116 0.3335 -0.0618 -0.0432 -0.0004 53  ASN L ND2 
3317 N N   . ARG C 55  ? 0.4116 0.3789 0.2570 -0.0773 -0.0211 -0.0076 54  ARG L N   
3318 C CA  . ARG C 55  ? 0.4114 0.3920 0.2731 -0.0718 -0.0200 -0.0124 54  ARG L CA  
3319 C C   . ARG C 55  ? 0.3860 0.3628 0.2601 -0.0592 -0.0264 -0.0172 54  ARG L C   
3320 O O   . ARG C 55  ? 0.3710 0.3483 0.2422 -0.0543 -0.0292 -0.0222 54  ARG L O   
3321 C CB  . ARG C 55  ? 0.4309 0.4394 0.2941 -0.0745 -0.0142 -0.0202 54  ARG L CB  
3322 C CG  . ARG C 55  ? 0.4708 0.4876 0.3253 -0.0884 -0.0082 -0.0154 54  ARG L CG  
3323 C CD  . ARG C 55  ? 0.5086 0.5585 0.3636 -0.0915 -0.0022 -0.0242 54  ARG L CD  
3324 N NE  . ARG C 55  ? 0.5518 0.6106 0.3922 -0.1086 0.0030  -0.0185 54  ARG L NE  
3325 C CZ  . ARG C 55  ? 0.5783 0.6470 0.4035 -0.1182 0.0058  -0.0179 54  ARG L CZ  
3326 N NH1 . ARG C 55  ? 0.5694 0.6424 0.3919 -0.1113 0.0047  -0.0238 54  ARG L NH1 
3327 N NH2 . ARG C 55  ? 0.6051 0.6805 0.4169 -0.1359 0.0094  -0.0111 54  ARG L NH2 
3328 N N   . TYR C 56  ? 0.3795 0.3514 0.2656 -0.0549 -0.0295 -0.0154 55  TYR L N   
3329 C CA  . TYR C 56  ? 0.3815 0.3506 0.2794 -0.0448 -0.0369 -0.0197 55  TYR L CA  
3330 C C   . TYR C 56  ? 0.3884 0.3766 0.2912 -0.0387 -0.0370 -0.0315 55  TYR L C   
3331 O O   . TYR C 56  ? 0.3780 0.3842 0.2794 -0.0429 -0.0302 -0.0350 55  TYR L O   
3332 C CB  . TYR C 56  ? 0.3860 0.3480 0.2937 -0.0444 -0.0396 -0.0139 55  TYR L CB  
3333 C CG  . TYR C 56  ? 0.4030 0.3573 0.3199 -0.0372 -0.0491 -0.0150 55  TYR L CG  
3334 C CD1 . TYR C 56  ? 0.4300 0.3708 0.3452 -0.0360 -0.0551 -0.0109 55  TYR L CD1 
3335 C CD2 . TYR C 56  ? 0.4181 0.3776 0.3446 -0.0322 -0.0533 -0.0197 55  TYR L CD2 
3336 C CE1 . TYR C 56  ? 0.4563 0.3887 0.3783 -0.0316 -0.0652 -0.0106 55  TYR L CE1 
3337 C CE2 . TYR C 56  ? 0.4349 0.3838 0.3675 -0.0270 -0.0642 -0.0197 55  TYR L CE2 
3338 C CZ  . TYR C 56  ? 0.4543 0.3894 0.3842 -0.0276 -0.0703 -0.0146 55  TYR L CZ  
3339 O OH  . TYR C 56  ? 0.4936 0.4167 0.4277 -0.0248 -0.0823 -0.0131 55  TYR L OH  
3340 N N   . ALA C 57  ? 0.4099 0.3945 0.3177 -0.0288 -0.0455 -0.0380 56  ALA L N   
3341 C CA  . ALA C 57  ? 0.4332 0.4341 0.3462 -0.0193 -0.0488 -0.0515 56  ALA L CA  
3342 C C   . ALA C 57  ? 0.4360 0.4504 0.3583 -0.0188 -0.0465 -0.0547 56  ALA L C   
3343 O O   . ALA C 57  ? 0.4324 0.4347 0.3613 -0.0197 -0.0498 -0.0480 56  ALA L O   
3344 C CB  . ALA C 57  ? 0.4392 0.4258 0.3562 -0.0086 -0.0620 -0.0559 56  ALA L CB  
3345 N N   . GLY C 58  ? 0.4407 0.4815 0.3631 -0.0176 -0.0410 -0.0647 57  GLY L N   
3346 C CA  . GLY C 58  ? 0.4487 0.5080 0.3802 -0.0157 -0.0389 -0.0708 57  GLY L CA  
3347 C C   . GLY C 58  ? 0.4419 0.5084 0.3710 -0.0292 -0.0283 -0.0622 57  GLY L C   
3348 O O   . GLY C 58  ? 0.4691 0.5524 0.4054 -0.0287 -0.0260 -0.0670 57  GLY L O   
3349 N N   . VAL C 59  ? 0.4243 0.4766 0.3435 -0.0400 -0.0238 -0.0502 58  VAL L N   
3350 C CA  . VAL C 59  ? 0.4052 0.4591 0.3195 -0.0530 -0.0160 -0.0414 58  VAL L CA  
3351 C C   . VAL C 59  ? 0.4120 0.4924 0.3188 -0.0613 -0.0080 -0.0459 58  VAL L C   
3352 O O   . VAL C 59  ? 0.4057 0.4903 0.3024 -0.0639 -0.0064 -0.0473 58  VAL L O   
3353 C CB  . VAL C 59  ? 0.4086 0.4374 0.3132 -0.0601 -0.0162 -0.0288 58  VAL L CB  
3354 C CG1 . VAL C 59  ? 0.4098 0.4388 0.3057 -0.0733 -0.0102 -0.0212 58  VAL L CG1 
3355 C CG2 . VAL C 59  ? 0.3999 0.4083 0.3122 -0.0540 -0.0230 -0.0238 58  VAL L CG2 
3356 N N   . PRO C 60  ? 0.4106 0.5103 0.3218 -0.0667 -0.0030 -0.0478 59  PRO L N   
3357 C CA  . PRO C 60  ? 0.4160 0.5459 0.3208 -0.0769 0.0047  -0.0517 59  PRO L CA  
3358 C C   . PRO C 60  ? 0.4265 0.5490 0.3125 -0.0932 0.0090  -0.0412 59  PRO L C   
3359 O O   . PRO C 60  ? 0.3950 0.4878 0.2740 -0.0973 0.0062  -0.0301 59  PRO L O   
3360 C CB  . PRO C 60  ? 0.4165 0.5593 0.3293 -0.0816 0.0078  -0.0514 59  PRO L CB  
3361 C CG  . PRO C 60  ? 0.4101 0.5369 0.3366 -0.0686 0.0008  -0.0531 59  PRO L CG  
3362 C CD  . PRO C 60  ? 0.4107 0.5055 0.3330 -0.0642 -0.0049 -0.0461 59  PRO L CD  
3363 N N   . ASP C 61  ? 0.4587 0.6099 0.3367 -0.1021 0.0149  -0.0453 60  ASP L N   
3364 C CA  . ASP C 61  ? 0.4947 0.6443 0.3524 -0.1193 0.0185  -0.0365 60  ASP L CA  
3365 C C   . ASP C 61  ? 0.4738 0.6048 0.3216 -0.1351 0.0186  -0.0228 60  ASP L C   
3366 O O   . ASP C 61  ? 0.4894 0.6001 0.3195 -0.1460 0.0167  -0.0128 60  ASP L O   
3367 C CB  . ASP C 61  ? 0.5476 0.7401 0.4005 -0.1273 0.0255  -0.0444 60  ASP L CB  
3368 C CG  . ASP C 61  ? 0.5936 0.8001 0.4464 -0.1159 0.0247  -0.0555 60  ASP L CG  
3369 O OD1 . ASP C 61  ? 0.6175 0.8033 0.4784 -0.0992 0.0181  -0.0595 60  ASP L OD1 
3370 O OD2 . ASP C 61  ? 0.6618 0.9007 0.5058 -0.1243 0.0304  -0.0600 60  ASP L OD2 
3371 N N   . ARG C 62  ? 0.4643 0.6006 0.3225 -0.1358 0.0195  -0.0227 61  ARG L N   
3372 C CA  . ARG C 62  ? 0.4528 0.5751 0.3012 -0.1515 0.0190  -0.0110 61  ARG L CA  
3373 C C   . ARG C 62  ? 0.4454 0.5245 0.2873 -0.1485 0.0118  -0.0013 61  ARG L C   
3374 O O   . ARG C 62  ? 0.4689 0.5301 0.2980 -0.1610 0.0090  0.0086  61  ARG L O   
3375 C CB  . ARG C 62  ? 0.4406 0.5805 0.3028 -0.1514 0.0214  -0.0146 61  ARG L CB  
3376 C CG  . ARG C 62  ? 0.4260 0.5556 0.3069 -0.1332 0.0178  -0.0198 61  ARG L CG  
3377 C CD  . ARG C 62  ? 0.4158 0.5614 0.3072 -0.1358 0.0199  -0.0219 61  ARG L CD  
3378 N NE  . ARG C 62  ? 0.3960 0.5355 0.3047 -0.1201 0.0164  -0.0271 61  ARG L NE  
3379 C CZ  . ARG C 62  ? 0.3898 0.5435 0.3123 -0.1048 0.0149  -0.0389 61  ARG L CZ  
3380 N NH1 . ARG C 62  ? 0.3984 0.5738 0.3203 -0.1013 0.0168  -0.0479 61  ARG L NH1 
3381 N NH2 . ARG C 62  ? 0.3770 0.5217 0.3128 -0.0927 0.0103  -0.0417 61  ARG L NH2 
3382 N N   . PHE C 63  ? 0.4130 0.4769 0.2636 -0.1324 0.0081  -0.0046 62  PHE L N   
3383 C CA  . PHE C 63  ? 0.4126 0.4407 0.2589 -0.1276 0.0014  0.0028  62  PHE L CA  
3384 C C   . PHE C 63  ? 0.4224 0.4353 0.2534 -0.1301 -0.0013 0.0064  62  PHE L C   
3385 O O   . PHE C 63  ? 0.4164 0.4392 0.2504 -0.1231 -0.0002 0.0000  62  PHE L O   
3386 C CB  . PHE C 63  ? 0.3951 0.4168 0.2589 -0.1108 -0.0016 -0.0015 62  PHE L CB  
3387 C CG  . PHE C 63  ? 0.3823 0.4158 0.2607 -0.1075 -0.0001 -0.0047 62  PHE L CG  
3388 C CD1 . PHE C 63  ? 0.3829 0.4035 0.2600 -0.1119 -0.0017 0.0017  62  PHE L CD1 
3389 C CD2 . PHE C 63  ? 0.3727 0.4299 0.2650 -0.0995 0.0019  -0.0149 62  PHE L CD2 
3390 C CE1 . PHE C 63  ? 0.3703 0.4014 0.2605 -0.1086 -0.0005 -0.0012 62  PHE L CE1 
3391 C CE2 . PHE C 63  ? 0.3637 0.4305 0.2689 -0.0959 0.0023  -0.0181 62  PHE L CE2 
3392 C CZ  . PHE C 63  ? 0.3659 0.4200 0.2699 -0.1012 0.0016  -0.0109 62  PHE L CZ  
3393 N N   . THR C 64  ? 0.4426 0.4307 0.2571 -0.1391 -0.0060 0.0158  63  THR L N   
3394 C CA  . THR C 64  ? 0.4671 0.4355 0.2655 -0.1412 -0.0106 0.0200  63  THR L CA  
3395 C C   . THR C 64  ? 0.4588 0.3939 0.2510 -0.1378 -0.0191 0.0265  63  THR L C   
3396 O O   . THR C 64  ? 0.4302 0.3581 0.2269 -0.1371 -0.0212 0.0286  63  THR L O   
3397 C CB  . THR C 64  ? 0.5038 0.4797 0.2819 -0.1591 -0.0088 0.0242  63  THR L CB  
3398 O OG1 . THR C 64  ? 0.5295 0.4930 0.2941 -0.1740 -0.0123 0.0329  63  THR L OG1 
3399 C CG2 . THR C 64  ? 0.5078 0.5231 0.2927 -0.1618 0.0000  0.0162  63  THR L CG2 
3400 N N   . GLY C 65  ? 0.4674 0.3838 0.2491 -0.1353 -0.0242 0.0286  64  GLY L N   
3401 C CA  . GLY C 65  ? 0.4621 0.3484 0.2367 -0.1305 -0.0335 0.0331  64  GLY L CA  
3402 C C   . GLY C 65  ? 0.4811 0.3488 0.2344 -0.1367 -0.0393 0.0373  64  GLY L C   
3403 O O   . GLY C 65  ? 0.4719 0.3522 0.2224 -0.1390 -0.0351 0.0349  64  GLY L O   
3404 N N   . SER C 66  ? 0.4850 0.3240 0.2235 -0.1383 -0.0495 0.0424  65  SER L N   
3405 C CA  . SER C 66  ? 0.5061 0.3226 0.2230 -0.1429 -0.0575 0.0464  65  SER L CA  
3406 C C   . SER C 66  ? 0.5155 0.3031 0.2276 -0.1329 -0.0695 0.0470  65  SER L C   
3407 O O   . SER C 66  ? 0.5076 0.2935 0.2301 -0.1255 -0.0715 0.0452  65  SER L O   
3408 C CB  . SER C 66  ? 0.5335 0.3466 0.2277 -0.1635 -0.0588 0.0534  65  SER L CB  
3409 O OG  . SER C 66  ? 0.5553 0.3521 0.2406 -0.1705 -0.0658 0.0584  65  SER L OG  
3410 N N   . GLY C 67  ? 0.5377 0.3048 0.2343 -0.1321 -0.0777 0.0486  66  GLY L N   
3411 C CA  . GLY C 67  ? 0.5518 0.2905 0.2400 -0.1228 -0.0913 0.0482  66  GLY L CA  
3412 C C   . GLY C 67  ? 0.5433 0.2812 0.2392 -0.1089 -0.0931 0.0434  66  GLY L C   
3413 O O   . GLY C 67  ? 0.5235 0.2837 0.2358 -0.1043 -0.0835 0.0399  66  GLY L O   
3414 N N   . TYR C 68  ? 0.5587 0.2701 0.2417 -0.1024 -0.1067 0.0430  67  TYR L N   
3415 C CA  . TYR C 68  ? 0.5630 0.2695 0.2502 -0.0890 -0.1119 0.0384  67  TYR L CA  
3416 C C   . TYR C 68  ? 0.5824 0.2638 0.2596 -0.0795 -0.1276 0.0358  67  TYR L C   
3417 O O   . TYR C 68  ? 0.6424 0.2954 0.2949 -0.0881 -0.1392 0.0403  67  TYR L O   
3418 C CB  . TYR C 68  ? 0.5726 0.2705 0.2443 -0.0959 -0.1131 0.0412  67  TYR L CB  
3419 C CG  . TYR C 68  ? 0.5796 0.2798 0.2606 -0.0824 -0.1152 0.0360  67  TYR L CG  
3420 C CD1 . TYR C 68  ? 0.5552 0.2796 0.2541 -0.0792 -0.1043 0.0333  67  TYR L CD1 
3421 C CD2 . TYR C 68  ? 0.5964 0.2748 0.2686 -0.0723 -0.1291 0.0331  67  TYR L CD2 
3422 C CE1 . TYR C 68  ? 0.5565 0.2837 0.2646 -0.0679 -0.1068 0.0290  67  TYR L CE1 
3423 C CE2 . TYR C 68  ? 0.5819 0.2660 0.2646 -0.0600 -0.1309 0.0280  67  TYR L CE2 
3424 C CZ  . TYR C 68  ? 0.5685 0.2775 0.2697 -0.0585 -0.1193 0.0265  67  TYR L CZ  
3425 O OH  . TYR C 68  ? 0.5919 0.3082 0.3042 -0.0482 -0.1207 0.0222  67  TYR L OH  
3426 N N   . GLY C 69  ? 0.5555 0.2465 0.2493 -0.0629 -0.1294 0.0288  68  GLY L N   
3427 C CA  . GLY C 69  ? 0.5730 0.2450 0.2594 -0.0503 -0.1449 0.0236  68  GLY L CA  
3428 C C   . GLY C 69  ? 0.5503 0.2337 0.2493 -0.0441 -0.1435 0.0202  68  GLY L C   
3429 O O   . GLY C 69  ? 0.5241 0.2368 0.2473 -0.0369 -0.1335 0.0168  68  GLY L O   
3430 N N   . THR C 70  ? 0.5785 0.2394 0.2612 -0.0474 -0.1539 0.0216  69  THR L N   
3431 C CA  . THR C 70  ? 0.5811 0.2512 0.2742 -0.0411 -0.1538 0.0180  69  THR L CA  
3432 C C   . THR C 70  ? 0.5782 0.2545 0.2721 -0.0565 -0.1442 0.0248  69  THR L C   
3433 O O   . THR C 70  ? 0.5730 0.2656 0.2815 -0.0519 -0.1392 0.0222  69  THR L O   
3434 C CB  . THR C 70  ? 0.6107 0.2520 0.2866 -0.0310 -0.1739 0.0127  69  THR L CB  
3435 O OG1 . THR C 70  ? 0.6557 0.2608 0.3026 -0.0452 -0.1854 0.0199  69  THR L OG1 
3436 C CG2 . THR C 70  ? 0.6221 0.2628 0.3003 -0.0130 -0.1836 0.0035  69  THR L CG2 
3437 N N   . ASP C 71  ? 0.6009 0.2644 0.2780 -0.0742 -0.1432 0.0331  70  ASP L N   
3438 C CA  . ASP C 71  ? 0.6118 0.2746 0.2832 -0.0896 -0.1395 0.0393  70  ASP L CA  
3439 C C   . ASP C 71  ? 0.5813 0.2738 0.2663 -0.1006 -0.1210 0.0429  70  ASP L C   
3440 O O   . ASP C 71  ? 0.5788 0.2716 0.2556 -0.1097 -0.1177 0.0466  70  ASP L O   
3441 C CB  . ASP C 71  ? 0.6813 0.3065 0.3204 -0.1029 -0.1552 0.0460  70  ASP L CB  
3442 C CG  . ASP C 71  ? 0.7332 0.3254 0.3569 -0.0909 -0.1765 0.0413  70  ASP L CG  
3443 O OD1 . ASP C 71  ? 0.7296 0.3323 0.3692 -0.0719 -0.1779 0.0320  70  ASP L OD1 
3444 O OD2 . ASP C 71  ? 0.8078 0.3638 0.4025 -0.1008 -0.1926 0.0467  70  ASP L OD2 
3445 N N   . PHE C 72  ? 0.5386 0.2568 0.2445 -0.0985 -0.1097 0.0409  71  PHE L N   
3446 C CA  . PHE C 72  ? 0.5217 0.2699 0.2434 -0.1051 -0.0934 0.0419  71  PHE L CA  
3447 C C   . PHE C 72  ? 0.5222 0.2800 0.2454 -0.1164 -0.0880 0.0451  71  PHE L C   
3448 O O   . PHE C 72  ? 0.5394 0.2921 0.2653 -0.1124 -0.0923 0.0439  71  PHE L O   
3449 C CB  . PHE C 72  ? 0.4795 0.2519 0.2266 -0.0912 -0.0850 0.0360  71  PHE L CB  
3450 C CG  . PHE C 72  ? 0.4843 0.2499 0.2310 -0.0807 -0.0903 0.0329  71  PHE L CG  
3451 C CD1 . PHE C 72  ? 0.4799 0.2516 0.2267 -0.0832 -0.0856 0.0334  71  PHE L CD1 
3452 C CD2 . PHE C 72  ? 0.4829 0.2374 0.2288 -0.0678 -0.1005 0.0287  71  PHE L CD2 
3453 C CE1 . PHE C 72  ? 0.4826 0.2475 0.2285 -0.0741 -0.0910 0.0308  71  PHE L CE1 
3454 C CE2 . PHE C 72  ? 0.4941 0.2457 0.2409 -0.0581 -0.1054 0.0252  71  PHE L CE2 
3455 C CZ  . PHE C 72  ? 0.4893 0.2447 0.2356 -0.0618 -0.1008 0.0268  71  PHE L CZ  
3456 N N   . THR C 73  ? 0.5110 0.2863 0.2349 -0.1287 -0.0781 0.0477  72  THR L N   
3457 C CA  . THR C 73  ? 0.5157 0.3040 0.2397 -0.1422 -0.0723 0.0509  72  THR L CA  
3458 C C   . THR C 73  ? 0.4951 0.3187 0.2413 -0.1398 -0.0576 0.0464  72  THR L C   
3459 O O   . THR C 73  ? 0.4879 0.3231 0.2366 -0.1392 -0.0523 0.0445  72  THR L O   
3460 C CB  . THR C 73  ? 0.5543 0.3310 0.2531 -0.1625 -0.0765 0.0587  72  THR L CB  
3461 O OG1 . THR C 73  ? 0.5927 0.3313 0.2691 -0.1631 -0.0931 0.0625  72  THR L OG1 
3462 C CG2 . THR C 73  ? 0.5468 0.3400 0.2454 -0.1779 -0.0707 0.0621  72  THR L CG2 
3463 N N   . PHE C 74  ? 0.4755 0.3142 0.2370 -0.1374 -0.0525 0.0441  73  PHE L N   
3464 C CA  . PHE C 74  ? 0.4507 0.3216 0.2322 -0.1357 -0.0405 0.0394  73  PHE L CA  
3465 C C   . PHE C 74  ? 0.4574 0.3416 0.2351 -0.1505 -0.0365 0.0419  73  PHE L C   
3466 O O   . PHE C 74  ? 0.4683 0.3407 0.2409 -0.1549 -0.0416 0.0452  73  PHE L O   
3467 C CB  . PHE C 74  ? 0.4422 0.3206 0.2448 -0.1207 -0.0386 0.0347  73  PHE L CB  
3468 C CG  . PHE C 74  ? 0.4264 0.3326 0.2483 -0.1180 -0.0293 0.0298  73  PHE L CG  
3469 C CD1 . PHE C 74  ? 0.4156 0.3358 0.2488 -0.1108 -0.0249 0.0251  73  PHE L CD1 
3470 C CD2 . PHE C 74  ? 0.4260 0.3426 0.2551 -0.1213 -0.0265 0.0294  73  PHE L CD2 
3471 C CE1 . PHE C 74  ? 0.4056 0.3484 0.2554 -0.1068 -0.0189 0.0197  73  PHE L CE1 
3472 C CE2 . PHE C 74  ? 0.4069 0.3478 0.2536 -0.1173 -0.0195 0.0241  73  PHE L CE2 
3473 C CZ  . PHE C 74  ? 0.3990 0.3522 0.2557 -0.1098 -0.0163 0.0190  73  PHE L CZ  
3474 N N   . THR C 75  ? 0.4546 0.3652 0.2368 -0.1567 -0.0277 0.0392  74  THR L N   
3475 C CA  . THR C 75  ? 0.4674 0.3974 0.2453 -0.1729 -0.0229 0.0411  74  THR L CA  
3476 C C   . THR C 75  ? 0.4411 0.4070 0.2406 -0.1670 -0.0126 0.0325  74  THR L C   
3477 O O   . THR C 75  ? 0.4322 0.4104 0.2408 -0.1574 -0.0087 0.0263  74  THR L O   
3478 C CB  . THR C 75  ? 0.4914 0.4208 0.2473 -0.1900 -0.0239 0.0467  74  THR L CB  
3479 O OG1 . THR C 75  ? 0.5145 0.4060 0.2505 -0.1926 -0.0358 0.0538  74  THR L OG1 
3480 C CG2 . THR C 75  ? 0.5165 0.4666 0.2658 -0.2096 -0.0200 0.0501  74  THR L CG2 
3481 N N   . ILE C 76  ? 0.4312 0.4115 0.2386 -0.1715 -0.0097 0.0317  75  ILE L N   
3482 C CA  . ILE C 76  ? 0.4155 0.4335 0.2394 -0.1701 -0.0007 0.0234  75  ILE L CA  
3483 C C   . ILE C 76  ? 0.4397 0.4757 0.2506 -0.1911 0.0021  0.0274  75  ILE L C   
3484 O O   . ILE C 76  ? 0.4572 0.4819 0.2596 -0.2026 -0.0018 0.0343  75  ILE L O   
3485 C CB  . ILE C 76  ? 0.3954 0.4190 0.2379 -0.1604 0.0001  0.0194  75  ILE L CB  
3486 C CG1 . ILE C 76  ? 0.3833 0.3812 0.2318 -0.1456 -0.0054 0.0203  75  ILE L CG1 
3487 C CG2 . ILE C 76  ? 0.3801 0.4392 0.2403 -0.1539 0.0072  0.0087  75  ILE L CG2 
3488 C CD1 . ILE C 76  ? 0.3834 0.3860 0.2488 -0.1365 -0.0050 0.0170  75  ILE L CD1 
3489 N N   . SER C 77  ? 0.4643 0.5258 0.2719 -0.1967 0.0078  0.0237  76  SER L N   
3490 C CA  . SER C 77  ? 0.5056 0.5857 0.2969 -0.2195 0.0104  0.0288  76  SER L CA  
3491 C C   . SER C 77  ? 0.5153 0.6223 0.3163 -0.2274 0.0147  0.0268  76  SER L C   
3492 O O   . SER C 77  ? 0.5355 0.6351 0.3220 -0.2467 0.0110  0.0365  76  SER L O   
3493 C CB  . SER C 77  ? 0.5141 0.6212 0.3027 -0.2206 0.0165  0.0230  76  SER L CB  
3494 O OG  . SER C 77  ? 0.5036 0.6430 0.3149 -0.2045 0.0231  0.0089  76  SER L OG  
3495 N N   . THR C 78  ? 0.5044 0.6373 0.3287 -0.2122 0.0203  0.0149  77  THR L N   
3496 C CA  . THR C 78  ? 0.5032 0.6643 0.3405 -0.2158 0.0243  0.0105  77  THR L CA  
3497 C C   . THR C 78  ? 0.4716 0.6254 0.3305 -0.1942 0.0230  0.0030  77  THR L C   
3498 O O   . THR C 78  ? 0.4496 0.6246 0.3251 -0.1786 0.0264  -0.0090 77  THR L O   
3499 C CB  . THR C 78  ? 0.5030 0.7151 0.3440 -0.2232 0.0329  0.0021  77  THR L CB  
3500 O OG1 . THR C 78  ? 0.5142 0.7426 0.3706 -0.2024 0.0359  -0.0115 77  THR L OG1 
3501 C CG2 . THR C 78  ? 0.5415 0.7590 0.3593 -0.2446 0.0338  0.0104  77  THR L CG2 
3502 N N   . VAL C 79  ? 0.4539 0.5782 0.3115 -0.1936 0.0173  0.0099  78  VAL L N   
3503 C CA  . VAL C 79  ? 0.4345 0.5473 0.3095 -0.1746 0.0150  0.0051  78  VAL L CA  
3504 C C   . VAL C 79  ? 0.4231 0.5713 0.3174 -0.1686 0.0200  -0.0057 78  VAL L C   
3505 O O   . VAL C 79  ? 0.4233 0.5983 0.3166 -0.1820 0.0239  -0.0065 78  VAL L O   
3506 C CB  . VAL C 79  ? 0.4385 0.5176 0.3068 -0.1768 0.0081  0.0141  78  VAL L CB  
3507 C CG1 . VAL C 79  ? 0.4480 0.5369 0.3133 -0.1918 0.0081  0.0178  78  VAL L CG1 
3508 C CG2 . VAL C 79  ? 0.4323 0.4969 0.3151 -0.1577 0.0053  0.0106  78  VAL L CG2 
3509 N N   . GLN C 80  ? 0.4117 0.5605 0.3224 -0.1493 0.0191  -0.0142 79  GLN L N   
3510 C CA  . GLN C 80  ? 0.4049 0.5819 0.3344 -0.1401 0.0212  -0.0256 79  GLN L CA  
3511 C C   . GLN C 80  ? 0.3776 0.5341 0.3161 -0.1314 0.0166  -0.0234 79  GLN L C   
3512 O O   . GLN C 80  ? 0.3605 0.4842 0.2929 -0.1287 0.0122  -0.0154 79  GLN L O   
3513 C CB  . GLN C 80  ? 0.4130 0.6078 0.3518 -0.1256 0.0218  -0.0378 79  GLN L CB  
3514 C CG  . GLN C 80  ? 0.4521 0.6716 0.3812 -0.1352 0.0270  -0.0404 79  GLN L CG  
3515 C CD  . GLN C 80  ? 0.4727 0.7086 0.4086 -0.1206 0.0267  -0.0530 79  GLN L CD  
3516 O OE1 . GLN C 80  ? 0.5071 0.7634 0.4351 -0.1265 0.0307  -0.0560 79  GLN L OE1 
3517 N NE2 . GLN C 80  ? 0.4788 0.7062 0.4284 -0.1018 0.0210  -0.0607 79  GLN L NE2 
3518 N N   . ALA C 81  ? 0.3663 0.5435 0.3187 -0.1270 0.0174  -0.0309 80  ALA L N   
3519 C CA  . ALA C 81  ? 0.3556 0.5182 0.3169 -0.1198 0.0133  -0.0296 80  ALA L CA  
3520 C C   . ALA C 81  ? 0.3447 0.4808 0.3094 -0.1052 0.0079  -0.0284 80  ALA L C   
3521 O O   . ALA C 81  ? 0.3364 0.4497 0.3000 -0.1037 0.0044  -0.0216 80  ALA L O   
3522 C CB  . ALA C 81  ? 0.3486 0.5414 0.3255 -0.1145 0.0144  -0.0407 80  ALA L CB  
3523 N N   . GLU C 82  ? 0.3412 0.4817 0.3096 -0.0952 0.0066  -0.0349 81  GLU L N   
3524 C CA  . GLU C 82  ? 0.3413 0.4603 0.3141 -0.0818 0.0004  -0.0347 81  GLU L CA  
3525 C C   . GLU C 82  ? 0.3423 0.4347 0.3031 -0.0854 -0.0005 -0.0244 81  GLU L C   
3526 O O   . GLU C 82  ? 0.3373 0.4119 0.3006 -0.0769 -0.0054 -0.0221 81  GLU L O   
3527 C CB  . GLU C 82  ? 0.3668 0.4998 0.3475 -0.0698 -0.0024 -0.0463 81  GLU L CB  
3528 C CG  . GLU C 82  ? 0.3848 0.5305 0.3578 -0.0736 0.0015  -0.0495 81  GLU L CG  
3529 C CD  . GLU C 82  ? 0.4274 0.6106 0.4026 -0.0791 0.0074  -0.0584 81  GLU L CD  
3530 O OE1 . GLU C 82  ? 0.4214 0.6199 0.4015 -0.0847 0.0100  -0.0594 81  GLU L OE1 
3531 O OE2 . GLU C 82  ? 0.4628 0.6620 0.4346 -0.0782 0.0094  -0.0646 81  GLU L OE2 
3532 N N   . ASP C 83  ? 0.3334 0.4229 0.2810 -0.0980 0.0029  -0.0182 82  ASP L N   
3533 C CA  . ASP C 83  ? 0.3355 0.4000 0.2702 -0.1011 0.0009  -0.0095 82  ASP L CA  
3534 C C   . ASP C 83  ? 0.3333 0.3768 0.2651 -0.1019 -0.0024 -0.0019 82  ASP L C   
3535 O O   . ASP C 83  ? 0.3421 0.3646 0.2643 -0.1021 -0.0054 0.0041  82  ASP L O   
3536 C CB  . ASP C 83  ? 0.3571 0.4257 0.2772 -0.1139 0.0041  -0.0065 82  ASP L CB  
3537 C CG  . ASP C 83  ? 0.3558 0.4462 0.2776 -0.1120 0.0074  -0.0145 82  ASP L CG  
3538 O OD1 . ASP C 83  ? 0.3430 0.4373 0.2755 -0.0988 0.0053  -0.0216 82  ASP L OD1 
3539 O OD2 . ASP C 83  ? 0.3626 0.4660 0.2742 -0.1241 0.0113  -0.0134 82  ASP L OD2 
3540 N N   . LEU C 84  ? 0.3309 0.3796 0.2706 -0.1010 -0.0026 -0.0030 83  LEU L N   
3541 C CA  . LEU C 84  ? 0.3323 0.3614 0.2692 -0.0997 -0.0065 0.0031  83  LEU L CA  
3542 C C   . LEU C 84  ? 0.2977 0.3135 0.2380 -0.0891 -0.0101 0.0047  83  LEU L C   
3543 O O   . LEU C 84  ? 0.2847 0.3074 0.2354 -0.0812 -0.0110 0.0005  83  LEU L O   
3544 C CB  . LEU C 84  ? 0.3507 0.3888 0.2957 -0.1003 -0.0062 0.0012  83  LEU L CB  
3545 C CG  . LEU C 84  ? 0.3695 0.4157 0.3296 -0.0897 -0.0076 -0.0038 83  LEU L CG  
3546 C CD1 . LEU C 84  ? 0.3773 0.4074 0.3386 -0.0834 -0.0117 0.0007  83  LEU L CD1 
3547 C CD2 . LEU C 84  ? 0.3977 0.4620 0.3654 -0.0925 -0.0057 -0.0087 83  LEU L CD2 
3548 N N   . ALA C 85  ? 0.2972 0.2948 0.2282 -0.0892 -0.0132 0.0103  84  ALA L N   
3549 C CA  . ALA C 85  ? 0.2865 0.2744 0.2191 -0.0810 -0.0163 0.0123  84  ALA L CA  
3550 C C   . ALA C 85  ? 0.2920 0.2629 0.2129 -0.0818 -0.0200 0.0169  84  ALA L C   
3551 O O   . ALA C 85  ? 0.3055 0.2694 0.2153 -0.0895 -0.0208 0.0187  84  ALA L O   
3552 C CB  . ALA C 85  ? 0.2933 0.2839 0.2261 -0.0792 -0.0155 0.0101  84  ALA L CB  
3553 N N   . VAL C 86  ? 0.2832 0.2485 0.2057 -0.0746 -0.0230 0.0185  85  VAL L N   
3554 C CA  . VAL C 86  ? 0.3052 0.2560 0.2165 -0.0729 -0.0273 0.0208  85  VAL L CA  
3555 C C   . VAL C 86  ? 0.3179 0.2656 0.2254 -0.0731 -0.0271 0.0209  85  VAL L C   
3556 O O   . VAL C 86  ? 0.3187 0.2744 0.2354 -0.0695 -0.0257 0.0199  85  VAL L O   
3557 C CB  . VAL C 86  ? 0.3109 0.2625 0.2266 -0.0648 -0.0306 0.0213  85  VAL L CB  
3558 C CG1 . VAL C 86  ? 0.3239 0.2625 0.2282 -0.0612 -0.0362 0.0215  85  VAL L CG1 
3559 C CG2 . VAL C 86  ? 0.3173 0.2745 0.2382 -0.0643 -0.0302 0.0207  85  VAL L CG2 
3560 N N   . TYR C 87  ? 0.3387 0.2736 0.2321 -0.0777 -0.0294 0.0223  86  TYR L N   
3561 C CA  . TYR C 87  ? 0.3361 0.2658 0.2235 -0.0780 -0.0300 0.0226  86  TYR L CA  
3562 C C   . TYR C 87  ? 0.3599 0.2766 0.2407 -0.0717 -0.0363 0.0236  86  TYR L C   
3563 O O   . TYR C 87  ? 0.3766 0.2829 0.2499 -0.0703 -0.0415 0.0239  86  TYR L O   
3564 C CB  . TYR C 87  ? 0.3435 0.2695 0.2187 -0.0886 -0.0285 0.0236  86  TYR L CB  
3565 C CG  . TYR C 87  ? 0.3455 0.2902 0.2287 -0.0935 -0.0220 0.0209  86  TYR L CG  
3566 C CD1 . TYR C 87  ? 0.3411 0.2932 0.2271 -0.0984 -0.0202 0.0206  86  TYR L CD1 
3567 C CD2 . TYR C 87  ? 0.3354 0.2917 0.2231 -0.0928 -0.0184 0.0175  86  TYR L CD2 
3568 C CE1 . TYR C 87  ? 0.3320 0.3044 0.2263 -0.1018 -0.0146 0.0166  86  TYR L CE1 
3569 C CE2 . TYR C 87  ? 0.3308 0.3069 0.2264 -0.0951 -0.0134 0.0129  86  TYR L CE2 
3570 C CZ  . TYR C 87  ? 0.3270 0.3123 0.2263 -0.0996 -0.0113 0.0122  86  TYR L CZ  
3571 O OH  . TYR C 87  ? 0.3174 0.3251 0.2249 -0.1012 -0.0068 0.0064  86  TYR L OH  
3572 N N   . PHE C 88  ? 0.3355 0.2546 0.2205 -0.0664 -0.0369 0.0232  87  PHE L N   
3573 C CA  . PHE C 88  ? 0.3402 0.2525 0.2216 -0.0590 -0.0427 0.0229  87  PHE L CA  
3574 C C   . PHE C 88  ? 0.3441 0.2489 0.2187 -0.0596 -0.0442 0.0232  87  PHE L C   
3575 O O   . PHE C 88  ? 0.3359 0.2478 0.2159 -0.0623 -0.0399 0.0232  87  PHE L O   
3576 C CB  . PHE C 88  ? 0.3527 0.2798 0.2480 -0.0520 -0.0423 0.0225  87  PHE L CB  
3577 C CG  . PHE C 88  ? 0.3566 0.2942 0.2602 -0.0502 -0.0410 0.0223  87  PHE L CG  
3578 C CD1 . PHE C 88  ? 0.3764 0.3148 0.2779 -0.0439 -0.0452 0.0205  87  PHE L CD1 
3579 C CD2 . PHE C 88  ? 0.3549 0.3026 0.2687 -0.0535 -0.0364 0.0231  87  PHE L CD2 
3580 C CE1 . PHE C 88  ? 0.3788 0.3282 0.2876 -0.0420 -0.0439 0.0202  87  PHE L CE1 
3581 C CE2 . PHE C 88  ? 0.3440 0.3007 0.2648 -0.0519 -0.0356 0.0233  87  PHE L CE2 
3582 C CZ  . PHE C 88  ? 0.3562 0.3138 0.2742 -0.0467 -0.0390 0.0221  87  PHE L CZ  
3583 N N   . CYS C 89  ? 0.3564 0.2471 0.2195 -0.0563 -0.0509 0.0227  88  CYS L N   
3584 C CA  . CYS C 89  ? 0.3688 0.2518 0.2255 -0.0549 -0.0538 0.0226  88  CYS L CA  
3585 C C   . CYS C 89  ? 0.3540 0.2473 0.2206 -0.0454 -0.0563 0.0207  88  CYS L C   
3586 O O   . CYS C 89  ? 0.3430 0.2460 0.2166 -0.0399 -0.0573 0.0192  88  CYS L O   
3587 C CB  . CYS C 89  ? 0.4056 0.2657 0.2421 -0.0578 -0.0612 0.0233  88  CYS L CB  
3588 S SG  . CYS C 89  ? 0.4434 0.2908 0.2719 -0.0484 -0.0722 0.0199  88  CYS L SG  
3589 N N   . GLN C 90  ? 0.3453 0.2395 0.2133 -0.0442 -0.0567 0.0209  89  GLN L N   
3590 C CA  . GLN C 90  ? 0.3344 0.2394 0.2107 -0.0369 -0.0596 0.0195  89  GLN L CA  
3591 C C   . GLN C 90  ? 0.3478 0.2404 0.2145 -0.0356 -0.0641 0.0187  89  GLN L C   
3592 O O   . GLN C 90  ? 0.3544 0.2412 0.2176 -0.0412 -0.0613 0.0204  89  GLN L O   
3593 C CB  . GLN C 90  ? 0.3215 0.2440 0.2135 -0.0389 -0.0548 0.0218  89  GLN L CB  
3594 C CG  . GLN C 90  ? 0.3236 0.2601 0.2241 -0.0342 -0.0577 0.0217  89  GLN L CG  
3595 C CD  . GLN C 90  ? 0.3357 0.2778 0.2443 -0.0381 -0.0566 0.0247  89  GLN L CD  
3596 O OE1 . GLN C 90  ? 0.3349 0.2786 0.2489 -0.0426 -0.0535 0.0266  89  GLN L OE1 
3597 N NE2 . GLN C 90  ? 0.3573 0.3015 0.2663 -0.0357 -0.0604 0.0244  89  GLN L NE2 
3598 N N   . GLN C 91  ? 0.3582 0.2504 0.2223 -0.0276 -0.0707 0.0155  90  GLN L N   
3599 C CA  . GLN C 91  ? 0.3636 0.2463 0.2205 -0.0247 -0.0761 0.0142  90  GLN L CA  
3600 C C   . GLN C 91  ? 0.3542 0.2578 0.2263 -0.0218 -0.0748 0.0143  90  GLN L C   
3601 O O   . GLN C 91  ? 0.3271 0.2511 0.2111 -0.0189 -0.0736 0.0137  90  GLN L O   
3602 C CB  . GLN C 91  ? 0.3733 0.2412 0.2167 -0.0169 -0.0862 0.0096  90  GLN L CB  
3603 C CG  . GLN C 91  ? 0.3622 0.2475 0.2140 -0.0056 -0.0906 0.0039  90  GLN L CG  
3604 C CD  . GLN C 91  ? 0.3616 0.2624 0.2215 0.0004  -0.0931 0.0012  90  GLN L CD  
3605 O OE1 . GLN C 91  ? 0.3780 0.2690 0.2331 -0.0011 -0.0949 0.0023  90  GLN L OE1 
3606 N NE2 . GLN C 91  ? 0.3430 0.2701 0.2154 0.0071  -0.0932 -0.0023 90  GLN L NE2 
3607 N N   . ASP C 92  ? 0.3394 0.2392 0.2106 -0.0235 -0.0756 0.0154  91  ASP L N   
3608 C CA  . ASP C 92  ? 0.3408 0.2581 0.2240 -0.0208 -0.0771 0.0154  91  ASP L CA  
3609 C C   . ASP C 92  ? 0.3535 0.2595 0.2278 -0.0166 -0.0835 0.0128  91  ASP L C   
3610 O O   . ASP C 92  ? 0.3417 0.2568 0.2233 -0.0170 -0.0846 0.0138  91  ASP L O   
3611 C CB  . ASP C 92  ? 0.3407 0.2672 0.2351 -0.0279 -0.0724 0.0201  91  ASP L CB  
3612 C CG  . ASP C 92  ? 0.3503 0.2616 0.2383 -0.0320 -0.0718 0.0212  91  ASP L CG  
3613 O OD1 . ASP C 92  ? 0.3634 0.2598 0.2402 -0.0345 -0.0695 0.0206  91  ASP L OD1 
3614 O OD2 . ASP C 92  ? 0.3730 0.2885 0.2668 -0.0331 -0.0739 0.0227  91  ASP L OD2 
3615 N N   . TYR C 93  ? 0.3837 0.2707 0.2427 -0.0125 -0.0891 0.0095  92  TYR L N   
3616 C CA  . TYR C 93  ? 0.4044 0.2800 0.2540 -0.0068 -0.0972 0.0062  92  TYR L CA  
3617 C C   . TYR C 93  ? 0.3993 0.2967 0.2594 0.0027  -0.1019 0.0010  92  TYR L C   
3618 O O   . TYR C 93  ? 0.4019 0.3080 0.2674 0.0046  -0.1043 0.0002  92  TYR L O   
3619 C CB  . TYR C 93  ? 0.4458 0.2929 0.2743 -0.0058 -0.1039 0.0046  92  TYR L CB  
3620 C CG  . TYR C 93  ? 0.4851 0.3163 0.3015 -0.0007 -0.1132 0.0015  92  TYR L CG  
3621 C CD1 . TYR C 93  ? 0.5205 0.3395 0.3296 -0.0068 -0.1121 0.0049  92  TYR L CD1 
3622 C CD2 . TYR C 93  ? 0.5198 0.3500 0.3327 0.0113  -0.1238 -0.0055 92  TYR L CD2 
3623 C CE1 . TYR C 93  ? 0.5429 0.3463 0.3402 -0.0023 -0.1211 0.0023  92  TYR L CE1 
3624 C CE2 . TYR C 93  ? 0.5557 0.3704 0.3573 0.0168  -0.1336 -0.0089 92  TYR L CE2 
3625 C CZ  . TYR C 93  ? 0.5716 0.3716 0.3648 0.0094  -0.1321 -0.0044 92  TYR L CZ  
3626 O OH  . TYR C 93  ? 0.6286 0.4128 0.4102 0.0147  -0.1421 -0.0075 92  TYR L OH  
3627 N N   . GLY C 94  ? 0.3956 0.3040 0.2589 0.0086  -0.1032 -0.0027 93  GLY L N   
3628 C CA  . GLY C 94  ? 0.4140 0.3486 0.2873 0.0187  -0.1075 -0.0092 93  GLY L CA  
3629 C C   . GLY C 94  ? 0.4030 0.3705 0.2949 0.0140  -0.0998 -0.0058 93  GLY L C   
3630 O O   . GLY C 94  ? 0.4351 0.4002 0.3300 0.0053  -0.0926 0.0001  93  GLY L O   
3631 N N   . SER C 95  ? 0.3970 0.3949 0.3007 0.0184  -0.1016 -0.0091 94  SER L N   
3632 C CA  . SER C 95  ? 0.3843 0.4170 0.3044 0.0131  -0.0956 -0.0057 94  SER L CA  
3633 C C   . SER C 95  ? 0.3711 0.4234 0.2930 0.0236  -0.0979 -0.0138 94  SER L C   
3634 O O   . SER C 95  ? 0.3858 0.4430 0.3039 0.0365  -0.1058 -0.0236 94  SER L O   
3635 C CB  . SER C 95  ? 0.3879 0.4444 0.3191 0.0089  -0.0963 -0.0033 94  SER L CB  
3636 O OG  . SER C 95  ? 0.4039 0.4908 0.3486 0.0003  -0.0911 0.0021  94  SER L OG  
3637 N N   . PRO C 96  ? 0.3474 0.4120 0.2747 0.0198  -0.0923 -0.0111 95  PRO L N   
3638 C CA  . PRO C 96  ? 0.3299 0.3891 0.2616 0.0059  -0.0844 -0.0006 95  PRO L CA  
3639 C C   . PRO C 96  ? 0.3282 0.3508 0.2481 0.0030  -0.0828 0.0018  95  PRO L C   
3640 O O   . PRO C 96  ? 0.3523 0.3552 0.2601 0.0105  -0.0874 -0.0035 95  PRO L O   
3641 C CB  . PRO C 96  ? 0.3289 0.4156 0.2691 0.0056  -0.0806 -0.0007 95  PRO L CB  
3642 C CG  . PRO C 96  ? 0.3370 0.4248 0.2704 0.0209  -0.0865 -0.0122 95  PRO L CG  
3643 C CD  . PRO C 96  ? 0.3474 0.4322 0.2764 0.0300  -0.0943 -0.0192 95  PRO L CD  
3644 N N   . PRO C 97  ? 0.3110 0.3244 0.2335 -0.0080 -0.0772 0.0099  96  PRO L N   
3645 C CA  . PRO C 97  ? 0.3055 0.2932 0.2192 -0.0116 -0.0742 0.0119  96  PRO L CA  
3646 C C   . PRO C 97  ? 0.3159 0.3071 0.2283 -0.0077 -0.0734 0.0090  96  PRO L C   
3647 O O   . PRO C 97  ? 0.2907 0.3074 0.2128 -0.0067 -0.0718 0.0087  96  PRO L O   
3648 C CB  . PRO C 97  ? 0.2982 0.2862 0.2193 -0.0226 -0.0689 0.0195  96  PRO L CB  
3649 C CG  . PRO C 97  ? 0.3028 0.3091 0.2335 -0.0257 -0.0708 0.0224  96  PRO L CG  
3650 C CD  . PRO C 97  ? 0.3047 0.3326 0.2382 -0.0177 -0.0746 0.0170  96  PRO L CD  
3651 N N   . THR C 98  ? 0.3338 0.3005 0.2338 -0.0067 -0.0746 0.0074  97  THR L N   
3652 C CA  . THR C 98  ? 0.3367 0.3024 0.2332 -0.0024 -0.0757 0.0040  97  THR L CA  
3653 C C   . THR C 98  ? 0.3401 0.2843 0.2293 -0.0102 -0.0722 0.0079  97  THR L C   
3654 O O   . THR C 98  ? 0.3480 0.2752 0.2303 -0.0159 -0.0715 0.0107  97  THR L O   
3655 C CB  . THR C 98  ? 0.3554 0.3144 0.2417 0.0100  -0.0856 -0.0046 97  THR L CB  
3656 O OG1 . THR C 98  ? 0.3780 0.3092 0.2499 0.0100  -0.0913 -0.0051 97  THR L OG1 
3657 C CG2 . THR C 98  ? 0.3599 0.3482 0.2556 0.0192  -0.0886 -0.0104 97  THR L CG2 
3658 N N   . PHE C 99  ? 0.3238 0.2728 0.2157 -0.0110 -0.0696 0.0081  98  PHE L N   
3659 C CA  . PHE C 99  ? 0.3277 0.2627 0.2155 -0.0191 -0.0654 0.0117  98  PHE L CA  
3660 C C   . PHE C 99  ? 0.3433 0.2620 0.2185 -0.0156 -0.0713 0.0082  98  PHE L C   
3661 O O   . PHE C 99  ? 0.3529 0.2780 0.2275 -0.0058 -0.0770 0.0027  98  PHE L O   
3662 C CB  . PHE C 99  ? 0.3098 0.2631 0.2112 -0.0236 -0.0585 0.0151  98  PHE L CB  
3663 C CG  . PHE C 99  ? 0.2911 0.2565 0.2035 -0.0288 -0.0545 0.0195  98  PHE L CG  
3664 C CD1 . PHE C 99  ? 0.2945 0.2526 0.2085 -0.0361 -0.0504 0.0229  98  PHE L CD1 
3665 C CD2 . PHE C 99  ? 0.2951 0.2797 0.2158 -0.0263 -0.0558 0.0199  98  PHE L CD2 
3666 C CE1 . PHE C 99  ? 0.2844 0.2512 0.2076 -0.0399 -0.0491 0.0263  98  PHE L CE1 
3667 C CE2 . PHE C 99  ? 0.2918 0.2852 0.2214 -0.0324 -0.0540 0.0248  98  PHE L CE2 
3668 C CZ  . PHE C 99  ? 0.2838 0.2658 0.2140 -0.0387 -0.0514 0.0279  98  PHE L CZ  
3669 N N   . GLY C 100 ? 0.3588 0.2587 0.2245 -0.0238 -0.0703 0.0112  99  GLY L N   
3670 C CA  . GLY C 100 ? 0.3730 0.2567 0.2273 -0.0246 -0.0752 0.0101  99  GLY L CA  
3671 C C   . GLY C 100 ? 0.3733 0.2733 0.2387 -0.0237 -0.0707 0.0098  99  GLY L C   
3672 O O   . GLY C 100 ? 0.3526 0.2734 0.2332 -0.0258 -0.0628 0.0122  99  GLY L O   
3673 N N   . GLY C 101 ? 0.3901 0.2786 0.2468 -0.0214 -0.0766 0.0074  100 GLY L N   
3674 C CA  . GLY C 101 ? 0.3962 0.2976 0.2613 -0.0201 -0.0736 0.0066  100 GLY L CA  
3675 C C   . GLY C 101 ? 0.3819 0.2832 0.2508 -0.0317 -0.0660 0.0118  100 GLY L C   
3676 O O   . GLY C 101 ? 0.3928 0.3050 0.2693 -0.0313 -0.0630 0.0116  100 GLY L O   
3677 N N   . GLY C 102 ? 0.3859 0.2778 0.2500 -0.0416 -0.0628 0.0158  101 GLY L N   
3678 C CA  . GLY C 102 ? 0.3719 0.2696 0.2416 -0.0516 -0.0551 0.0192  101 GLY L CA  
3679 C C   . GLY C 102 ? 0.3950 0.2764 0.2518 -0.0600 -0.0586 0.0209  101 GLY L C   
3680 O O   . GLY C 102 ? 0.4355 0.3003 0.2803 -0.0566 -0.0681 0.0191  101 GLY L O   
3681 N N   . THR C 103 ? 0.3911 0.2775 0.2499 -0.0707 -0.0521 0.0237  102 THR L N   
3682 C CA  . THR C 103 ? 0.4059 0.2835 0.2549 -0.0822 -0.0533 0.0263  102 THR L CA  
3683 C C   . THR C 103 ? 0.4038 0.3021 0.2676 -0.0857 -0.0445 0.0259  102 THR L C   
3684 O O   . THR C 103 ? 0.3740 0.2868 0.2471 -0.0869 -0.0375 0.0253  102 THR L O   
3685 C CB  . THR C 103 ? 0.4184 0.2853 0.2529 -0.0938 -0.0542 0.0299  102 THR L CB  
3686 O OG1 . THR C 103 ? 0.4313 0.2750 0.2497 -0.0908 -0.0644 0.0304  102 THR L OG1 
3687 C CG2 . THR C 103 ? 0.4349 0.3001 0.2617 -0.1083 -0.0537 0.0333  102 THR L CG2 
3688 N N   . LYS C 104 ? 0.4092 0.3086 0.2755 -0.0857 -0.0458 0.0253  103 LYS L N   
3689 C CA  . LYS C 104 ? 0.4010 0.3194 0.2809 -0.0891 -0.0384 0.0244  103 LYS L CA  
3690 C C   . LYS C 104 ? 0.4001 0.3205 0.2736 -0.1031 -0.0361 0.0265  103 LYS L C   
3691 O O   . LYS C 104 ? 0.4414 0.3475 0.3018 -0.1108 -0.0421 0.0292  103 LYS L O   
3692 C CB  . LYS C 104 ? 0.4266 0.3473 0.3122 -0.0841 -0.0404 0.0229  103 LYS L CB  
3693 C CG  . LYS C 104 ? 0.4299 0.3696 0.3298 -0.0863 -0.0336 0.0216  103 LYS L CG  
3694 C CD  . LYS C 104 ? 0.4711 0.4122 0.3754 -0.0817 -0.0360 0.0204  103 LYS L CD  
3695 C CE  . LYS C 104 ? 0.4641 0.4237 0.3842 -0.0803 -0.0304 0.0185  103 LYS L CE  
3696 N NZ  . LYS C 104 ? 0.5235 0.4825 0.4456 -0.0761 -0.0334 0.0177  103 LYS L NZ  
3697 N N   . VAL C 105 ? 0.3841 0.3231 0.2667 -0.1065 -0.0285 0.0248  104 VAL L N   
3698 C CA  . VAL C 105 ? 0.3974 0.3466 0.2758 -0.1201 -0.0249 0.0257  104 VAL L CA  
3699 C C   . VAL C 105 ? 0.3935 0.3619 0.2856 -0.1204 -0.0204 0.0223  104 VAL L C   
3700 O O   . VAL C 105 ? 0.3683 0.3519 0.2755 -0.1122 -0.0162 0.0178  104 VAL L O   
3701 C CB  . VAL C 105 ? 0.3909 0.3505 0.2690 -0.1225 -0.0201 0.0243  104 VAL L CB  
3702 C CG1 . VAL C 105 ? 0.3956 0.3752 0.2730 -0.1353 -0.0148 0.0233  104 VAL L CG1 
3703 C CG2 . VAL C 105 ? 0.4090 0.3475 0.2712 -0.1239 -0.0255 0.0282  104 VAL L CG2 
3704 N N   . GLU C 106 ? 0.4189 0.3847 0.3053 -0.1296 -0.0229 0.0246  105 GLU L N   
3705 C CA  . GLU C 106 ? 0.4272 0.4105 0.3261 -0.1302 -0.0196 0.0214  105 GLU L CA  
3706 C C   . GLU C 106 ? 0.4167 0.4171 0.3122 -0.1456 -0.0159 0.0218  105 GLU L C   
3707 O O   . GLU C 106 ? 0.4217 0.4121 0.3004 -0.1584 -0.0187 0.0272  105 GLU L O   
3708 C CB  . GLU C 106 ? 0.4687 0.4376 0.3648 -0.1283 -0.0257 0.0233  105 GLU L CB  
3709 C CG  . GLU C 106 ? 0.5054 0.4520 0.3948 -0.1182 -0.0324 0.0247  105 GLU L CG  
3710 C CD  . GLU C 106 ? 0.5604 0.4964 0.4483 -0.1139 -0.0385 0.0246  105 GLU L CD  
3711 O OE1 . GLU C 106 ? 0.6443 0.5591 0.5166 -0.1183 -0.0472 0.0275  105 GLU L OE1 
3712 O OE2 . GLU C 106 ? 0.5745 0.5223 0.4759 -0.1063 -0.0357 0.0215  105 GLU L OE2 
3713 N N   . ILE C 107 ? 0.3845 0.4109 0.2949 -0.1445 -0.0103 0.0161  106 ILE L N   
3714 C CA  . ILE C 107 ? 0.3840 0.4368 0.2950 -0.1576 -0.0051 0.0140  106 ILE L CA  
3715 C C   . ILE C 107 ? 0.3972 0.4519 0.3052 -0.1690 -0.0076 0.0170  106 ILE L C   
3716 O O   . ILE C 107 ? 0.3856 0.4377 0.3030 -0.1612 -0.0094 0.0149  106 ILE L O   
3717 C CB  . ILE C 107 ? 0.3619 0.4444 0.2908 -0.1483 0.0011  0.0041  106 ILE L CB  
3718 C CG1 . ILE C 107 ? 0.3557 0.4338 0.2861 -0.1377 0.0020  0.0015  106 ILE L CG1 
3719 C CG2 . ILE C 107 ? 0.3696 0.4851 0.3004 -0.1608 0.0065  0.0003  106 ILE L CG2 
3720 C CD1 . ILE C 107 ? 0.3738 0.4443 0.2883 -0.1469 0.0023  0.0064  106 ILE L CD1 
3721 N N   . LYS C 108 ? 0.4102 0.4700 0.3053 -0.1879 -0.0080 0.0221  107 LYS L N   
3722 C CA  . LYS C 108 ? 0.4255 0.4932 0.3180 -0.2024 -0.0100 0.0250  107 LYS L CA  
3723 C C   . LYS C 108 ? 0.4065 0.5187 0.3133 -0.2068 -0.0011 0.0174  107 LYS L C   
3724 O O   . LYS C 108 ? 0.4224 0.5547 0.3288 -0.2100 0.0043  0.0146  107 LYS L O   
3725 C CB  . LYS C 108 ? 0.4669 0.5121 0.3349 -0.2219 -0.0177 0.0360  107 LYS L CB  
3726 C CG  . LYS C 108 ? 0.5005 0.5497 0.3627 -0.2397 -0.0218 0.0408  107 LYS L CG  
3727 C CD  . LYS C 108 ? 0.5542 0.6001 0.3947 -0.2646 -0.0258 0.0505  107 LYS L CD  
3728 C CE  . LYS C 108 ? 0.6034 0.6506 0.4352 -0.2853 -0.0317 0.0571  107 LYS L CE  
3729 N NZ  . LYS C 108 ? 0.6355 0.6423 0.4592 -0.2792 -0.0442 0.0607  107 LYS L NZ  
3730 N N   . ARG C 109 ? 0.3919 0.5204 0.3118 -0.2050 -0.0001 0.0128  108 ARG L N   
3731 C CA  . ARG C 109 ? 0.3749 0.5488 0.3086 -0.2097 0.0070  0.0045  108 ARG L CA  
3732 C C   . ARG C 109 ? 0.3855 0.5684 0.3197 -0.2230 0.0047  0.0071  108 ARG L C   
3733 O O   . ARG C 109 ? 0.3900 0.5411 0.3126 -0.2283 -0.0031 0.0156  108 ARG L O   
3734 C CB  . ARG C 109 ? 0.3501 0.5403 0.3050 -0.1880 0.0106  -0.0079 108 ARG L CB  
3735 C CG  . ARG C 109 ? 0.3475 0.5148 0.3099 -0.1738 0.0056  -0.0082 108 ARG L CG  
3736 C CD  . ARG C 109 ? 0.3329 0.5246 0.3159 -0.1592 0.0078  -0.0203 108 ARG L CD  
3737 N NE  . ARG C 109 ? 0.3415 0.5660 0.3319 -0.1688 0.0104  -0.0251 108 ARG L NE  
3738 C CZ  . ARG C 109 ? 0.3337 0.5920 0.3410 -0.1605 0.0131  -0.0376 108 ARG L CZ  
3739 N NH1 . ARG C 109 ? 0.3277 0.5886 0.3454 -0.1419 0.0125  -0.0467 108 ARG L NH1 
3740 N NH2 . ARG C 109 ? 0.3451 0.6346 0.3580 -0.1712 0.0155  -0.0412 108 ARG L NH2 
3741 N N   . THR C 110 ? 0.3644 0.5901 0.3121 -0.2269 0.0105  -0.0009 109 THR L N   
3742 C CA  . THR C 110 ? 0.3771 0.6193 0.3276 -0.2405 0.0092  0.0003  109 THR L CA  
3743 C C   . THR C 110 ? 0.3685 0.5914 0.3294 -0.2250 0.0045  -0.0024 109 THR L C   
3744 O O   . THR C 110 ? 0.3360 0.5415 0.3040 -0.2042 0.0037  -0.0066 109 THR L O   
3745 C CB  . THR C 110 ? 0.3762 0.6749 0.3394 -0.2473 0.0174  -0.0093 109 THR L CB  
3746 O OG1 . THR C 110 ? 0.3672 0.6841 0.3514 -0.2237 0.0207  -0.0240 109 THR L OG1 
3747 C CG2 . THR C 110 ? 0.3832 0.7011 0.3346 -0.2621 0.0222  -0.0065 109 THR L CG2 
3748 N N   . VAL C 111 ? 0.3589 0.5826 0.3189 -0.2359 0.0007  0.0010  110 VAL L N   
3749 C CA  . VAL C 111 ? 0.3561 0.5649 0.3260 -0.2222 -0.0037 -0.0019 110 VAL L CA  
3750 C C   . VAL C 111 ? 0.3290 0.5698 0.3221 -0.2054 0.0015  -0.0161 110 VAL L C   
3751 O O   . VAL C 111 ? 0.3166 0.5988 0.3191 -0.2102 0.0073  -0.0237 110 VAL L O   
3752 C CB  . VAL C 111 ? 0.3728 0.5756 0.3356 -0.2388 -0.0098 0.0048  110 VAL L CB  
3753 C CG1 . VAL C 111 ? 0.3662 0.5607 0.3407 -0.2253 -0.0135 0.0004  110 VAL L CG1 
3754 C CG2 . VAL C 111 ? 0.3981 0.5606 0.3360 -0.2520 -0.0185 0.0183  110 VAL L CG2 
3755 N N   . ALA C 112 ? 0.3252 0.5463 0.3262 -0.1863 -0.0017 -0.0194 111 ALA L N   
3756 C CA  . ALA C 112 ? 0.3047 0.5465 0.3257 -0.1692 -0.0004 -0.0318 111 ALA L CA  
3757 C C   . ALA C 112 ? 0.2961 0.5139 0.3198 -0.1603 -0.0065 -0.0301 111 ALA L C   
3758 O O   . ALA C 112 ? 0.2800 0.4628 0.2950 -0.1535 -0.0105 -0.0236 111 ALA L O   
3759 C CB  . ALA C 112 ? 0.2977 0.5380 0.3234 -0.1533 0.0014  -0.0376 111 ALA L CB  
3760 N N   . ALA C 113 ? 0.2928 0.5311 0.3281 -0.1602 -0.0074 -0.0362 112 ALA L N   
3761 C CA  . ALA C 113 ? 0.2897 0.5104 0.3290 -0.1520 -0.0131 -0.0359 112 ALA L CA  
3762 C C   . ALA C 113 ? 0.2845 0.4945 0.3322 -0.1306 -0.0151 -0.0415 112 ALA L C   
3763 O O   . ALA C 113 ? 0.2645 0.4922 0.3219 -0.1210 -0.0132 -0.0502 112 ALA L O   
3764 C CB  . ALA C 113 ? 0.2899 0.5402 0.3405 -0.1577 -0.0132 -0.0421 112 ALA L CB  
3765 N N   . PRO C 114 ? 0.2974 0.4782 0.3411 -0.1227 -0.0202 -0.0367 113 PRO L N   
3766 C CA  . PRO C 114 ? 0.2972 0.4696 0.3483 -0.1050 -0.0232 -0.0411 113 PRO L CA  
3767 C C   . PRO C 114 ? 0.2857 0.4792 0.3523 -0.0971 -0.0259 -0.0516 113 PRO L C   
3768 O O   . PRO C 114 ? 0.2621 0.4679 0.3324 -0.1043 -0.0265 -0.0531 113 PRO L O   
3769 C CB  . PRO C 114 ? 0.2955 0.4350 0.3358 -0.1027 -0.0274 -0.0321 113 PRO L CB  
3770 C CG  . PRO C 114 ? 0.2989 0.4380 0.3341 -0.1153 -0.0289 -0.0285 113 PRO L CG  
3771 C CD  . PRO C 114 ? 0.3049 0.4605 0.3363 -0.1300 -0.0243 -0.0275 113 PRO L CD  
3772 N N   . SER C 115 ? 0.2828 0.4790 0.3578 -0.0827 -0.0288 -0.0589 114 SER L N   
3773 C CA  . SER C 115 ? 0.2871 0.4876 0.3729 -0.0711 -0.0354 -0.0666 114 SER L CA  
3774 C C   . SER C 115 ? 0.2638 0.4329 0.3425 -0.0657 -0.0405 -0.0585 114 SER L C   
3775 O O   . SER C 115 ? 0.2658 0.4140 0.3359 -0.0631 -0.0406 -0.0515 114 SER L O   
3776 C CB  . SER C 115 ? 0.3146 0.5289 0.4109 -0.0576 -0.0394 -0.0784 114 SER L CB  
3777 O OG  . SER C 115 ? 0.3544 0.5887 0.4521 -0.0604 -0.0341 -0.0832 114 SER L OG  
3778 N N   . VAL C 116 ? 0.2512 0.4194 0.3337 -0.0640 -0.0447 -0.0598 115 VAL L N   
3779 C CA  . VAL C 116 ? 0.2518 0.3941 0.3265 -0.0610 -0.0489 -0.0519 115 VAL L CA  
3780 C C   . VAL C 116 ? 0.2419 0.3804 0.3231 -0.0487 -0.0571 -0.0569 115 VAL L C   
3781 O O   . VAL C 116 ? 0.2301 0.3866 0.3225 -0.0444 -0.0604 -0.0668 115 VAL L O   
3782 C CB  . VAL C 116 ? 0.2484 0.3878 0.3184 -0.0705 -0.0480 -0.0475 115 VAL L CB  
3783 C CG1 . VAL C 116 ? 0.2575 0.3726 0.3188 -0.0663 -0.0522 -0.0405 115 VAL L CG1 
3784 C CG2 . VAL C 116 ? 0.2565 0.3972 0.3183 -0.0837 -0.0423 -0.0424 115 VAL L CG2 
3785 N N   . PHE C 117 ? 0.2342 0.3503 0.3076 -0.0437 -0.0608 -0.0499 116 PHE L N   
3786 C CA  . PHE C 117 ? 0.2365 0.3432 0.3119 -0.0340 -0.0702 -0.0517 116 PHE L CA  
3787 C C   . PHE C 117 ? 0.2450 0.3319 0.3097 -0.0350 -0.0719 -0.0416 116 PHE L C   
3788 O O   . PHE C 117 ? 0.2434 0.3203 0.2986 -0.0392 -0.0674 -0.0333 116 PHE L O   
3789 C CB  . PHE C 117 ? 0.2426 0.3445 0.3188 -0.0268 -0.0749 -0.0541 116 PHE L CB  
3790 C CG  . PHE C 117 ? 0.2472 0.3693 0.3325 -0.0243 -0.0732 -0.0647 116 PHE L CG  
3791 C CD1 . PHE C 117 ? 0.2547 0.3904 0.3508 -0.0150 -0.0806 -0.0774 116 PHE L CD1 
3792 C CD2 . PHE C 117 ? 0.2469 0.3759 0.3297 -0.0305 -0.0647 -0.0629 116 PHE L CD2 
3793 C CE1 . PHE C 117 ? 0.2568 0.4151 0.3616 -0.0113 -0.0792 -0.0888 116 PHE L CE1 
3794 C CE2 . PHE C 117 ? 0.2521 0.4026 0.3429 -0.0280 -0.0630 -0.0732 116 PHE L CE2 
3795 C CZ  . PHE C 117 ? 0.2464 0.4130 0.3485 -0.0181 -0.0700 -0.0865 116 PHE L CZ  
3796 N N   . ILE C 118 ? 0.2561 0.3380 0.3220 -0.0302 -0.0793 -0.0427 117 ILE L N   
3797 C CA  . ILE C 118 ? 0.2621 0.3281 0.3178 -0.0304 -0.0820 -0.0339 117 ILE L CA  
3798 C C   . ILE C 118 ? 0.2710 0.3257 0.3245 -0.0244 -0.0921 -0.0324 117 ILE L C   
3799 O O   . ILE C 118 ? 0.2668 0.3250 0.3279 -0.0184 -0.0995 -0.0405 117 ILE L O   
3800 C CB  . ILE C 118 ? 0.2627 0.3310 0.3184 -0.0324 -0.0819 -0.0345 117 ILE L CB  
3801 C CG1 . ILE C 118 ? 0.2628 0.3178 0.3067 -0.0327 -0.0831 -0.0258 117 ILE L CG1 
3802 C CG2 . ILE C 118 ? 0.2734 0.3507 0.3394 -0.0278 -0.0883 -0.0435 117 ILE L CG2 
3803 C CD1 . ILE C 118 ? 0.2615 0.3163 0.3027 -0.0343 -0.0829 -0.0258 117 ILE L CD1 
3804 N N   . PHE C 119 ? 0.2654 0.3076 0.3079 -0.0264 -0.0932 -0.0226 118 PHE L N   
3805 C CA  . PHE C 119 ? 0.2772 0.3064 0.3143 -0.0239 -0.1039 -0.0184 118 PHE L CA  
3806 C C   . PHE C 119 ? 0.2834 0.3064 0.3107 -0.0266 -0.1058 -0.0102 118 PHE L C   
3807 O O   . PHE C 119 ? 0.2786 0.3032 0.2986 -0.0308 -0.0991 -0.0036 118 PHE L O   
3808 C CB  . PHE C 119 ? 0.2880 0.3106 0.3204 -0.0258 -0.1041 -0.0132 118 PHE L CB  
3809 C CG  . PHE C 119 ? 0.2774 0.3063 0.3182 -0.0228 -0.1023 -0.0210 118 PHE L CG  
3810 C CD1 . PHE C 119 ? 0.3016 0.3273 0.3478 -0.0158 -0.1128 -0.0288 118 PHE L CD1 
3811 C CD2 . PHE C 119 ? 0.2829 0.3208 0.3251 -0.0264 -0.0913 -0.0212 118 PHE L CD2 
3812 C CE1 . PHE C 119 ? 0.2987 0.3326 0.3521 -0.0120 -0.1114 -0.0370 118 PHE L CE1 
3813 C CE2 . PHE C 119 ? 0.2820 0.3268 0.3306 -0.0242 -0.0897 -0.0278 118 PHE L CE2 
3814 C CZ  . PHE C 119 ? 0.2897 0.3341 0.3444 -0.0167 -0.0993 -0.0363 118 PHE L CZ  
3815 N N   . PRO C 120 ? 0.2958 0.3118 0.3215 -0.0239 -0.1159 -0.0107 119 PRO L N   
3816 C CA  . PRO C 120 ? 0.3032 0.3148 0.3184 -0.0269 -0.1182 -0.0027 119 PRO L CA  
3817 C C   . PRO C 120 ? 0.3029 0.3069 0.3066 -0.0325 -0.1213 0.0083  119 PRO L C   
3818 O O   . PRO C 120 ? 0.2846 0.2826 0.2888 -0.0330 -0.1246 0.0091  119 PRO L O   
3819 C CB  . PRO C 120 ? 0.3216 0.3269 0.3387 -0.0224 -0.1295 -0.0071 119 PRO L CB  
3820 C CG  . PRO C 120 ? 0.3388 0.3415 0.3654 -0.0164 -0.1366 -0.0162 119 PRO L CG  
3821 C CD  . PRO C 120 ? 0.3174 0.3296 0.3504 -0.0172 -0.1268 -0.0193 119 PRO L CD  
3822 N N   . PRO C 121 ? 0.3038 0.3092 0.2964 -0.0371 -0.1208 0.0169  120 PRO L N   
3823 C CA  . PRO C 121 ? 0.3284 0.3297 0.3096 -0.0445 -0.1247 0.0283  120 PRO L CA  
3824 C C   . PRO C 121 ? 0.3493 0.3331 0.3260 -0.0456 -0.1406 0.0308  120 PRO L C   
3825 O O   . PRO C 121 ? 0.3582 0.3358 0.3375 -0.0408 -0.1480 0.0256  120 PRO L O   
3826 C CB  . PRO C 121 ? 0.3333 0.3456 0.3049 -0.0481 -0.1203 0.0344  120 PRO L CB  
3827 C CG  . PRO C 121 ? 0.3298 0.3426 0.3060 -0.0420 -0.1210 0.0269  120 PRO L CG  
3828 C CD  . PRO C 121 ? 0.3185 0.3313 0.3086 -0.0361 -0.1169 0.0162  120 PRO L CD  
3829 N N   . SER C 122 ? 0.3626 0.3379 0.3321 -0.0519 -0.1464 0.0388  121 SER L N   
3830 C CA  . SER C 122 ? 0.4032 0.3577 0.3641 -0.0552 -0.1642 0.0439  121 SER L CA  
3831 C C   . SER C 122 ? 0.4216 0.3749 0.3688 -0.0628 -0.1700 0.0538  121 SER L C   
3832 O O   . SER C 122 ? 0.4177 0.3880 0.3594 -0.0687 -0.1602 0.0603  121 SER L O   
3833 C CB  . SER C 122 ? 0.4034 0.3491 0.3591 -0.0614 -0.1690 0.0507  121 SER L CB  
3834 O OG  . SER C 122 ? 0.3970 0.3550 0.3433 -0.0726 -0.1619 0.0629  121 SER L OG  
3835 N N   . ASP C 123 ? 0.4795 0.4128 0.4207 -0.0623 -0.1870 0.0543  122 ASP L N   
3836 C CA  . ASP C 123 ? 0.4997 0.4280 0.4246 -0.0720 -0.1957 0.0660  122 ASP L CA  
3837 C C   . ASP C 123 ? 0.4960 0.4283 0.4071 -0.0873 -0.1957 0.0814  122 ASP L C   
3838 O O   . ASP C 123 ? 0.5036 0.4507 0.4049 -0.0959 -0.1912 0.0902  122 ASP L O   
3839 C CB  . ASP C 123 ? 0.5655 0.4674 0.4850 -0.0691 -0.2164 0.0641  122 ASP L CB  
3840 C CG  . ASP C 123 ? 0.5875 0.4911 0.5197 -0.0552 -0.2159 0.0496  122 ASP L CG  
3841 O OD1 . ASP C 123 ? 0.5676 0.4922 0.5089 -0.0511 -0.2001 0.0441  122 ASP L OD1 
3842 O OD2 . ASP C 123 ? 0.6864 0.5698 0.6186 -0.0488 -0.2324 0.0438  122 ASP L OD2 
3843 N N   . GLU C 124 ? 0.4826 0.4056 0.3940 -0.0902 -0.1996 0.0838  123 GLU L N   
3844 C CA  . GLU C 124 ? 0.5252 0.4533 0.4245 -0.1057 -0.1999 0.0985  123 GLU L CA  
3845 C C   . GLU C 124 ? 0.4842 0.4459 0.3859 -0.1086 -0.1799 0.1006  123 GLU L C   
3846 O O   . GLU C 124 ? 0.5020 0.4775 0.3909 -0.1214 -0.1794 0.1127  123 GLU L O   
3847 C CB  . GLU C 124 ? 0.5530 0.4663 0.4553 -0.1056 -0.2058 0.0979  123 GLU L CB  
3848 C CG  . GLU C 124 ? 0.6102 0.5223 0.4981 -0.1232 -0.2115 0.1141  123 GLU L CG  
3849 C CD  . GLU C 124 ? 0.6608 0.5655 0.5540 -0.1222 -0.2121 0.1125  123 GLU L CD  
3850 O OE1 . GLU C 124 ? 0.6851 0.5767 0.5899 -0.1080 -0.2148 0.0992  123 GLU L OE1 
3851 O OE2 . GLU C 124 ? 0.7235 0.6388 0.6098 -0.1353 -0.2089 0.1238  123 GLU L OE2 
3852 N N   . GLN C 125 ? 0.4352 0.4109 0.3520 -0.0972 -0.1649 0.0891  124 GLN L N   
3853 C CA  . GLN C 125 ? 0.4136 0.4188 0.3320 -0.0978 -0.1480 0.0895  124 GLN L CA  
3854 C C   . GLN C 125 ? 0.4198 0.4385 0.3317 -0.0984 -0.1458 0.0908  124 GLN L C   
3855 O O   . GLN C 125 ? 0.4170 0.4590 0.3212 -0.1053 -0.1392 0.0974  124 GLN L O   
3856 C CB  . GLN C 125 ? 0.3755 0.3878 0.3092 -0.0855 -0.1351 0.0768  124 GLN L CB  
3857 C CG  . GLN C 125 ? 0.3568 0.3953 0.2907 -0.0856 -0.1208 0.0770  124 GLN L CG  
3858 C CD  . GLN C 125 ? 0.3288 0.3720 0.2751 -0.0744 -0.1096 0.0652  124 GLN L CD  
3859 O OE1 . GLN C 125 ? 0.3058 0.3376 0.2613 -0.0664 -0.1105 0.0561  124 GLN L OE1 
3860 N NE2 . GLN C 125 ? 0.3126 0.3743 0.2584 -0.0742 -0.0997 0.0654  124 GLN L NE2 
3861 N N   . LEU C 126 ? 0.4404 0.4476 0.3560 -0.0904 -0.1504 0.0836  125 LEU L N   
3862 C CA  . LEU C 126 ? 0.4843 0.5025 0.3949 -0.0888 -0.1485 0.0829  125 LEU L CA  
3863 C C   . LEU C 126 ? 0.5495 0.5735 0.4420 -0.1035 -0.1558 0.0974  125 LEU L C   
3864 O O   . LEU C 126 ? 0.5689 0.6169 0.4555 -0.1053 -0.1483 0.0993  125 LEU L O   
3865 C CB  . LEU C 126 ? 0.4950 0.4951 0.4116 -0.0797 -0.1562 0.0742  125 LEU L CB  
3866 C CG  . LEU C 126 ? 0.4869 0.4890 0.4206 -0.0664 -0.1473 0.0596  125 LEU L CG  
3867 C CD1 . LEU C 126 ? 0.5067 0.4956 0.4457 -0.0587 -0.1554 0.0516  125 LEU L CD1 
3868 C CD2 . LEU C 126 ? 0.4829 0.5076 0.4189 -0.0627 -0.1327 0.0560  125 LEU L CD2 
3869 N N   . LYS C 127 ? 0.6171 0.6205 0.5002 -0.1137 -0.1705 0.1070  126 LYS L N   
3870 C CA  . LYS C 127 ? 0.7026 0.7085 0.5659 -0.1316 -0.1800 0.1233  126 LYS L CA  
3871 C C   . LYS C 127 ? 0.6809 0.7223 0.5398 -0.1401 -0.1670 0.1299  126 LYS L C   
3872 O O   . LYS C 127 ? 0.7119 0.7711 0.5573 -0.1509 -0.1677 0.1390  126 LYS L O   
3873 C CB  . LYS C 127 ? 0.7660 0.7421 0.6204 -0.1417 -0.1981 0.1326  126 LYS L CB  
3874 C CG  . LYS C 127 ? 0.8589 0.8044 0.7045 -0.1419 -0.2174 0.1340  126 LYS L CG  
3875 C CD  . LYS C 127 ? 0.9270 0.8361 0.7707 -0.1418 -0.2361 0.1344  126 LYS L CD  
3876 C CE  . LYS C 127 ? 0.9953 0.8767 0.8395 -0.1314 -0.2514 0.1263  126 LYS L CE  
3877 N NZ  . LYS C 127 ? 1.0811 0.9245 0.9124 -0.1374 -0.2768 0.1326  126 LYS L NZ  
3878 N N   . SER C 128 ? 0.6485 0.7012 0.5189 -0.1345 -0.1556 0.1242  127 SER L N   
3879 C CA  . SER C 128 ? 0.6290 0.7149 0.4972 -0.1412 -0.1441 0.1289  127 SER L CA  
3880 C C   . SER C 128 ? 0.5850 0.7001 0.4595 -0.1293 -0.1291 0.1184  127 SER L C   
3881 O O   . SER C 128 ? 0.6116 0.7563 0.4853 -0.1319 -0.1197 0.1196  127 SER L O   
3882 C CB  . SER C 128 ? 0.6382 0.7182 0.5144 -0.1410 -0.1417 0.1281  127 SER L CB  
3883 O OG  . SER C 128 ? 0.6660 0.7469 0.5583 -0.1241 -0.1305 0.1133  127 SER L OG  
3884 N N   . GLY C 129 ? 0.5420 0.6489 0.4228 -0.1161 -0.1276 0.1076  128 GLY L N   
3885 C CA  . GLY C 129 ? 0.5091 0.6398 0.3926 -0.1052 -0.1170 0.0981  128 GLY L CA  
3886 C C   . GLY C 129 ? 0.4707 0.6009 0.3688 -0.0897 -0.1070 0.0842  128 GLY L C   
3887 O O   . GLY C 129 ? 0.4483 0.5956 0.3475 -0.0800 -0.1000 0.0758  128 GLY L O   
3888 N N   . THR C 130 ? 0.4440 0.5559 0.3519 -0.0875 -0.1071 0.0816  129 THR L N   
3889 C CA  . THR C 130 ? 0.4152 0.5245 0.3357 -0.0748 -0.0987 0.0696  129 THR L CA  
3890 C C   . THR C 130 ? 0.3949 0.4764 0.3253 -0.0696 -0.1034 0.0637  129 THR L C   
3891 O O   . THR C 130 ? 0.3932 0.4578 0.3220 -0.0757 -0.1128 0.0691  129 THR L O   
3892 C CB  . THR C 130 ? 0.4232 0.5443 0.3460 -0.0768 -0.0921 0.0710  129 THR L CB  
3893 O OG1 . THR C 130 ? 0.4423 0.5939 0.3563 -0.0801 -0.0879 0.0744  129 THR L OG1 
3894 C CG2 . THR C 130 ? 0.4021 0.5179 0.3356 -0.0655 -0.0849 0.0600  129 THR L CG2 
3895 N N   . ALA C 131 ? 0.3554 0.4336 0.2949 -0.0589 -0.0983 0.0526  130 ALA L N   
3896 C CA  . ALA C 131 ? 0.3291 0.3884 0.2799 -0.0534 -0.1002 0.0451  130 ALA L CA  
3897 C C   . ALA C 131 ? 0.3119 0.3724 0.2707 -0.0490 -0.0919 0.0390  130 ALA L C   
3898 O O   . ALA C 131 ? 0.2987 0.3685 0.2573 -0.0436 -0.0856 0.0339  130 ALA L O   
3899 C CB  . ALA C 131 ? 0.3483 0.4040 0.3014 -0.0472 -0.1020 0.0384  130 ALA L CB  
3900 N N   . SER C 132 ? 0.2893 0.3398 0.2540 -0.0509 -0.0931 0.0393  131 SER L N   
3901 C CA  . SER C 132 ? 0.2725 0.3213 0.2453 -0.0473 -0.0864 0.0334  131 SER L CA  
3902 C C   . SER C 132 ? 0.2721 0.3095 0.2550 -0.0433 -0.0891 0.0255  131 SER L C   
3903 O O   . SER C 132 ? 0.2851 0.3127 0.2703 -0.0442 -0.0972 0.0260  131 SER L O   
3904 C CB  . SER C 132 ? 0.2780 0.3266 0.2499 -0.0521 -0.0856 0.0387  131 SER L CB  
3905 O OG  . SER C 132 ? 0.2727 0.3357 0.2358 -0.0568 -0.0832 0.0459  131 SER L OG  
3906 N N   . VAL C 133 ? 0.2577 0.2970 0.2458 -0.0392 -0.0839 0.0182  132 VAL L N   
3907 C CA  . VAL C 133 ? 0.2555 0.2900 0.2540 -0.0366 -0.0847 0.0102  132 VAL L CA  
3908 C C   . VAL C 133 ? 0.2526 0.2883 0.2557 -0.0374 -0.0782 0.0073  132 VAL L C   
3909 O O   . VAL C 133 ? 0.2589 0.2976 0.2576 -0.0377 -0.0726 0.0082  132 VAL L O   
3910 C CB  . VAL C 133 ? 0.2613 0.2975 0.2607 -0.0338 -0.0847 0.0053  132 VAL L CB  
3911 C CG1 . VAL C 133 ? 0.2547 0.2897 0.2651 -0.0323 -0.0871 -0.0023 132 VAL L CG1 
3912 C CG2 . VAL C 133 ? 0.2802 0.3173 0.2716 -0.0331 -0.0895 0.0094  132 VAL L CG2 
3913 N N   . VAL C 134 ? 0.2513 0.2849 0.2623 -0.0372 -0.0797 0.0035  133 VAL L N   
3914 C CA  . VAL C 134 ? 0.2422 0.2777 0.2562 -0.0387 -0.0738 0.0018  133 VAL L CA  
3915 C C   . VAL C 134 ? 0.2505 0.2912 0.2736 -0.0384 -0.0715 -0.0065 133 VAL L C   
3916 O O   . VAL C 134 ? 0.2589 0.3018 0.2893 -0.0357 -0.0766 -0.0120 133 VAL L O   
3917 C CB  . VAL C 134 ? 0.2443 0.2755 0.2583 -0.0393 -0.0770 0.0048  133 VAL L CB  
3918 C CG1 . VAL C 134 ? 0.2383 0.2718 0.2558 -0.0402 -0.0714 0.0021  133 VAL L CG1 
3919 C CG2 . VAL C 134 ? 0.2551 0.2846 0.2594 -0.0422 -0.0783 0.0142  133 VAL L CG2 
3920 N N   . CYS C 135 ? 0.2440 0.2874 0.2663 -0.0415 -0.0649 -0.0075 134 CYS L N   
3921 C CA  . CYS C 135 ? 0.2424 0.2936 0.2721 -0.0442 -0.0620 -0.0142 134 CYS L CA  
3922 C C   . CYS C 135 ? 0.2342 0.2877 0.2644 -0.0467 -0.0574 -0.0143 134 CYS L C   
3923 O O   . CYS C 135 ? 0.2391 0.2861 0.2614 -0.0479 -0.0547 -0.0088 134 CYS L O   
3924 C CB  . CYS C 135 ? 0.2553 0.3054 0.2807 -0.0480 -0.0600 -0.0142 134 CYS L CB  
3925 S SG  . CYS C 135 ? 0.2898 0.3520 0.3231 -0.0548 -0.0573 -0.0208 134 CYS L SG  
3926 N N   . LEU C 136 ? 0.2256 0.2886 0.2647 -0.0460 -0.0576 -0.0207 135 LEU L N   
3927 C CA  . LEU C 136 ? 0.2317 0.2996 0.2725 -0.0477 -0.0537 -0.0225 135 LEU L CA  
3928 C C   . LEU C 136 ? 0.2360 0.3177 0.2806 -0.0542 -0.0485 -0.0273 135 LEU L C   
3929 O O   . LEU C 136 ? 0.2501 0.3447 0.3033 -0.0538 -0.0502 -0.0340 135 LEU L O   
3930 C CB  . LEU C 136 ? 0.2335 0.3034 0.2810 -0.0408 -0.0595 -0.0273 135 LEU L CB  
3931 C CG  . LEU C 136 ? 0.2351 0.3136 0.2864 -0.0405 -0.0567 -0.0322 135 LEU L CG  
3932 C CD1 . LEU C 136 ? 0.2435 0.3124 0.2858 -0.0443 -0.0522 -0.0245 135 LEU L CD1 
3933 C CD2 . LEU C 136 ? 0.2338 0.3130 0.2914 -0.0319 -0.0651 -0.0389 135 LEU L CD2 
3934 N N   . LEU C 137 ? 0.2413 0.3213 0.2795 -0.0604 -0.0431 -0.0240 136 LEU L N   
3935 C CA  . LEU C 137 ? 0.2361 0.3296 0.2757 -0.0691 -0.0382 -0.0270 136 LEU L CA  
3936 C C   . LEU C 137 ? 0.2382 0.3382 0.2800 -0.0673 -0.0356 -0.0296 136 LEU L C   
3937 O O   . LEU C 137 ? 0.2340 0.3207 0.2683 -0.0663 -0.0347 -0.0240 136 LEU L O   
3938 C CB  . LEU C 137 ? 0.2425 0.3244 0.2700 -0.0778 -0.0361 -0.0202 136 LEU L CB  
3939 C CG  . LEU C 137 ? 0.2557 0.3318 0.2796 -0.0814 -0.0392 -0.0185 136 LEU L CG  
3940 C CD1 . LEU C 137 ? 0.2507 0.3178 0.2753 -0.0722 -0.0438 -0.0177 136 LEU L CD1 
3941 C CD2 . LEU C 137 ? 0.2672 0.3286 0.2772 -0.0894 -0.0396 -0.0126 136 LEU L CD2 
3942 N N   . ASN C 138 ? 0.2358 0.3559 0.2878 -0.0654 -0.0353 -0.0385 137 ASN L N   
3943 C CA  . ASN C 138 ? 0.2470 0.3745 0.3020 -0.0611 -0.0345 -0.0431 137 ASN L CA  
3944 C C   . ASN C 138 ? 0.2494 0.3952 0.3035 -0.0705 -0.0276 -0.0455 137 ASN L C   
3945 O O   . ASN C 138 ? 0.2502 0.4175 0.3098 -0.0770 -0.0252 -0.0504 137 ASN L O   
3946 C CB  . ASN C 138 ? 0.2596 0.3961 0.3256 -0.0497 -0.0411 -0.0529 137 ASN L CB  
3947 C CG  . ASN C 138 ? 0.2811 0.4073 0.3457 -0.0417 -0.0453 -0.0535 137 ASN L CG  
3948 O OD1 . ASN C 138 ? 0.3039 0.4113 0.3598 -0.0432 -0.0448 -0.0445 137 ASN L OD1 
3949 N ND2 . ASN C 138 ? 0.2965 0.4351 0.3697 -0.0326 -0.0504 -0.0646 137 ASN L ND2 
3950 N N   . ASN C 139 ? 0.2600 0.3992 0.3076 -0.0718 -0.0248 -0.0421 138 ASN L N   
3951 C CA  . ASN C 139 ? 0.2692 0.4268 0.3160 -0.0784 -0.0191 -0.0455 138 ASN L CA  
3952 C C   . ASN C 139 ? 0.2738 0.4405 0.3149 -0.0940 -0.0145 -0.0417 138 ASN L C   
3953 O O   . ASN C 139 ? 0.2579 0.4529 0.3061 -0.0991 -0.0119 -0.0486 138 ASN L O   
3954 C CB  . ASN C 139 ? 0.2806 0.4629 0.3399 -0.0693 -0.0208 -0.0588 138 ASN L CB  
3955 C CG  . ASN C 139 ? 0.2947 0.4619 0.3565 -0.0551 -0.0279 -0.0613 138 ASN L CG  
3956 O OD1 . ASN C 139 ? 0.2875 0.4317 0.3410 -0.0544 -0.0288 -0.0531 138 ASN L OD1 
3957 N ND2 . ASN C 139 ? 0.3144 0.4933 0.3868 -0.0439 -0.0342 -0.0724 138 ASN L ND2 
3958 N N   . PHE C 140 ? 0.2723 0.4167 0.3004 -0.1017 -0.0145 -0.0313 139 PHE L N   
3959 C CA  . PHE C 140 ? 0.2849 0.4319 0.3049 -0.1176 -0.0130 -0.0263 139 PHE L CA  
3960 C C   . PHE C 140 ? 0.2966 0.4262 0.3007 -0.1263 -0.0119 -0.0178 139 PHE L C   
3961 O O   . PHE C 140 ? 0.2892 0.4024 0.2890 -0.1188 -0.0124 -0.0153 139 PHE L O   
3962 C CB  . PHE C 140 ? 0.2864 0.4201 0.3049 -0.1183 -0.0176 -0.0229 139 PHE L CB  
3963 C CG  . PHE C 140 ? 0.2824 0.3860 0.2930 -0.1108 -0.0218 -0.0166 139 PHE L CG  
3964 C CD1 . PHE C 140 ? 0.3074 0.3891 0.3029 -0.1176 -0.0245 -0.0088 139 PHE L CD1 
3965 C CD2 . PHE C 140 ? 0.2767 0.3747 0.2941 -0.0970 -0.0241 -0.0189 139 PHE L CD2 
3966 C CE1 . PHE C 140 ? 0.3173 0.3758 0.3061 -0.1092 -0.0283 -0.0048 139 PHE L CE1 
3967 C CE2 . PHE C 140 ? 0.2722 0.3477 0.2822 -0.0910 -0.0272 -0.0133 139 PHE L CE2 
3968 C CZ  . PHE C 140 ? 0.2927 0.3505 0.2892 -0.0963 -0.0289 -0.0070 139 PHE L CZ  
3969 N N   . TYR C 141 ? 0.2981 0.4312 0.2931 -0.1426 -0.0115 -0.0133 140 TYR L N   
3970 C CA  . TYR C 141 ? 0.3183 0.4343 0.2957 -0.1540 -0.0124 -0.0048 140 TYR L CA  
3971 C C   . TYR C 141 ? 0.3349 0.4460 0.3018 -0.1711 -0.0164 0.0012  140 TYR L C   
3972 O O   . TYR C 141 ? 0.3268 0.4639 0.3008 -0.1801 -0.0141 -0.0019 140 TYR L O   
3973 C CB  . TYR C 141 ? 0.3216 0.4562 0.2982 -0.1589 -0.0065 -0.0071 140 TYR L CB  
3974 C CG  . TYR C 141 ? 0.3473 0.4580 0.3052 -0.1670 -0.0088 0.0017  140 TYR L CG  
3975 C CD1 . TYR C 141 ? 0.3679 0.4738 0.3108 -0.1862 -0.0115 0.0092  140 TYR L CD1 
3976 C CD2 . TYR C 141 ? 0.3495 0.4388 0.3034 -0.1556 -0.0101 0.0034  140 TYR L CD2 
3977 C CE1 . TYR C 141 ? 0.3840 0.4628 0.3078 -0.1930 -0.0161 0.0175  140 TYR L CE1 
3978 C CE2 . TYR C 141 ? 0.3631 0.4288 0.2997 -0.1616 -0.0135 0.0108  140 TYR L CE2 
3979 C CZ  . TYR C 141 ? 0.3866 0.4458 0.3076 -0.1800 -0.0170 0.0177  140 TYR L CZ  
3980 O OH  . TYR C 141 ? 0.4120 0.4447 0.3140 -0.1862 -0.0226 0.0251  140 TYR L OH  
3981 N N   . PRO C 142 ? 0.3660 0.4447 0.3154 -0.1763 -0.0235 0.0097  141 PRO L N   
3982 C CA  . PRO C 142 ? 0.3801 0.4305 0.3215 -0.1650 -0.0268 0.0126  141 PRO L CA  
3983 C C   . PRO C 142 ? 0.4000 0.4376 0.3481 -0.1478 -0.0297 0.0100  141 PRO L C   
3984 O O   . PRO C 142 ? 0.3656 0.4146 0.3248 -0.1440 -0.0293 0.0060  141 PRO L O   
3985 C CB  . PRO C 142 ? 0.4085 0.4316 0.3282 -0.1778 -0.0354 0.0212  141 PRO L CB  
3986 C CG  . PRO C 142 ? 0.4172 0.4447 0.3359 -0.1898 -0.0394 0.0228  141 PRO L CG  
3987 C CD  . PRO C 142 ? 0.3996 0.4677 0.3353 -0.1940 -0.0301 0.0167  141 PRO L CD  
3988 N N   . ARG C 143 ? 0.4184 0.4338 0.3588 -0.1386 -0.0329 0.0124  142 ARG L N   
3989 C CA  A ARG C 143 ? 0.4402 0.4458 0.3853 -0.1227 -0.0352 0.0105  142 ARG L CA  
3990 C CA  B ARG C 143 ? 0.4331 0.4386 0.3782 -0.1226 -0.0352 0.0105  142 ARG L CA  
3991 C C   . ARG C 143 ? 0.4437 0.4376 0.3850 -0.1221 -0.0421 0.0111  142 ARG L C   
3992 O O   . ARG C 143 ? 0.4395 0.4352 0.3886 -0.1109 -0.0424 0.0083  142 ARG L O   
3993 C CB  A ARG C 143 ? 0.4698 0.4567 0.4051 -0.1158 -0.0378 0.0132  142 ARG L CB  
3994 C CB  B ARG C 143 ? 0.4519 0.4387 0.3872 -0.1156 -0.0378 0.0131  142 ARG L CB  
3995 C CG  A ARG C 143 ? 0.4763 0.4695 0.4217 -0.1022 -0.0341 0.0106  142 ARG L CG  
3996 C CG  B ARG C 143 ? 0.4525 0.4349 0.3926 -0.1004 -0.0391 0.0114  142 ARG L CG  
3997 C CD  A ARG C 143 ? 0.4989 0.4766 0.4345 -0.0971 -0.0367 0.0131  142 ARG L CD  
3998 C CD  B ARG C 143 ? 0.4638 0.4363 0.3974 -0.0948 -0.0396 0.0130  142 ARG L CD  
3999 N NE  A ARG C 143 ? 0.5241 0.5007 0.4535 -0.1045 -0.0345 0.0150  142 ARG L NE  
4000 N NE  B ARG C 143 ? 0.4597 0.4333 0.3981 -0.0819 -0.0397 0.0119  142 ARG L NE  
4001 C CZ  A ARG C 143 ? 0.5339 0.4993 0.4557 -0.1009 -0.0361 0.0167  142 ARG L CZ  
4002 C CZ  B ARG C 143 ? 0.4488 0.4180 0.3858 -0.0746 -0.0440 0.0108  142 ARG L CZ  
4003 N NH1 A ARG C 143 ? 0.5631 0.5280 0.4790 -0.1082 -0.0341 0.0185  142 ARG L NH1 
4004 N NH1 B ARG C 143 ? 0.4395 0.4138 0.3802 -0.0648 -0.0435 0.0103  142 ARG L NH1 
4005 N NH2 A ARG C 143 ? 0.5352 0.4918 0.4552 -0.0900 -0.0397 0.0162  142 ARG L NH2 
4006 N NH2 B ARG C 143 ? 0.4701 0.4313 0.4016 -0.0775 -0.0492 0.0102  142 ARG L NH2 
4007 N N   . GLU C 144 ? 0.4721 0.4529 0.4003 -0.1341 -0.0484 0.0150  143 GLU L N   
4008 C CA  . GLU C 144 ? 0.4882 0.4529 0.4098 -0.1331 -0.0573 0.0156  143 GLU L CA  
4009 C C   . GLU C 144 ? 0.4555 0.4400 0.3915 -0.1337 -0.0541 0.0119  143 GLU L C   
4010 O O   . GLU C 144 ? 0.4362 0.4408 0.3788 -0.1445 -0.0493 0.0113  143 GLU L O   
4011 C CB  . GLU C 144 ? 0.5596 0.5028 0.4618 -0.1474 -0.0667 0.0213  143 GLU L CB  
4012 C CG  . GLU C 144 ? 0.6174 0.5354 0.5038 -0.1427 -0.0731 0.0236  143 GLU L CG  
4013 C CD  . GLU C 144 ? 0.6320 0.5576 0.5194 -0.1434 -0.0659 0.0247  143 GLU L CD  
4014 O OE1 . GLU C 144 ? 0.5790 0.5241 0.4714 -0.1553 -0.0586 0.0261  143 GLU L OE1 
4015 O OE2 . GLU C 144 ? 0.7068 0.6212 0.5907 -0.1313 -0.0675 0.0234  143 GLU L OE2 
4016 N N   . ALA C 145 ? 0.4392 0.4202 0.3799 -0.1219 -0.0566 0.0090  144 ALA L N   
4017 C CA  . ALA C 145 ? 0.4306 0.4274 0.3843 -0.1202 -0.0550 0.0052  144 ALA L CA  
4018 C C   . ALA C 145 ? 0.4376 0.4195 0.3873 -0.1104 -0.0621 0.0041  144 ALA L C   
4019 O O   . ALA C 145 ? 0.4538 0.4216 0.3960 -0.1002 -0.0653 0.0043  144 ALA L O   
4020 C CB  . ALA C 145 ? 0.4019 0.4207 0.3721 -0.1128 -0.0468 0.0009  144 ALA L CB  
4021 N N   . LYS C 146 ? 0.4597 0.4453 0.4131 -0.1135 -0.0652 0.0025  145 LYS L N   
4022 C CA  . LYS C 146 ? 0.4695 0.4436 0.4198 -0.1035 -0.0718 0.0006  145 LYS L CA  
4023 C C   . LYS C 146 ? 0.4272 0.4209 0.3938 -0.0965 -0.0667 -0.0034 145 LYS L C   
4024 O O   . LYS C 146 ? 0.4124 0.4221 0.3888 -0.1039 -0.0643 -0.0053 145 LYS L O   
4025 C CB  . LYS C 146 ? 0.5229 0.4797 0.4614 -0.1118 -0.0822 0.0021  145 LYS L CB  
4026 C CG  . LYS C 146 ? 0.5647 0.5073 0.4974 -0.0997 -0.0904 -0.0006 145 LYS L CG  
4027 C CD  . LYS C 146 ? 0.6317 0.5541 0.5519 -0.1062 -0.1030 0.0001  145 LYS L CD  
4028 C CE  . LYS C 146 ? 0.6487 0.5805 0.5735 -0.1237 -0.1030 0.0025  145 LYS L CE  
4029 N NZ  . LYS C 146 ? 0.6799 0.5945 0.5954 -0.1277 -0.1153 0.0026  145 LYS L NZ  
4030 N N   . VAL C 147 ? 0.3863 0.3800 0.3551 -0.0833 -0.0656 -0.0046 146 VAL L N   
4031 C CA  . VAL C 147 ? 0.3584 0.3661 0.3396 -0.0757 -0.0628 -0.0074 146 VAL L CA  
4032 C C   . VAL C 147 ? 0.3355 0.3342 0.3110 -0.0676 -0.0689 -0.0085 146 VAL L C   
4033 O O   . VAL C 147 ? 0.3330 0.3223 0.2993 -0.0605 -0.0713 -0.0077 146 VAL L O   
4034 C CB  . VAL C 147 ? 0.3737 0.3893 0.3605 -0.0696 -0.0572 -0.0068 146 VAL L CB  
4035 C CG1 . VAL C 147 ? 0.3732 0.3993 0.3702 -0.0631 -0.0566 -0.0088 146 VAL L CG1 
4036 C CG2 . VAL C 147 ? 0.3873 0.4104 0.3777 -0.0771 -0.0521 -0.0065 146 VAL L CG2 
4037 N N   . GLN C 148 ? 0.3133 0.3157 0.2937 -0.0690 -0.0718 -0.0108 147 GLN L N   
4038 C CA  A GLN C 148 ? 0.3200 0.3141 0.2945 -0.0617 -0.0782 -0.0124 147 GLN L CA  
4039 C CA  B GLN C 148 ? 0.3196 0.3139 0.2943 -0.0621 -0.0783 -0.0125 147 GLN L CA  
4040 C C   . GLN C 148 ? 0.3026 0.3095 0.2875 -0.0560 -0.0765 -0.0143 147 GLN L C   
4041 O O   . GLN C 148 ? 0.3133 0.3319 0.3098 -0.0607 -0.0743 -0.0162 147 GLN L O   
4042 C CB  A GLN C 148 ? 0.3368 0.3190 0.3043 -0.0690 -0.0858 -0.0130 147 GLN L CB  
4043 C CB  B GLN C 148 ? 0.3334 0.3185 0.3034 -0.0705 -0.0850 -0.0132 147 GLN L CB  
4044 C CG  A GLN C 148 ? 0.3552 0.3182 0.3077 -0.0729 -0.0912 -0.0108 147 GLN L CG  
4045 C CG  B GLN C 148 ? 0.3444 0.3207 0.3088 -0.0637 -0.0927 -0.0157 147 GLN L CG  
4046 C CD  A GLN C 148 ? 0.3795 0.3246 0.3212 -0.0780 -0.1023 -0.0112 147 GLN L CD  
4047 C CD  B GLN C 148 ? 0.3522 0.3154 0.3034 -0.0530 -0.0974 -0.0165 147 GLN L CD  
4048 O OE1 A GLN C 148 ? 0.4020 0.3272 0.3292 -0.0725 -0.1112 -0.0122 147 GLN L OE1 
4049 O OE1 B GLN C 148 ? 0.3795 0.3260 0.3186 -0.0550 -0.1034 -0.0160 147 GLN L OE1 
4050 N NE2 A GLN C 148 ? 0.3827 0.3347 0.3310 -0.0883 -0.1030 -0.0111 147 GLN L NE2 
4051 N NE2 B GLN C 148 ? 0.3417 0.3130 0.2943 -0.0416 -0.0958 -0.0181 147 GLN L NE2 
4052 N N   . TRP C 149 ? 0.2933 0.2992 0.2739 -0.0464 -0.0781 -0.0141 148 TRP L N   
4053 C CA  . TRP C 149 ? 0.2768 0.2912 0.2636 -0.0412 -0.0786 -0.0149 148 TRP L CA  
4054 C C   . TRP C 149 ? 0.2954 0.3047 0.2791 -0.0395 -0.0851 -0.0178 148 TRP L C   
4055 O O   . TRP C 149 ? 0.2947 0.2936 0.2673 -0.0360 -0.0897 -0.0188 148 TRP L O   
4056 C CB  . TRP C 149 ? 0.2704 0.2889 0.2530 -0.0340 -0.0770 -0.0121 148 TRP L CB  
4057 C CG  . TRP C 149 ? 0.2641 0.2886 0.2518 -0.0360 -0.0717 -0.0089 148 TRP L CG  
4058 C CD1 . TRP C 149 ? 0.2715 0.2944 0.2551 -0.0365 -0.0683 -0.0067 148 TRP L CD1 
4059 C CD2 . TRP C 149 ? 0.2577 0.2890 0.2551 -0.0375 -0.0706 -0.0083 148 TRP L CD2 
4060 N NE1 . TRP C 149 ? 0.2654 0.2943 0.2554 -0.0382 -0.0648 -0.0042 148 TRP L NE1 
4061 C CE2 . TRP C 149 ? 0.2550 0.2882 0.2534 -0.0388 -0.0667 -0.0055 148 TRP L CE2 
4062 C CE3 . TRP C 149 ? 0.2563 0.2914 0.2616 -0.0371 -0.0738 -0.0107 148 TRP L CE3 
4063 C CZ2 . TRP C 149 ? 0.2459 0.2832 0.2519 -0.0394 -0.0668 -0.0050 148 TRP L CZ2 
4064 C CZ3 . TRP C 149 ? 0.2481 0.2872 0.2606 -0.0370 -0.0742 -0.0106 148 TRP L CZ3 
4065 C CH2 . TRP C 149 ? 0.2458 0.2854 0.2585 -0.0382 -0.0710 -0.0078 148 TRP L CH2 
4066 N N   . LYS C 150 ? 0.2963 0.3123 0.2892 -0.0411 -0.0862 -0.0199 149 LYS L N   
4067 C CA  . LYS C 150 ? 0.3293 0.3424 0.3207 -0.0382 -0.0924 -0.0227 149 LYS L CA  
4068 C C   . LYS C 150 ? 0.3145 0.3352 0.3103 -0.0324 -0.0929 -0.0225 149 LYS L C   
4069 O O   . LYS C 150 ? 0.3029 0.3314 0.3082 -0.0340 -0.0904 -0.0223 149 LYS L O   
4070 C CB  . LYS C 150 ? 0.3656 0.3795 0.3635 -0.0469 -0.0947 -0.0255 149 LYS L CB  
4071 C CG  . LYS C 150 ? 0.4104 0.4147 0.4014 -0.0552 -0.0959 -0.0242 149 LYS L CG  
4072 C CD  . LYS C 150 ? 0.4554 0.4611 0.4505 -0.0659 -0.0996 -0.0259 149 LYS L CD  
4073 C CE  . LYS C 150 ? 0.5243 0.5226 0.5127 -0.0776 -0.1001 -0.0229 149 LYS L CE  
4074 N NZ  . LYS C 150 ? 0.5552 0.5709 0.5548 -0.0903 -0.0961 -0.0234 149 LYS L NZ  
4075 N N   . VAL C 151 ? 0.3137 0.3316 0.3020 -0.0260 -0.0973 -0.0229 150 VAL L N   
4076 C CA  . VAL C 151 ? 0.3108 0.3343 0.2995 -0.0212 -0.0992 -0.0217 150 VAL L CA  
4077 C C   . VAL C 151 ? 0.3213 0.3409 0.3086 -0.0190 -0.1056 -0.0257 150 VAL L C   
4078 O O   . VAL C 151 ? 0.3307 0.3437 0.3087 -0.0157 -0.1089 -0.0276 150 VAL L O   
4079 C CB  . VAL C 151 ? 0.3077 0.3352 0.2862 -0.0160 -0.0976 -0.0177 150 VAL L CB  
4080 C CG1 . VAL C 151 ? 0.3110 0.3439 0.2868 -0.0132 -0.1006 -0.0153 150 VAL L CG1 
4081 C CG2 . VAL C 151 ? 0.3023 0.3331 0.2820 -0.0187 -0.0917 -0.0137 150 VAL L CG2 
4082 N N   . ASP C 152 ? 0.3332 0.3559 0.3302 -0.0210 -0.1082 -0.0280 151 ASP L N   
4083 C CA  . ASP C 152 ? 0.3368 0.3565 0.3355 -0.0207 -0.1143 -0.0324 151 ASP L CA  
4084 C C   . ASP C 152 ? 0.3415 0.3533 0.3369 -0.0254 -0.1160 -0.0345 151 ASP L C   
4085 O O   . ASP C 152 ? 0.3354 0.3391 0.3230 -0.0223 -0.1220 -0.0366 151 ASP L O   
4086 C CB  . ASP C 152 ? 0.3510 0.3691 0.3406 -0.0133 -0.1188 -0.0318 151 ASP L CB  
4087 C CG  . ASP C 152 ? 0.3719 0.3952 0.3648 -0.0115 -0.1200 -0.0294 151 ASP L CG  
4088 O OD1 . ASP C 152 ? 0.3881 0.4146 0.3926 -0.0144 -0.1203 -0.0311 151 ASP L OD1 
4089 O OD2 . ASP C 152 ? 0.4015 0.4260 0.3847 -0.0073 -0.1218 -0.0262 151 ASP L OD2 
4090 N N   . ASN C 153 ? 0.3185 0.3320 0.3184 -0.0328 -0.1116 -0.0336 152 ASN L N   
4091 C CA  . ASN C 153 ? 0.3244 0.3299 0.3207 -0.0407 -0.1136 -0.0339 152 ASN L CA  
4092 C C   . ASN C 153 ? 0.3388 0.3292 0.3191 -0.0361 -0.1169 -0.0328 152 ASN L C   
4093 O O   . ASN C 153 ? 0.3555 0.3348 0.3302 -0.0424 -0.1214 -0.0329 152 ASN L O   
4094 C CB  . ASN C 153 ? 0.3416 0.3470 0.3425 -0.0463 -0.1196 -0.0373 152 ASN L CB  
4095 C CG  . ASN C 153 ? 0.3428 0.3470 0.3448 -0.0595 -0.1199 -0.0363 152 ASN L CG  
4096 O OD1 . ASN C 153 ? 0.3547 0.3658 0.3605 -0.0653 -0.1137 -0.0343 152 ASN L OD1 
4097 N ND2 . ASN C 153 ? 0.3636 0.3580 0.3604 -0.0648 -0.1279 -0.0372 152 ASN L ND2 
4098 N N   . ALA C 154 ? 0.3254 0.3165 0.2985 -0.0263 -0.1154 -0.0318 153 ALA L N   
4099 C CA  . ALA C 154 ? 0.3357 0.3166 0.2945 -0.0199 -0.1186 -0.0326 153 ALA L CA  
4100 C C   . ALA C 154 ? 0.3306 0.3124 0.2889 -0.0227 -0.1126 -0.0294 153 ALA L C   
4101 O O   . ALA C 154 ? 0.3058 0.2995 0.2703 -0.0222 -0.1054 -0.0265 153 ALA L O   
4102 C CB  . ALA C 154 ? 0.3498 0.3364 0.3014 -0.0080 -0.1201 -0.0343 153 ALA L CB  
4103 N N   . LEU C 155 ? 0.3400 0.3077 0.2907 -0.0266 -0.1166 -0.0297 154 LEU L N   
4104 C CA  A LEU C 155 ? 0.3437 0.3089 0.2913 -0.0288 -0.1126 -0.0271 154 LEU L CA  
4105 C CA  B LEU C 155 ? 0.3362 0.3026 0.2847 -0.0292 -0.1119 -0.0268 154 LEU L CA  
4106 C C   . LEU C 155 ? 0.3324 0.3047 0.2744 -0.0172 -0.1101 -0.0278 154 LEU L C   
4107 O O   . LEU C 155 ? 0.3481 0.3146 0.2794 -0.0075 -0.1169 -0.0321 154 LEU L O   
4108 C CB  A LEU C 155 ? 0.3713 0.3153 0.3070 -0.0331 -0.1216 -0.0279 154 LEU L CB  
4109 C CB  B LEU C 155 ? 0.3504 0.2978 0.2897 -0.0365 -0.1186 -0.0265 154 LEU L CB  
4110 C CG  A LEU C 155 ? 0.3780 0.3172 0.3097 -0.0369 -0.1185 -0.0250 154 LEU L CG  
4111 C CG  B LEU C 155 ? 0.3502 0.2995 0.2974 -0.0524 -0.1163 -0.0233 154 LEU L CG  
4112 C CD1 A LEU C 155 ? 0.3712 0.3251 0.3169 -0.0477 -0.1086 -0.0210 154 LEU L CD1 
4113 C CD1 B LEU C 155 ? 0.3495 0.3047 0.3048 -0.0566 -0.1187 -0.0251 154 LEU L CD1 
4114 C CD2 A LEU C 155 ? 0.4000 0.3151 0.3179 -0.0426 -0.1291 -0.0249 154 LEU L CD2 
4115 C CD2 B LEU C 155 ? 0.3676 0.2973 0.3028 -0.0617 -0.1235 -0.0212 154 LEU L CD2 
4116 N N   . GLN C 156 ? 0.3151 0.3001 0.2636 -0.0181 -0.1014 -0.0241 155 GLN L N   
4117 C CA  . GLN C 156 ? 0.3259 0.3213 0.2696 -0.0090 -0.0985 -0.0239 155 GLN L CA  
4118 C C   . GLN C 156 ? 0.3339 0.3212 0.2689 -0.0062 -0.1001 -0.0252 155 GLN L C   
4119 O O   . GLN C 156 ? 0.3371 0.3128 0.2721 -0.0140 -0.1003 -0.0235 155 GLN L O   
4120 C CB  . GLN C 156 ? 0.3177 0.3285 0.2714 -0.0124 -0.0903 -0.0188 155 GLN L CB  
4121 C CG  . GLN C 156 ? 0.3236 0.3403 0.2846 -0.0142 -0.0907 -0.0180 155 GLN L CG  
4122 C CD  . GLN C 156 ? 0.3519 0.3741 0.3059 -0.0061 -0.0948 -0.0201 155 GLN L CD  
4123 O OE1 . GLN C 156 ? 0.3707 0.4052 0.3200 -0.0016 -0.0926 -0.0183 155 GLN L OE1 
4124 N NE2 . GLN C 156 ? 0.3418 0.3564 0.2941 -0.0046 -0.1009 -0.0241 155 GLN L NE2 
4125 N N   . SER C 157 ? 0.3506 0.3457 0.2781 0.0044  -0.1012 -0.0282 156 SER L N   
4126 C CA  . SER C 157 ? 0.3790 0.3710 0.2999 0.0083  -0.1017 -0.0296 156 SER L CA  
4127 C C   . SER C 157 ? 0.3681 0.3828 0.2879 0.0170  -0.0976 -0.0304 156 SER L C   
4128 O O   . SER C 157 ? 0.3590 0.3876 0.2772 0.0232  -0.0984 -0.0327 156 SER L O   
4129 C CB  . SER C 157 ? 0.4137 0.3840 0.3216 0.0136  -0.1133 -0.0356 156 SER L CB  
4130 O OG  . SER C 157 ? 0.4227 0.3956 0.3224 0.0264  -0.1209 -0.0431 156 SER L OG  
4131 N N   . GLY C 158 ? 0.3667 0.3860 0.2873 0.0161  -0.0931 -0.0283 157 GLY L N   
4132 C CA  . GLY C 158 ? 0.3685 0.4097 0.2870 0.0235  -0.0899 -0.0295 157 GLY L CA  
4133 C C   . GLY C 158 ? 0.3560 0.4171 0.2832 0.0164  -0.0811 -0.0216 157 GLY L C   
4134 O O   . GLY C 158 ? 0.3656 0.4478 0.2915 0.0198  -0.0779 -0.0211 157 GLY L O   
4135 N N   . ASN C 159 ? 0.3301 0.3853 0.2653 0.0068  -0.0784 -0.0160 158 ASN L N   
4136 C CA  . ASN C 159 ? 0.3048 0.3748 0.2461 0.0006  -0.0733 -0.0088 158 ASN L CA  
4137 C C   . ASN C 159 ? 0.2905 0.3523 0.2408 -0.0091 -0.0692 -0.0031 158 ASN L C   
4138 O O   . ASN C 159 ? 0.2913 0.3575 0.2468 -0.0147 -0.0679 0.0021  158 ASN L O   
4139 C CB  . ASN C 159 ? 0.2948 0.3689 0.2358 0.0012  -0.0761 -0.0088 158 ASN L CB  
4140 C CG  . ASN C 159 ? 0.2972 0.3531 0.2418 -0.0009 -0.0798 -0.0113 158 ASN L CG  
4141 O OD1 . ASN C 159 ? 0.2871 0.3281 0.2340 -0.0040 -0.0802 -0.0127 158 ASN L OD1 
4142 N ND2 . ASN C 159 ? 0.3024 0.3607 0.2462 0.0005  -0.0830 -0.0122 158 ASN L ND2 
4143 N N   . SER C 160 ? 0.2917 0.3427 0.2426 -0.0106 -0.0681 -0.0042 159 SER L N   
4144 C CA  . SER C 160 ? 0.2860 0.3308 0.2449 -0.0189 -0.0642 -0.0001 159 SER L CA  
4145 C C   . SER C 160 ? 0.2854 0.3286 0.2421 -0.0189 -0.0616 0.0002  159 SER L C   
4146 O O   . SER C 160 ? 0.2899 0.3306 0.2387 -0.0126 -0.0643 -0.0039 159 SER L O   
4147 C CB  . SER C 160 ? 0.2957 0.3276 0.2597 -0.0237 -0.0657 -0.0022 159 SER L CB  
4148 O OG  . SER C 160 ? 0.2965 0.3158 0.2542 -0.0225 -0.0692 -0.0063 159 SER L OG  
4149 N N   . GLN C 161 ? 0.2727 0.3176 0.2356 -0.0248 -0.0576 0.0048  160 GLN L N   
4150 C CA  . GLN C 161 ? 0.2770 0.3194 0.2389 -0.0260 -0.0549 0.0058  160 GLN L CA  
4151 C C   . GLN C 161 ? 0.2594 0.2938 0.2287 -0.0332 -0.0524 0.0072  160 GLN L C   
4152 O O   . GLN C 161 ? 0.2300 0.2665 0.2061 -0.0363 -0.0524 0.0087  160 GLN L O   
4153 C CB  . GLN C 161 ? 0.2822 0.3396 0.2438 -0.0256 -0.0526 0.0101  160 GLN L CB  
4154 C CG  . GLN C 161 ? 0.3084 0.3805 0.2633 -0.0186 -0.0542 0.0080  160 GLN L CG  
4155 C CD  . GLN C 161 ? 0.3258 0.4155 0.2801 -0.0196 -0.0516 0.0121  160 GLN L CD  
4156 O OE1 . GLN C 161 ? 0.3541 0.4553 0.3103 -0.0250 -0.0509 0.0183  160 GLN L OE1 
4157 N NE2 . GLN C 161 ? 0.3226 0.4146 0.2734 -0.0148 -0.0512 0.0088  160 GLN L NE2 
4158 N N   . GLU C 162 ? 0.2705 0.2973 0.2377 -0.0351 -0.0510 0.0064  161 GLU L N   
4159 C CA  . GLU C 162 ? 0.2758 0.2976 0.2487 -0.0417 -0.0483 0.0066  161 GLU L CA  
4160 C C   . GLU C 162 ? 0.2731 0.2967 0.2465 -0.0428 -0.0452 0.0094  161 GLU L C   
4161 O O   . GLU C 162 ? 0.2569 0.2822 0.2243 -0.0389 -0.0455 0.0102  161 GLU L O   
4162 C CB  . GLU C 162 ? 0.3022 0.3123 0.2699 -0.0453 -0.0499 0.0039  161 GLU L CB  
4163 C CG  . GLU C 162 ? 0.3308 0.3368 0.2976 -0.0462 -0.0537 0.0013  161 GLU L CG  
4164 C CD  . GLU C 162 ? 0.3360 0.3312 0.2983 -0.0537 -0.0555 0.0003  161 GLU L CD  
4165 O OE1 . GLU C 162 ? 0.3442 0.3326 0.3007 -0.0565 -0.0549 0.0016  161 GLU L OE1 
4166 O OE2 . GLU C 162 ? 0.3671 0.3605 0.3306 -0.0577 -0.0582 -0.0012 161 GLU L OE2 
4167 N N   . SER C 163 ? 0.2610 0.2858 0.2414 -0.0469 -0.0430 0.0101  162 SER L N   
4168 C CA  . SER C 163 ? 0.2683 0.2928 0.2493 -0.0486 -0.0404 0.0120  162 SER L CA  
4169 C C   . SER C 163 ? 0.2602 0.2824 0.2450 -0.0536 -0.0382 0.0092  162 SER L C   
4170 O O   . SER C 163 ? 0.2319 0.2579 0.2231 -0.0553 -0.0386 0.0063  162 SER L O   
4171 C CB  . SER C 163 ? 0.2748 0.3055 0.2602 -0.0480 -0.0415 0.0157  162 SER L CB  
4172 O OG  . SER C 163 ? 0.2925 0.3223 0.2783 -0.0494 -0.0401 0.0176  162 SER L OG  
4173 N N   . VAL C 164 ? 0.2721 0.2905 0.2533 -0.0558 -0.0359 0.0098  163 VAL L N   
4174 C CA  . VAL C 164 ? 0.2871 0.3067 0.2709 -0.0614 -0.0333 0.0072  163 VAL L CA  
4175 C C   . VAL C 164 ? 0.2799 0.3013 0.2660 -0.0609 -0.0314 0.0079  163 VAL L C   
4176 O O   . VAL C 164 ? 0.2822 0.2997 0.2638 -0.0585 -0.0317 0.0112  163 VAL L O   
4177 C CB  . VAL C 164 ? 0.3141 0.3250 0.2883 -0.0666 -0.0334 0.0072  163 VAL L CB  
4178 C CG1 . VAL C 164 ? 0.3257 0.3421 0.3020 -0.0747 -0.0303 0.0051  163 VAL L CG1 
4179 C CG2 . VAL C 164 ? 0.3220 0.3277 0.2919 -0.0663 -0.0372 0.0066  163 VAL L CG2 
4180 N N   . THR C 165 ? 0.2760 0.3047 0.2696 -0.0621 -0.0303 0.0044  164 THR L N   
4181 C CA  . THR C 165 ? 0.2868 0.3168 0.2826 -0.0608 -0.0297 0.0039  164 THR L CA  
4182 C C   . THR C 165 ? 0.3182 0.3447 0.3067 -0.0654 -0.0262 0.0046  164 THR L C   
4183 O O   . THR C 165 ? 0.3017 0.3253 0.2840 -0.0706 -0.0250 0.0050  164 THR L O   
4184 C CB  . THR C 165 ? 0.2830 0.3225 0.2884 -0.0589 -0.0310 -0.0021 164 THR L CB  
4185 O OG1 . THR C 165 ? 0.2879 0.3375 0.2954 -0.0636 -0.0277 -0.0069 164 THR L OG1 
4186 C CG2 . THR C 165 ? 0.2991 0.3388 0.3104 -0.0541 -0.0366 -0.0026 164 THR L CG2 
4187 N N   . GLU C 166 ? 0.3460 0.3707 0.3340 -0.0638 -0.0260 0.0056  165 GLU L N   
4188 C CA  . GLU C 166 ? 0.3893 0.4117 0.3709 -0.0679 -0.0229 0.0055  165 GLU L CA  
4189 C C   . GLU C 166 ? 0.3673 0.4025 0.3536 -0.0719 -0.0202 -0.0002 165 GLU L C   
4190 O O   . GLU C 166 ? 0.3398 0.3852 0.3358 -0.0684 -0.0215 -0.0051 165 GLU L O   
4191 C CB  . GLU C 166 ? 0.4686 0.4863 0.4487 -0.0648 -0.0238 0.0078  165 GLU L CB  
4192 C CG  . GLU C 166 ? 0.5531 0.5622 0.5268 -0.0626 -0.0255 0.0130  165 GLU L CG  
4193 C CD  . GLU C 166 ? 0.6806 0.6805 0.6431 -0.0649 -0.0249 0.0147  165 GLU L CD  
4194 O OE1 . GLU C 166 ? 0.6913 0.6888 0.6494 -0.0689 -0.0230 0.0139  165 GLU L OE1 
4195 O OE2 . GLU C 166 ? 0.7773 0.7722 0.7347 -0.0620 -0.0273 0.0166  165 GLU L OE2 
4196 N N   . GLN C 167 ? 0.3795 0.4147 0.3582 -0.0791 -0.0171 0.0003  166 GLN L N   
4197 C CA  . GLN C 167 ? 0.3700 0.4215 0.3511 -0.0856 -0.0135 -0.0045 166 GLN L CA  
4198 C C   . GLN C 167 ? 0.3361 0.4005 0.3266 -0.0791 -0.0134 -0.0113 166 GLN L C   
4199 O O   . GLN C 167 ? 0.3260 0.3829 0.3150 -0.0745 -0.0147 -0.0102 166 GLN L O   
4200 C CB  . GLN C 167 ? 0.3974 0.4439 0.3657 -0.0954 -0.0113 -0.0009 166 GLN L CB  
4201 C CG  . GLN C 167 ? 0.4090 0.4735 0.3768 -0.1061 -0.0077 -0.0038 166 GLN L CG  
4202 C CD  . GLN C 167 ? 0.4379 0.4914 0.3895 -0.1189 -0.0081 0.0026  166 GLN L CD  
4203 O OE1 . GLN C 167 ? 0.4130 0.4483 0.3542 -0.1184 -0.0103 0.0072  166 GLN L OE1 
4204 N NE2 . GLN C 167 ? 0.3945 0.4583 0.3434 -0.1308 -0.0072 0.0031  166 GLN L NE2 
4205 N N   . ASP C 168 ? 0.3036 0.3872 0.3031 -0.0786 -0.0125 -0.0188 167 ASP L N   
4206 C CA  . ASP C 168 ? 0.3090 0.4069 0.3176 -0.0708 -0.0139 -0.0279 167 ASP L CA  
4207 C C   . ASP C 168 ? 0.3249 0.4309 0.3282 -0.0746 -0.0099 -0.0298 167 ASP L C   
4208 O O   . ASP C 168 ? 0.3077 0.4238 0.3050 -0.0855 -0.0048 -0.0285 167 ASP L O   
4209 C CB  . ASP C 168 ? 0.3252 0.4459 0.3443 -0.0693 -0.0139 -0.0371 167 ASP L CB  
4210 C CG  . ASP C 168 ? 0.3421 0.4751 0.3708 -0.0577 -0.0183 -0.0482 167 ASP L CG  
4211 O OD1 . ASP C 168 ? 0.3547 0.4757 0.3880 -0.0485 -0.0258 -0.0489 167 ASP L OD1 
4212 O OD2 . ASP C 168 ? 0.3506 0.5044 0.3810 -0.0581 -0.0152 -0.0559 167 ASP L OD2 
4213 N N   . SER C 169 ? 0.3260 0.4290 0.3311 -0.0664 -0.0129 -0.0332 168 SER L N   
4214 C CA  . SER C 169 ? 0.3401 0.4484 0.3393 -0.0688 -0.0097 -0.0348 168 SER L CA  
4215 C C   . SER C 169 ? 0.3498 0.4889 0.3538 -0.0703 -0.0060 -0.0453 168 SER L C   
4216 O O   . SER C 169 ? 0.3539 0.5012 0.3510 -0.0756 -0.0018 -0.0458 168 SER L O   
4217 C CB  . SER C 169 ? 0.3621 0.4574 0.3621 -0.0592 -0.0153 -0.0356 168 SER L CB  
4218 O OG  . SER C 169 ? 0.3670 0.4706 0.3775 -0.0480 -0.0217 -0.0454 168 SER L OG  
4219 N N   . LYS C 170 ? 0.3582 0.5150 0.3734 -0.0651 -0.0078 -0.0539 169 LYS L N   
4220 C CA  . LYS C 170 ? 0.3937 0.5866 0.4157 -0.0652 -0.0045 -0.0662 169 LYS L CA  
4221 C C   . LYS C 170 ? 0.3814 0.5924 0.4020 -0.0797 0.0019  -0.0635 169 LYS L C   
4222 O O   . LYS C 170 ? 0.3693 0.6058 0.3865 -0.0891 0.0080  -0.0664 169 LYS L O   
4223 C CB  . LYS C 170 ? 0.4412 0.6447 0.4768 -0.0494 -0.0121 -0.0792 169 LYS L CB  
4224 C CG  . LYS C 170 ? 0.5031 0.7475 0.5472 -0.0461 -0.0098 -0.0947 169 LYS L CG  
4225 C CD  . LYS C 170 ? 0.5620 0.8175 0.6198 -0.0303 -0.0186 -0.1085 169 LYS L CD  
4226 C CE  . LYS C 170 ? 0.5874 0.8396 0.6508 -0.0327 -0.0200 -0.1055 169 LYS L CE  
4227 N NZ  . LYS C 170 ? 0.6205 0.9121 0.6914 -0.0388 -0.0141 -0.1137 169 LYS L NZ  
4228 N N   . ASP C 171 ? 0.3760 0.5778 0.3992 -0.0820 0.0002  -0.0590 170 ASP L N   
4229 C CA  . ASP C 171 ? 0.3724 0.5939 0.3963 -0.0948 0.0046  -0.0582 170 ASP L CA  
4230 C C   . ASP C 171 ? 0.3437 0.5402 0.3542 -0.1083 0.0056  -0.0437 170 ASP L C   
4231 O O   . ASP C 171 ? 0.3396 0.5475 0.3476 -0.1213 0.0080  -0.0410 170 ASP L O   
4232 C CB  . ASP C 171 ? 0.3829 0.6195 0.4211 -0.0869 0.0011  -0.0671 170 ASP L CB  
4233 C CG  . ASP C 171 ? 0.4041 0.6124 0.4444 -0.0793 -0.0052 -0.0621 170 ASP L CG  
4234 O OD1 . ASP C 171 ? 0.4158 0.5945 0.4463 -0.0825 -0.0060 -0.0506 170 ASP L OD1 
4235 O OD2 . ASP C 171 ? 0.4554 0.6730 0.5072 -0.0700 -0.0097 -0.0703 170 ASP L OD2 
4236 N N   . SER C 172 ? 0.3041 0.4688 0.3060 -0.1053 0.0029  -0.0353 171 SER L N   
4237 C CA  . SER C 172 ? 0.3059 0.4454 0.2932 -0.1159 0.0023  -0.0231 171 SER L CA  
4238 C C   . SER C 172 ? 0.3035 0.4331 0.2926 -0.1169 -0.0008 -0.0197 171 SER L C   
4239 O O   . SER C 172 ? 0.3096 0.4218 0.2871 -0.1258 -0.0026 -0.0115 171 SER L O   
4240 C CB  . SER C 172 ? 0.3164 0.4659 0.2920 -0.1325 0.0063  -0.0193 171 SER L CB  
4241 O OG  . SER C 172 ? 0.3121 0.4738 0.2868 -0.1304 0.0094  -0.0237 171 SER L OG  
4242 N N   . THR C 173 ? 0.2834 0.4214 0.2858 -0.1069 -0.0029 -0.0262 172 THR L N   
4243 C CA  . THR C 173 ? 0.2841 0.4135 0.2889 -0.1067 -0.0062 -0.0236 172 THR L CA  
4244 C C   . THR C 173 ? 0.2805 0.3836 0.2833 -0.0968 -0.0108 -0.0188 172 THR L C   
4245 O O   . THR C 173 ? 0.2701 0.3649 0.2728 -0.0891 -0.0118 -0.0186 172 THR L O   
4246 C CB  . THR C 173 ? 0.2802 0.4335 0.2998 -0.1018 -0.0067 -0.0333 172 THR L CB  
4247 O OG1 . THR C 173 ? 0.2880 0.4410 0.3170 -0.0866 -0.0103 -0.0397 172 THR L OG1 
4248 C CG2 . THR C 173 ? 0.2837 0.4706 0.3074 -0.1106 -0.0018 -0.0399 172 THR L CG2 
4249 N N   . TYR C 174 ? 0.2905 0.3840 0.2927 -0.0971 -0.0138 -0.0156 173 TYR L N   
4250 C CA  . TYR C 174 ? 0.2801 0.3541 0.2809 -0.0887 -0.0180 -0.0115 173 TYR L CA  
4251 C C   . TYR C 174 ? 0.2601 0.3415 0.2720 -0.0820 -0.0210 -0.0161 173 TYR L C   
4252 O O   . TYR C 174 ? 0.2505 0.3495 0.2696 -0.0852 -0.0201 -0.0217 173 TYR L O   
4253 C CB  . TYR C 174 ? 0.3200 0.3758 0.3082 -0.0944 -0.0200 -0.0045 173 TYR L CB  
4254 C CG  . TYR C 174 ? 0.3709 0.4158 0.3466 -0.1003 -0.0191 0.0000  173 TYR L CG  
4255 C CD1 . TYR C 174 ? 0.4128 0.4615 0.3808 -0.1132 -0.0177 0.0015  173 TYR L CD1 
4256 C CD2 . TYR C 174 ? 0.4018 0.4331 0.3728 -0.0937 -0.0203 0.0030  173 TYR L CD2 
4257 C CE1 . TYR C 174 ? 0.4462 0.4829 0.4012 -0.1189 -0.0181 0.0060  173 TYR L CE1 
4258 C CE2 . TYR C 174 ? 0.4308 0.4514 0.3902 -0.0982 -0.0203 0.0066  173 TYR L CE2 
4259 C CZ  . TYR C 174 ? 0.4699 0.4918 0.4208 -0.1106 -0.0195 0.0081  173 TYR L CZ  
4260 O OH  . TYR C 174 ? 0.5025 0.5115 0.4404 -0.1154 -0.0207 0.0121  173 TYR L OH  
4261 N N   . SER C 175 ? 0.2341 0.3038 0.2471 -0.0735 -0.0248 -0.0138 174 SER L N   
4262 C CA  . SER C 175 ? 0.2316 0.3025 0.2513 -0.0683 -0.0289 -0.0158 174 SER L CA  
4263 C C   . SER C 175 ? 0.2333 0.2884 0.2455 -0.0671 -0.0312 -0.0090 174 SER L C   
4264 O O   . SER C 175 ? 0.2439 0.2879 0.2479 -0.0668 -0.0307 -0.0039 174 SER L O   
4265 C CB  . SER C 175 ? 0.2301 0.3056 0.2587 -0.0596 -0.0330 -0.0208 174 SER L CB  
4266 O OG  . SER C 175 ? 0.2233 0.3180 0.2605 -0.0590 -0.0320 -0.0300 174 SER L OG  
4267 N N   . LEU C 176 ? 0.2333 0.2883 0.2480 -0.0653 -0.0342 -0.0096 175 LEU L N   
4268 C CA  . LEU C 176 ? 0.2375 0.2805 0.2445 -0.0637 -0.0364 -0.0045 175 LEU L CA  
4269 C C   . LEU C 176 ? 0.2433 0.2877 0.2557 -0.0580 -0.0407 -0.0052 175 LEU L C   
4270 O O   . LEU C 176 ? 0.2418 0.2949 0.2624 -0.0575 -0.0423 -0.0104 175 LEU L O   
4271 C CB  . LEU C 176 ? 0.2512 0.2896 0.2512 -0.0701 -0.0362 -0.0038 175 LEU L CB  
4272 C CG  . LEU C 176 ? 0.2594 0.2861 0.2509 -0.0671 -0.0399 -0.0008 175 LEU L CG  
4273 C CD1 . LEU C 176 ? 0.2808 0.2970 0.2617 -0.0736 -0.0416 0.0004  175 LEU L CD1 
4274 C CD2 . LEU C 176 ? 0.2587 0.2884 0.2548 -0.0636 -0.0431 -0.0025 175 LEU L CD2 
4275 N N   . SER C 177 ? 0.2390 0.2767 0.2464 -0.0542 -0.0429 -0.0005 176 SER L N   
4276 C CA  A SER C 177 ? 0.2597 0.2972 0.2683 -0.0502 -0.0473 0.0008  176 SER L CA  
4277 C CA  B SER C 177 ? 0.2474 0.2850 0.2560 -0.0502 -0.0473 0.0007  176 SER L CA  
4278 C C   . SER C 177 ? 0.2637 0.2974 0.2647 -0.0495 -0.0478 0.0025  176 SER L C   
4279 O O   . SER C 177 ? 0.2747 0.3040 0.2680 -0.0495 -0.0461 0.0046  176 SER L O   
4280 C CB  A SER C 177 ? 0.2739 0.3095 0.2813 -0.0480 -0.0498 0.0055  176 SER L CB  
4281 C CB  B SER C 177 ? 0.2468 0.2826 0.2546 -0.0479 -0.0501 0.0052  176 SER L CB  
4282 O OG  A SER C 177 ? 0.2949 0.3304 0.3058 -0.0458 -0.0557 0.0057  176 SER L OG  
4283 O OG  B SER C 177 ? 0.2320 0.2660 0.2319 -0.0478 -0.0483 0.0104  176 SER L OG  
4284 N N   . SER C 178 ? 0.2584 0.2933 0.2611 -0.0479 -0.0509 0.0010  177 SER L N   
4285 C CA  . SER C 178 ? 0.2551 0.2870 0.2504 -0.0453 -0.0529 0.0021  177 SER L CA  
4286 C C   . SER C 178 ? 0.2506 0.2862 0.2471 -0.0421 -0.0565 0.0042  177 SER L C   
4287 O O   . SER C 178 ? 0.2472 0.2844 0.2510 -0.0424 -0.0591 0.0020  177 SER L O   
4288 C CB  . SER C 178 ? 0.2649 0.2936 0.2593 -0.0475 -0.0541 -0.0014 177 SER L CB  
4289 O OG  . SER C 178 ? 0.2758 0.3005 0.2623 -0.0432 -0.0573 -0.0012 177 SER L OG  
4290 N N   . THR C 179 ? 0.2420 0.2805 0.2317 -0.0396 -0.0570 0.0083  178 THR L N   
4291 C CA  . THR C 179 ? 0.2432 0.2863 0.2315 -0.0386 -0.0608 0.0119  178 THR L CA  
4292 C C   . THR C 179 ? 0.2466 0.2933 0.2282 -0.0346 -0.0621 0.0107  178 THR L C   
4293 O O   . THR C 179 ? 0.2424 0.2930 0.2171 -0.0314 -0.0604 0.0104  178 THR L O   
4294 C CB  . THR C 179 ? 0.2521 0.2998 0.2374 -0.0407 -0.0609 0.0184  178 THR L CB  
4295 O OG1 . THR C 179 ? 0.2644 0.3070 0.2553 -0.0431 -0.0598 0.0180  178 THR L OG1 
4296 C CG2 . THR C 179 ? 0.2582 0.3091 0.2410 -0.0426 -0.0661 0.0234  178 THR L CG2 
4297 N N   . LEU C 180 ? 0.2492 0.2956 0.2322 -0.0338 -0.0660 0.0098  179 LEU L N   
4298 C CA  . LEU C 180 ? 0.2651 0.3150 0.2418 -0.0296 -0.0683 0.0081  179 LEU L CA  
4299 C C   . LEU C 180 ? 0.2760 0.3357 0.2479 -0.0306 -0.0703 0.0141  179 LEU L C   
4300 O O   . LEU C 180 ? 0.2708 0.3273 0.2460 -0.0345 -0.0737 0.0176  179 LEU L O   
4301 C CB  . LEU C 180 ? 0.2674 0.3111 0.2488 -0.0291 -0.0716 0.0035  179 LEU L CB  
4302 C CG  . LEU C 180 ? 0.2752 0.3212 0.2507 -0.0247 -0.0753 0.0016  179 LEU L CG  
4303 C CD1 . LEU C 180 ? 0.2853 0.3292 0.2535 -0.0199 -0.0752 -0.0025 179 LEU L CD1 
4304 C CD2 . LEU C 180 ? 0.2812 0.3220 0.2628 -0.0254 -0.0792 -0.0017 179 LEU L CD2 
4305 N N   . THR C 181 ? 0.2824 0.3541 0.2461 -0.0277 -0.0691 0.0152  180 THR L N   
4306 C CA  . THR C 181 ? 0.2922 0.3774 0.2501 -0.0310 -0.0707 0.0219  180 THR L CA  
4307 C C   . THR C 181 ? 0.3011 0.3940 0.2529 -0.0263 -0.0732 0.0191  180 THR L C   
4308 O O   . THR C 181 ? 0.2906 0.3880 0.2386 -0.0187 -0.0721 0.0128  180 THR L O   
4309 C CB  . THR C 181 ? 0.3038 0.4033 0.2578 -0.0329 -0.0670 0.0259  180 THR L CB  
4310 O OG1 . THR C 181 ? 0.3047 0.3930 0.2651 -0.0366 -0.0655 0.0274  180 THR L OG1 
4311 C CG2 . THR C 181 ? 0.3179 0.4331 0.2655 -0.0396 -0.0688 0.0344  180 THR L CG2 
4312 N N   . LEU C 182 ? 0.3180 0.4112 0.2679 -0.0302 -0.0776 0.0236  181 LEU L N   
4313 C CA  . LEU C 182 ? 0.3562 0.4582 0.2992 -0.0269 -0.0805 0.0222  181 LEU L CA  
4314 C C   . LEU C 182 ? 0.3665 0.4819 0.3016 -0.0347 -0.0828 0.0317  181 LEU L C   
4315 O O   . LEU C 182 ? 0.3740 0.4828 0.3105 -0.0430 -0.0851 0.0390  181 LEU L O   
4316 C CB  . LEU C 182 ? 0.3868 0.4727 0.3347 -0.0253 -0.0852 0.0185  181 LEU L CB  
4317 C CG  . LEU C 182 ? 0.4097 0.4822 0.3653 -0.0209 -0.0839 0.0106  181 LEU L CG  
4318 C CD1 . LEU C 182 ? 0.4381 0.4988 0.3997 -0.0209 -0.0886 0.0075  181 LEU L CD1 
4319 C CD2 . LEU C 182 ? 0.4309 0.5083 0.3808 -0.0131 -0.0826 0.0041  181 LEU L CD2 
4320 N N   . SER C 183 ? 0.3913 0.5236 0.3176 -0.0327 -0.0835 0.0315  182 SER L N   
4321 C CA  . SER C 183 ? 0.4014 0.5441 0.3188 -0.0422 -0.0876 0.0414  182 SER L CA  
4322 C C   . SER C 183 ? 0.4124 0.5324 0.3320 -0.0457 -0.0954 0.0439  182 SER L C   
4323 O O   . SER C 183 ? 0.4059 0.5099 0.3333 -0.0386 -0.0965 0.0361  182 SER L O   
4324 C CB  . SER C 183 ? 0.4146 0.5832 0.3220 -0.0389 -0.0863 0.0397  182 SER L CB  
4325 O OG  . SER C 183 ? 0.4229 0.5838 0.3305 -0.0296 -0.0888 0.0315  182 SER L OG  
4326 N N   . LYS C 184 ? 0.4234 0.5422 0.3357 -0.0567 -0.1015 0.0546  183 LYS L N   
4327 C CA  . LYS C 184 ? 0.4419 0.5396 0.3537 -0.0594 -0.1114 0.0570  183 LYS L CA  
4328 C C   . LYS C 184 ? 0.4269 0.5276 0.3367 -0.0516 -0.1122 0.0503  183 LYS L C   
4329 O O   . LYS C 184 ? 0.4131 0.4958 0.3305 -0.0461 -0.1162 0.0440  183 LYS L O   
4330 C CB  . LYS C 184 ? 0.4780 0.5738 0.3782 -0.0735 -0.1199 0.0706  183 LYS L CB  
4331 C CG  . LYS C 184 ? 0.5279 0.6040 0.4239 -0.0755 -0.1318 0.0730  183 LYS L CG  
4332 C CD  . LYS C 184 ? 0.5840 0.6491 0.4677 -0.0900 -0.1438 0.0867  183 LYS L CD  
4333 C CE  . LYS C 184 ? 0.6549 0.7122 0.5275 -0.0934 -0.1542 0.0907  183 LYS L CE  
4334 N NZ  . LYS C 184 ? 0.7129 0.7413 0.5795 -0.1010 -0.1705 0.0980  183 LYS L NZ  
4335 N N   . ALA C 185 ? 0.4257 0.5503 0.3267 -0.0500 -0.1082 0.0500  184 ALA L N   
4336 C CA  . ALA C 185 ? 0.4572 0.5867 0.3541 -0.0425 -0.1097 0.0438  184 ALA L CA  
4337 C C   . ALA C 185 ? 0.4467 0.5623 0.3551 -0.0305 -0.1077 0.0314  184 ALA L C   
4338 O O   . ALA C 185 ? 0.4618 0.5624 0.3733 -0.0274 -0.1132 0.0278  184 ALA L O   
4339 C CB  . ALA C 185 ? 0.4616 0.6230 0.3477 -0.0415 -0.1051 0.0440  184 ALA L CB  
4340 N N   . ASP C 186 ? 0.4484 0.5676 0.3624 -0.0252 -0.1012 0.0258  185 ASP L N   
4341 C CA  . ASP C 186 ? 0.4335 0.5391 0.3564 -0.0161 -0.1001 0.0153  185 ASP L CA  
4342 C C   . ASP C 186 ? 0.4096 0.4931 0.3437 -0.0192 -0.1032 0.0151  185 ASP L C   
4343 O O   . ASP C 186 ? 0.3968 0.4696 0.3363 -0.0145 -0.1056 0.0084  185 ASP L O   
4344 C CB  . ASP C 186 ? 0.4397 0.5520 0.3642 -0.0109 -0.0941 0.0104  185 ASP L CB  
4345 C CG  . ASP C 186 ? 0.4679 0.6020 0.3826 -0.0032 -0.0925 0.0058  185 ASP L CG  
4346 O OD1 . ASP C 186 ? 0.5254 0.6684 0.4328 -0.0009 -0.0958 0.0050  185 ASP L OD1 
4347 O OD2 . ASP C 186 ? 0.4626 0.6053 0.3769 0.0011  -0.0887 0.0023  185 ASP L OD2 
4348 N N   . TYR C 187 ? 0.3969 0.4750 0.3349 -0.0262 -0.1031 0.0212  186 TYR L N   
4349 C CA  . TYR C 187 ? 0.3859 0.4461 0.3348 -0.0278 -0.1067 0.0196  186 TYR L CA  
4350 C C   . TYR C 187 ? 0.4125 0.4637 0.3616 -0.0267 -0.1147 0.0180  186 TYR L C   
4351 O O   . TYR C 187 ? 0.3898 0.4313 0.3490 -0.0233 -0.1168 0.0111  186 TYR L O   
4352 C CB  . TYR C 187 ? 0.3823 0.4389 0.3314 -0.0353 -0.1081 0.0272  186 TYR L CB  
4353 C CG  . TYR C 187 ? 0.3724 0.4128 0.3318 -0.0353 -0.1131 0.0242  186 TYR L CG  
4354 C CD1 . TYR C 187 ? 0.3639 0.4011 0.3348 -0.0315 -0.1084 0.0166  186 TYR L CD1 
4355 C CD2 . TYR C 187 ? 0.3756 0.4049 0.3326 -0.0391 -0.1231 0.0288  186 TYR L CD2 
4356 C CE1 . TYR C 187 ? 0.3628 0.3905 0.3440 -0.0305 -0.1124 0.0122  186 TYR L CE1 
4357 C CE2 . TYR C 187 ? 0.3836 0.3999 0.3505 -0.0366 -0.1286 0.0237  186 TYR L CE2 
4358 C CZ  . TYR C 187 ? 0.3779 0.3957 0.3577 -0.0320 -0.1226 0.0148  186 TYR L CZ  
4359 O OH  . TYR C 187 ? 0.3820 0.3926 0.3724 -0.0288 -0.1272 0.0082  186 TYR L OH  
4360 N N   . GLU C 188 ? 0.4400 0.4962 0.3779 -0.0303 -0.1195 0.0246  187 GLU L N   
4361 C CA  . GLU C 188 ? 0.4864 0.5325 0.4220 -0.0304 -0.1289 0.0249  187 GLU L CA  
4362 C C   . GLU C 188 ? 0.4895 0.5381 0.4257 -0.0228 -0.1287 0.0170  187 GLU L C   
4363 O O   . GLU C 188 ? 0.4893 0.5289 0.4258 -0.0215 -0.1363 0.0154  187 GLU L O   
4364 C CB  . GLU C 188 ? 0.5090 0.5579 0.4304 -0.0391 -0.1351 0.0363  187 GLU L CB  
4365 C CG  . GLU C 188 ? 0.5408 0.5792 0.4624 -0.0467 -0.1396 0.0434  187 GLU L CG  
4366 C CD  . GLU C 188 ? 0.5839 0.6193 0.4903 -0.0577 -0.1490 0.0559  187 GLU L CD  
4367 O OE1 . GLU C 188 ? 0.5951 0.6432 0.4897 -0.0609 -0.1492 0.0603  187 GLU L OE1 
4368 O OE2 . GLU C 188 ? 0.6252 0.6458 0.5308 -0.0635 -0.1566 0.0612  187 GLU L OE2 
4369 N N   . LYS C 189 ? 0.4982 0.5566 0.4341 -0.0175 -0.1219 0.0118  188 LYS L N   
4370 C CA  . LYS C 189 ? 0.5036 0.5615 0.4392 -0.0099 -0.1232 0.0038  188 LYS L CA  
4371 C C   . LYS C 189 ? 0.4766 0.5218 0.4258 -0.0074 -0.1236 -0.0038 188 LYS L C   
4372 O O   . LYS C 189 ? 0.4591 0.5012 0.4091 -0.0028 -0.1263 -0.0100 188 LYS L O   
4373 C CB  . LYS C 189 ? 0.5277 0.5988 0.4563 -0.0040 -0.1181 0.0000  188 LYS L CB  
4374 C CG  . LYS C 189 ? 0.5875 0.6787 0.5023 -0.0045 -0.1170 0.0047  188 LYS L CG  
4375 C CD  . LYS C 189 ? 0.6336 0.7376 0.5427 0.0049  -0.1139 -0.0028 188 LYS L CD  
4376 C CE  . LYS C 189 ? 0.6815 0.8073 0.5845 0.0042  -0.1080 0.0000  188 LYS L CE  
4377 N NZ  . LYS C 189 ? 0.7356 0.8858 0.6258 0.0039  -0.1085 0.0028  188 LYS L NZ  
4378 N N   . HIS C 190 ? 0.4339 0.4740 0.3931 -0.0108 -0.1210 -0.0037 189 HIS L N   
4379 C CA  . HIS C 190 ? 0.4360 0.4696 0.4076 -0.0099 -0.1199 -0.0110 189 HIS L CA  
4380 C C   . HIS C 190 ? 0.4226 0.4508 0.4053 -0.0124 -0.1233 -0.0120 189 HIS L C   
4381 O O   . HIS C 190 ? 0.4292 0.4558 0.4096 -0.0150 -0.1255 -0.0065 189 HIS L O   
4382 C CB  . HIS C 190 ? 0.4255 0.4612 0.3980 -0.0104 -0.1127 -0.0121 189 HIS L CB  
4383 C CG  . HIS C 190 ? 0.4469 0.4873 0.4084 -0.0055 -0.1117 -0.0134 189 HIS L CG  
4384 N ND1 . HIS C 190 ? 0.4722 0.5086 0.4311 -0.0009 -0.1158 -0.0192 189 HIS L ND1 
4385 C CD2 . HIS C 190 ? 0.4721 0.5220 0.4246 -0.0035 -0.1080 -0.0107 189 HIS L CD2 
4386 C CE1 . HIS C 190 ? 0.4770 0.5190 0.4251 0.0048  -0.1153 -0.0207 189 HIS L CE1 
4387 N NE2 . HIS C 190 ? 0.4984 0.5505 0.4429 0.0035  -0.1103 -0.0159 189 HIS L NE2 
4388 N N   . LYS C 191 ? 0.4073 0.4338 0.4015 -0.0119 -0.1240 -0.0191 190 LYS L N   
4389 C CA  . LYS C 191 ? 0.4194 0.4448 0.4256 -0.0122 -0.1282 -0.0230 190 LYS L CA  
4390 C C   . LYS C 191 ? 0.3841 0.4140 0.4003 -0.0150 -0.1222 -0.0260 190 LYS L C   
4391 O O   . LYS C 191 ? 0.3701 0.3995 0.3910 -0.0150 -0.1240 -0.0257 190 LYS L O   
4392 C CB  . LYS C 191 ? 0.4702 0.4958 0.4836 -0.0097 -0.1337 -0.0302 190 LYS L CB  
4393 C CG  . LYS C 191 ? 0.5155 0.5428 0.5415 -0.0079 -0.1393 -0.0360 190 LYS L CG  
4394 C CD  . LYS C 191 ? 0.5695 0.5993 0.6031 -0.0051 -0.1455 -0.0435 190 LYS L CD  
4395 C CE  . LYS C 191 ? 0.6146 0.6550 0.6650 -0.0040 -0.1468 -0.0527 190 LYS L CE  
4396 N NZ  . LYS C 191 ? 0.6409 0.6904 0.7006 -0.0046 -0.1482 -0.0602 190 LYS L NZ  
4397 N N   . VAL C 192 ? 0.3663 0.3997 0.3852 -0.0175 -0.1169 -0.0290 191 VAL L N   
4398 C CA  . VAL C 192 ? 0.3485 0.3885 0.3778 -0.0216 -0.1118 -0.0327 191 VAL L CA  
4399 C C   . VAL C 192 ? 0.3207 0.3588 0.3433 -0.0243 -0.1048 -0.0277 191 VAL L C   
4400 O O   . VAL C 192 ? 0.3105 0.3443 0.3234 -0.0240 -0.1032 -0.0252 191 VAL L O   
4401 C CB  . VAL C 192 ? 0.3567 0.4023 0.3937 -0.0252 -0.1119 -0.0389 191 VAL L CB  
4402 C CG1 . VAL C 192 ? 0.3484 0.4047 0.3955 -0.0309 -0.1068 -0.0423 191 VAL L CG1 
4403 C CG2 . VAL C 192 ? 0.3728 0.4212 0.4164 -0.0219 -0.1192 -0.0443 191 VAL L CG2 
4404 N N   . TYR C 193 ? 0.3025 0.3437 0.3299 -0.0256 -0.1019 -0.0271 192 TYR L N   
4405 C CA  . TYR C 193 ? 0.3027 0.3430 0.3255 -0.0282 -0.0956 -0.0228 192 TYR L CA  
4406 C C   . TYR C 193 ? 0.2909 0.3385 0.3233 -0.0328 -0.0912 -0.0272 192 TYR L C   
4407 O O   . TYR C 193 ? 0.2915 0.3462 0.3341 -0.0318 -0.0929 -0.0318 192 TYR L O   
4408 C CB  . TYR C 193 ? 0.2971 0.3346 0.3157 -0.0264 -0.0969 -0.0173 192 TYR L CB  
4409 C CG  . TYR C 193 ? 0.2947 0.3289 0.3017 -0.0244 -0.0996 -0.0116 192 TYR L CG  
4410 C CD1 . TYR C 193 ? 0.3014 0.3369 0.2987 -0.0247 -0.0951 -0.0071 192 TYR L CD1 
4411 C CD2 . TYR C 193 ? 0.3076 0.3392 0.3128 -0.0220 -0.1067 -0.0116 192 TYR L CD2 
4412 C CE1 . TYR C 193 ? 0.3097 0.3474 0.2964 -0.0227 -0.0969 -0.0031 192 TYR L CE1 
4413 C CE2 . TYR C 193 ? 0.3162 0.3477 0.3098 -0.0210 -0.1087 -0.0065 192 TYR L CE2 
4414 C CZ  . TYR C 193 ? 0.3156 0.3520 0.3002 -0.0214 -0.1034 -0.0024 192 TYR L CZ  
4415 O OH  . TYR C 193 ? 0.3334 0.3748 0.3067 -0.0202 -0.1047 0.0016  192 TYR L OH  
4416 N N   . ALA C 194 ? 0.2886 0.3346 0.3169 -0.0375 -0.0868 -0.0262 193 ALA L N   
4417 C CA  . ALA C 194 ? 0.2847 0.3385 0.3198 -0.0444 -0.0828 -0.0294 193 ALA L CA  
4418 C C   . ALA C 194 ? 0.2762 0.3247 0.3038 -0.0477 -0.0777 -0.0250 193 ALA L C   
4419 O O   . ALA C 194 ? 0.2787 0.3168 0.2950 -0.0460 -0.0782 -0.0213 193 ALA L O   
4420 C CB  . ALA C 194 ? 0.2929 0.3489 0.3299 -0.0495 -0.0852 -0.0326 193 ALA L CB  
4421 N N   . CYS C 195 ? 0.2721 0.3289 0.3059 -0.0514 -0.0735 -0.0265 194 CYS L N   
4422 C CA  . CYS C 195 ? 0.2839 0.3376 0.3122 -0.0564 -0.0686 -0.0234 194 CYS L CA  
4423 C C   . CYS C 195 ? 0.2803 0.3417 0.3117 -0.0666 -0.0669 -0.0258 194 CYS L C   
4424 O O   . CYS C 195 ? 0.2813 0.3593 0.3240 -0.0690 -0.0657 -0.0310 194 CYS L O   
4425 C CB  . CYS C 195 ? 0.3022 0.3606 0.3348 -0.0533 -0.0656 -0.0231 194 CYS L CB  
4426 S SG  . CYS C 195 ? 0.3533 0.4078 0.3790 -0.0591 -0.0598 -0.0194 194 CYS L SG  
4427 N N   . GLU C 196 ? 0.2883 0.3381 0.3089 -0.0727 -0.0680 -0.0223 195 GLU L N   
4428 C CA  . GLU C 196 ? 0.3094 0.3634 0.3291 -0.0856 -0.0680 -0.0224 195 GLU L CA  
4429 C C   . GLU C 196 ? 0.2975 0.3460 0.3093 -0.0916 -0.0645 -0.0183 195 GLU L C   
4430 O O   . GLU C 196 ? 0.3110 0.3419 0.3111 -0.0876 -0.0664 -0.0145 195 GLU L O   
4431 C CB  . GLU C 196 ? 0.3351 0.3760 0.3464 -0.0893 -0.0751 -0.0211 195 GLU L CB  
4432 C CG  . GLU C 196 ? 0.3662 0.4096 0.3746 -0.1051 -0.0764 -0.0195 195 GLU L CG  
4433 C CD  . GLU C 196 ? 0.4193 0.4401 0.4129 -0.1097 -0.0855 -0.0161 195 GLU L CD  
4434 O OE1 . GLU C 196 ? 0.4548 0.4546 0.4340 -0.1074 -0.0889 -0.0125 195 GLU L OE1 
4435 O OE2 . GLU C 196 ? 0.4134 0.4368 0.4096 -0.1145 -0.0903 -0.0177 195 GLU L OE2 
4436 N N   . VAL C 197 ? 0.2905 0.3558 0.3089 -0.1000 -0.0598 -0.0200 196 VAL L N   
4437 C CA  . VAL C 197 ? 0.2946 0.3588 0.3071 -0.1063 -0.0556 -0.0167 196 VAL L CA  
4438 C C   . VAL C 197 ? 0.3075 0.3747 0.3141 -0.1235 -0.0567 -0.0140 196 VAL L C   
4439 O O   . VAL C 197 ? 0.3041 0.3937 0.3202 -0.1320 -0.0552 -0.0175 196 VAL L O   
4440 C CB  . VAL C 197 ? 0.2774 0.3597 0.3014 -0.1010 -0.0493 -0.0209 196 VAL L CB  
4441 C CG1 . VAL C 197 ? 0.2781 0.3623 0.2969 -0.1081 -0.0447 -0.0183 196 VAL L CG1 
4442 C CG2 . VAL C 197 ? 0.2675 0.3422 0.2938 -0.0867 -0.0502 -0.0214 196 VAL L CG2 
4443 N N   . THR C 198 ? 0.3275 0.3738 0.3183 -0.1291 -0.0599 -0.0078 197 THR L N   
4444 C CA  . THR C 198 ? 0.3509 0.3937 0.3311 -0.1474 -0.0628 -0.0029 197 THR L CA  
4445 C C   . THR C 198 ? 0.3467 0.3898 0.3214 -0.1514 -0.0580 0.0000  197 THR L C   
4446 O O   . THR C 198 ? 0.3476 0.3753 0.3171 -0.1406 -0.0579 0.0010  197 THR L O   
4447 C CB  . THR C 198 ? 0.3894 0.4018 0.3526 -0.1505 -0.0741 0.0017  197 THR L CB  
4448 O OG1 . THR C 198 ? 0.4053 0.4172 0.3737 -0.1449 -0.0785 -0.0015 197 THR L OG1 
4449 C CG2 . THR C 198 ? 0.4232 0.4282 0.3731 -0.1711 -0.0794 0.0081  197 THR L CG2 
4450 N N   . HIS C 199 ? 0.3479 0.4104 0.3242 -0.1663 -0.0539 0.0009  198 HIS L N   
4451 C CA  . HIS C 199 ? 0.3501 0.4168 0.3222 -0.1703 -0.0485 0.0030  198 HIS L CA  
4452 C C   . HIS C 199 ? 0.3730 0.4562 0.3403 -0.1924 -0.0474 0.0066  198 HIS L C   
4453 O O   . HIS C 199 ? 0.3745 0.4802 0.3509 -0.2004 -0.0466 0.0038  198 HIS L O   
4454 C CB  . HIS C 199 ? 0.3253 0.4128 0.3134 -0.1567 -0.0400 -0.0041 198 HIS L CB  
4455 C CG  . HIS C 199 ? 0.3263 0.4185 0.3109 -0.1593 -0.0347 -0.0028 198 HIS L CG  
4456 N ND1 . HIS C 199 ? 0.3413 0.4103 0.3164 -0.1516 -0.0359 0.0007  198 HIS L ND1 
4457 C CD2 . HIS C 199 ? 0.3264 0.4446 0.3150 -0.1687 -0.0285 -0.0050 198 HIS L CD2 
4458 C CE1 . HIS C 199 ? 0.3319 0.4105 0.3053 -0.1562 -0.0308 0.0011  198 HIS L CE1 
4459 N NE2 . HIS C 199 ? 0.3451 0.4538 0.3262 -0.1669 -0.0262 -0.0022 198 HIS L NE2 
4460 N N   . GLN C 200 ? 0.3870 0.4618 0.3409 -0.2023 -0.0472 0.0125  199 GLN L N   
4461 C CA  A GLN C 200 ? 0.4016 0.4908 0.3473 -0.2264 -0.0471 0.0178  199 GLN L CA  
4462 C CA  B GLN C 200 ? 0.4105 0.4998 0.3563 -0.2264 -0.0471 0.0178  199 GLN L CA  
4463 C C   . GLN C 200 ? 0.3916 0.5289 0.3562 -0.2305 -0.0372 0.0102  199 GLN L C   
4464 O O   . GLN C 200 ? 0.3955 0.5526 0.3579 -0.2502 -0.0374 0.0130  199 GLN L O   
4465 C CB  A GLN C 200 ? 0.4084 0.4860 0.3392 -0.2335 -0.0465 0.0238  199 GLN L CB  
4466 C CB  B GLN C 200 ? 0.4288 0.5070 0.3601 -0.2334 -0.0464 0.0236  199 GLN L CB  
4467 C CG  A GLN C 200 ? 0.4217 0.5109 0.3404 -0.2606 -0.0480 0.0312  199 GLN L CG  
4468 C CG  B GLN C 200 ? 0.4567 0.4889 0.3659 -0.2339 -0.0584 0.0315  199 GLN L CG  
4469 C CD  A GLN C 200 ? 0.4374 0.5043 0.3362 -0.2685 -0.0512 0.0390  199 GLN L CD  
4470 C CD  B GLN C 200 ? 0.4545 0.4743 0.3552 -0.2293 -0.0565 0.0335  199 GLN L CD  
4471 O OE1 A GLN C 200 ? 0.4197 0.4630 0.3149 -0.2527 -0.0524 0.0382  199 GLN L OE1 
4472 O OE1 B GLN C 200 ? 0.4578 0.4930 0.3545 -0.2423 -0.0518 0.0363  199 GLN L OE1 
4473 N NE2 A GLN C 200 ? 0.4492 0.5229 0.3342 -0.2938 -0.0537 0.0472  199 GLN L NE2 
4474 N NE2 B GLN C 200 ? 0.4530 0.4476 0.3511 -0.2109 -0.0599 0.0318  199 GLN L NE2 
4475 N N   . GLY C 201 ? 0.3766 0.5310 0.3577 -0.2124 -0.0298 0.0009  200 GLY L N   
4476 C CA  . GLY C 201 ? 0.3760 0.5763 0.3756 -0.2117 -0.0214 -0.0090 200 GLY L CA  
4477 C C   . GLY C 201 ? 0.3684 0.5893 0.3826 -0.2099 -0.0225 -0.0156 200 GLY L C   
4478 O O   . GLY C 201 ? 0.3635 0.6255 0.3922 -0.2115 -0.0169 -0.0243 200 GLY L O   
4479 N N   . LEU C 202 ? 0.3750 0.5696 0.3861 -0.2051 -0.0298 -0.0127 201 LEU L N   
4480 C CA  . LEU C 202 ? 0.3808 0.5901 0.4046 -0.2027 -0.0322 -0.0183 201 LEU L CA  
4481 C C   . LEU C 202 ? 0.4080 0.6117 0.4210 -0.2239 -0.0387 -0.0104 201 LEU L C   
4482 O O   . LEU C 202 ? 0.4241 0.5895 0.4193 -0.2280 -0.0467 -0.0012 201 LEU L O   
4483 C CB  . LEU C 202 ? 0.3741 0.5565 0.4005 -0.1822 -0.0365 -0.0203 201 LEU L CB  
4484 C CG  . LEU C 202 ? 0.3527 0.5369 0.3883 -0.1626 -0.0322 -0.0268 201 LEU L CG  
4485 C CD1 . LEU C 202 ? 0.3556 0.5094 0.3884 -0.1469 -0.0372 -0.0252 201 LEU L CD1 
4486 C CD2 . LEU C 202 ? 0.3340 0.5564 0.3893 -0.1558 -0.0280 -0.0390 201 LEU L CD2 
4487 N N   . SER C 203 ? 0.4289 0.6688 0.4519 -0.2364 -0.0368 -0.0142 202 SER L N   
4488 C CA  . SER C 203 ? 0.4633 0.7001 0.4762 -0.2592 -0.0438 -0.0060 202 SER L CA  
4489 C C   . SER C 203 ? 0.4604 0.6636 0.4693 -0.2512 -0.0537 -0.0040 202 SER L C   
4490 O O   . SER C 203 ? 0.4828 0.6620 0.4755 -0.2665 -0.0634 0.0053  202 SER L O   
4491 C CB  . SER C 203 ? 0.4750 0.7634 0.5014 -0.2738 -0.0388 -0.0114 202 SER L CB  
4492 O OG  . SER C 203 ? 0.4823 0.7999 0.5319 -0.2551 -0.0340 -0.0258 202 SER L OG  
4493 N N   . SER C 204 ? 0.4452 0.6452 0.4669 -0.2283 -0.0526 -0.0123 203 SER L N   
4494 C CA  . SER C 204 ? 0.4496 0.6173 0.4671 -0.2175 -0.0613 -0.0111 203 SER L CA  
4495 C C   . SER C 204 ? 0.4106 0.5663 0.4348 -0.1922 -0.0586 -0.0168 203 SER L C   
4496 O O   . SER C 204 ? 0.3862 0.5630 0.4220 -0.1833 -0.0510 -0.0232 203 SER L O   
4497 C CB  . SER C 204 ? 0.4607 0.6465 0.4884 -0.2230 -0.0648 -0.0149 203 SER L CB  
4498 O OG  . SER C 204 ? 0.4614 0.6865 0.5110 -0.2138 -0.0574 -0.0266 203 SER L OG  
4499 N N   . PRO C 205 ? 0.4182 0.5410 0.4347 -0.1803 -0.0653 -0.0146 204 PRO L N   
4500 C CA  . PRO C 205 ? 0.4058 0.5174 0.4261 -0.1590 -0.0630 -0.0181 204 PRO L CA  
4501 C C   . PRO C 205 ? 0.3667 0.5041 0.4068 -0.1467 -0.0588 -0.0280 204 PRO L C   
4502 O O   . PRO C 205 ? 0.3423 0.4973 0.3920 -0.1501 -0.0605 -0.0324 204 PRO L O   
4503 C CB  . PRO C 205 ? 0.4221 0.5004 0.4306 -0.1515 -0.0718 -0.0147 204 PRO L CB  
4504 C CG  . PRO C 205 ? 0.4571 0.5201 0.4505 -0.1692 -0.0796 -0.0077 204 PRO L CG  
4505 C CD  . PRO C 205 ? 0.4484 0.5436 0.4512 -0.1865 -0.0762 -0.0090 204 PRO L CD  
4506 N N   . VAL C 206 ? 0.3352 0.4748 0.3807 -0.1336 -0.0542 -0.0313 205 VAL L N   
4507 C CA  . VAL C 206 ? 0.3152 0.4735 0.3772 -0.1200 -0.0527 -0.0406 205 VAL L CA  
4508 C C   . VAL C 206 ? 0.3065 0.4409 0.3650 -0.1054 -0.0573 -0.0392 205 VAL L C   
4509 O O   . VAL C 206 ? 0.2992 0.4108 0.3461 -0.1016 -0.0574 -0.0330 205 VAL L O   
4510 C CB  . VAL C 206 ? 0.3186 0.4944 0.3875 -0.1158 -0.0466 -0.0454 205 VAL L CB  
4511 C CG1 . VAL C 206 ? 0.3170 0.4984 0.3977 -0.0985 -0.0485 -0.0535 205 VAL L CG1 
4512 C CG2 . VAL C 206 ? 0.3327 0.5417 0.4079 -0.1292 -0.0417 -0.0493 205 VAL L CG2 
4513 N N   . THR C 207 ? 0.2946 0.4355 0.3624 -0.0980 -0.0612 -0.0448 206 THR L N   
4514 C CA  . THR C 207 ? 0.3015 0.4235 0.3664 -0.0852 -0.0659 -0.0437 206 THR L CA  
4515 C C   . THR C 207 ? 0.2905 0.4243 0.3674 -0.0733 -0.0669 -0.0510 206 THR L C   
4516 O O   . THR C 207 ? 0.2931 0.4503 0.3829 -0.0734 -0.0674 -0.0595 206 THR L O   
4517 C CB  . THR C 207 ? 0.3005 0.4140 0.3627 -0.0864 -0.0720 -0.0429 206 THR L CB  
4518 O OG1 . THR C 207 ? 0.3161 0.4132 0.3645 -0.0959 -0.0733 -0.0361 206 THR L OG1 
4519 C CG2 . THR C 207 ? 0.3023 0.4000 0.3612 -0.0736 -0.0765 -0.0421 206 THR L CG2 
4520 N N   . LYS C 208 ? 0.2768 0.3950 0.3489 -0.0637 -0.0682 -0.0480 207 LYS L N   
4521 C CA  . LYS C 208 ? 0.2680 0.3881 0.3473 -0.0520 -0.0729 -0.0531 207 LYS L CA  
4522 C C   . LYS C 208 ? 0.2735 0.3740 0.3449 -0.0460 -0.0784 -0.0480 207 LYS L C   
4523 O O   . LYS C 208 ? 0.2737 0.3585 0.3331 -0.0477 -0.0768 -0.0401 207 LYS L O   
4524 C CB  . LYS C 208 ? 0.2742 0.3937 0.3536 -0.0479 -0.0709 -0.0531 207 LYS L CB  
4525 C CG  . LYS C 208 ? 0.2726 0.4130 0.3589 -0.0527 -0.0653 -0.0585 207 LYS L CG  
4526 C CD  . LYS C 208 ? 0.2890 0.4553 0.3902 -0.0492 -0.0678 -0.0708 207 LYS L CD  
4527 C CE  . LYS C 208 ? 0.2924 0.4833 0.3993 -0.0554 -0.0612 -0.0759 207 LYS L CE  
4528 N NZ  . LYS C 208 ? 0.3147 0.5370 0.4367 -0.0525 -0.0630 -0.0890 207 LYS L NZ  
4529 N N   . SER C 209 ? 0.2739 0.3761 0.3512 -0.0390 -0.0853 -0.0528 208 SER L N   
4530 C CA  . SER C 209 ? 0.2867 0.3727 0.3560 -0.0345 -0.0908 -0.0481 208 SER L CA  
4531 C C   . SER C 209 ? 0.2962 0.3797 0.3697 -0.0254 -0.0995 -0.0519 208 SER L C   
4532 O O   . SER C 209 ? 0.3136 0.4088 0.3975 -0.0214 -0.1021 -0.0602 208 SER L O   
4533 C CB  . SER C 209 ? 0.2946 0.3809 0.3628 -0.0385 -0.0919 -0.0484 208 SER L CB  
4534 O OG  . SER C 209 ? 0.3053 0.4086 0.3862 -0.0388 -0.0944 -0.0572 208 SER L OG  
4535 N N   . PHE C 210 ? 0.3053 0.3743 0.3700 -0.0223 -0.1048 -0.0465 209 PHE L N   
4536 C CA  . PHE C 210 ? 0.3117 0.3734 0.3766 -0.0150 -0.1154 -0.0483 209 PHE L CA  
4537 C C   . PHE C 210 ? 0.3238 0.3757 0.3796 -0.0150 -0.1187 -0.0432 209 PHE L C   
4538 O O   . PHE C 210 ? 0.2930 0.3424 0.3412 -0.0192 -0.1128 -0.0378 209 PHE L O   
4539 C CB  . PHE C 210 ? 0.3098 0.3608 0.3692 -0.0127 -0.1189 -0.0438 209 PHE L CB  
4540 C CG  . PHE C 210 ? 0.3048 0.3442 0.3500 -0.0168 -0.1158 -0.0319 209 PHE L CG  
4541 C CD1 . PHE C 210 ? 0.2941 0.3356 0.3363 -0.0213 -0.1068 -0.0277 209 PHE L CD1 
4542 C CD2 . PHE C 210 ? 0.3152 0.3442 0.3499 -0.0166 -0.1214 -0.0253 209 PHE L CD2 
4543 C CE1 . PHE C 210 ? 0.2863 0.3207 0.3164 -0.0243 -0.1042 -0.0180 209 PHE L CE1 
4544 C CE2 . PHE C 210 ? 0.3125 0.3366 0.3347 -0.0207 -0.1179 -0.0152 209 PHE L CE2 
4545 C CZ  . PHE C 210 ? 0.2982 0.3258 0.3187 -0.0240 -0.1093 -0.0121 209 PHE L CZ  
4546 N N   . ASN C 211 ? 0.3601 0.4067 0.4164 -0.0097 -0.1287 -0.0457 210 ASN L N   
4547 C CA  . ASN C 211 ? 0.4142 0.4515 0.4610 -0.0091 -0.1334 -0.0410 210 ASN L CA  
4548 C C   . ASN C 211 ? 0.4396 0.4623 0.4749 -0.0079 -0.1412 -0.0334 210 ASN L C   
4549 O O   . ASN C 211 ? 0.4751 0.4930 0.5140 -0.0038 -0.1497 -0.0369 210 ASN L O   
4550 C CB  . ASN C 211 ? 0.4620 0.5038 0.5169 -0.0050 -0.1403 -0.0493 210 ASN L CB  
4551 C CG  . ASN C 211 ? 0.4901 0.5492 0.5580 -0.0075 -0.1345 -0.0575 210 ASN L CG  
4552 O OD1 . ASN C 211 ? 0.5889 0.6595 0.6694 -0.0038 -0.1389 -0.0673 210 ASN L OD1 
4553 N ND2 . ASN C 211 ? 0.5022 0.5639 0.5667 -0.0142 -0.1257 -0.0538 210 ASN L ND2 
4554 N N   . ARG C 212 ? 0.4839 0.5013 0.5057 -0.0118 -0.1382 -0.0236 211 ARG L N   
4555 C CA  . ARG C 212 ? 0.5227 0.5287 0.5311 -0.0137 -0.1454 -0.0143 211 ARG L CA  
4556 C C   . ARG C 212 ? 0.6199 0.6182 0.6264 -0.0100 -0.1573 -0.0166 211 ARG L C   
4557 O O   . ARG C 212 ? 0.6416 0.6454 0.6528 -0.0074 -0.1561 -0.0221 211 ARG L O   
4558 C CB  . ARG C 212 ? 0.5047 0.5146 0.5007 -0.0183 -0.1380 -0.0055 211 ARG L CB  
4559 C CG  . ARG C 212 ? 0.5202 0.5240 0.5013 -0.0232 -0.1437 0.0054  211 ARG L CG  
4560 C CD  . ARG C 212 ? 0.5162 0.5298 0.4862 -0.0259 -0.1371 0.0113  211 ARG L CD  
4561 N NE  . ARG C 212 ? 0.5505 0.5662 0.5199 -0.0218 -0.1385 0.0068  211 ARG L NE  
4562 C CZ  . ARG C 212 ? 0.5818 0.5929 0.5434 -0.0219 -0.1467 0.0094  211 ARG L CZ  
4563 N NH1 . ARG C 212 ? 0.6009 0.6039 0.5530 -0.0271 -0.1552 0.0176  211 ARG L NH1 
4564 N NH2 . ARG C 212 ? 0.6311 0.6442 0.5932 -0.0175 -0.1475 0.0042  211 ARG L NH2 
4565 N N   . GLY C 213 ? 0.7378 0.7222 0.7372 -0.0100 -0.1695 -0.0126 212 GLY L N   
4566 C CA  . GLY C 213 ? 0.8157 0.7894 0.8113 -0.0066 -0.1829 -0.0142 212 GLY L CA  
4567 C C   . GLY C 213 ? 0.8457 0.8275 0.8444 -0.0040 -0.1797 -0.0189 212 GLY L C   
4568 O O   . GLY C 213 ? 0.8879 0.8630 0.8783 -0.0035 -0.1874 -0.0165 212 GLY L O   
# 
