data_8Z3A
# 
_entry.id   8Z3A 
# 
_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   8Z3A         pdb_00008z3a 10.2210/pdb8z3a/pdb 
WWPDB D_1300046918 ?            ?                   
# 
_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                        8Z3A 
_pdbx_database_status.recvd_initial_deposition_date   2024-04-15 
_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'      26008.797 1   ? ? ? ? 
4 non-polymer syn GLYCEROL                           92.094    1   ? ? ? ? 
5 non-polymer syn 'NITRATE ION'                      62.005    1   ? ? ? ? 
6 water       nat water                              18.015    572 ? ? ? ? 
# 
_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 
;DIVMTQTPKFLLVSAGDKVTITCKASQSVSNDLTWYQQKPGQSPKLLIYYASNRYTGVPDRFTGSGYGTDFTFTISTVQA
EDLAVYFCQQDYGSPPTFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQ
ESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGECEQKLISEEDLNSAVDHHHHHH
;
;DIVMTQTPKFLLVSAGDKVTITCKASQSVSNDLTWYQQKPGQSPKLLIYYASNRYTGVPDRFTGSGYGTDFTFTISTVQA
EDLAVYFCQQDYGSPPTFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQ
ESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGECEQKLISEEDLNSAVDHHHHHH
;
L ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
4 GLYCEROL      GOL 
5 'NITRATE ION' NO3 
6 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   ASP n 
3 2   ILE n 
3 3   VAL n 
3 4   MET n 
3 5   THR n 
3 6   GLN n 
3 7   THR n 
3 8   PRO n 
3 9   LYS n 
3 10  PHE n 
3 11  LEU n 
3 12  LEU n 
3 13  VAL n 
3 14  SER n 
3 15  ALA n 
3 16  GLY n 
3 17  ASP n 
3 18  LYS n 
3 19  VAL n 
3 20  THR n 
3 21  ILE n 
3 22  THR n 
3 23  CYS n 
3 24  LYS n 
3 25  ALA n 
3 26  SER n 
3 27  GLN n 
3 28  SER n 
3 29  VAL n 
3 30  SER n 
3 31  ASN n 
3 32  ASP n 
3 33  LEU n 
3 34  THR n 
3 35  TRP n 
3 36  TYR n 
3 37  GLN n 
3 38  GLN n 
3 39  LYS n 
3 40  PRO n 
3 41  GLY n 
3 42  GLN n 
3 43  SER n 
3 44  PRO n 
3 45  LYS n 
3 46  LEU n 
3 47  LEU n 
3 48  ILE n 
3 49  TYR n 
3 50  TYR n 
3 51  ALA n 
3 52  SER n 
3 53  ASN n 
3 54  ARG n 
3 55  TYR n 
3 56  THR n 
3 57  GLY n 
3 58  VAL n 
3 59  PRO n 
3 60  ASP n 
3 61  ARG n 
3 62  PHE n 
3 63  THR n 
3 64  GLY n 
3 65  SER n 
3 66  GLY n 
3 67  TYR n 
3 68  GLY n 
3 69  THR n 
3 70  ASP n 
3 71  PHE n 
3 72  THR n 
3 73  PHE n 
3 74  THR n 
3 75  ILE n 
3 76  SER n 
3 77  THR n 
3 78  VAL n 
3 79  GLN n 
3 80  ALA n 
3 81  GLU n 
3 82  ASP n 
3 83  LEU n 
3 84  ALA n 
3 85  VAL n 
3 86  TYR n 
3 87  PHE n 
3 88  CYS n 
3 89  GLN n 
3 90  GLN n 
3 91  ASP n 
3 92  TYR n 
3 93  GLY n 
3 94  SER n 
3 95  PRO n 
3 96  PRO n 
3 97  THR n 
3 98  PHE n 
3 99  GLY n 
3 100 GLY n 
3 101 GLY n 
3 102 THR n 
3 103 LYS n 
3 104 VAL n 
3 105 GLU n 
3 106 ILE n 
3 107 LYS n 
3 108 ARG n 
3 109 THR n 
3 110 VAL n 
3 111 ALA n 
3 112 ALA n 
3 113 PRO n 
3 114 SER n 
3 115 VAL n 
3 116 PHE n 
3 117 ILE n 
3 118 PHE n 
3 119 PRO n 
3 120 PRO n 
3 121 SER n 
3 122 ASP n 
3 123 GLU n 
3 124 GLN n 
3 125 LEU n 
3 126 LYS n 
3 127 SER n 
3 128 GLY n 
3 129 THR n 
3 130 ALA n 
3 131 SER n 
3 132 VAL n 
3 133 VAL n 
3 134 CYS n 
3 135 LEU n 
3 136 LEU n 
3 137 ASN n 
3 138 ASN n 
3 139 PHE n 
3 140 TYR n 
3 141 PRO n 
3 142 ARG n 
3 143 GLU n 
3 144 ALA n 
3 145 LYS n 
3 146 VAL n 
3 147 GLN n 
3 148 TRP n 
3 149 LYS n 
3 150 VAL n 
3 151 ASP n 
3 152 ASN n 
3 153 ALA n 
3 154 LEU n 
3 155 GLN n 
3 156 SER n 
3 157 GLY n 
3 158 ASN n 
3 159 SER n 
3 160 GLN n 
3 161 GLU n 
3 162 SER n 
3 163 VAL n 
3 164 THR n 
3 165 GLU n 
3 166 GLN n 
3 167 ASP n 
3 168 SER n 
3 169 LYS n 
3 170 ASP n 
3 171 SER n 
3 172 THR n 
3 173 TYR n 
3 174 SER n 
3 175 LEU n 
3 176 SER n 
3 177 SER n 
3 178 THR n 
3 179 LEU n 
3 180 THR n 
3 181 LEU n 
3 182 SER n 
3 183 LYS n 
3 184 ALA n 
3 185 ASP n 
3 186 TYR n 
3 187 GLU n 
3 188 LYS n 
3 189 HIS n 
3 190 LYS n 
3 191 VAL n 
3 192 TYR n 
3 193 ALA n 
3 194 CYS n 
3 195 GLU n 
3 196 VAL n 
3 197 THR n 
3 198 HIS n 
3 199 GLN n 
3 200 GLY n 
3 201 LEU n 
3 202 SER n 
3 203 SER n 
3 204 PRO n 
3 205 VAL n 
3 206 THR n 
3 207 LYS n 
3 208 SER n 
3 209 PHE n 
3 210 ASN n 
3 211 ARG n 
3 212 GLY n 
3 213 GLU n 
3 214 CYS n 
3 215 GLU n 
3 216 GLN n 
3 217 LYS n 
3 218 LEU n 
3 219 ILE n 
3 220 SER n 
3 221 GLU n 
3 222 GLU n 
3 223 ASP n 
3 224 LEU n 
3 225 ASN n 
3 226 SER n 
3 227 ALA n 
3 228 VAL n 
3 229 ASP n 
3 230 HIS n 
3 231 HIS n 
3 232 HIS n 
3 233 HIS n 
3 234 HIS n 
3 235 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' 1 235 ?     ? 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 
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  
GOL non-polymer         . GLYCEROL        'GLYCERIN; PROPANE-1,2,3-TRIOL' 'C3 H8 O3'       92.094  
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 
NO3 non-polymer         . 'NITRATE ION'   ?                               'N O3 -1'        62.005  
PHE 'L-peptide linking' y PHENYLALANINE   ?                               'C9 H11 N O2'    165.189 
PRO 'L-peptide linking' y PROLINE         ?                               'C5 H9 N O2'     115.130 
SER 'L-peptide linking' y SERINE          ?                               'C3 H7 N O3'     105.093 
THR 'L-peptide linking' y THREONINE       ?                               'C4 H9 N O3'     119.119 
TRP 'L-peptide linking' y TRYPTOPHAN      ?                               'C11 H12 N2 O2'  204.225 
TYR 'L-peptide linking' y TYROSINE        ?                               'C9 H11 N O3'    181.189 
VAL 'L-peptide linking' y VALINE          ?                               'C5 H11 N O2'    117.146 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   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 ?   ?   ?   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 ?   ?   ?   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   ASP 1   1   1   ASP ASP L . n 
C 3 2   ILE 2   2   2   ILE ILE L . n 
C 3 3   VAL 3   3   3   VAL VAL L . n 
C 3 4   MET 4   4   4   MET MET L . n 
C 3 5   THR 5   5   5   THR THR L . n 
C 3 6   GLN 6   6   6   GLN GLN L . n 
C 3 7   THR 7   7   7   THR THR L . n 
C 3 8   PRO 8   8   8   PRO PRO L . n 
C 3 9   LYS 9   9   9   LYS LYS L . n 
C 3 10  PHE 10  10  10  PHE PHE L . n 
C 3 11  LEU 11  11  11  LEU LEU L . n 
C 3 12  LEU 12  12  12  LEU LEU L . n 
C 3 13  VAL 13  13  13  VAL VAL L . n 
C 3 14  SER 14  14  14  SER SER L . n 
C 3 15  ALA 15  15  15  ALA ALA L . n 
C 3 16  GLY 16  16  16  GLY GLY L . n 
C 3 17  ASP 17  17  17  ASP ASP L . n 
C 3 18  LYS 18  18  18  LYS LYS L . n 
C 3 19  VAL 19  19  19  VAL VAL L . n 
C 3 20  THR 20  20  20  THR THR L . n 
C 3 21  ILE 21  21  21  ILE ILE L . n 
C 3 22  THR 22  22  22  THR THR L . n 
C 3 23  CYS 23  23  23  CYS CYS L . n 
C 3 24  LYS 24  24  24  LYS LYS L . n 
C 3 25  ALA 25  25  25  ALA ALA L . n 
C 3 26  SER 26  26  26  SER SER L . n 
C 3 27  GLN 27  27  27  GLN GLN L . n 
C 3 28  SER 28  28  28  SER SER L . n 
C 3 29  VAL 29  29  29  VAL VAL L . n 
C 3 30  SER 30  30  30  SER SER L . n 
C 3 31  ASN 31  31  31  ASN ASN L . n 
C 3 32  ASP 32  32  32  ASP ASP L . n 
C 3 33  LEU 33  33  33  LEU LEU L . n 
C 3 34  THR 34  34  34  THR THR L . n 
C 3 35  TRP 35  35  35  TRP TRP L . n 
C 3 36  TYR 36  36  36  TYR TYR L . n 
C 3 37  GLN 37  37  37  GLN GLN L . n 
C 3 38  GLN 38  38  38  GLN GLN L . n 
C 3 39  LYS 39  39  39  LYS LYS L . n 
C 3 40  PRO 40  40  40  PRO PRO L . n 
C 3 41  GLY 41  41  41  GLY GLY L . n 
C 3 42  GLN 42  42  42  GLN GLN L . n 
C 3 43  SER 43  43  43  SER SER L . n 
C 3 44  PRO 44  44  44  PRO PRO L . n 
C 3 45  LYS 45  45  45  LYS LYS L . n 
C 3 46  LEU 46  46  46  LEU LEU L . n 
C 3 47  LEU 47  47  47  LEU LEU L . n 
C 3 48  ILE 48  48  48  ILE ILE L . n 
C 3 49  TYR 49  49  49  TYR TYR L . n 
C 3 50  TYR 50  50  50  TYR TYR L . n 
C 3 51  ALA 51  51  51  ALA ALA L . n 
C 3 52  SER 52  52  52  SER SER L . n 
C 3 53  ASN 53  53  53  ASN ASN L . n 
C 3 54  ARG 54  54  54  ARG ARG L . n 
C 3 55  TYR 55  55  55  TYR TYR L . n 
C 3 56  THR 56  56  56  THR THR L . n 
C 3 57  GLY 57  57  57  GLY GLY L . n 
C 3 58  VAL 58  58  58  VAL VAL L . n 
C 3 59  PRO 59  59  59  PRO PRO L . n 
C 3 60  ASP 60  60  60  ASP ASP L . n 
C 3 61  ARG 61  61  61  ARG ARG L . n 
C 3 62  PHE 62  62  62  PHE PHE L . n 
C 3 63  THR 63  63  63  THR THR L . n 
C 3 64  GLY 64  64  64  GLY GLY L . n 
C 3 65  SER 65  65  65  SER SER L . n 
C 3 66  GLY 66  66  66  GLY GLY L . n 
C 3 67  TYR 67  67  67  TYR TYR L . n 
C 3 68  GLY 68  68  68  GLY GLY L . n 
C 3 69  THR 69  69  69  THR THR L . n 
C 3 70  ASP 70  70  70  ASP ASP L . n 
C 3 71  PHE 71  71  71  PHE PHE L . n 
C 3 72  THR 72  72  72  THR THR L . n 
C 3 73  PHE 73  73  73  PHE PHE L . n 
C 3 74  THR 74  74  74  THR THR L . n 
C 3 75  ILE 75  75  75  ILE ILE L . n 
C 3 76  SER 76  76  76  SER SER L . n 
C 3 77  THR 77  77  77  THR THR L . n 
C 3 78  VAL 78  78  78  VAL VAL L . n 
C 3 79  GLN 79  79  79  GLN GLN L . n 
C 3 80  ALA 80  80  80  ALA ALA L . n 
C 3 81  GLU 81  81  81  GLU GLU L . n 
C 3 82  ASP 82  82  82  ASP ASP L . n 
C 3 83  LEU 83  83  83  LEU LEU L . n 
C 3 84  ALA 84  84  84  ALA ALA L . n 
C 3 85  VAL 85  85  85  VAL VAL L . n 
C 3 86  TYR 86  86  86  TYR TYR L . n 
C 3 87  PHE 87  87  87  PHE PHE L . n 
C 3 88  CYS 88  88  88  CYS CYS L . n 
C 3 89  GLN 89  89  89  GLN GLN L . n 
C 3 90  GLN 90  90  90  GLN GLN L . n 
C 3 91  ASP 91  91  91  ASP ASP L . n 
C 3 92  TYR 92  92  92  TYR TYR L . n 
C 3 93  GLY 93  93  93  GLY GLY L . n 
C 3 94  SER 94  94  94  SER SER L . n 
C 3 95  PRO 95  95  95  PRO PRO L . n 
C 3 96  PRO 96  96  96  PRO PRO L . n 
C 3 97  THR 97  97  97  THR THR L . n 
C 3 98  PHE 98  98  98  PHE PHE L . n 
C 3 99  GLY 99  99  99  GLY GLY L . n 
C 3 100 GLY 100 100 100 GLY GLY L . n 
C 3 101 GLY 101 101 101 GLY GLY L . n 
C 3 102 THR 102 102 102 THR THR L . n 
C 3 103 LYS 103 103 103 LYS LYS L . n 
C 3 104 VAL 104 104 104 VAL VAL L . n 
C 3 105 GLU 105 105 105 GLU GLU L . n 
C 3 106 ILE 106 106 106 ILE ILE L . n 
C 3 107 LYS 107 107 107 LYS LYS L . n 
C 3 108 ARG 108 108 108 ARG ARG L . n 
C 3 109 THR 109 109 109 THR THR L . n 
C 3 110 VAL 110 110 110 VAL VAL L . n 
C 3 111 ALA 111 111 111 ALA ALA L . n 
C 3 112 ALA 112 112 112 ALA ALA L . n 
C 3 113 PRO 113 113 113 PRO PRO L . n 
C 3 114 SER 114 114 114 SER SER L . n 
C 3 115 VAL 115 115 115 VAL VAL L . n 
C 3 116 PHE 116 116 116 PHE PHE L . n 
C 3 117 ILE 117 117 117 ILE ILE L . n 
C 3 118 PHE 118 118 118 PHE PHE L . n 
C 3 119 PRO 119 119 119 PRO PRO L . n 
C 3 120 PRO 120 120 120 PRO PRO L . n 
C 3 121 SER 121 121 121 SER SER L . n 
C 3 122 ASP 122 122 122 ASP ASP L . n 
C 3 123 GLU 123 123 123 GLU GLU L . n 
C 3 124 GLN 124 124 124 GLN GLN L . n 
C 3 125 LEU 125 125 125 LEU LEU L . n 
C 3 126 LYS 126 126 126 LYS LYS L . n 
C 3 127 SER 127 127 127 SER SER L . n 
C 3 128 GLY 128 128 128 GLY GLY L . n 
C 3 129 THR 129 129 129 THR THR L . n 
C 3 130 ALA 130 130 130 ALA ALA L . n 
C 3 131 SER 131 131 131 SER SER L . n 
C 3 132 VAL 132 132 132 VAL VAL L . n 
C 3 133 VAL 133 133 133 VAL VAL L . n 
C 3 134 CYS 134 134 134 CYS CYS L . n 
C 3 135 LEU 135 135 135 LEU LEU L . n 
C 3 136 LEU 136 136 136 LEU LEU L . n 
C 3 137 ASN 137 137 137 ASN ASN L . n 
C 3 138 ASN 138 138 138 ASN ASN L . n 
C 3 139 PHE 139 139 139 PHE PHE L . n 
C 3 140 TYR 140 140 140 TYR TYR L . n 
C 3 141 PRO 141 141 141 PRO PRO L . n 
C 3 142 ARG 142 142 142 ARG ARG L . n 
C 3 143 GLU 143 143 143 GLU GLU L . n 
C 3 144 ALA 144 144 144 ALA ALA L . n 
C 3 145 LYS 145 145 145 LYS LYS L . n 
C 3 146 VAL 146 146 146 VAL VAL L . n 
C 3 147 GLN 147 147 147 GLN GLN L . n 
C 3 148 TRP 148 148 148 TRP TRP L . n 
C 3 149 LYS 149 149 149 LYS LYS L . n 
C 3 150 VAL 150 150 150 VAL VAL L . n 
C 3 151 ASP 151 151 151 ASP ASP L . n 
C 3 152 ASN 152 152 152 ASN ASN L . n 
C 3 153 ALA 153 153 153 ALA ALA L . n 
C 3 154 LEU 154 154 154 LEU LEU L . n 
C 3 155 GLN 155 155 155 GLN GLN L . n 
C 3 156 SER 156 156 156 SER SER L . n 
C 3 157 GLY 157 157 157 GLY GLY L . n 
C 3 158 ASN 158 158 158 ASN ASN L . n 
C 3 159 SER 159 159 159 SER SER L . n 
C 3 160 GLN 160 160 160 GLN GLN L . n 
C 3 161 GLU 161 161 161 GLU GLU L . n 
C 3 162 SER 162 162 162 SER SER L . n 
C 3 163 VAL 163 163 163 VAL VAL L . n 
C 3 164 THR 164 164 164 THR THR L . n 
C 3 165 GLU 165 165 165 GLU GLU L . n 
C 3 166 GLN 166 166 166 GLN GLN L . n 
C 3 167 ASP 167 167 167 ASP ASP L . n 
C 3 168 SER 168 168 168 SER SER L . n 
C 3 169 LYS 169 169 169 LYS LYS L . n 
C 3 170 ASP 170 170 170 ASP ASP L . n 
C 3 171 SER 171 171 171 SER SER L . n 
C 3 172 THR 172 172 172 THR THR L . n 
C 3 173 TYR 173 173 173 TYR TYR L . n 
C 3 174 SER 174 174 174 SER SER L . n 
C 3 175 LEU 175 175 175 LEU LEU L . n 
C 3 176 SER 176 176 176 SER SER L . n 
C 3 177 SER 177 177 177 SER SER L . n 
C 3 178 THR 178 178 178 THR THR L . n 
C 3 179 LEU 179 179 179 LEU LEU L . n 
C 3 180 THR 180 180 180 THR THR L . n 
C 3 181 LEU 181 181 181 LEU LEU L . n 
C 3 182 SER 182 182 182 SER SER L . n 
C 3 183 LYS 183 183 183 LYS LYS L . n 
C 3 184 ALA 184 184 184 ALA ALA L . n 
C 3 185 ASP 185 185 185 ASP ASP L . n 
C 3 186 TYR 186 186 186 TYR TYR L . n 
C 3 187 GLU 187 187 187 GLU GLU L . n 
C 3 188 LYS 188 188 188 LYS LYS L . n 
C 3 189 HIS 189 189 189 HIS HIS L . n 
C 3 190 LYS 190 190 190 LYS LYS L . n 
C 3 191 VAL 191 191 191 VAL VAL L . n 
C 3 192 TYR 192 192 192 TYR TYR L . n 
C 3 193 ALA 193 193 193 ALA ALA L . n 
C 3 194 CYS 194 194 194 CYS CYS L . n 
C 3 195 GLU 195 195 195 GLU GLU L . n 
C 3 196 VAL 196 196 196 VAL VAL L . n 
C 3 197 THR 197 197 197 THR THR L . n 
C 3 198 HIS 198 198 198 HIS HIS L . n 
C 3 199 GLN 199 199 199 GLN GLN L . n 
C 3 200 GLY 200 200 200 GLY GLY L . n 
C 3 201 LEU 201 201 201 LEU LEU L . n 
C 3 202 SER 202 202 202 SER SER L . n 
C 3 203 SER 203 203 203 SER SER L . n 
C 3 204 PRO 204 204 204 PRO PRO L . n 
C 3 205 VAL 205 205 205 VAL VAL L . n 
C 3 206 THR 206 206 206 THR THR L . n 
C 3 207 LYS 207 207 207 LYS LYS L . n 
C 3 208 SER 208 208 208 SER SER L . n 
C 3 209 PHE 209 209 209 PHE PHE L . n 
C 3 210 ASN 210 210 210 ASN ASN L . n 
C 3 211 ARG 211 211 211 ARG ARG L . n 
C 3 212 GLY 212 212 ?   ?   ?   L . n 
C 3 213 GLU 213 213 ?   ?   ?   L . n 
C 3 214 CYS 214 214 ?   ?   ?   L . n 
C 3 215 GLU 215 215 ?   ?   ?   L . n 
C 3 216 GLN 216 216 ?   ?   ?   L . n 
C 3 217 LYS 217 217 ?   ?   ?   L . n 
C 3 218 LEU 218 218 ?   ?   ?   L . n 
C 3 219 ILE 219 219 ?   ?   ?   L . n 
C 3 220 SER 220 220 ?   ?   ?   L . n 
C 3 221 GLU 221 221 ?   ?   ?   L . n 
C 3 222 GLU 222 222 ?   ?   ?   L . n 
C 3 223 ASP 223 223 ?   ?   ?   L . n 
C 3 224 LEU 224 224 ?   ?   ?   L . n 
C 3 225 ASN 225 225 ?   ?   ?   L . n 
C 3 226 SER 226 226 ?   ?   ?   L . n 
C 3 227 ALA 227 227 ?   ?   ?   L . n 
C 3 228 VAL 228 228 ?   ?   ?   L . n 
C 3 229 ASP 229 229 ?   ?   ?   L . n 
C 3 230 HIS 230 230 ?   ?   ?   L . n 
C 3 231 HIS 231 231 ?   ?   ?   L . n 
C 3 232 HIS 232 232 ?   ?   ?   L . n 
C 3 233 HIS 233 233 ?   ?   ?   L . n 
C 3 234 HIS 234 234 ?   ?   ?   L . n 
C 3 235 HIS 235 235 ?   ?   ?   L . n 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
D 4 GOL 1   301 1   GOL GOL H . 
E 5 NO3 1   301 11  NO3 NO3 L . 
F 6 HOH 1   201 197 HOH HOH A . 
F 6 HOH 2   202 461 HOH HOH A . 
F 6 HOH 3   203 289 HOH HOH A . 
F 6 HOH 4   204 92  HOH HOH A . 
F 6 HOH 5   205 103 HOH HOH A . 
F 6 HOH 6   206 450 HOH HOH A . 
F 6 HOH 7   207 175 HOH HOH A . 
F 6 HOH 8   208 280 HOH HOH A . 
F 6 HOH 9   209 322 HOH HOH A . 
F 6 HOH 10  210 451 HOH HOH A . 
F 6 HOH 11  211 143 HOH HOH A . 
F 6 HOH 12  212 288 HOH HOH A . 
F 6 HOH 13  213 375 HOH HOH A . 
F 6 HOH 14  214 281 HOH HOH A . 
F 6 HOH 15  215 429 HOH HOH A . 
F 6 HOH 16  216 76  HOH HOH A . 
F 6 HOH 17  217 87  HOH HOH A . 
F 6 HOH 18  218 270 HOH HOH A . 
F 6 HOH 19  219 3   HOH HOH A . 
F 6 HOH 20  220 551 HOH HOH A . 
F 6 HOH 21  221 9   HOH HOH A . 
F 6 HOH 22  222 144 HOH HOH A . 
F 6 HOH 23  223 12  HOH HOH A . 
F 6 HOH 24  224 112 HOH HOH A . 
F 6 HOH 25  225 231 HOH HOH A . 
F 6 HOH 26  226 445 HOH HOH A . 
F 6 HOH 27  227 463 HOH HOH A . 
F 6 HOH 28  228 20  HOH HOH A . 
F 6 HOH 29  229 222 HOH HOH A . 
F 6 HOH 30  230 212 HOH HOH A . 
F 6 HOH 31  231 172 HOH HOH A . 
F 6 HOH 32  232 279 HOH HOH A . 
F 6 HOH 33  233 34  HOH HOH A . 
F 6 HOH 34  234 127 HOH HOH A . 
F 6 HOH 35  235 21  HOH HOH A . 
F 6 HOH 36  236 14  HOH HOH A . 
F 6 HOH 37  237 359 HOH HOH A . 
F 6 HOH 38  238 55  HOH HOH A . 
F 6 HOH 39  239 152 HOH HOH A . 
F 6 HOH 40  240 160 HOH HOH A . 
F 6 HOH 41  241 230 HOH HOH A . 
F 6 HOH 42  242 169 HOH HOH A . 
F 6 HOH 43  243 37  HOH HOH A . 
F 6 HOH 44  244 171 HOH HOH A . 
F 6 HOH 45  245 476 HOH HOH A . 
F 6 HOH 46  246 33  HOH HOH A . 
F 6 HOH 47  247 339 HOH HOH A . 
F 6 HOH 48  248 16  HOH HOH A . 
F 6 HOH 49  249 554 HOH HOH A . 
F 6 HOH 50  250 69  HOH HOH A . 
F 6 HOH 51  251 361 HOH HOH A . 
F 6 HOH 52  252 56  HOH HOH A . 
F 6 HOH 53  253 63  HOH HOH A . 
F 6 HOH 54  254 293 HOH HOH A . 
F 6 HOH 55  255 83  HOH HOH A . 
F 6 HOH 56  256 97  HOH HOH A . 
F 6 HOH 57  257 58  HOH HOH A . 
F 6 HOH 58  258 86  HOH HOH A . 
F 6 HOH 59  259 178 HOH HOH A . 
F 6 HOH 60  260 431 HOH HOH A . 
F 6 HOH 61  261 25  HOH HOH A . 
F 6 HOH 62  262 348 HOH HOH A . 
F 6 HOH 63  263 153 HOH HOH A . 
F 6 HOH 64  264 393 HOH HOH A . 
F 6 HOH 65  265 246 HOH HOH A . 
F 6 HOH 66  266 102 HOH HOH A . 
F 6 HOH 67  267 122 HOH HOH A . 
F 6 HOH 68  268 4   HOH HOH A . 
F 6 HOH 69  269 587 HOH HOH A . 
F 6 HOH 70  270 109 HOH HOH A . 
F 6 HOH 71  271 316 HOH HOH A . 
F 6 HOH 72  272 243 HOH HOH A . 
F 6 HOH 73  273 10  HOH HOH A . 
F 6 HOH 74  274 75  HOH HOH A . 
F 6 HOH 75  275 131 HOH HOH A . 
F 6 HOH 76  276 513 HOH HOH A . 
F 6 HOH 77  277 427 HOH HOH A . 
F 6 HOH 78  278 72  HOH HOH A . 
F 6 HOH 79  279 323 HOH HOH A . 
F 6 HOH 80  280 448 HOH HOH A . 
F 6 HOH 81  281 328 HOH HOH A . 
F 6 HOH 82  282 295 HOH HOH A . 
F 6 HOH 83  283 420 HOH HOH A . 
F 6 HOH 84  284 78  HOH HOH A . 
F 6 HOH 85  285 225 HOH HOH A . 
F 6 HOH 86  286 441 HOH HOH A . 
F 6 HOH 87  287 77  HOH HOH A . 
F 6 HOH 88  288 159 HOH HOH A . 
F 6 HOH 89  289 204 HOH HOH A . 
F 6 HOH 90  290 80  HOH HOH A . 
F 6 HOH 91  291 135 HOH HOH A . 
F 6 HOH 92  292 81  HOH HOH A . 
F 6 HOH 93  293 213 HOH HOH A . 
F 6 HOH 94  294 188 HOH HOH A . 
F 6 HOH 95  295 248 HOH HOH A . 
F 6 HOH 96  296 586 HOH HOH A . 
F 6 HOH 97  297 462 HOH HOH A . 
F 6 HOH 98  298 263 HOH HOH A . 
F 6 HOH 99  299 64  HOH HOH A . 
F 6 HOH 100 300 260 HOH HOH A . 
F 6 HOH 101 301 162 HOH HOH A . 
F 6 HOH 102 302 187 HOH HOH A . 
F 6 HOH 103 303 394 HOH HOH A . 
F 6 HOH 104 304 561 HOH HOH A . 
F 6 HOH 105 305 406 HOH HOH A . 
F 6 HOH 106 306 98  HOH HOH A . 
F 6 HOH 107 307 428 HOH HOH A . 
F 6 HOH 108 308 468 HOH HOH A . 
F 6 HOH 109 309 168 HOH HOH A . 
F 6 HOH 110 310 430 HOH HOH A . 
F 6 HOH 111 311 585 HOH HOH A . 
F 6 HOH 112 312 557 HOH HOH A . 
F 6 HOH 113 313 191 HOH HOH A . 
F 6 HOH 114 314 443 HOH HOH A . 
F 6 HOH 115 315 332 HOH HOH A . 
F 6 HOH 116 316 192 HOH HOH A . 
F 6 HOH 117 317 329 HOH HOH A . 
F 6 HOH 118 318 421 HOH HOH A . 
F 6 HOH 119 319 446 HOH HOH A . 
F 6 HOH 120 320 346 HOH HOH A . 
F 6 HOH 121 321 115 HOH HOH A . 
F 6 HOH 122 322 510 HOH HOH A . 
F 6 HOH 123 323 357 HOH HOH A . 
F 6 HOH 124 324 477 HOH HOH A . 
F 6 HOH 125 325 552 HOH HOH A . 
F 6 HOH 126 326 558 HOH HOH A . 
F 6 HOH 127 327 444 HOH HOH A . 
F 6 HOH 128 328 189 HOH HOH A . 
F 6 HOH 129 329 376 HOH HOH A . 
F 6 HOH 130 330 371 HOH HOH A . 
F 6 HOH 131 331 403 HOH HOH A . 
F 6 HOH 132 332 449 HOH HOH A . 
F 6 HOH 133 333 193 HOH HOH A . 
F 6 HOH 134 334 555 HOH HOH A . 
F 6 HOH 135 335 466 HOH HOH A . 
F 6 HOH 136 336 358 HOH HOH A . 
F 6 HOH 137 337 447 HOH HOH A . 
F 6 HOH 138 338 338 HOH HOH A . 
F 6 HOH 139 339 349 HOH HOH A . 
F 6 HOH 140 340 379 HOH HOH A . 
F 6 HOH 141 341 464 HOH HOH A . 
F 6 HOH 142 342 334 HOH HOH A . 
F 6 HOH 143 343 395 HOH HOH A . 
F 6 HOH 144 344 419 HOH HOH A . 
F 6 HOH 145 345 482 HOH HOH A . 
F 6 HOH 146 346 368 HOH HOH A . 
F 6 HOH 147 347 194 HOH HOH A . 
F 6 HOH 148 348 588 HOH HOH A . 
G 6 HOH 1   401 517 HOH HOH H . 
G 6 HOH 2   402 512 HOH HOH H . 
G 6 HOH 3   403 345 HOH HOH H . 
G 6 HOH 4   404 53  HOH HOH H . 
G 6 HOH 5   405 278 HOH HOH H . 
G 6 HOH 6   406 100 HOH HOH H . 
G 6 HOH 7   407 459 HOH HOH H . 
G 6 HOH 8   408 161 HOH HOH H . 
G 6 HOH 9   409 472 HOH HOH H . 
G 6 HOH 10  410 291 HOH HOH H . 
G 6 HOH 11  411 195 HOH HOH H . 
G 6 HOH 12  412 559 HOH HOH H . 
G 6 HOH 13  413 487 HOH HOH H . 
G 6 HOH 14  414 130 HOH HOH H . 
G 6 HOH 15  415 36  HOH HOH H . 
G 6 HOH 16  416 151 HOH HOH H . 
G 6 HOH 17  417 396 HOH HOH H . 
G 6 HOH 18  418 183 HOH HOH H . 
G 6 HOH 19  419 40  HOH HOH H . 
G 6 HOH 20  420 241 HOH HOH H . 
G 6 HOH 21  421 436 HOH HOH H . 
G 6 HOH 22  422 418 HOH HOH H . 
G 6 HOH 23  423 511 HOH HOH H . 
G 6 HOH 24  424 410 HOH HOH H . 
G 6 HOH 25  425 404 HOH HOH H . 
G 6 HOH 26  426 408 HOH HOH H . 
G 6 HOH 27  427 564 HOH HOH H . 
G 6 HOH 28  428 516 HOH HOH H . 
G 6 HOH 29  429 272 HOH HOH H . 
G 6 HOH 30  430 110 HOH HOH H . 
G 6 HOH 31  431 301 HOH HOH H . 
G 6 HOH 32  432 67  HOH HOH H . 
G 6 HOH 33  433 582 HOH HOH H . 
G 6 HOH 34  434 508 HOH HOH H . 
G 6 HOH 35  435 140 HOH HOH H . 
G 6 HOH 36  436 107 HOH HOH H . 
G 6 HOH 37  437 483 HOH HOH H . 
G 6 HOH 38  438 99  HOH HOH H . 
G 6 HOH 39  439 300 HOH HOH H . 
G 6 HOH 40  440 473 HOH HOH H . 
G 6 HOH 41  441 305 HOH HOH H . 
G 6 HOH 42  442 54  HOH HOH H . 
G 6 HOH 43  443 65  HOH HOH H . 
G 6 HOH 44  444 173 HOH HOH H . 
G 6 HOH 45  445 234 HOH HOH H . 
G 6 HOH 46  446 566 HOH HOH H . 
G 6 HOH 47  447 150 HOH HOH H . 
G 6 HOH 48  448 8   HOH HOH H . 
G 6 HOH 49  449 118 HOH HOH H . 
G 6 HOH 50  450 156 HOH HOH H . 
G 6 HOH 51  451 62  HOH HOH H . 
G 6 HOH 52  452 254 HOH HOH H . 
G 6 HOH 53  453 474 HOH HOH H . 
G 6 HOH 54  454 302 HOH HOH H . 
G 6 HOH 55  455 424 HOH HOH H . 
G 6 HOH 56  456 520 HOH HOH H . 
G 6 HOH 57  457 324 HOH HOH H . 
G 6 HOH 58  458 5   HOH HOH H . 
G 6 HOH 59  459 362 HOH HOH H . 
G 6 HOH 60  460 219 HOH HOH H . 
G 6 HOH 61  461 389 HOH HOH H . 
G 6 HOH 62  462 22  HOH HOH H . 
G 6 HOH 63  463 27  HOH HOH H . 
G 6 HOH 64  464 214 HOH HOH H . 
G 6 HOH 65  465 186 HOH HOH H . 
G 6 HOH 66  466 232 HOH HOH H . 
G 6 HOH 67  467 139 HOH HOH H . 
G 6 HOH 68  468 522 HOH HOH H . 
G 6 HOH 69  469 415 HOH HOH H . 
G 6 HOH 70  470 398 HOH HOH H . 
G 6 HOH 71  471 61  HOH HOH H . 
G 6 HOH 72  472 209 HOH HOH H . 
G 6 HOH 73  473 205 HOH HOH H . 
G 6 HOH 74  474 19  HOH HOH H . 
G 6 HOH 75  475 298 HOH HOH H . 
G 6 HOH 76  476 93  HOH HOH H . 
G 6 HOH 77  477 467 HOH HOH H . 
G 6 HOH 78  478 133 HOH HOH H . 
G 6 HOH 79  479 306 HOH HOH H . 
G 6 HOH 80  480 1   HOH HOH H . 
G 6 HOH 81  481 126 HOH HOH H . 
G 6 HOH 82  482 199 HOH HOH H . 
G 6 HOH 83  483 490 HOH HOH H . 
G 6 HOH 84  484 23  HOH HOH H . 
G 6 HOH 85  485 499 HOH HOH H . 
G 6 HOH 86  486 47  HOH HOH H . 
G 6 HOH 87  487 24  HOH HOH H . 
G 6 HOH 88  488 583 HOH HOH H . 
G 6 HOH 89  489 145 HOH HOH H . 
G 6 HOH 90  490 211 HOH HOH H . 
G 6 HOH 91  491 266 HOH HOH H . 
G 6 HOH 92  492 116 HOH HOH H . 
G 6 HOH 93  493 157 HOH HOH H . 
G 6 HOH 94  494 530 HOH HOH H . 
G 6 HOH 95  495 304 HOH HOH H . 
G 6 HOH 96  496 553 HOH HOH H . 
G 6 HOH 97  497 89  HOH HOH H . 
G 6 HOH 98  498 373 HOH HOH H . 
G 6 HOH 99  499 66  HOH HOH H . 
G 6 HOH 100 500 494 HOH HOH H . 
G 6 HOH 101 501 96  HOH HOH H . 
G 6 HOH 102 502 569 HOH HOH H . 
G 6 HOH 103 503 247 HOH HOH H . 
G 6 HOH 104 504 435 HOH HOH H . 
G 6 HOH 105 505 250 HOH HOH H . 
G 6 HOH 106 506 385 HOH HOH H . 
G 6 HOH 107 507 377 HOH HOH H . 
G 6 HOH 108 508 233 HOH HOH H . 
G 6 HOH 109 509 320 HOH HOH H . 
G 6 HOH 110 510 28  HOH HOH H . 
G 6 HOH 111 511 249 HOH HOH H . 
G 6 HOH 112 512 397 HOH HOH H . 
G 6 HOH 113 513 240 HOH HOH H . 
G 6 HOH 114 514 11  HOH HOH H . 
G 6 HOH 115 515 177 HOH HOH H . 
G 6 HOH 116 516 105 HOH HOH H . 
G 6 HOH 117 517 258 HOH HOH H . 
G 6 HOH 118 518 216 HOH HOH H . 
G 6 HOH 119 519 158 HOH HOH H . 
G 6 HOH 120 520 174 HOH HOH H . 
G 6 HOH 121 521 309 HOH HOH H . 
G 6 HOH 122 522 556 HOH HOH H . 
G 6 HOH 123 523 114 HOH HOH H . 
G 6 HOH 124 524 382 HOH HOH H . 
G 6 HOH 125 525 73  HOH HOH H . 
G 6 HOH 126 526 85  HOH HOH H . 
G 6 HOH 127 527 155 HOH HOH H . 
G 6 HOH 128 528 207 HOH HOH H . 
G 6 HOH 129 529 388 HOH HOH H . 
G 6 HOH 130 530 498 HOH HOH H . 
G 6 HOH 131 531 132 HOH HOH H . 
G 6 HOH 132 532 571 HOH HOH H . 
G 6 HOH 133 533 434 HOH HOH H . 
G 6 HOH 134 534 313 HOH HOH H . 
G 6 HOH 135 535 253 HOH HOH H . 
G 6 HOH 136 536 203 HOH HOH H . 
G 6 HOH 137 537 106 HOH HOH H . 
G 6 HOH 138 538 495 HOH HOH H . 
G 6 HOH 139 539 95  HOH HOH H . 
G 6 HOH 140 540 319 HOH HOH H . 
G 6 HOH 141 541 206 HOH HOH H . 
G 6 HOH 142 542 274 HOH HOH H . 
G 6 HOH 143 543 261 HOH HOH H . 
G 6 HOH 144 544 148 HOH HOH H . 
G 6 HOH 145 545 124 HOH HOH H . 
G 6 HOH 146 546 340 HOH HOH H . 
G 6 HOH 147 547 239 HOH HOH H . 
G 6 HOH 148 548 414 HOH HOH H . 
G 6 HOH 149 549 489 HOH HOH H . 
G 6 HOH 150 550 268 HOH HOH H . 
G 6 HOH 151 551 226 HOH HOH H . 
G 6 HOH 152 552 242 HOH HOH H . 
G 6 HOH 153 553 149 HOH HOH H . 
G 6 HOH 154 554 383 HOH HOH H . 
G 6 HOH 155 555 147 HOH HOH H . 
G 6 HOH 156 556 128 HOH HOH H . 
G 6 HOH 157 557 525 HOH HOH H . 
G 6 HOH 158 558 138 HOH HOH H . 
G 6 HOH 159 559 538 HOH HOH H . 
G 6 HOH 160 560 493 HOH HOH H . 
G 6 HOH 161 561 528 HOH HOH H . 
G 6 HOH 162 562 565 HOH HOH H . 
G 6 HOH 163 563 546 HOH HOH H . 
G 6 HOH 164 564 515 HOH HOH H . 
G 6 HOH 165 565 327 HOH HOH H . 
G 6 HOH 166 566 562 HOH HOH H . 
G 6 HOH 167 567 342 HOH HOH H . 
G 6 HOH 168 568 437 HOH HOH H . 
G 6 HOH 169 569 492 HOH HOH H . 
G 6 HOH 170 570 256 HOH HOH H . 
G 6 HOH 171 571 310 HOH HOH H . 
G 6 HOH 172 572 563 HOH HOH H . 
G 6 HOH 173 573 374 HOH HOH H . 
G 6 HOH 174 574 352 HOH HOH H . 
G 6 HOH 175 575 416 HOH HOH H . 
G 6 HOH 176 576 354 HOH HOH H . 
G 6 HOH 177 577 426 HOH HOH H . 
G 6 HOH 178 578 333 HOH HOH H . 
G 6 HOH 179 579 347 HOH HOH H . 
G 6 HOH 180 580 337 HOH HOH H . 
G 6 HOH 181 581 460 HOH HOH H . 
G 6 HOH 182 582 469 HOH HOH H . 
G 6 HOH 183 583 356 HOH HOH H . 
G 6 HOH 184 584 491 HOH HOH H . 
G 6 HOH 185 585 488 HOH HOH H . 
G 6 HOH 186 586 190 HOH HOH H . 
G 6 HOH 187 587 237 HOH HOH H . 
G 6 HOH 188 588 442 HOH HOH H . 
G 6 HOH 189 589 514 HOH HOH H . 
G 6 HOH 190 590 363 HOH HOH H . 
G 6 HOH 191 591 38  HOH HOH H . 
G 6 HOH 192 592 519 HOH HOH H . 
G 6 HOH 193 593 560 HOH HOH H . 
G 6 HOH 194 594 341 HOH HOH H . 
G 6 HOH 195 595 503 HOH HOH H . 
G 6 HOH 196 596 570 HOH HOH H . 
G 6 HOH 197 597 353 HOH HOH H . 
G 6 HOH 198 598 540 HOH HOH H . 
G 6 HOH 199 599 470 HOH HOH H . 
G 6 HOH 200 600 526 HOH HOH H . 
H 6 HOH 1   401 452 HOH HOH L . 
H 6 HOH 2   402 217 HOH HOH L . 
H 6 HOH 3   403 579 HOH HOH L . 
H 6 HOH 4   404 412 HOH HOH L . 
H 6 HOH 5   405 535 HOH HOH L . 
H 6 HOH 6   406 425 HOH HOH L . 
H 6 HOH 7   407 399 HOH HOH L . 
H 6 HOH 8   408 432 HOH HOH L . 
H 6 HOH 9   409 303 HOH HOH L . 
H 6 HOH 10  410 269 HOH HOH L . 
H 6 HOH 11  411 307 HOH HOH L . 
H 6 HOH 12  412 284 HOH HOH L . 
H 6 HOH 13  413 496 HOH HOH L . 
H 6 HOH 14  414 50  HOH HOH L . 
H 6 HOH 15  415 84  HOH HOH L . 
H 6 HOH 16  416 104 HOH HOH L . 
H 6 HOH 17  417 401 HOH HOH L . 
H 6 HOH 18  418 125 HOH HOH L . 
H 6 HOH 19  419 196 HOH HOH L . 
H 6 HOH 20  420 455 HOH HOH L . 
H 6 HOH 21  421 108 HOH HOH L . 
H 6 HOH 22  422 208 HOH HOH L . 
H 6 HOH 23  423 68  HOH HOH L . 
H 6 HOH 24  424 454 HOH HOH L . 
H 6 HOH 25  425 265 HOH HOH L . 
H 6 HOH 26  426 18  HOH HOH L . 
H 6 HOH 27  427 411 HOH HOH L . 
H 6 HOH 28  428 57  HOH HOH L . 
H 6 HOH 29  429 568 HOH HOH L . 
H 6 HOH 30  430 574 HOH HOH L . 
H 6 HOH 31  431 221 HOH HOH L . 
H 6 HOH 32  432 259 HOH HOH L . 
H 6 HOH 33  433 184 HOH HOH L . 
H 6 HOH 34  434 117 HOH HOH L . 
H 6 HOH 35  435 94  HOH HOH L . 
H 6 HOH 36  436 481 HOH HOH L . 
H 6 HOH 37  437 166 HOH HOH L . 
H 6 HOH 38  438 277 HOH HOH L . 
H 6 HOH 39  439 378 HOH HOH L . 
H 6 HOH 40  440 485 HOH HOH L . 
H 6 HOH 41  441 524 HOH HOH L . 
H 6 HOH 42  442 267 HOH HOH L . 
H 6 HOH 43  443 325 HOH HOH L . 
H 6 HOH 44  444 567 HOH HOH L . 
H 6 HOH 45  445 29  HOH HOH L . 
H 6 HOH 46  446 534 HOH HOH L . 
H 6 HOH 47  447 453 HOH HOH L . 
H 6 HOH 48  448 136 HOH HOH L . 
H 6 HOH 49  449 42  HOH HOH L . 
H 6 HOH 50  450 367 HOH HOH L . 
H 6 HOH 51  451 74  HOH HOH L . 
H 6 HOH 52  452 387 HOH HOH L . 
H 6 HOH 53  453 164 HOH HOH L . 
H 6 HOH 54  454 533 HOH HOH L . 
H 6 HOH 55  455 500 HOH HOH L . 
H 6 HOH 56  456 509 HOH HOH L . 
H 6 HOH 57  457 238 HOH HOH L . 
H 6 HOH 58  458 497 HOH HOH L . 
H 6 HOH 59  459 39  HOH HOH L . 
H 6 HOH 60  460 478 HOH HOH L . 
H 6 HOH 61  461 30  HOH HOH L . 
H 6 HOH 62  462 577 HOH HOH L . 
H 6 HOH 63  463 170 HOH HOH L . 
H 6 HOH 64  464 179 HOH HOH L . 
H 6 HOH 65  465 318 HOH HOH L . 
H 6 HOH 66  466 120 HOH HOH L . 
H 6 HOH 67  467 154 HOH HOH L . 
H 6 HOH 68  468 43  HOH HOH L . 
H 6 HOH 69  469 182 HOH HOH L . 
H 6 HOH 70  470 45  HOH HOH L . 
H 6 HOH 71  471 321 HOH HOH L . 
H 6 HOH 72  472 7   HOH HOH L . 
H 6 HOH 73  473 41  HOH HOH L . 
H 6 HOH 74  474 502 HOH HOH L . 
H 6 HOH 75  475 314 HOH HOH L . 
H 6 HOH 76  476 44  HOH HOH L . 
H 6 HOH 77  477 202 HOH HOH L . 
H 6 HOH 78  478 167 HOH HOH L . 
H 6 HOH 79  479 312 HOH HOH L . 
H 6 HOH 80  480 70  HOH HOH L . 
H 6 HOH 81  481 59  HOH HOH L . 
H 6 HOH 82  482 297 HOH HOH L . 
H 6 HOH 83  483 282 HOH HOH L . 
H 6 HOH 84  484 2   HOH HOH L . 
H 6 HOH 85  485 506 HOH HOH L . 
H 6 HOH 86  486 137 HOH HOH L . 
H 6 HOH 87  487 227 HOH HOH L . 
H 6 HOH 88  488 273 HOH HOH L . 
H 6 HOH 89  489 35  HOH HOH L . 
H 6 HOH 90  490 111 HOH HOH L . 
H 6 HOH 91  491 317 HOH HOH L . 
H 6 HOH 92  492 456 HOH HOH L . 
H 6 HOH 93  493 439 HOH HOH L . 
H 6 HOH 94  494 49  HOH HOH L . 
H 6 HOH 95  495 31  HOH HOH L . 
H 6 HOH 96  496 480 HOH HOH L . 
H 6 HOH 97  497 548 HOH HOH L . 
H 6 HOH 98  498 88  HOH HOH L . 
H 6 HOH 99  499 129 HOH HOH L . 
H 6 HOH 100 500 13  HOH HOH L . 
H 6 HOH 101 501 26  HOH HOH L . 
H 6 HOH 102 502 547 HOH HOH L . 
H 6 HOH 103 503 6   HOH HOH L . 
H 6 HOH 104 504 251 HOH HOH L . 
H 6 HOH 105 505 244 HOH HOH L . 
H 6 HOH 106 506 438 HOH HOH L . 
H 6 HOH 107 507 544 HOH HOH L . 
H 6 HOH 108 508 15  HOH HOH L . 
H 6 HOH 109 509 372 HOH HOH L . 
H 6 HOH 110 510 46  HOH HOH L . 
H 6 HOH 111 511 17  HOH HOH L . 
H 6 HOH 112 512 113 HOH HOH L . 
H 6 HOH 113 513 176 HOH HOH L . 
H 6 HOH 114 514 484 HOH HOH L . 
H 6 HOH 115 515 271 HOH HOH L . 
H 6 HOH 116 516 299 HOH HOH L . 
H 6 HOH 117 517 315 HOH HOH L . 
H 6 HOH 118 518 229 HOH HOH L . 
H 6 HOH 119 519 119 HOH HOH L . 
H 6 HOH 120 520 505 HOH HOH L . 
H 6 HOH 121 521 52  HOH HOH L . 
H 6 HOH 122 522 223 HOH HOH L . 
H 6 HOH 123 523 384 HOH HOH L . 
H 6 HOH 124 524 471 HOH HOH L . 
H 6 HOH 125 525 296 HOH HOH L . 
H 6 HOH 126 526 294 HOH HOH L . 
H 6 HOH 127 527 146 HOH HOH L . 
H 6 HOH 128 528 32  HOH HOH L . 
H 6 HOH 129 529 224 HOH HOH L . 
H 6 HOH 130 530 71  HOH HOH L . 
H 6 HOH 131 531 545 HOH HOH L . 
H 6 HOH 132 532 51  HOH HOH L . 
H 6 HOH 133 533 539 HOH HOH L . 
H 6 HOH 134 534 465 HOH HOH L . 
H 6 HOH 135 535 581 HOH HOH L . 
H 6 HOH 136 536 180 HOH HOH L . 
H 6 HOH 137 537 60  HOH HOH L . 
H 6 HOH 138 538 121 HOH HOH L . 
H 6 HOH 139 539 252 HOH HOH L . 
H 6 HOH 140 540 283 HOH HOH L . 
H 6 HOH 141 541 529 HOH HOH L . 
H 6 HOH 142 542 486 HOH HOH L . 
H 6 HOH 143 543 479 HOH HOH L . 
H 6 HOH 144 544 381 HOH HOH L . 
H 6 HOH 145 545 523 HOH HOH L . 
H 6 HOH 146 546 380 HOH HOH L . 
H 6 HOH 147 547 573 HOH HOH L . 
H 6 HOH 148 548 423 HOH HOH L . 
H 6 HOH 149 549 163 HOH HOH L . 
H 6 HOH 150 550 79  HOH HOH L . 
H 6 HOH 151 551 518 HOH HOH L . 
H 6 HOH 152 552 257 HOH HOH L . 
H 6 HOH 153 553 134 HOH HOH L . 
H 6 HOH 154 554 210 HOH HOH L . 
H 6 HOH 155 555 287 HOH HOH L . 
H 6 HOH 156 556 475 HOH HOH L . 
H 6 HOH 157 557 276 HOH HOH L . 
H 6 HOH 158 558 185 HOH HOH L . 
H 6 HOH 159 559 220 HOH HOH L . 
H 6 HOH 160 560 504 HOH HOH L . 
H 6 HOH 161 561 228 HOH HOH L . 
H 6 HOH 162 562 235 HOH HOH L . 
H 6 HOH 163 563 218 HOH HOH L . 
H 6 HOH 164 564 82  HOH HOH L . 
H 6 HOH 165 565 165 HOH HOH L . 
H 6 HOH 166 566 285 HOH HOH L . 
H 6 HOH 167 567 457 HOH HOH L . 
H 6 HOH 168 568 48  HOH HOH L . 
H 6 HOH 169 569 215 HOH HOH L . 
H 6 HOH 170 570 501 HOH HOH L . 
H 6 HOH 171 571 440 HOH HOH L . 
H 6 HOH 172 572 91  HOH HOH L . 
H 6 HOH 173 573 245 HOH HOH L . 
H 6 HOH 174 574 413 HOH HOH L . 
H 6 HOH 175 575 142 HOH HOH L . 
H 6 HOH 176 576 578 HOH HOH L . 
H 6 HOH 177 577 292 HOH HOH L . 
H 6 HOH 178 578 507 HOH HOH L . 
H 6 HOH 179 579 311 HOH HOH L . 
H 6 HOH 180 580 286 HOH HOH L . 
H 6 HOH 181 581 364 HOH HOH L . 
H 6 HOH 182 582 141 HOH HOH L . 
H 6 HOH 183 583 580 HOH HOH L . 
H 6 HOH 184 584 527 HOH HOH L . 
H 6 HOH 185 585 531 HOH HOH L . 
H 6 HOH 186 586 390 HOH HOH L . 
H 6 HOH 187 587 236 HOH HOH L . 
H 6 HOH 188 588 90  HOH HOH L . 
H 6 HOH 189 589 575 HOH HOH L . 
H 6 HOH 190 590 255 HOH HOH L . 
H 6 HOH 191 591 543 HOH HOH L . 
H 6 HOH 192 592 355 HOH HOH L . 
H 6 HOH 193 593 330 HOH HOH L . 
H 6 HOH 194 594 335 HOH HOH L . 
H 6 HOH 195 595 344 HOH HOH L . 
H 6 HOH 196 596 576 HOH HOH L . 
H 6 HOH 197 597 537 HOH HOH L . 
H 6 HOH 198 598 366 HOH HOH L . 
H 6 HOH 199 599 386 HOH HOH L . 
H 6 HOH 200 600 360 HOH HOH L . 
H 6 HOH 201 601 336 HOH HOH L . 
H 6 HOH 202 602 402 HOH HOH L . 
H 6 HOH 203 603 417 HOH HOH L . 
H 6 HOH 204 604 550 HOH HOH L . 
H 6 HOH 205 605 351 HOH HOH L . 
H 6 HOH 206 606 331 HOH HOH L . 
H 6 HOH 207 607 409 HOH HOH L . 
H 6 HOH 208 608 433 HOH HOH L . 
H 6 HOH 209 609 521 HOH HOH L . 
H 6 HOH 210 610 326 HOH HOH L . 
H 6 HOH 211 611 369 HOH HOH L . 
H 6 HOH 212 612 536 HOH HOH L . 
H 6 HOH 213 613 123 HOH HOH L . 
H 6 HOH 214 614 549 HOH HOH L . 
H 6 HOH 215 615 343 HOH HOH L . 
H 6 HOH 216 616 262 HOH HOH L . 
H 6 HOH 217 617 200 HOH HOH L . 
H 6 HOH 218 618 584 HOH HOH L . 
H 6 HOH 219 619 201 HOH HOH L . 
H 6 HOH 220 620 400 HOH HOH L . 
H 6 HOH 221 621 458 HOH HOH L . 
H 6 HOH 222 622 392 HOH HOH L . 
H 6 HOH 223 623 541 HOH HOH L . 
H 6 HOH 224 624 542 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' ? ? ? ? ? ? ? ? ? ? ? MOSFLM ? ? ? 7.2.2    2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? SCALA  ? ? ? 3.3.22   3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? 2.8.2    4 
# 
_cell.angle_alpha                  90.00 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.00 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.00 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     8Z3A 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     69.370 
_cell.length_a_esd                 ? 
_cell.length_b                     83.990 
_cell.length_b_esd                 ? 
_cell.length_c                     126.850 
_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                         8Z3A 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                19 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 21 21 21' 
_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                   8Z3A 
_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             2.59 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          52.44 
_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 KNO3, 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                                       8Z3A 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.75 
_reflns.d_resolution_low                               53.5 
_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                                     75399 
_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                                9.3 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          11.8 
_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                                0.04 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.997 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.117 
_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                                    1.75 
_reflns_shell.d_res_low                                     1.84 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           2.3 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             10836 
_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                               8.5 
_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                               0.339 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.693 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          99.7 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  0.943 
_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]                            -0.37 
_refine.aniso_B[1][2]                            0.00 
_refine.aniso_B[1][3]                            0.00 
_refine.aniso_B[2][2]                            0.83 
_refine.aniso_B[2][3]                            0.00 
_refine.aniso_B[3][3]                            -0.45 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               25.300 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.964 
_refine.correlation_coeff_Fo_to_Fc_free          0.951 
_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                                 8Z3A 
_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                            1.75 
_refine.ls_d_res_low                             50.67 
_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                     72234 
_refine.ls_number_reflns_R_free                  3093 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.88 
_refine.ls_percent_reflns_R_free                 4.1 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.17677 
_refine.ls_R_factor_R_free                       0.20745 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.17546 
_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                       0.098 
_refine.pdbx_overall_ESU_R_Free                  0.098 
_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                             4.827 
_refine.overall_SU_ML                            0.077 
_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                       1.75 
_refine_hist.d_res_low                        50.67 
_refine_hist.number_atoms_solvent             572 
_refine_hist.number_atoms_total               5049 
_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        4467 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         10 
_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' ? 0.014  0.013  4681 ? r_bond_refined_d             ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.017  4218 ? r_bond_other_d               ? ? 
'X-RAY DIFFRACTION' ? 1.825  1.647  6378 ? r_angle_refined_deg          ? ? 
'X-RAY DIFFRACTION' ? 1.457  1.577  9857 ? r_angle_other_deg            ? ? 
'X-RAY DIFFRACTION' ? 7.764  5.000  598  ? r_dihedral_angle_1_deg       ? ? 
'X-RAY DIFFRACTION' ? 33.019 23.040 227  ? r_dihedral_angle_2_deg       ? ? 
'X-RAY DIFFRACTION' ? 13.867 15.000 781  ? r_dihedral_angle_3_deg       ? ? 
'X-RAY DIFFRACTION' ? 14.228 15.000 22   ? r_dihedral_angle_4_deg       ? ? 
'X-RAY DIFFRACTION' ? 0.085  0.200  616  ? r_chiral_restr               ? ? 
'X-RAY DIFFRACTION' ? 0.011  0.020  5255 ? 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' ? 1.162  1.474  2327 ? r_mcbond_it                  ? ? 
'X-RAY DIFFRACTION' ? 1.162  1.473  2326 ? r_mcbond_other               ? ? 
'X-RAY DIFFRACTION' ? 1.840  2.203  2910 ? r_mcangle_it                 ? ? 
'X-RAY DIFFRACTION' ? 1.839  2.204  2911 ? r_mcangle_other              ? ? 
'X-RAY DIFFRACTION' ? 1.699  1.673  2354 ? r_scbond_it                  ? ? 
'X-RAY DIFFRACTION' ? 1.697  1.673  2352 ? r_scbond_other               ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_scangle_it                 ? ? 
'X-RAY DIFFRACTION' ? 2.721  2.420  3453 ? r_scangle_other              ? ? 
'X-RAY DIFFRACTION' ? 5.269  18.318 5273 ? r_long_range_B_refined       ? ? 
'X-RAY DIFFRACTION' ? 5.269  18.325 5274 ? 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                       1.750 
_refine_ls_shell.d_res_low                        1.795 
_refine_ls_shell.number_reflns_all                ? 
_refine_ls_shell.number_reflns_obs                ? 
_refine_ls_shell.number_reflns_R_free             229 
_refine_ls_shell.number_reflns_R_work             5248 
_refine_ls_shell.percent_reflns_obs               99.58 
_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                  0.282 
_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                  0.343 
# 
_struct.entry_id                     8Z3A 
_struct.title                        'Crystal structure of Sonic hedgehog in complex with antibody 5E1 without 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        8Z3A 
_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 5 ? 
F N N 6 ? 
G N N 6 ? 
H N N 6 ? 
# 
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 8Z3A      8Z3A   ? 2 ? 1  
3 PDB 8Z3A      8Z3A   ? 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 8Z3A A 1 ? 169 ? Q15465 29 ? 197 ? 29 197 
2 2 8Z3A H 1 ? 241 ? 8Z3A   1  ? 241 ? 1  241 
3 3 8Z3A L 1 ? 235 ? 8Z3A   1  ? 235 ? 1  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 
# 
_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 ? GLY A 141 ? LYS A 157 GLY A 169 1 ? 13 
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 LYS B 207 ? ASN B 210 ? LYS H 207 ASN H 210 5 ? 4  
HELX_P HELX_P13 AB4 GLN C 79  ? LEU C 83  ? GLN L 79  LEU L 83  5 ? 5  
HELX_P HELX_P14 AB5 SER C 121 ? SER C 127 ? SER L 121 SER L 127 1 ? 7  
HELX_P HELX_P15 AB6 LYS C 183 ? LYS C 188 ? LYS L 183 LYS L 188 1 ? 6  
# 
_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 ? ? ? ? ? ? ? 2.037 ? ? 
disulf2 disulf ? ? B CYS 146 SG ? ? ? 1_555 B CYS 202 SG ? ? H CYS 146 H CYS 202 1_555 ? ? ? ? ? ? ? 2.051 ? ? 
disulf3 disulf ? ? C CYS 23  SG A ? ? 1_555 C CYS 88  SG ? ? L CYS 23  L CYS 88  1_555 ? ? ? ? ? ? ? 2.135 ? ? 
disulf4 disulf ? ? C CYS 23  SG B ? ? 1_555 C CYS 88  SG ? ? L CYS 23  L CYS 88  1_555 ? ? ? ? ? ? ? 1.945 ? ? 
disulf5 disulf ? ? C CYS 134 SG ? ? ? 1_555 C CYS 194 SG ? ? L CYS 134 L CYS 194 1_555 ? ? ? ? ? ? ? 1.965 ? ? 
# 
_struct_conn_type.id          disulf 
_struct_conn_type.criteria    ? 
_struct_conn_type.reference   ? 
# 
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 23  A CYS C 88  ? CYS L 23  ? 1_555 CYS L 88  ? 1_555 SG SG . . . None 'Disulfide bridge' 
4 CYS C 23  B CYS C 88  ? CYS L 23  ? 1_555 CYS L 88  ? 1_555 SG SG . . . None 'Disulfide bridge' 
5 CYS C 134 ? CYS C 194 ? 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 -4.51  
2 ILE 20  A . ? ILE 48  A PRO 21  A ? PRO 49  A 1 -4.23  
3 PHE 152 B . ? PHE 152 H PRO 153 B ? PRO 153 H 1 -12.01 
4 GLU 154 B . ? GLU 154 H PRO 155 B ? PRO 155 H 1 -3.47  
5 THR 7   C . ? THR 7   L PRO 8   C ? PRO 8   L 1 -11.14 
6 SER 94  C . ? SER 94  L PRO 95  C ? PRO 95  L 1 2.11   
7 TYR 140 C . ? TYR 140 L PRO 141 C ? PRO 141 L 1 1.54   
# 
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 4   ? THR C 7   ? MET L 4   THR L 7   
AA9 2 VAL C 19  ? ALA C 25  ? VAL L 19  ALA L 25  
AA9 3 ASP C 70  ? ILE C 75  ? ASP L 70  ILE L 75  
AA9 4 PHE C 62  ? GLY C 66  ? PHE L 62  GLY L 66  
AB1 1 PHE C 10  ? SER C 14  ? PHE L 10  SER L 14  
AB1 2 THR C 102 ? LYS C 107 ? THR L 102 LYS L 107 
AB1 3 ALA C 84  ? GLN C 90  ? ALA L 84  GLN L 90  
AB1 4 LEU C 33  ? GLN C 38  ? LEU L 33  GLN L 38  
AB1 5 LYS C 45  ? TYR C 49  ? LYS L 45  TYR L 49  
AB1 6 ASN C 53  ? ARG C 54  ? ASN L 53  ARG L 54  
AB2 1 PHE C 10  ? SER C 14  ? PHE L 10  SER L 14  
AB2 2 THR C 102 ? LYS C 107 ? THR L 102 LYS L 107 
AB2 3 ALA C 84  ? GLN C 90  ? ALA L 84  GLN L 90  
AB2 4 THR C 97  ? PHE C 98  ? THR L 97  PHE L 98  
AB3 1 SER C 114 ? PHE C 118 ? SER L 114 PHE L 118 
AB3 2 THR C 129 ? PHE C 139 ? THR L 129 PHE L 139 
AB3 3 TYR C 173 ? SER C 182 ? TYR L 173 SER L 182 
AB3 4 SER C 159 ? VAL C 163 ? SER L 159 VAL L 163 
AB4 1 ALA C 153 ? LEU C 154 ? ALA L 153 LEU L 154 
AB4 2 LYS C 145 ? VAL C 150 ? LYS L 145 VAL L 150 
AB4 3 VAL C 191 ? THR C 197 ? VAL L 191 THR L 197 
AB4 4 VAL C 205 ? ASN C 210 ? 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 ILE B 20  ? N ILE H 20  O LEU B 81  ? O LEU H 81  
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 TRP B 36  ? N TRP H 36  O ILE B 48  ? O ILE H 48  
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 PHE B 128 ? N PHE H 128 O LEU B 147 ? O LEU H 147 
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 PHE B 128 ? N PHE H 128 O LEU B 147 ? O LEU H 147 
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 VAL B 204 ? N VAL H 204 O VAL B 213 ? O VAL H 213 
AA9 1 2 N THR C 7   ? N THR L 7   O THR C 22  ? O THR L 22  
AA9 2 3 N ILE C 21  ? N ILE L 21  O PHE C 73  ? O PHE L 73  
AA9 3 4 O THR C 74  ? O THR L 74  N THR C 63  ? N THR L 63  
AB1 1 2 N LEU C 11  ? N LEU L 11  O GLU C 105 ? O GLU L 105 
AB1 2 3 O VAL C 104 ? O VAL L 104 N ALA C 84  ? N ALA L 84  
AB1 3 4 O VAL C 85  ? O VAL L 85  N GLN C 38  ? N GLN L 38  
AB1 4 5 N TRP C 35  ? N TRP L 35  O ILE C 48  ? O ILE L 48  
AB1 5 6 N TYR C 49  ? N TYR L 49  O ASN C 53  ? O ASN L 53  
AB2 1 2 N LEU C 11  ? N LEU L 11  O GLU C 105 ? O GLU L 105 
AB2 2 3 O VAL C 104 ? O VAL L 104 N ALA C 84  ? N ALA L 84  
AB2 3 4 N GLN C 90  ? N GLN L 90  O THR C 97  ? O THR L 97  
AB3 1 2 N PHE C 116 ? N PHE L 116 O LEU C 135 ? O LEU L 135 
AB3 2 3 N CYS C 134 ? N CYS L 134 O SER C 177 ? O SER L 177 
AB3 3 4 O THR C 178 ? O THR L 178 N GLN C 160 ? N GLN L 160 
AB4 1 2 O ALA C 153 ? O ALA L 153 N VAL C 150 ? N VAL L 150 
AB4 2 3 N GLN C 147 ? N GLN L 147 O GLU C 195 ? O GLU L 195 
AB4 3 4 N VAL C 196 ? N VAL L 196 O VAL C 205 ? O VAL L 205 
# 
_pdbx_entry_details.entry_id                   8Z3A 
_pdbx_entry_details.has_ligand_of_interest     N 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.has_protein_modification   Y 
# 
loop_
_pdbx_validate_close_contact.id 
_pdbx_validate_close_contact.PDB_model_num 
_pdbx_validate_close_contact.auth_atom_id_1 
_pdbx_validate_close_contact.auth_asym_id_1 
_pdbx_validate_close_contact.auth_comp_id_1 
_pdbx_validate_close_contact.auth_seq_id_1 
_pdbx_validate_close_contact.PDB_ins_code_1 
_pdbx_validate_close_contact.label_alt_id_1 
_pdbx_validate_close_contact.auth_atom_id_2 
_pdbx_validate_close_contact.auth_asym_id_2 
_pdbx_validate_close_contact.auth_comp_id_2 
_pdbx_validate_close_contact.auth_seq_id_2 
_pdbx_validate_close_contact.PDB_ins_code_2 
_pdbx_validate_close_contact.label_alt_id_2 
_pdbx_validate_close_contact.dist 
1 1 OE1 A GLU 89 ? ? O A HOH 201 ? ? 2.16 
2 1 OD2 L ASP 17 ? ? O L HOH 401 ? ? 2.16 
# 
_pdbx_validate_rmsd_bond.id                        1 
_pdbx_validate_rmsd_bond.PDB_model_num             1 
_pdbx_validate_rmsd_bond.auth_atom_id_1            CD 
_pdbx_validate_rmsd_bond.auth_asym_id_1            H 
_pdbx_validate_rmsd_bond.auth_comp_id_1            GLU 
_pdbx_validate_rmsd_bond.auth_seq_id_1             154 
_pdbx_validate_rmsd_bond.PDB_ins_code_1            ? 
_pdbx_validate_rmsd_bond.label_alt_id_1            ? 
_pdbx_validate_rmsd_bond.auth_atom_id_2            OE2 
_pdbx_validate_rmsd_bond.auth_asym_id_2            H 
_pdbx_validate_rmsd_bond.auth_comp_id_2            GLU 
_pdbx_validate_rmsd_bond.auth_seq_id_2             154 
_pdbx_validate_rmsd_bond.PDB_ins_code_2            ? 
_pdbx_validate_rmsd_bond.label_alt_id_2            ? 
_pdbx_validate_rmsd_bond.bond_value                1.335 
_pdbx_validate_rmsd_bond.bond_target_value         1.252 
_pdbx_validate_rmsd_bond.bond_deviation            0.083 
_pdbx_validate_rmsd_bond.bond_standard_deviation   0.011 
_pdbx_validate_rmsd_bond.linker_flag               N 
# 
loop_
_pdbx_validate_rmsd_angle.id 
_pdbx_validate_rmsd_angle.PDB_model_num 
_pdbx_validate_rmsd_angle.auth_atom_id_1 
_pdbx_validate_rmsd_angle.auth_asym_id_1 
_pdbx_validate_rmsd_angle.auth_comp_id_1 
_pdbx_validate_rmsd_angle.auth_seq_id_1 
_pdbx_validate_rmsd_angle.PDB_ins_code_1 
_pdbx_validate_rmsd_angle.label_alt_id_1 
_pdbx_validate_rmsd_angle.auth_atom_id_2 
_pdbx_validate_rmsd_angle.auth_asym_id_2 
_pdbx_validate_rmsd_angle.auth_comp_id_2 
_pdbx_validate_rmsd_angle.auth_seq_id_2 
_pdbx_validate_rmsd_angle.PDB_ins_code_2 
_pdbx_validate_rmsd_angle.label_alt_id_2 
_pdbx_validate_rmsd_angle.auth_atom_id_3 
_pdbx_validate_rmsd_angle.auth_asym_id_3 
_pdbx_validate_rmsd_angle.auth_comp_id_3 
_pdbx_validate_rmsd_angle.auth_seq_id_3 
_pdbx_validate_rmsd_angle.PDB_ins_code_3 
_pdbx_validate_rmsd_angle.label_alt_id_3 
_pdbx_validate_rmsd_angle.angle_value 
_pdbx_validate_rmsd_angle.angle_target_value 
_pdbx_validate_rmsd_angle.angle_deviation 
_pdbx_validate_rmsd_angle.angle_standard_deviation 
_pdbx_validate_rmsd_angle.linker_flag 
1 1 NE A ARG 96 ? ? CZ A ARG 96 ? ? NH2 A ARG 96 ? ? 116.61 120.30 -3.69  0.50 N 
2 1 CB L ASP 60 ? ? CA L ASP 60 ? ? C   L ASP 60 ? ? 96.50  110.40 -13.90 2.00 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 ALA A 58  ? ? -110.64 -117.65 
2  1 SER H 44  ? ? 43.90   -126.47 
3  1 GLU H 101 ? ? 73.68   35.06   
4  1 ASP H 150 ? ? 71.25   62.72   
5  1 SER H 194 ? ? -78.60  49.37   
6  1 LEU H 195 ? ? -107.78 -67.78  
7  1 THR H 197 ? ? -64.55  -74.88  
8  1 SER L 30  ? ? 52.60   -130.62 
9  1 ALA L 51  ? ? 70.37   -34.44  
10 1 ALA L 84  ? ? 177.50  170.66  
11 1 LYS L 169 ? B -78.41  -71.57  
# 
_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            -146.40 
# 
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 -1.5517 -23.9202 -0.0028  0.0112 ? 0.0154 ? -0.0025 ? 0.0347 ? 0.0025 ? 0.0351 ? 4.3753 ? -0.5699 
? 0.5272  ? 1.8448 ? -0.8797 ? 2.3102 ? 0.0577  ? 0.1095  ? -0.3212 ? -0.0747 ? -0.0134 ? 0.1534 ? 0.0964 ? 0.0157  ? -0.0443 ? 
2 'X-RAY DIFFRACTION' ? refined 0.2695  -14.1882 -39.1737 0.0074 ? 0.0030 ? 0.0018  ? 0.0108 ? 0.0090 ? 0.0460 ? 1.1241 ? -0.1945 
? -0.2855 ? 0.9572 ? 0.7947  ? 3.2220 ? -0.0629 ? -0.0196 ? -0.1066 ? -0.0345 ? -0.0599 ? 0.0567 ? 0.0142 ? -0.1084 ? 0.1228  ? 
3 'X-RAY DIFFRACTION' ? refined 14.0910 -26.9716 -42.7316 0.0814 ? 0.0550 ? 0.0268  ? 0.0803 ? 0.0267 ? 0.0493 ? 0.4906 ? -0.0185 
? -0.2540 ? 0.1949 ? 0.7064  ? 2.8980 ? -0.0995 ? -0.0053 ? -0.1261 ? -0.0077 ? -0.0054 ? 0.0098 ? 0.1319 ? 0.1256  ? 0.1049  ? 
# 
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 188 ? ? ? 
2 'X-RAY DIFFRACTION' 2 ? ? H 1  ? ? ? H 219 ? ? ? 
3 'X-RAY DIFFRACTION' 3 ? ? L 1  ? ? ? L 211 ? ? ? 
# 
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 ASN 189 ? A ASN 161 
12 1 Y 1 A SER 190 ? A SER 162 
13 1 Y 1 A VAL 191 ? A VAL 163 
14 1 Y 1 A ALA 192 ? A ALA 164 
15 1 Y 1 A ALA 193 ? A ALA 165 
16 1 Y 1 A LYS 194 ? A LYS 166 
17 1 Y 1 A SER 195 ? A SER 167 
18 1 Y 1 A GLY 196 ? A GLY 168 
19 1 Y 1 A GLY 197 ? A GLY 169 
20 1 Y 1 H SER 133 ? B SER 133 
21 1 Y 1 H SER 134 ? B SER 134 
22 1 Y 1 H LYS 135 ? B LYS 135 
23 1 Y 1 H SER 136 ? B SER 136 
24 1 Y 1 H THR 137 ? B THR 137 
25 1 Y 1 H SER 138 ? B SER 138 
26 1 Y 1 H LYS 220 ? B LYS 220 
27 1 Y 1 H GLU 221 ? B GLU 221 
28 1 Y 1 H GLN 222 ? B GLN 222 
29 1 Y 1 H LYS 223 ? B LYS 223 
30 1 Y 1 H LEU 224 ? B LEU 224 
31 1 Y 1 H ILE 225 ? B ILE 225 
32 1 Y 1 H SER 226 ? B SER 226 
33 1 Y 1 H GLU 227 ? B GLU 227 
34 1 Y 1 H GLU 228 ? B GLU 228 
35 1 Y 1 H ASP 229 ? B ASP 229 
36 1 Y 1 H LEU 230 ? B LEU 230 
37 1 Y 1 H ASN 231 ? B ASN 231 
38 1 Y 1 H SER 232 ? B SER 232 
39 1 Y 1 H ALA 233 ? B ALA 233 
40 1 Y 1 H VAL 234 ? B VAL 234 
41 1 Y 1 H ASP 235 ? B ASP 235 
42 1 Y 1 H HIS 236 ? B HIS 236 
43 1 Y 1 H HIS 237 ? B HIS 237 
44 1 Y 1 H HIS 238 ? B HIS 238 
45 1 Y 1 H HIS 239 ? B HIS 239 
46 1 Y 1 H HIS 240 ? B HIS 240 
47 1 Y 1 H HIS 241 ? B HIS 241 
48 1 Y 1 L GLY 212 ? C GLY 212 
49 1 Y 1 L GLU 213 ? C GLU 213 
50 1 Y 1 L CYS 214 ? C CYS 214 
51 1 Y 1 L GLU 215 ? C GLU 215 
52 1 Y 1 L GLN 216 ? C GLN 216 
53 1 Y 1 L LYS 217 ? C LYS 217 
54 1 Y 1 L LEU 218 ? C LEU 218 
55 1 Y 1 L ILE 219 ? C ILE 219 
56 1 Y 1 L SER 220 ? C SER 220 
57 1 Y 1 L GLU 221 ? C GLU 221 
58 1 Y 1 L GLU 222 ? C GLU 222 
59 1 Y 1 L ASP 223 ? C ASP 223 
60 1 Y 1 L LEU 224 ? C LEU 224 
61 1 Y 1 L ASN 225 ? C ASN 225 
62 1 Y 1 L SER 226 ? C SER 226 
63 1 Y 1 L ALA 227 ? C ALA 227 
64 1 Y 1 L VAL 228 ? C VAL 228 
65 1 Y 1 L ASP 229 ? C ASP 229 
66 1 Y 1 L HIS 230 ? C HIS 230 
67 1 Y 1 L HIS 231 ? C HIS 231 
68 1 Y 1 L HIS 232 ? C HIS 232 
69 1 Y 1 L HIS 233 ? C HIS 233 
70 1 Y 1 L HIS 234 ? C HIS 234 
71 1 Y 1 L HIS 235 ? C HIS 235 
# 
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  
CYS N    N N N 74  
CYS CA   C N R 75  
CYS C    C N N 76  
CYS O    O N N 77  
CYS CB   C N N 78  
CYS SG   S N N 79  
CYS OXT  O N N 80  
CYS H    H N N 81  
CYS H2   H N N 82  
CYS HA   H N N 83  
CYS HB2  H N N 84  
CYS HB3  H N N 85  
CYS HG   H N N 86  
CYS HXT  H N N 87  
GLN N    N N N 88  
GLN CA   C N S 89  
GLN C    C N N 90  
GLN O    O N N 91  
GLN CB   C N N 92  
GLN CG   C N N 93  
GLN CD   C N N 94  
GLN OE1  O N N 95  
GLN NE2  N N N 96  
GLN OXT  O N N 97  
GLN H    H N N 98  
GLN H2   H N N 99  
GLN HA   H N N 100 
GLN HB2  H N N 101 
GLN HB3  H N N 102 
GLN HG2  H N N 103 
GLN HG3  H N N 104 
GLN HE21 H N N 105 
GLN HE22 H N N 106 
GLN HXT  H N N 107 
GLU N    N N N 108 
GLU CA   C N S 109 
GLU C    C N N 110 
GLU O    O N N 111 
GLU CB   C N N 112 
GLU CG   C N N 113 
GLU CD   C N N 114 
GLU OE1  O N N 115 
GLU OE2  O N N 116 
GLU OXT  O N N 117 
GLU H    H N N 118 
GLU H2   H N N 119 
GLU HA   H N N 120 
GLU HB2  H N N 121 
GLU HB3  H N N 122 
GLU HG2  H N N 123 
GLU HG3  H N N 124 
GLU HE2  H N N 125 
GLU HXT  H N N 126 
GLY N    N N N 127 
GLY CA   C N N 128 
GLY C    C N N 129 
GLY O    O N N 130 
GLY OXT  O N N 131 
GLY H    H N N 132 
GLY H2   H N N 133 
GLY HA2  H N N 134 
GLY HA3  H N N 135 
GLY HXT  H N N 136 
GOL C1   C N N 137 
GOL O1   O N N 138 
GOL C2   C N N 139 
GOL O2   O N N 140 
GOL C3   C N N 141 
GOL O3   O N N 142 
GOL H11  H N N 143 
GOL H12  H N N 144 
GOL HO1  H N N 145 
GOL H2   H N N 146 
GOL HO2  H N N 147 
GOL H31  H N N 148 
GOL H32  H N N 149 
GOL HO3  H N N 150 
HIS N    N N N 151 
HIS CA   C N S 152 
HIS C    C N N 153 
HIS O    O N N 154 
HIS CB   C N N 155 
HIS CG   C Y N 156 
HIS ND1  N Y N 157 
HIS CD2  C Y N 158 
HIS CE1  C Y N 159 
HIS NE2  N Y N 160 
HIS OXT  O N N 161 
HIS H    H N N 162 
HIS H2   H N N 163 
HIS HA   H N N 164 
HIS HB2  H N N 165 
HIS HB3  H N N 166 
HIS HD1  H N N 167 
HIS HD2  H N N 168 
HIS HE1  H N N 169 
HIS HE2  H N N 170 
HIS HXT  H N N 171 
HOH O    O N N 172 
HOH H1   H N N 173 
HOH H2   H N N 174 
ILE N    N N N 175 
ILE CA   C N S 176 
ILE C    C N N 177 
ILE O    O N N 178 
ILE CB   C N S 179 
ILE CG1  C N N 180 
ILE CG2  C N N 181 
ILE CD1  C N N 182 
ILE OXT  O N N 183 
ILE H    H N N 184 
ILE H2   H N N 185 
ILE HA   H N N 186 
ILE HB   H N N 187 
ILE HG12 H N N 188 
ILE HG13 H N N 189 
ILE HG21 H N N 190 
ILE HG22 H N N 191 
ILE HG23 H N N 192 
ILE HD11 H N N 193 
ILE HD12 H N N 194 
ILE HD13 H N N 195 
ILE HXT  H N N 196 
LEU N    N N N 197 
LEU CA   C N S 198 
LEU C    C N N 199 
LEU O    O N N 200 
LEU CB   C N N 201 
LEU CG   C N N 202 
LEU CD1  C N N 203 
LEU CD2  C N N 204 
LEU OXT  O N N 205 
LEU H    H N N 206 
LEU H2   H N N 207 
LEU HA   H N N 208 
LEU HB2  H N N 209 
LEU HB3  H N N 210 
LEU HG   H N N 211 
LEU HD11 H N N 212 
LEU HD12 H N N 213 
LEU HD13 H N N 214 
LEU HD21 H N N 215 
LEU HD22 H N N 216 
LEU HD23 H N N 217 
LEU HXT  H N N 218 
LYS N    N N N 219 
LYS CA   C N S 220 
LYS C    C N N 221 
LYS O    O N N 222 
LYS CB   C N N 223 
LYS CG   C N N 224 
LYS CD   C N N 225 
LYS CE   C N N 226 
LYS NZ   N N N 227 
LYS OXT  O N N 228 
LYS H    H N N 229 
LYS H2   H N N 230 
LYS HA   H N N 231 
LYS HB2  H N N 232 
LYS HB3  H N N 233 
LYS HG2  H N N 234 
LYS HG3  H N N 235 
LYS HD2  H N N 236 
LYS HD3  H N N 237 
LYS HE2  H N N 238 
LYS HE3  H N N 239 
LYS HZ1  H N N 240 
LYS HZ2  H N N 241 
LYS HZ3  H N N 242 
LYS HXT  H N N 243 
MET N    N N N 244 
MET CA   C N S 245 
MET C    C N N 246 
MET O    O N N 247 
MET CB   C N N 248 
MET CG   C N N 249 
MET SD   S N N 250 
MET CE   C N N 251 
MET OXT  O N N 252 
MET H    H N N 253 
MET H2   H N N 254 
MET HA   H N N 255 
MET HB2  H N N 256 
MET HB3  H N N 257 
MET HG2  H N N 258 
MET HG3  H N N 259 
MET HE1  H N N 260 
MET HE2  H N N 261 
MET HE3  H N N 262 
MET HXT  H N N 263 
NO3 N    N N N 264 
NO3 O1   O N N 265 
NO3 O2   O N N 266 
NO3 O3   O N N 267 
PHE N    N N N 268 
PHE CA   C N S 269 
PHE C    C N N 270 
PHE O    O N N 271 
PHE CB   C N N 272 
PHE CG   C Y N 273 
PHE CD1  C Y N 274 
PHE CD2  C Y N 275 
PHE CE1  C Y N 276 
PHE CE2  C Y N 277 
PHE CZ   C Y N 278 
PHE OXT  O N N 279 
PHE H    H N N 280 
PHE H2   H N N 281 
PHE HA   H N N 282 
PHE HB2  H N N 283 
PHE HB3  H N N 284 
PHE HD1  H N N 285 
PHE HD2  H N N 286 
PHE HE1  H N N 287 
PHE HE2  H N N 288 
PHE HZ   H N N 289 
PHE HXT  H N N 290 
PRO N    N N N 291 
PRO CA   C N S 292 
PRO C    C N N 293 
PRO O    O N N 294 
PRO CB   C N N 295 
PRO CG   C N N 296 
PRO CD   C N N 297 
PRO OXT  O N N 298 
PRO H    H N N 299 
PRO HA   H N N 300 
PRO HB2  H N N 301 
PRO HB3  H N N 302 
PRO HG2  H N N 303 
PRO HG3  H N N 304 
PRO HD2  H N N 305 
PRO HD3  H N N 306 
PRO HXT  H N N 307 
SER N    N N N 308 
SER CA   C N S 309 
SER C    C N N 310 
SER O    O N N 311 
SER CB   C N N 312 
SER OG   O N N 313 
SER OXT  O N N 314 
SER H    H N N 315 
SER H2   H N N 316 
SER HA   H N N 317 
SER HB2  H N N 318 
SER HB3  H N N 319 
SER HG   H N N 320 
SER HXT  H N N 321 
THR N    N N N 322 
THR CA   C N S 323 
THR C    C N N 324 
THR O    O N N 325 
THR CB   C N R 326 
THR OG1  O N N 327 
THR CG2  C N N 328 
THR OXT  O N N 329 
THR H    H N N 330 
THR H2   H N N 331 
THR HA   H N N 332 
THR HB   H N N 333 
THR HG1  H N N 334 
THR HG21 H N N 335 
THR HG22 H N N 336 
THR HG23 H N N 337 
THR HXT  H N N 338 
TRP N    N N N 339 
TRP CA   C N S 340 
TRP C    C N N 341 
TRP O    O N N 342 
TRP CB   C N N 343 
TRP CG   C Y N 344 
TRP CD1  C Y N 345 
TRP CD2  C Y N 346 
TRP NE1  N Y N 347 
TRP CE2  C Y N 348 
TRP CE3  C Y N 349 
TRP CZ2  C Y N 350 
TRP CZ3  C Y N 351 
TRP CH2  C Y N 352 
TRP OXT  O N N 353 
TRP H    H N N 354 
TRP H2   H N N 355 
TRP HA   H N N 356 
TRP HB2  H N N 357 
TRP HB3  H N N 358 
TRP HD1  H N N 359 
TRP HE1  H N N 360 
TRP HE3  H N N 361 
TRP HZ2  H N N 362 
TRP HZ3  H N N 363 
TRP HH2  H N N 364 
TRP HXT  H N N 365 
TYR N    N N N 366 
TYR CA   C N S 367 
TYR C    C N N 368 
TYR O    O N N 369 
TYR CB   C N N 370 
TYR CG   C Y N 371 
TYR CD1  C Y N 372 
TYR CD2  C Y N 373 
TYR CE1  C Y N 374 
TYR CE2  C Y N 375 
TYR CZ   C Y N 376 
TYR OH   O N N 377 
TYR OXT  O N N 378 
TYR H    H N N 379 
TYR H2   H N N 380 
TYR HA   H N N 381 
TYR HB2  H N N 382 
TYR HB3  H N N 383 
TYR HD1  H N N 384 
TYR HD2  H N N 385 
TYR HE1  H N N 386 
TYR HE2  H N N 387 
TYR HH   H N N 388 
TYR HXT  H N N 389 
VAL N    N N N 390 
VAL CA   C N S 391 
VAL C    C N N 392 
VAL O    O N N 393 
VAL CB   C N N 394 
VAL CG1  C N N 395 
VAL CG2  C N N 396 
VAL OXT  O N N 397 
VAL H    H N N 398 
VAL H2   H N N 399 
VAL HA   H N N 400 
VAL HB   H N N 401 
VAL HG11 H N N 402 
VAL HG12 H N N 403 
VAL HG13 H N N 404 
VAL HG21 H N N 405 
VAL HG22 H N N 406 
VAL HG23 H N N 407 
VAL HXT  H N N 408 
# 
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 
GOL C1  O1   sing N N 129 
GOL C1  C2   sing N N 130 
GOL C1  H11  sing N N 131 
GOL C1  H12  sing N N 132 
GOL O1  HO1  sing N N 133 
GOL C2  O2   sing N N 134 
GOL C2  C3   sing N N 135 
GOL C2  H2   sing N N 136 
GOL O2  HO2  sing N N 137 
GOL C3  O3   sing N N 138 
GOL C3  H31  sing N N 139 
GOL C3  H32  sing N N 140 
GOL O3  HO3  sing N N 141 
HIS N   CA   sing N N 142 
HIS N   H    sing N N 143 
HIS N   H2   sing N N 144 
HIS CA  C    sing N N 145 
HIS CA  CB   sing N N 146 
HIS CA  HA   sing N N 147 
HIS C   O    doub N N 148 
HIS C   OXT  sing N N 149 
HIS CB  CG   sing N N 150 
HIS CB  HB2  sing N N 151 
HIS CB  HB3  sing N N 152 
HIS CG  ND1  sing Y N 153 
HIS CG  CD2  doub Y N 154 
HIS ND1 CE1  doub Y N 155 
HIS ND1 HD1  sing N N 156 
HIS CD2 NE2  sing Y N 157 
HIS CD2 HD2  sing N N 158 
HIS CE1 NE2  sing Y N 159 
HIS CE1 HE1  sing N N 160 
HIS NE2 HE2  sing N N 161 
HIS OXT HXT  sing N N 162 
HOH O   H1   sing N N 163 
HOH O   H2   sing N N 164 
ILE N   CA   sing N N 165 
ILE N   H    sing N N 166 
ILE N   H2   sing N N 167 
ILE CA  C    sing N N 168 
ILE CA  CB   sing N N 169 
ILE CA  HA   sing N N 170 
ILE C   O    doub N N 171 
ILE C   OXT  sing N N 172 
ILE CB  CG1  sing N N 173 
ILE CB  CG2  sing N N 174 
ILE CB  HB   sing N N 175 
ILE CG1 CD1  sing N N 176 
ILE CG1 HG12 sing N N 177 
ILE CG1 HG13 sing N N 178 
ILE CG2 HG21 sing N N 179 
ILE CG2 HG22 sing N N 180 
ILE CG2 HG23 sing N N 181 
ILE CD1 HD11 sing N N 182 
ILE CD1 HD12 sing N N 183 
ILE CD1 HD13 sing N N 184 
ILE OXT HXT  sing N N 185 
LEU N   CA   sing N N 186 
LEU N   H    sing N N 187 
LEU N   H2   sing N N 188 
LEU CA  C    sing N N 189 
LEU CA  CB   sing N N 190 
LEU CA  HA   sing N N 191 
LEU C   O    doub N N 192 
LEU C   OXT  sing N N 193 
LEU CB  CG   sing N N 194 
LEU CB  HB2  sing N N 195 
LEU CB  HB3  sing N N 196 
LEU CG  CD1  sing N N 197 
LEU CG  CD2  sing N N 198 
LEU CG  HG   sing N N 199 
LEU CD1 HD11 sing N N 200 
LEU CD1 HD12 sing N N 201 
LEU CD1 HD13 sing N N 202 
LEU CD2 HD21 sing N N 203 
LEU CD2 HD22 sing N N 204 
LEU CD2 HD23 sing N N 205 
LEU OXT HXT  sing N N 206 
LYS N   CA   sing N N 207 
LYS N   H    sing N N 208 
LYS N   H2   sing N N 209 
LYS CA  C    sing N N 210 
LYS CA  CB   sing N N 211 
LYS CA  HA   sing N N 212 
LYS C   O    doub N N 213 
LYS C   OXT  sing N N 214 
LYS CB  CG   sing N N 215 
LYS CB  HB2  sing N N 216 
LYS CB  HB3  sing N N 217 
LYS CG  CD   sing N N 218 
LYS CG  HG2  sing N N 219 
LYS CG  HG3  sing N N 220 
LYS CD  CE   sing N N 221 
LYS CD  HD2  sing N N 222 
LYS CD  HD3  sing N N 223 
LYS CE  NZ   sing N N 224 
LYS CE  HE2  sing N N 225 
LYS CE  HE3  sing N N 226 
LYS NZ  HZ1  sing N N 227 
LYS NZ  HZ2  sing N N 228 
LYS NZ  HZ3  sing N N 229 
LYS OXT HXT  sing N N 230 
MET N   CA   sing N N 231 
MET N   H    sing N N 232 
MET N   H2   sing N N 233 
MET CA  C    sing N N 234 
MET CA  CB   sing N N 235 
MET CA  HA   sing N N 236 
MET C   O    doub N N 237 
MET C   OXT  sing N N 238 
MET CB  CG   sing N N 239 
MET CB  HB2  sing N N 240 
MET CB  HB3  sing N N 241 
MET CG  SD   sing N N 242 
MET CG  HG2  sing N N 243 
MET CG  HG3  sing N N 244 
MET SD  CE   sing N N 245 
MET CE  HE1  sing N N 246 
MET CE  HE2  sing N N 247 
MET CE  HE3  sing N N 248 
MET OXT HXT  sing N N 249 
NO3 N   O1   doub N N 250 
NO3 N   O2   sing N N 251 
NO3 N   O3   sing N N 252 
PHE N   CA   sing N N 253 
PHE N   H    sing N N 254 
PHE N   H2   sing N N 255 
PHE CA  C    sing N N 256 
PHE CA  CB   sing N N 257 
PHE CA  HA   sing N N 258 
PHE C   O    doub N N 259 
PHE C   OXT  sing N N 260 
PHE CB  CG   sing N N 261 
PHE CB  HB2  sing N N 262 
PHE CB  HB3  sing N N 263 
PHE CG  CD1  doub Y N 264 
PHE CG  CD2  sing Y N 265 
PHE CD1 CE1  sing Y N 266 
PHE CD1 HD1  sing N N 267 
PHE CD2 CE2  doub Y N 268 
PHE CD2 HD2  sing N N 269 
PHE CE1 CZ   doub Y N 270 
PHE CE1 HE1  sing N N 271 
PHE CE2 CZ   sing Y N 272 
PHE CE2 HE2  sing N N 273 
PHE CZ  HZ   sing N N 274 
PHE OXT HXT  sing N N 275 
PRO N   CA   sing N N 276 
PRO N   CD   sing N N 277 
PRO N   H    sing N N 278 
PRO CA  C    sing N N 279 
PRO CA  CB   sing N N 280 
PRO CA  HA   sing N N 281 
PRO C   O    doub N N 282 
PRO C   OXT  sing N N 283 
PRO CB  CG   sing N N 284 
PRO CB  HB2  sing N N 285 
PRO CB  HB3  sing N N 286 
PRO CG  CD   sing N N 287 
PRO CG  HG2  sing N N 288 
PRO CG  HG3  sing N N 289 
PRO CD  HD2  sing N N 290 
PRO CD  HD3  sing N N 291 
PRO OXT HXT  sing N N 292 
SER N   CA   sing N N 293 
SER N   H    sing N N 294 
SER N   H2   sing N N 295 
SER CA  C    sing N N 296 
SER CA  CB   sing N N 297 
SER CA  HA   sing N N 298 
SER C   O    doub N N 299 
SER C   OXT  sing N N 300 
SER CB  OG   sing N N 301 
SER CB  HB2  sing N N 302 
SER CB  HB3  sing N N 303 
SER OG  HG   sing N N 304 
SER OXT HXT  sing N N 305 
THR N   CA   sing N N 306 
THR N   H    sing N N 307 
THR N   H2   sing N N 308 
THR CA  C    sing N N 309 
THR CA  CB   sing N N 310 
THR CA  HA   sing N N 311 
THR C   O    doub N N 312 
THR C   OXT  sing N N 313 
THR CB  OG1  sing N N 314 
THR CB  CG2  sing N N 315 
THR CB  HB   sing N N 316 
THR OG1 HG1  sing N N 317 
THR CG2 HG21 sing N N 318 
THR CG2 HG22 sing N N 319 
THR CG2 HG23 sing N N 320 
THR OXT HXT  sing N N 321 
TRP N   CA   sing N N 322 
TRP N   H    sing N N 323 
TRP N   H2   sing N N 324 
TRP CA  C    sing N N 325 
TRP CA  CB   sing N N 326 
TRP CA  HA   sing N N 327 
TRP C   O    doub N N 328 
TRP C   OXT  sing N N 329 
TRP CB  CG   sing N N 330 
TRP CB  HB2  sing N N 331 
TRP CB  HB3  sing N N 332 
TRP CG  CD1  doub Y N 333 
TRP CG  CD2  sing Y N 334 
TRP CD1 NE1  sing Y N 335 
TRP CD1 HD1  sing N N 336 
TRP CD2 CE2  doub Y N 337 
TRP CD2 CE3  sing Y N 338 
TRP NE1 CE2  sing Y N 339 
TRP NE1 HE1  sing N N 340 
TRP CE2 CZ2  sing Y N 341 
TRP CE3 CZ3  doub Y N 342 
TRP CE3 HE3  sing N N 343 
TRP CZ2 CH2  doub Y N 344 
TRP CZ2 HZ2  sing N N 345 
TRP CZ3 CH2  sing Y N 346 
TRP CZ3 HZ3  sing N N 347 
TRP CH2 HH2  sing N N 348 
TRP OXT HXT  sing N N 349 
TYR N   CA   sing N N 350 
TYR N   H    sing N N 351 
TYR N   H2   sing N N 352 
TYR CA  C    sing N N 353 
TYR CA  CB   sing N N 354 
TYR CA  HA   sing N N 355 
TYR C   O    doub N N 356 
TYR C   OXT  sing N N 357 
TYR CB  CG   sing N N 358 
TYR CB  HB2  sing N N 359 
TYR CB  HB3  sing N N 360 
TYR CG  CD1  doub Y N 361 
TYR CG  CD2  sing Y N 362 
TYR CD1 CE1  sing Y N 363 
TYR CD1 HD1  sing N N 364 
TYR CD2 CE2  doub Y N 365 
TYR CD2 HD2  sing N N 366 
TYR CE1 CZ   doub Y N 367 
TYR CE1 HE1  sing N N 368 
TYR CE2 CZ   sing Y N 369 
TYR CE2 HE2  sing N N 370 
TYR CZ  OH   sing N N 371 
TYR OH  HH   sing N N 372 
TYR OXT HXT  sing N N 373 
VAL N   CA   sing N N 374 
VAL N   H    sing N N 375 
VAL N   H2   sing N N 376 
VAL CA  C    sing N N 377 
VAL CA  CB   sing N N 378 
VAL CA  HA   sing N N 379 
VAL C   O    doub N N 380 
VAL C   OXT  sing N N 381 
VAL CB  CG1  sing N N 382 
VAL CB  CG2  sing N N 383 
VAL CB  HB   sing N N 384 
VAL CG1 HG11 sing N N 385 
VAL CG1 HG12 sing N N 386 
VAL CG1 HG13 sing N N 387 
VAL CG2 HG21 sing N N 388 
VAL CG2 HG22 sing N N 389 
VAL CG2 HG23 sing N N 390 
VAL OXT HXT  sing N N 391 
# 
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                    8Z3A 
_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]   0.014415 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.011906 
_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]   0.007883 
_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 
N 
O 
S 
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
ATOM   1    N N   . LEU A 1 11  ? 7.537   -9.769  12.698  1.00 46.37 ? 39  LEU A N   1 
ATOM   2    C CA  . LEU A 1 11  ? 7.504   -10.915 11.675  1.00 43.30 ? 39  LEU A CA  1 
ATOM   3    C C   . LEU A 1 11  ? 8.394   -10.551 10.478  1.00 38.74 ? 39  LEU A C   1 
ATOM   4    O O   . LEU A 1 11  ? 8.218   -9.423  9.946   1.00 38.92 ? 39  LEU A O   1 
ATOM   5    C CB  . LEU A 1 11  ? 6.075   -11.117 11.166  1.00 45.28 ? 39  LEU A CB  1 
ATOM   6    C CG  . LEU A 1 11  ? 4.975   -11.462 12.171  1.00 50.01 ? 39  LEU A CG  1 
ATOM   7    C CD1 . LEU A 1 11  ? 3.613   -10.977 11.644  1.00 50.97 ? 39  LEU A CD1 1 
ATOM   8    C CD2 . LEU A 1 11  ? 4.934   -12.961 12.436  1.00 49.03 ? 39  LEU A CD2 1 
ATOM   9    N N   . THR A 1 12  ? 9.321   -11.417 10.067  1.00 34.94 ? 40  THR A N   1 
ATOM   10   C CA  . THR A 1 12  ? 10.183  -11.108 8.894   1.00 32.86 ? 40  THR A CA  1 
ATOM   11   C C   . THR A 1 12  ? 9.692   -11.916 7.683   1.00 28.03 ? 40  THR A C   1 
ATOM   12   O O   . THR A 1 12  ? 9.482   -13.137 7.705   1.00 24.25 ? 40  THR A O   1 
ATOM   13   C CB  . THR A 1 12  ? 11.678  -11.218 9.195   1.00 35.84 ? 40  THR A CB  1 
ATOM   14   O OG1 . THR A 1 12  ? 12.035  -12.582 9.247   1.00 38.78 ? 40  THR A OG1 1 
ATOM   15   C CG2 . THR A 1 12  ? 12.080  -10.638 10.527  1.00 37.47 ? 40  THR A CG2 1 
ATOM   16   N N   . PRO A 1 13  ? 9.532   -11.223 6.551   1.00 26.73 ? 41  PRO A N   1 
ATOM   17   C CA  . PRO A 1 13  ? 9.071   -11.885 5.330   1.00 24.32 ? 41  PRO A CA  1 
ATOM   18   C C   . PRO A 1 13  ? 10.072  -12.979 4.926   1.00 22.01 ? 41  PRO A C   1 
ATOM   19   O O   . PRO A 1 13  ? 11.253  -12.813 5.229   1.00 21.69 ? 41  PRO A O   1 
ATOM   20   C CB  . PRO A 1 13  ? 9.060   -10.800 4.246   1.00 25.50 ? 41  PRO A CB  1 
ATOM   21   C CG  . PRO A 1 13  ? 9.357   -9.508  4.953   1.00 29.49 ? 41  PRO A CG  1 
ATOM   22   C CD  . PRO A 1 13  ? 9.886   -9.811  6.346   1.00 29.52 ? 41  PRO A CD  1 
ATOM   23   N N   . LEU A 1 14  ? 9.615   -14.033 4.248   1.00 19.51 ? 42  LEU A N   1 
ATOM   24   C CA  . LEU A 1 14  ? 10.555  -14.954 3.572   1.00 19.04 ? 42  LEU A CA  1 
ATOM   25   C C   . LEU A 1 14  ? 11.174  -14.224 2.359   1.00 19.43 ? 42  LEU A C   1 
ATOM   26   O O   . LEU A 1 14  ? 10.498  -13.343 1.755   1.00 19.83 ? 42  LEU A O   1 
ATOM   27   C CB  . LEU A 1 14  ? 9.883   -16.228 3.123   1.00 18.01 ? 42  LEU A CB  1 
ATOM   28   C CG  . LEU A 1 14  ? 9.780   -17.328 4.169   1.00 18.15 ? 42  LEU A CG  1 
ATOM   29   C CD1 . LEU A 1 14  ? 8.885   -16.917 5.336   1.00 18.83 ? 42  LEU A CD1 1 
ATOM   30   C CD2 . LEU A 1 14  ? 9.286   -18.604 3.548   1.00 17.20 ? 42  LEU A CD2 1 
ATOM   31   N N   . ALA A 1 15  ? 12.411  -14.570 2.066   1.00 19.20 ? 43  ALA A N   1 
ATOM   32   C CA  . ALA A 1 15  ? 13.172  -14.095 0.894   1.00 20.00 ? 43  ALA A CA  1 
ATOM   33   C C   . ALA A 1 15  ? 12.655  -14.869 -0.328  1.00 18.89 ? 43  ALA A C   1 
ATOM   34   O O   . ALA A 1 15  ? 12.037  -15.922 -0.190  1.00 16.61 ? 43  ALA A O   1 
ATOM   35   C CB  . ALA A 1 15  ? 14.625  -14.365 1.071   1.00 21.64 ? 43  ALA A CB  1 
ATOM   36   N N   . TYR A 1 16  ? 12.973  -14.344 -1.494  1.00 20.21 ? 44  TYR A N   1 
ATOM   37   C CA  . TYR A 1 16  ? 12.587  -14.983 -2.778  1.00 19.73 ? 44  TYR A CA  1 
ATOM   38   C C   . TYR A 1 16  ? 13.298  -16.339 -2.889  1.00 19.46 ? 44  TYR A C   1 
ATOM   39   O O   . TYR A 1 16  ? 14.506  -16.386 -2.674  1.00 20.21 ? 44  TYR A O   1 
ATOM   40   C CB  . TYR A 1 16  ? 13.074  -14.046 -3.862  1.00 21.53 ? 44  TYR A CB  1 
ATOM   41   C CG  . TYR A 1 16  ? 12.656  -14.432 -5.255  1.00 21.51 ? 44  TYR A CG  1 
ATOM   42   C CD1 . TYR A 1 16  ? 11.327  -14.486 -5.623  1.00 21.46 ? 44  TYR A CD1 1 
ATOM   43   C CD2 . TYR A 1 16  ? 13.626  -14.731 -6.196  1.00 23.14 ? 44  TYR A CD2 1 
ATOM   44   C CE1 . TYR A 1 16  ? 10.956  -14.816 -6.919  1.00 22.13 ? 44  TYR A CE1 1 
ATOM   45   C CE2 . TYR A 1 16  ? 13.261  -14.997 -7.511  1.00 24.04 ? 44  TYR A CE2 1 
ATOM   46   C CZ  . TYR A 1 16  ? 11.933  -15.073 -7.858  1.00 23.35 ? 44  TYR A CZ  1 
ATOM   47   O OH  . TYR A 1 16  ? 11.650  -15.353 -9.182  1.00 26.30 ? 44  TYR A OH  1 
ATOM   48   N N   . LYS A 1 17  ? 12.539  -17.385 -3.167  1.00 18.09 ? 45  LYS A N   1 
ATOM   49   C CA  . LYS A 1 17  ? 12.966  -18.812 -3.299  1.00 18.25 ? 45  LYS A CA  1 
ATOM   50   C C   . LYS A 1 17  ? 13.275  -19.460 -1.952  1.00 17.68 ? 45  LYS A C   1 
ATOM   51   O O   . LYS A 1 17  ? 13.632  -20.624 -1.964  1.00 17.77 ? 45  LYS A O   1 
ATOM   52   C CB  . LYS A 1 17  ? 14.093  -18.994 -4.314  1.00 19.71 ? 45  LYS A CB  1 
ATOM   53   C CG  . LYS A 1 17  ? 13.776  -18.453 -5.705  1.00 21.74 ? 45  LYS A CG  1 
ATOM   54   C CD  . LYS A 1 17  ? 12.680  -19.161 -6.468  1.00 21.34 ? 45  LYS A CD  1 
ATOM   55   C CE  . LYS A 1 17  ? 12.462  -18.459 -7.782  1.00 22.55 ? 45  LYS A CE  1 
ATOM   56   N NZ  . LYS A 1 17  ? 11.574  -19.189 -8.701  1.00 22.72 ? 45  LYS A NZ  1 
ATOM   57   N N   . GLN A 1 18  ? 13.065  -18.761 -0.858  1.00 17.37 ? 46  GLN A N   1 
ATOM   58   C CA  . GLN A 1 18  ? 13.269  -19.336 0.498   1.00 17.88 ? 46  GLN A CA  1 
ATOM   59   C C   . GLN A 1 18  ? 12.155  -20.335 0.822   1.00 16.05 ? 46  GLN A C   1 
ATOM   60   O O   . GLN A 1 18  ? 10.982  -20.060 0.456   1.00 14.88 ? 46  GLN A O   1 
ATOM   61   C CB  . GLN A 1 18  ? 13.249  -18.264 1.593   1.00 18.37 ? 46  GLN A CB  1 
ATOM   62   C CG  . GLN A 1 18  ? 13.470  -18.898 2.968   1.00 18.48 ? 46  GLN A CG  1 
ATOM   63   C CD  . GLN A 1 18  ? 13.822  -17.831 3.975   1.00 20.04 ? 46  GLN A CD  1 
ATOM   64   O OE1 . GLN A 1 18  ? 13.500  -16.651 3.778   1.00 20.41 ? 46  GLN A OE1 1 
ATOM   65   N NE2 . GLN A 1 18  ? 14.425  -18.244 5.096   1.00 20.84 ? 46  GLN A NE2 1 
ATOM   66   N N   . PHE A 1 19  ? 12.526  -21.457 1.434   1.00 16.34 ? 47  PHE A N   1 
ATOM   67   C CA  . PHE A 1 19  ? 11.574  -22.454 1.975   1.00 16.41 ? 47  PHE A CA  1 
ATOM   68   C C   . PHE A 1 19  ? 11.866  -22.712 3.460   1.00 16.42 ? 47  PHE A C   1 
ATOM   69   O O   . PHE A 1 19  ? 13.012  -22.769 3.883   1.00 17.35 ? 47  PHE A O   1 
ATOM   70   C CB  . PHE A 1 19  ? 11.596  -23.745 1.171   1.00 17.44 ? 47  PHE A CB  1 
ATOM   71   C CG  . PHE A 1 19  ? 12.943  -24.296 0.864   1.00 19.94 ? 47  PHE A CG  1 
ATOM   72   C CD1 . PHE A 1 19  ? 13.658  -23.881 -0.257  1.00 21.54 ? 47  PHE A CD1 1 
ATOM   73   C CD2 . PHE A 1 19  ? 13.503  -25.276 1.675   1.00 21.12 ? 47  PHE A CD2 1 
ATOM   74   C CE1 . PHE A 1 19  ? 14.925  -24.360 -0.515  1.00 24.39 ? 47  PHE A CE1 1 
ATOM   75   C CE2 . PHE A 1 19  ? 14.707  -25.854 1.344   1.00 23.53 ? 47  PHE A CE2 1 
ATOM   76   C CZ  . PHE A 1 19  ? 15.464  -25.357 0.290   1.00 26.01 ? 47  PHE A CZ  1 
ATOM   77   N N   . ILE A 1 20  ? 10.781  -22.844 4.211   1.00 16.11 ? 48  ILE A N   1 
ATOM   78   C CA  A ILE A 1 20  ? 10.791  -23.038 5.683   0.50 16.52 ? 48  ILE A CA  1 
ATOM   79   C CA  B ILE A 1 20  ? 10.800  -23.045 5.682   0.50 16.20 ? 48  ILE A CA  1 
ATOM   80   C C   . ILE A 1 20  ? 9.851   -24.183 6.007   1.00 15.88 ? 48  ILE A C   1 
ATOM   81   O O   . ILE A 1 20  ? 8.672   -24.158 5.619   1.00 14.52 ? 48  ILE A O   1 
ATOM   82   C CB  A ILE A 1 20  ? 10.368  -21.753 6.399   0.50 17.08 ? 48  ILE A CB  1 
ATOM   83   C CB  B ILE A 1 20  ? 10.410  -21.756 6.411   0.50 16.32 ? 48  ILE A CB  1 
ATOM   84   C CG1 A ILE A 1 20  ? 11.456  -20.690 6.265   0.50 18.25 ? 48  ILE A CG1 1 
ATOM   85   C CG1 B ILE A 1 20  ? 11.479  -20.689 6.187   0.50 16.95 ? 48  ILE A CG1 1 
ATOM   86   C CG2 A ILE A 1 20  ? 10.027  -22.037 7.869   0.50 17.72 ? 48  ILE A CG2 1 
ATOM   87   C CG2 B ILE A 1 20  ? 10.178  -22.028 7.907   0.50 17.06 ? 48  ILE A CG2 1 
ATOM   88   C CD1 A ILE A 1 20  ? 11.090  -19.385 6.937   0.50 19.17 ? 48  ILE A CD1 1 
ATOM   89   C CD1 B ILE A 1 20  ? 12.733  -20.928 6.958   0.50 18.07 ? 48  ILE A CD1 1 
ATOM   90   N N   . PRO A 1 21  ? 10.317  -25.209 6.739   1.00 16.69 ? 49  PRO A N   1 
ATOM   91   C CA  . PRO A 1 21  ? 11.712  -25.370 7.187   1.00 18.05 ? 49  PRO A CA  1 
ATOM   92   C C   . PRO A 1 21  ? 12.679  -25.625 6.029   1.00 18.10 ? 49  PRO A C   1 
ATOM   93   O O   . PRO A 1 21  ? 12.226  -25.931 4.908   1.00 17.59 ? 49  PRO A O   1 
ATOM   94   C CB  . PRO A 1 21  ? 11.664  -26.606 8.078   1.00 18.92 ? 49  PRO A CB  1 
ATOM   95   C CG  . PRO A 1 21  ? 10.465  -27.365 7.601   1.00 18.41 ? 49  PRO A CG  1 
ATOM   96   C CD  . PRO A 1 21  ? 9.468   -26.295 7.239   1.00 17.08 ? 49  PRO A CD  1 
ATOM   97   N N   . ASN A 1 22  ? 13.967  -25.501 6.329   1.00 18.31 ? 50  ASN A N   1 
ATOM   98   C CA  . ASN A 1 22  ? 15.064  -25.439 5.352   1.00 19.46 ? 50  ASN A CA  1 
ATOM   99   C C   . ASN A 1 22  ? 15.454  -26.872 4.947   1.00 19.80 ? 50  ASN A C   1 
ATOM   100  O O   . ASN A 1 22  ? 16.628  -27.279 5.055   1.00 20.83 ? 50  ASN A O   1 
ATOM   101  C CB  . ASN A 1 22  ? 16.216  -24.590 5.916   1.00 22.13 ? 50  ASN A CB  1 
ATOM   102  C CG  . ASN A 1 22  ? 17.406  -24.566 5.013   1.00 24.41 ? 50  ASN A CG  1 
ATOM   103  O OD1 . ASN A 1 22  ? 18.561  -24.684 5.495   1.00 27.73 ? 50  ASN A OD1 1 
ATOM   104  N ND2 . ASN A 1 22  ? 17.111  -24.508 3.729   1.00 24.68 ? 50  ASN A ND2 1 
ATOM   105  N N   . VAL A 1 23  ? 14.475  -27.630 4.497   1.00 18.63 ? 51  VAL A N   1 
ATOM   106  C CA  . VAL A 1 23  ? 14.662  -29.034 4.053   1.00 20.16 ? 51  VAL A CA  1 
ATOM   107  C C   . VAL A 1 23  ? 13.681  -29.207 2.910   1.00 18.82 ? 51  VAL A C   1 
ATOM   108  O O   . VAL A 1 23  ? 12.744  -28.385 2.816   1.00 18.32 ? 51  VAL A O   1 
ATOM   109  C CB  . VAL A 1 23  ? 14.440  -30.079 5.170   1.00 20.82 ? 51  VAL A CB  1 
ATOM   110  C CG1 . VAL A 1 23  ? 15.540  -30.030 6.217   1.00 22.39 ? 51  VAL A CG1 1 
ATOM   111  C CG2 . VAL A 1 23  ? 13.069  -29.943 5.776   1.00 20.04 ? 51  VAL A CG2 1 
ATOM   112  N N   . ALA A 1 24  ? 13.836  -30.276 2.135   1.00 19.83 ? 52  ALA A N   1 
ATOM   113  C CA  . ALA A 1 24  ? 12.895  -30.561 1.015   1.00 19.67 ? 52  ALA A CA  1 
ATOM   114  C C   . ALA A 1 24  ? 11.496  -30.812 1.571   1.00 19.33 ? 52  ALA A C   1 
ATOM   115  O O   . ALA A 1 24  ? 11.363  -31.392 2.683   1.00 19.37 ? 52  ALA A O   1 
ATOM   116  C CB  . ALA A 1 24  ? 13.381  -31.715 0.196   1.00 21.89 ? 52  ALA A CB  1 
ATOM   117  N N   . GLU A 1 25  ? 10.476  -30.518 0.742   1.00 18.40 ? 53  GLU A N   1 
ATOM   118  C CA  . GLU A 1 25  ? 9.066   -30.534 1.144   1.00 18.16 ? 53  GLU A CA  1 
ATOM   119  C C   . GLU A 1 25  ? 8.672   -31.888 1.716   1.00 20.13 ? 53  GLU A C   1 
ATOM   120  O O   . GLU A 1 25  ? 7.914   -31.904 2.702   1.00 20.15 ? 53  GLU A O   1 
ATOM   121  C CB  . GLU A 1 25  ? 8.175   -30.250 -0.056  1.00 17.92 ? 53  GLU A CB  1 
ATOM   122  C CG  . GLU A 1 25  ? 6.735   -30.146 0.325   1.00 16.86 ? 53  GLU A CG  1 
ATOM   123  C CD  . GLU A 1 25  ? 5.847   -29.653 -0.823  1.00 17.04 ? 53  GLU A CD  1 
ATOM   124  O OE1 . GLU A 1 25  ? 6.259   -29.947 -1.976  1.00 18.47 ? 53  GLU A OE1 1 
ATOM   125  O OE2 . GLU A 1 25  ? 4.822   -29.000 -0.537  1.00 16.28 ? 53  GLU A OE2 1 
ATOM   126  N N   . LYS A 1 26  ? 9.074   -32.977 1.084   1.00 22.62 ? 54  LYS A N   1 
ATOM   127  C CA  . LYS A 1 26  ? 8.473   -34.302 1.392   1.00 24.77 ? 54  LYS A CA  1 
ATOM   128  C C   . LYS A 1 26  ? 9.354   -35.049 2.383   1.00 25.54 ? 54  LYS A C   1 
ATOM   129  O O   . LYS A 1 26  ? 9.161   -36.276 2.521   1.00 27.15 ? 54  LYS A O   1 
ATOM   130  C CB  . LYS A 1 26  ? 8.234   -35.049 0.076   1.00 27.99 ? 54  LYS A CB  1 
ATOM   131  C CG  . LYS A 1 26  ? 6.929   -34.657 -0.578  1.00 29.94 ? 54  LYS A CG  1 
ATOM   132  C CD  . LYS A 1 26  ? 6.736   -35.187 -1.972  1.00 33.21 ? 54  LYS A CD  1 
ATOM   133  C CE  . LYS A 1 26  ? 7.386   -34.278 -2.985  1.00 35.12 ? 54  LYS A CE  1 
ATOM   134  N NZ  . LYS A 1 26  ? 7.359   -34.937 -4.307  1.00 39.03 ? 54  LYS A NZ  1 
ATOM   135  N N   . THR A 1 27  ? 10.284  -34.370 3.045   1.00 23.59 ? 55  THR A N   1 
ATOM   136  C CA  . THR A 1 27  ? 11.119  -34.998 4.081   1.00 24.99 ? 55  THR A CA  1 
ATOM   137  C C   . THR A 1 27  ? 10.336  -35.020 5.394   1.00 24.44 ? 55  THR A C   1 
ATOM   138  O O   . THR A 1 27  ? 9.357   -34.267 5.571   1.00 23.21 ? 55  THR A O   1 
ATOM   139  C CB  . THR A 1 27  ? 12.496  -34.321 4.232   1.00 24.77 ? 55  THR A CB  1 
ATOM   140  O OG1 . THR A 1 27  ? 12.258  -32.975 4.668   1.00 22.55 ? 55  THR A OG1 1 
ATOM   141  C CG2 . THR A 1 27  ? 13.304  -34.401 2.955   1.00 25.79 ? 55  THR A CG2 1 
ATOM   142  N N   . LEU A 1 28  ? 10.815  -35.828 6.312   1.00 27.19 ? 56  LEU A N   1 
ATOM   143  C CA  . LEU A 1 28  ? 10.139  -36.122 7.597   1.00 28.59 ? 56  LEU A CA  1 
ATOM   144  C C   . LEU A 1 28  ? 9.875   -34.841 8.367   1.00 26.56 ? 56  LEU A C   1 
ATOM   145  O O   . LEU A 1 28  ? 8.837   -34.797 9.014   1.00 28.18 ? 56  LEU A O   1 
ATOM   146  C CB  . LEU A 1 28  ? 11.022  -37.037 8.444   1.00 31.69 ? 56  LEU A CB  1 
ATOM   147  C CG  . LEU A 1 28  ? 11.164  -38.464 7.924   1.00 35.18 ? 56  LEU A CG  1 
ATOM   148  C CD1 . LEU A 1 28  ? 11.877  -39.324 8.924   1.00 37.52 ? 56  LEU A CD1 1 
ATOM   149  C CD2 . LEU A 1 28  ? 9.787   -39.030 7.601   1.00 36.33 ? 56  LEU A CD2 1 
ATOM   150  N N   . GLY A 1 29  ? 10.781  -33.879 8.349   1.00 25.56 ? 57  GLY A N   1 
ATOM   151  C CA  . GLY A 1 29  ? 10.632  -32.667 9.173   1.00 24.82 ? 57  GLY A CA  1 
ATOM   152  C C   . GLY A 1 29  ? 9.863   -31.570 8.488   1.00 23.05 ? 57  GLY A C   1 
ATOM   153  O O   . GLY A 1 29  ? 9.535   -30.554 9.132   1.00 24.20 ? 57  GLY A O   1 
ATOM   154  N N   . ALA A 1 30  ? 9.430   -31.807 7.266   1.00 21.76 ? 58  ALA A N   1 
ATOM   155  C CA  . ALA A 1 30  ? 8.587   -30.853 6.528   1.00 19.78 ? 58  ALA A CA  1 
ATOM   156  C C   . ALA A 1 30  ? 7.196   -31.450 6.399   1.00 19.25 ? 58  ALA A C   1 
ATOM   157  O O   . ALA A 1 30  ? 6.562   -31.681 7.408   1.00 19.11 ? 58  ALA A O   1 
ATOM   158  C CB  . ALA A 1 30  ? 9.256   -30.551 5.213   1.00 19.72 ? 58  ALA A CB  1 
ATOM   159  N N   . SER A 1 31  ? 6.702   -31.716 5.196   1.00 18.59 ? 59  SER A N   1 
ATOM   160  C CA  . SER A 1 31  ? 5.308   -32.213 5.049   1.00 18.05 ? 59  SER A CA  1 
ATOM   161  C C   . SER A 1 31  ? 5.281   -33.730 4.896   1.00 20.61 ? 59  SER A C   1 
ATOM   162  O O   . SER A 1 31  ? 4.195   -34.326 4.938   1.00 20.68 ? 59  SER A O   1 
ATOM   163  C CB  . SER A 1 31  ? 4.678   -31.510 3.879   1.00 16.90 ? 59  SER A CB  1 
ATOM   164  O OG  . SER A 1 31  ? 4.408   -30.164 4.170   1.00 14.99 ? 59  SER A OG  1 
ATOM   165  N N   . GLY A 1 32  ? 6.453   -34.370 4.806   1.00 21.91 ? 60  GLY A N   1 
ATOM   166  C CA  . GLY A 1 32  ? 6.579   -35.829 4.708   1.00 25.42 ? 60  GLY A CA  1 
ATOM   167  C C   . GLY A 1 32  ? 6.094   -36.392 3.390   1.00 26.88 ? 60  GLY A C   1 
ATOM   168  O O   . GLY A 1 32  ? 5.721   -35.595 2.440   1.00 25.05 ? 60  GLY A O   1 
ATOM   169  N N   . ARG A 1 33  ? 6.053   -37.722 3.377   1.00 30.99 ? 61  ARG A N   1 
ATOM   170  C CA  . ARG A 1 33  ? 6.026   -38.561 2.166   1.00 35.53 ? 61  ARG A CA  1 
ATOM   171  C C   . ARG A 1 33  ? 4.704   -38.347 1.401   1.00 35.18 ? 61  ARG A C   1 
ATOM   172  O O   . ARG A 1 33  ? 3.662   -38.261 2.056   1.00 33.01 ? 61  ARG A O   1 
ATOM   173  C CB  . ARG A 1 33  ? 6.115   -40.051 2.520   1.00 40.81 ? 61  ARG A CB  1 
ATOM   174  C CG  . ARG A 1 33  ? 6.797   -40.820 1.385   1.00 46.72 ? 61  ARG A CG  1 
ATOM   175  C CD  . ARG A 1 33  ? 6.960   -42.290 1.761   1.00 52.48 ? 61  ARG A CD  1 
ATOM   176  N NE  . ARG A 1 33  ? 5.658   -42.671 2.304   1.00 55.26 ? 61  ARG A NE  1 
ATOM   177  C CZ  . ARG A 1 33  ? 4.709   -43.329 1.644   1.00 60.16 ? 61  ARG A CZ  1 
ATOM   178  N NH1 . ARG A 1 33  ? 4.932   -43.792 0.422   1.00 63.75 ? 61  ARG A NH1 1 
ATOM   179  N NH2 . ARG A 1 33  ? 3.539   -43.548 2.228   1.00 62.00 ? 61  ARG A NH2 1 
ATOM   180  N N   . TYR A 1 34  ? 4.834   -38.275 0.086   1.00 37.51 ? 62  TYR A N   1 
ATOM   181  C CA  . TYR A 1 34  ? 3.735   -38.424 -0.900  1.00 40.38 ? 62  TYR A CA  1 
ATOM   182  C C   . TYR A 1 34  ? 3.227   -39.856 -0.763  1.00 46.34 ? 62  TYR A C   1 
ATOM   183  O O   . TYR A 1 34  ? 4.039   -40.817 -0.938  1.00 48.81 ? 62  TYR A O   1 
ATOM   184  C CB  . TYR A 1 34  ? 4.261   -38.171 -2.313  1.00 41.64 ? 62  TYR A CB  1 
ATOM   185  C CG  . TYR A 1 34  ? 3.225   -38.346 -3.394  1.00 42.69 ? 62  TYR A CG  1 
ATOM   186  C CD1 . TYR A 1 34  ? 2.310   -37.348 -3.659  1.00 40.66 ? 62  TYR A CD1 1 
ATOM   187  C CD2 . TYR A 1 34  ? 3.158   -39.511 -4.147  1.00 46.41 ? 62  TYR A CD2 1 
ATOM   188  C CE1 . TYR A 1 34  ? 1.383   -37.480 -4.677  1.00 42.23 ? 62  TYR A CE1 1 
ATOM   189  C CE2 . TYR A 1 34  ? 2.197   -39.681 -5.134  1.00 47.70 ? 62  TYR A CE2 1 
ATOM   190  C CZ  . TYR A 1 34  ? 1.321   -38.649 -5.416  1.00 45.33 ? 62  TYR A CZ  1 
ATOM   191  O OH  . TYR A 1 34  ? 0.358   -38.773 -6.372  1.00 46.34 ? 62  TYR A OH  1 
ATOM   192  N N   . GLU A 1 35  ? 1.947   -39.993 -0.413  1.00 48.96 ? 63  GLU A N   1 
ATOM   193  C CA  . GLU A 1 35  ? 1.301   -41.305 -0.135  1.00 53.65 ? 63  GLU A CA  1 
ATOM   194  C C   . GLU A 1 35  ? 0.719   -41.842 -1.450  1.00 54.10 ? 63  GLU A C   1 
ATOM   195  O O   . GLU A 1 35  ? 0.958   -43.053 -1.778  1.00 59.82 ? 63  GLU A O   1 
ATOM   196  C CB  . GLU A 1 35  ? 0.337   -41.116 1.043   1.00 55.21 ? 63  GLU A CB  1 
ATOM   197  C CG  . GLU A 1 35  ? 1.103   -41.061 2.360   1.00 57.99 ? 63  GLU A CG  1 
ATOM   198  C CD  . GLU A 1 35  ? 0.290   -40.796 3.620   1.00 60.75 ? 63  GLU A CD  1 
ATOM   199  O OE1 . GLU A 1 35  ? -0.949  -40.952 3.569   1.00 64.87 ? 63  GLU A OE1 1 
ATOM   200  O OE2 . GLU A 1 35  ? 0.908   -40.451 4.658   1.00 61.81 ? 63  GLU A OE2 1 
ATOM   201  N N   . GLY A 1 36  ? 0.035   -40.977 -2.202  1.00 49.84 ? 64  GLY A N   1 
ATOM   202  C CA  . GLY A 1 36  ? -0.502  -41.276 -3.548  1.00 49.94 ? 64  GLY A CA  1 
ATOM   203  C C   . GLY A 1 36  ? -1.562  -40.255 -3.972  1.00 46.62 ? 64  GLY A C   1 
ATOM   204  O O   . GLY A 1 36  ? -2.141  -39.597 -3.090  1.00 43.50 ? 64  GLY A O   1 
ATOM   205  N N   . LYS A 1 37  ? -1.837  -40.192 -5.270  1.00 46.82 ? 65  LYS A N   1 
ATOM   206  C CA  . LYS A 1 37  ? -2.792  -39.257 -5.909  1.00 46.87 ? 65  LYS A CA  1 
ATOM   207  C C   . LYS A 1 37  ? -4.221  -39.557 -5.438  1.00 45.43 ? 65  LYS A C   1 
ATOM   208  O O   . LYS A 1 37  ? -4.581  -40.705 -5.412  1.00 47.50 ? 65  LYS A O   1 
ATOM   209  C CB  . LYS A 1 37  ? -2.591  -39.380 -7.417  1.00 51.72 ? 65  LYS A CB  1 
ATOM   210  C CG  . LYS A 1 37  ? -3.676  -38.798 -8.315  1.00 55.31 ? 65  LYS A CG  1 
ATOM   211  C CD  . LYS A 1 37  ? -3.264  -38.813 -9.799  1.00 60.34 ? 65  LYS A CD  1 
ATOM   212  C CE  . LYS A 1 37  ? -1.994  -38.007 -10.050 1.00 61.95 ? 65  LYS A CE  1 
ATOM   213  N NZ  . LYS A 1 37  ? -1.959  -37.386 -11.400 1.00 64.00 ? 65  LYS A NZ  1 
ATOM   214  N N   . ILE A 1 38  ? -5.019  -38.547 -5.077  1.00 41.31 ? 66  ILE A N   1 
ATOM   215  C CA  . ILE A 1 38  ? -6.444  -38.739 -4.728  1.00 41.68 ? 66  ILE A CA  1 
ATOM   216  C C   . ILE A 1 38  ? -7.264  -38.372 -5.974  1.00 43.05 ? 66  ILE A C   1 
ATOM   217  O O   . ILE A 1 38  ? -7.152  -37.194 -6.434  1.00 38.33 ? 66  ILE A O   1 
ATOM   218  C CB  . ILE A 1 38  ? -6.832  -37.910 -3.489  1.00 39.17 ? 66  ILE A CB  1 
ATOM   219  C CG1 . ILE A 1 38  ? -6.029  -38.313 -2.246  1.00 38.72 ? 66  ILE A CG1 1 
ATOM   220  C CG2 . ILE A 1 38  ? -8.342  -37.987 -3.240  1.00 39.36 ? 66  ILE A CG2 1 
ATOM   221  C CD1 . ILE A 1 38  ? -6.437  -37.596 -0.993  1.00 36.60 ? 66  ILE A CD1 1 
ATOM   222  N N   . SER A 1 39  ? -8.071  -39.312 -6.469  1.00 47.02 ? 67  SER A N   1 
ATOM   223  C CA  . SER A 1 39  ? -8.967  -39.132 -7.644  1.00 50.49 ? 67  SER A CA  1 
ATOM   224  C C   . SER A 1 39  ? -10.416 -38.956 -7.165  1.00 52.40 ? 67  SER A C   1 
ATOM   225  O O   . SER A 1 39  ? -10.806 -39.501 -6.080  1.00 53.55 ? 67  SER A O   1 
ATOM   226  C CB  . SER A 1 39  ? -8.866  -40.273 -8.622  1.00 54.48 ? 67  SER A CB  1 
ATOM   227  O OG  . SER A 1 39  ? -7.650  -40.188 -9.368  1.00 55.12 ? 67  SER A OG  1 
ATOM   228  N N   . ARG A 1 40  ? -11.191 -38.227 -7.967  1.00 53.36 ? 68  ARG A N   1 
ATOM   229  C CA  . ARG A 1 40  ? -12.596 -37.891 -7.616  1.00 55.83 ? 68  ARG A CA  1 
ATOM   230  C C   . ARG A 1 40  ? -13.410 -39.172 -7.403  1.00 62.20 ? 68  ARG A C   1 
ATOM   231  O O   . ARG A 1 40  ? -14.194 -39.237 -6.448  1.00 64.99 ? 68  ARG A O   1 
ATOM   232  C CB  . ARG A 1 40  ? -13.195 -36.986 -8.693  1.00 54.29 ? 68  ARG A CB  1 
ATOM   233  C CG  . ARG A 1 40  ? -14.539 -36.393 -8.312  1.00 53.39 ? 68  ARG A CG  1 
ATOM   234  C CD  . ARG A 1 40  ? -14.961 -35.398 -9.378  1.00 52.92 ? 68  ARG A CD  1 
ATOM   235  N NE  . ARG A 1 40  ? -14.251 -34.119 -9.308  1.00 47.36 ? 68  ARG A NE  1 
ATOM   236  C CZ  . ARG A 1 40  ? -14.607 -33.117 -8.522  1.00 45.23 ? 68  ARG A CZ  1 
ATOM   237  N NH1 . ARG A 1 40  ? -13.946 -31.975 -8.556  1.00 41.94 ? 68  ARG A NH1 1 
ATOM   238  N NH2 . ARG A 1 40  ? -15.625 -33.261 -7.683  1.00 46.60 ? 68  ARG A NH2 1 
ATOM   239  N N   . ASN A 1 41  ? -13.230 -40.182 -8.237  1.00 69.04 ? 69  ASN A N   1 
ATOM   240  C CA  . ASN A 1 41  ? -14.128 -41.368 -8.195  1.00 77.79 ? 69  ASN A CA  1 
ATOM   241  C C   . ASN A 1 41  ? -13.836 -42.161 -6.911  1.00 78.22 ? 69  ASN A C   1 
ATOM   242  O O   . ASN A 1 41  ? -14.617 -43.055 -6.581  1.00 80.81 ? 69  ASN A O   1 
ATOM   243  C CB  . ASN A 1 41  ? -13.977 -42.237 -9.453  1.00 83.70 ? 69  ASN A CB  1 
ATOM   244  C CG  . ASN A 1 41  ? -12.558 -42.751 -9.647  1.00 86.49 ? 69  ASN A CG  1 
ATOM   245  O OD1 . ASN A 1 41  ? -12.098 -43.623 -8.907  1.00 89.36 ? 69  ASN A OD1 1 
ATOM   246  N ND2 . ASN A 1 41  ? -11.839 -42.201 -10.618 1.00 87.16 ? 69  ASN A ND2 1 
ATOM   247  N N   . SER A 1 42  ? -12.737 -41.862 -6.216  1.00 75.59 ? 70  SER A N   1 
ATOM   248  C CA  . SER A 1 42  ? -12.079 -42.841 -5.313  1.00 76.39 ? 70  SER A CA  1 
ATOM   249  C C   . SER A 1 42  ? -12.708 -42.824 -3.909  1.00 74.44 ? 70  SER A C   1 
ATOM   250  O O   . SER A 1 42  ? -13.586 -41.939 -3.622  1.00 69.37 ? 70  SER A O   1 
ATOM   251  C CB  . SER A 1 42  ? -10.595 -42.633 -5.275  1.00 73.29 ? 70  SER A CB  1 
ATOM   252  O OG  . SER A 1 42  ? -10.236 -41.703 -4.271  1.00 73.51 ? 70  SER A OG  1 
ATOM   253  N N   . GLU A 1 43  ? -12.304 -43.847 -3.122  1.00 75.29 ? 71  GLU A N   1 
ATOM   254  C CA  . GLU A 1 43  ? -12.667 -44.054 -1.696  1.00 72.74 ? 71  GLU A CA  1 
ATOM   255  C C   . GLU A 1 43  ? -11.940 -43.002 -0.862  1.00 65.99 ? 71  GLU A C   1 
ATOM   256  O O   . GLU A 1 43  ? -12.501 -42.581 0.143   1.00 66.75 ? 71  GLU A O   1 
ATOM   257  C CB  . GLU A 1 43  ? -12.295 -45.458 -1.217  1.00 73.95 ? 71  GLU A CB  1 
ATOM   258  C CG  . GLU A 1 43  ? -13.210 -46.538 -1.754  1.00 77.12 ? 71  GLU A CG  1 
ATOM   259  C CD  . GLU A 1 43  ? -12.855 -47.939 -1.282  1.00 79.35 ? 71  GLU A CD  1 
ATOM   260  O OE1 . GLU A 1 43  ? -11.647 -48.210 -1.055  1.00 77.70 ? 71  GLU A OE1 1 
ATOM   261  O OE2 . GLU A 1 43  ? -13.783 -48.750 -1.132  1.00 82.46 ? 71  GLU A OE2 1 
ATOM   262  N N   . ARG A 1 44  ? -10.739 -42.601 -1.272  1.00 62.00 ? 72  ARG A N   1 
ATOM   263  C CA  . ARG A 1 44  ? -9.935  -41.570 -0.573  1.00 57.27 ? 72  ARG A CA  1 
ATOM   264  C C   . ARG A 1 44  ? -10.482 -40.143 -0.812  1.00 52.77 ? 72  ARG A C   1 
ATOM   265  O O   . ARG A 1 44  ? -10.013 -39.240 -0.145  1.00 46.29 ? 72  ARG A O   1 
ATOM   266  C CB  . ARG A 1 44  ? -8.481  -41.600 -1.055  1.00 57.82 ? 72  ARG A CB  1 
ATOM   267  C CG  . ARG A 1 44  ? -7.725  -42.905 -0.790  1.00 61.42 ? 72  ARG A CG  1 
ATOM   268  C CD  . ARG A 1 44  ? -6.229  -42.769 -1.079  1.00 60.82 ? 72  ARG A CD  1 
ATOM   269  N NE  . ARG A 1 44  ? -5.545  -41.753 -0.266  1.00 60.64 ? 72  ARG A NE  1 
ATOM   270  C CZ  . ARG A 1 44  ? -4.392  -41.130 -0.576  1.00 58.78 ? 72  ARG A CZ  1 
ATOM   271  N NH1 . ARG A 1 44  ? -3.885  -40.232 0.242   1.00 58.88 ? 72  ARG A NH1 1 
ATOM   272  N NH2 . ARG A 1 44  ? -3.742  -41.378 -1.697  1.00 61.17 ? 72  ARG A NH2 1 
ATOM   273  N N   . PHE A 1 45  ? -11.401 -39.917 -1.757  1.00 51.97 ? 73  PHE A N   1 
ATOM   274  C CA  . PHE A 1 45  ? -11.940 -38.562 -2.059  1.00 48.09 ? 73  PHE A CA  1 
ATOM   275  C C   . PHE A 1 45  ? -12.628 -38.040 -0.795  1.00 46.41 ? 73  PHE A C   1 
ATOM   276  O O   . PHE A 1 45  ? -12.500 -36.858 -0.531  1.00 42.14 ? 73  PHE A O   1 
ATOM   277  C CB  . PHE A 1 45  ? -12.889 -38.628 -3.262  1.00 49.39 ? 73  PHE A CB  1 
ATOM   278  C CG  . PHE A 1 45  ? -13.564 -37.340 -3.659  1.00 47.29 ? 73  PHE A CG  1 
ATOM   279  C CD1 . PHE A 1 45  ? -12.837 -36.287 -4.202  1.00 44.92 ? 73  PHE A CD1 1 
ATOM   280  C CD2 . PHE A 1 45  ? -14.934 -37.199 -3.524  1.00 48.23 ? 73  PHE A CD2 1 
ATOM   281  C CE1 . PHE A 1 45  ? -13.474 -35.113 -4.581  1.00 43.72 ? 73  PHE A CE1 1 
ATOM   282  C CE2 . PHE A 1 45  ? -15.574 -36.035 -3.928  1.00 47.38 ? 73  PHE A CE2 1 
ATOM   283  C CZ  . PHE A 1 45  ? -14.844 -34.996 -4.457  1.00 44.68 ? 73  PHE A CZ  1 
ATOM   284  N N   . LYS A 1 46  ? -13.318 -38.929 -0.059  1.00 48.40 ? 74  LYS A N   1 
ATOM   285  C CA  . LYS A 1 46  ? -14.137 -38.629 1.148   1.00 49.01 ? 74  LYS A CA  1 
ATOM   286  C C   . LYS A 1 46  ? -13.253 -37.997 2.239   1.00 45.03 ? 74  LYS A C   1 
ATOM   287  O O   . LYS A 1 46  ? -13.797 -37.319 3.148   1.00 44.68 ? 74  LYS A O   1 
ATOM   288  C CB  . LYS A 1 46  ? -14.849 -39.893 1.661   1.00 56.10 ? 74  LYS A CB  1 
ATOM   289  C CG  . LYS A 1 46  ? -14.028 -40.747 2.621   1.00 58.58 ? 74  LYS A CG  1 
ATOM   290  C CD  . LYS A 1 46  ? -14.827 -41.802 3.358   1.00 64.61 ? 74  LYS A CD  1 
ATOM   291  C CE  . LYS A 1 46  ? -13.940 -42.591 4.301   1.00 67.59 ? 74  LYS A CE  1 
ATOM   292  N NZ  . LYS A 1 46  ? -14.420 -43.979 4.471   1.00 72.63 ? 74  LYS A NZ  1 
ATOM   293  N N   . GLU A 1 47  ? -11.930 -38.147 2.140   1.00 41.36 ? 75  GLU A N   1 
ATOM   294  C CA  . GLU A 1 47  ? -10.982 -37.520 3.089   1.00 39.61 ? 75  GLU A CA  1 
ATOM   295  C C   . GLU A 1 47  ? -10.940 -36.008 2.857   1.00 35.35 ? 75  GLU A C   1 
ATOM   296  O O   . GLU A 1 47  ? -10.453 -35.277 3.713   1.00 33.63 ? 75  GLU A O   1 
ATOM   297  C CB  . GLU A 1 47  ? -9.579  -38.092 2.911   1.00 40.99 ? 75  GLU A CB  1 
ATOM   298  C CG  . GLU A 1 47  ? -9.527  -39.618 3.046   1.00 45.62 ? 75  GLU A CG  1 
ATOM   299  C CD  . GLU A 1 47  ? -8.161  -40.247 2.782   1.00 47.85 ? 75  GLU A CD  1 
ATOM   300  O OE1 . GLU A 1 47  ? -7.182  -39.489 2.640   1.00 48.72 ? 75  GLU A OE1 1 
ATOM   301  O OE2 . GLU A 1 47  ? -8.085  -41.491 2.706   1.00 50.48 ? 75  GLU A OE2 1 
ATOM   302  N N   . LEU A 1 48  ? -11.277 -35.564 1.659   1.00 33.32 ? 76  LEU A N   1 
ATOM   303  C CA  . LEU A 1 48  ? -11.162 -34.137 1.347   1.00 30.42 ? 76  LEU A CA  1 
ATOM   304  C C   . LEU A 1 48  ? -12.484 -33.473 1.738   1.00 29.95 ? 76  LEU A C   1 
ATOM   305  O O   . LEU A 1 48  ? -13.527 -34.103 1.615   1.00 30.45 ? 76  LEU A O   1 
ATOM   306  C CB  . LEU A 1 48  ? -10.844 -33.970 -0.135  1.00 30.25 ? 76  LEU A CB  1 
ATOM   307  C CG  . LEU A 1 48  ? -9.575  -34.668 -0.601  1.00 30.29 ? 76  LEU A CG  1 
ATOM   308  C CD1 . LEU A 1 48  ? -9.327  -34.353 -2.055  1.00 31.17 ? 76  LEU A CD1 1 
ATOM   309  C CD2 . LEU A 1 48  ? -8.398  -34.248 0.219   1.00 29.61 ? 76  LEU A CD2 1 
ATOM   310  N N   . THR A 1 49  ? -12.370 -32.253 2.222   1.00 28.11 ? 77  THR A N   1 
ATOM   311  C CA  . THR A 1 49  ? -13.483 -31.439 2.781   1.00 29.38 ? 77  THR A CA  1 
ATOM   312  C C   . THR A 1 49  ? -13.398 -30.067 2.105   1.00 26.53 ? 77  THR A C   1 
ATOM   313  O O   . THR A 1 49  ? -12.305 -29.560 1.883   1.00 23.16 ? 77  THR A O   1 
ATOM   314  C CB  . THR A 1 49  ? -13.344 -31.423 4.320   1.00 31.02 ? 77  THR A CB  1 
ATOM   315  O OG1 . THR A 1 49  ? -14.279 -30.548 4.927   1.00 32.61 ? 77  THR A OG1 1 
ATOM   316  C CG2 . THR A 1 49  ? -11.971 -31.015 4.812   1.00 30.62 ? 77  THR A CG2 1 
ATOM   317  N N   . PRO A 1 50  ? -14.536 -29.466 1.704   1.00 26.54 ? 78  PRO A N   1 
ATOM   318  C CA  . PRO A 1 50  ? -14.476 -28.204 0.980   1.00 25.28 ? 78  PRO A CA  1 
ATOM   319  C C   . PRO A 1 50  ? -14.382 -27.006 1.927   1.00 24.18 ? 78  PRO A C   1 
ATOM   320  O O   . PRO A 1 50  ? -15.175 -26.900 2.820   1.00 26.96 ? 78  PRO A O   1 
ATOM   321  C CB  . PRO A 1 50  ? -15.793 -28.200 0.192   1.00 27.20 ? 78  PRO A CB  1 
ATOM   322  C CG  . PRO A 1 50  ? -16.739 -29.037 1.025   1.00 29.18 ? 78  PRO A CG  1 
ATOM   323  C CD  . PRO A 1 50  ? -15.888 -30.043 1.765   1.00 28.81 ? 78  PRO A CD  1 
ATOM   324  N N   . ASN A 1 51  ? -13.551 -26.046 1.583   1.00 21.76 ? 79  ASN A N   1 
ATOM   325  C CA  . ASN A 1 51  ? -13.401 -24.804 2.363   1.00 20.96 ? 79  ASN A CA  1 
ATOM   326  C C   . ASN A 1 51  ? -14.255 -23.704 1.695   1.00 20.36 ? 79  ASN A C   1 
ATOM   327  O O   . ASN A 1 51  ? -13.856 -23.233 0.636   1.00 19.51 ? 79  ASN A O   1 
ATOM   328  C CB  . ASN A 1 51  ? -11.938 -24.460 2.502   1.00 19.62 ? 79  ASN A CB  1 
ATOM   329  C CG  . ASN A 1 51  ? -11.709 -23.302 3.422   1.00 19.85 ? 79  ASN A CG  1 
ATOM   330  O OD1 . ASN A 1 51  ? -12.537 -22.379 3.468   1.00 22.00 ? 79  ASN A OD1 1 
ATOM   331  N ND2 . ASN A 1 51  ? -10.657 -23.399 4.228   1.00 18.80 ? 79  ASN A ND2 1 
ATOM   332  N N   . TYR A 1 52  ? -15.360 -23.279 2.324   1.00 21.07 ? 80  TYR A N   1 
ATOM   333  C CA  . TYR A 1 52  ? -16.198 -22.163 1.825   1.00 21.96 ? 80  TYR A CA  1 
ATOM   334  C C   . TYR A 1 52  ? -16.109 -20.950 2.758   1.00 20.68 ? 80  TYR A C   1 
ATOM   335  O O   . TYR A 1 52  ? -17.012 -20.075 2.744   1.00 21.88 ? 80  TYR A O   1 
ATOM   336  C CB  . TYR A 1 52  ? -17.632 -22.615 1.489   1.00 24.64 ? 80  TYR A CB  1 
ATOM   337  C CG  . TYR A 1 52  ? -17.745 -23.316 0.140   1.00 26.95 ? 80  TYR A CG  1 
ATOM   338  C CD1 . TYR A 1 52  ? -17.881 -22.597 -1.045  1.00 28.47 ? 80  TYR A CD1 1 
ATOM   339  C CD2 . TYR A 1 52  ? -17.664 -24.697 0.024   1.00 29.16 ? 80  TYR A CD2 1 
ATOM   340  C CE1 . TYR A 1 52  ? -17.979 -23.220 -2.292  1.00 29.32 ? 80  TYR A CE1 1 
ATOM   341  C CE2 . TYR A 1 52  ? -17.689 -25.333 -1.219  1.00 30.54 ? 80  TYR A CE2 1 
ATOM   342  C CZ  . TYR A 1 52  ? -17.841 -24.588 -2.383  1.00 30.83 ? 80  TYR A CZ  1 
ATOM   343  O OH  . TYR A 1 52  ? -17.844 -25.208 -3.585  1.00 33.49 ? 80  TYR A OH  1 
ATOM   344  N N   . ASN A 1 53  ? -14.992 -20.795 3.431   1.00 19.08 ? 81  ASN A N   1 
ATOM   345  C CA  . ASN A 1 53  ? -14.674 -19.566 4.189   1.00 19.00 ? 81  ASN A CA  1 
ATOM   346  C C   . ASN A 1 53  ? -14.912 -18.350 3.296   1.00 19.71 ? 81  ASN A C   1 
ATOM   347  O O   . ASN A 1 53  ? -14.209 -18.213 2.292   1.00 18.50 ? 81  ASN A O   1 
ATOM   348  C CB  . ASN A 1 53  ? -13.240 -19.580 4.670   1.00 17.90 ? 81  ASN A CB  1 
ATOM   349  C CG  . ASN A 1 53  ? -12.881 -18.487 5.655   1.00 17.79 ? 81  ASN A CG  1 
ATOM   350  O OD1 . ASN A 1 53  ? -13.470 -17.409 5.688   1.00 18.90 ? 81  ASN A OD1 1 
ATOM   351  N ND2 . ASN A 1 53  ? -11.904 -18.801 6.509   1.00 17.79 ? 81  ASN A ND2 1 
ATOM   352  N N   . PRO A 1 54  ? -15.842 -17.448 3.646   1.00 20.91 ? 82  PRO A N   1 
ATOM   353  C CA  . PRO A 1 54  ? -16.135 -16.296 2.786   1.00 21.20 ? 82  PRO A CA  1 
ATOM   354  C C   . PRO A 1 54  ? -14.952 -15.319 2.734   1.00 20.39 ? 82  PRO A C   1 
ATOM   355  O O   . PRO A 1 54  ? -14.949 -14.497 1.845   1.00 19.61 ? 82  PRO A O   1 
ATOM   356  C CB  . PRO A 1 54  ? -17.393 -15.679 3.434   1.00 23.58 ? 82  PRO A CB  1 
ATOM   357  C CG  . PRO A 1 54  ? -17.299 -16.089 4.865   1.00 23.92 ? 82  PRO A CG  1 
ATOM   358  C CD  . PRO A 1 54  ? -16.702 -17.465 4.843   1.00 22.54 ? 82  PRO A CD  1 
ATOM   359  N N   . ASP A 1 55  ? -13.973 -15.414 3.638   1.00 19.47 ? 83  ASP A N   1 
ATOM   360  C CA  . ASP A 1 55  ? -12.804 -14.508 3.628   1.00 20.50 ? 83  ASP A CA  1 
ATOM   361  C C   . ASP A 1 55  ? -11.602 -15.129 2.911   1.00 18.62 ? 83  ASP A C   1 
ATOM   362  O O   . ASP A 1 55  ? -10.473 -14.707 3.179   1.00 18.82 ? 83  ASP A O   1 
ATOM   363  C CB  . ASP A 1 55  ? -12.494 -14.035 5.047   1.00 22.36 ? 83  ASP A CB  1 
ATOM   364  C CG  . ASP A 1 55  ? -13.621 -13.156 5.534   1.00 24.92 ? 83  ASP A CG  1 
ATOM   365  O OD1 . ASP A 1 55  ? -14.077 -12.305 4.763   1.00 26.58 ? 83  ASP A OD1 1 
ATOM   366  O OD2 . ASP A 1 55  ? -14.080 -13.345 6.661   1.00 25.48 ? 83  ASP A OD2 1 
ATOM   367  N N   . ILE A 1 56  ? -11.815 -16.198 2.141   1.00 17.58 ? 84  ILE A N   1 
ATOM   368  C CA  . ILE A 1 56  ? -10.762 -16.783 1.264   1.00 16.45 ? 84  ILE A CA  1 
ATOM   369  C C   . ILE A 1 56  ? -11.269 -16.740 -0.177  1.00 16.78 ? 84  ILE A C   1 
ATOM   370  O O   . ILE A 1 56  ? -12.360 -17.244 -0.421  1.00 17.55 ? 84  ILE A O   1 
ATOM   371  C CB  . ILE A 1 56  ? -10.307 -18.200 1.674   1.00 16.06 ? 84  ILE A CB  1 
ATOM   372  C CG1 . ILE A 1 56  ? -9.905  -18.314 3.156   1.00 15.50 ? 84  ILE A CG1 1 
ATOM   373  C CG2 . ILE A 1 56  ? -9.186  -18.606 0.718   1.00 15.25 ? 84  ILE A CG2 1 
ATOM   374  C CD1 . ILE A 1 56  ? -9.656  -19.747 3.621   1.00 15.39 ? 84  ILE A CD1 1 
ATOM   375  N N   . ILE A 1 57  ? -10.491 -16.113 -1.060  1.00 16.14 ? 85  ILE A N   1 
ATOM   376  C CA  . ILE A 1 57  ? -10.819 -16.024 -2.503  1.00 17.37 ? 85  ILE A CA  1 
ATOM   377  C C   . ILE A 1 57  ? -10.240 -17.267 -3.158  1.00 16.07 ? 85  ILE A C   1 
ATOM   378  O O   . ILE A 1 57  ? -9.079  -17.562 -2.892  1.00 16.68 ? 85  ILE A O   1 
ATOM   379  C CB  . ILE A 1 57  ? -10.188 -14.761 -3.107  1.00 18.69 ? 85  ILE A CB  1 
ATOM   380  C CG1 . ILE A 1 57  ? -10.730 -13.524 -2.385  1.00 21.00 ? 85  ILE A CG1 1 
ATOM   381  C CG2 . ILE A 1 57  ? -10.436 -14.726 -4.638  1.00 19.62 ? 85  ILE A CG2 1 
ATOM   382  C CD1 . ILE A 1 57  ? -12.260 -13.458 -2.351  1.00 23.60 ? 85  ILE A CD1 1 
ATOM   383  N N   . PHE A 1 58  ? -11.041 -17.990 -3.907  1.00 16.46 ? 86  PHE A N   1 
ATOM   384  C CA  . PHE A 1 58  ? -10.550 -19.187 -4.654  1.00 15.89 ? 86  PHE A CA  1 
ATOM   385  C C   . PHE A 1 58  ? -10.642 -18.801 -6.130  1.00 16.25 ? 86  PHE A C   1 
ATOM   386  O O   . PHE A 1 58  ? -11.725 -18.451 -6.644  1.00 16.47 ? 86  PHE A O   1 
ATOM   387  C CB  . PHE A 1 58  ? -11.316 -20.478 -4.325  1.00 16.33 ? 86  PHE A CB  1 
ATOM   388  C CG  . PHE A 1 58  ? -10.976 -21.037 -2.952  1.00 16.05 ? 86  PHE A CG  1 
ATOM   389  C CD1 . PHE A 1 58  ? -10.027 -22.020 -2.797  1.00 15.71 ? 86  PHE A CD1 1 
ATOM   390  C CD2 . PHE A 1 58  ? -11.583 -20.500 -1.815  1.00 16.12 ? 86  PHE A CD2 1 
ATOM   391  C CE1 . PHE A 1 58  ? -9.732  -22.567 -1.562  1.00 15.63 ? 86  PHE A CE1 1 
ATOM   392  C CE2 . PHE A 1 58  ? -11.304 -21.051 -0.568  1.00 16.23 ? 86  PHE A CE2 1 
ATOM   393  C CZ  . PHE A 1 58  ? -10.363 -22.049 -0.436  1.00 15.83 ? 86  PHE A CZ  1 
ATOM   394  N N   . LYS A 1 59  ? -9.505  -18.838 -6.809  1.00 16.50 ? 87  LYS A N   1 
ATOM   395  C CA  . LYS A 1 59  ? -9.455  -18.452 -8.229  1.00 17.49 ? 87  LYS A CA  1 
ATOM   396  C C   . LYS A 1 59  ? -10.308 -19.388 -9.071  1.00 18.75 ? 87  LYS A C   1 
ATOM   397  O O   . LYS A 1 59  ? -10.852 -18.911 -10.112 1.00 19.29 ? 87  LYS A O   1 
ATOM   398  C CB  . LYS A 1 59  ? -7.985  -18.526 -8.658  1.00 17.53 ? 87  LYS A CB  1 
ATOM   399  C CG  . LYS A 1 59  ? -7.736  -18.056 -10.085 1.00 19.59 ? 87  LYS A CG  1 
ATOM   400  C CD  . LYS A 1 59  ? -6.241  -18.078 -10.407 1.00 19.31 ? 87  LYS A CD  1 
ATOM   401  C CE  . LYS A 1 59  ? -6.007  -17.621 -11.853 1.00 21.38 ? 87  LYS A CE  1 
ATOM   402  N NZ  . LYS A 1 59  ? -4.560  -17.621 -12.159 1.00 22.07 ? 87  LYS A NZ  1 
ATOM   403  N N   . ASP A 1 60  ? -10.376 -20.672 -8.704  1.00 19.46 ? 88  ASP A N   1 
ATOM   404  C CA  . ASP A 1 60  ? -11.239 -21.672 -9.400  1.00 22.89 ? 88  ASP A CA  1 
ATOM   405  C C   . ASP A 1 60  ? -10.886 -21.686 -10.907 1.00 25.37 ? 88  ASP A C   1 
ATOM   406  O O   . ASP A 1 60  ? -11.794 -21.623 -11.724 1.00 25.58 ? 88  ASP A O   1 
ATOM   407  C CB  . ASP A 1 60  ? -12.734 -21.416 -9.201  1.00 24.53 ? 88  ASP A CB  1 
ATOM   408  C CG  . ASP A 1 60  ? -13.650 -22.609 -9.490  1.00 27.25 ? 88  ASP A CG  1 
ATOM   409  O OD1 . ASP A 1 60  ? -13.124 -23.742 -9.689  1.00 27.92 ? 88  ASP A OD1 1 
ATOM   410  O OD2 . ASP A 1 60  ? -14.912 -22.403 -9.553  1.00 29.15 ? 88  ASP A OD2 1 
ATOM   411  N N   . GLU A 1 61  ? -9.604  -21.890 -11.201 1.00 27.72 ? 89  GLU A N   1 
ATOM   412  C CA  . GLU A 1 61  ? -9.015  -21.894 -12.580 1.00 31.83 ? 89  GLU A CA  1 
ATOM   413  C C   . GLU A 1 61  ? -9.805  -22.862 -13.450 1.00 35.16 ? 89  GLU A C   1 
ATOM   414  O O   . GLU A 1 61  ? -10.078 -22.494 -14.578 1.00 37.63 ? 89  GLU A O   1 
ATOM   415  C CB  . GLU A 1 61  ? -7.523  -22.252 -12.569 1.00 33.64 ? 89  GLU A CB  1 
ATOM   416  C CG  . GLU A 1 61  ? -6.601  -21.149 -12.028 1.00 34.32 ? 89  GLU A CG  1 
ATOM   417  C CD  . GLU A 1 61  ? -5.098  -21.466 -11.942 1.00 36.68 ? 89  GLU A CD  1 
ATOM   418  O OE1 . GLU A 1 61  ? -4.271  -20.533 -11.637 1.00 38.58 ? 89  GLU A OE1 1 
ATOM   419  O OE2 . GLU A 1 61  ? -4.756  -22.648 -12.099 1.00 38.53 ? 89  GLU A OE2 1 
ATOM   420  N N   . GLU A 1 62  ? -10.199 -24.025 -12.924 1.00 36.57 ? 90  GLU A N   1 
ATOM   421  C CA  . GLU A 1 62  ? -10.852 -25.102 -13.724 1.00 40.23 ? 90  GLU A CA  1 
ATOM   422  C C   . GLU A 1 62  ? -12.384 -24.988 -13.688 1.00 39.80 ? 90  GLU A C   1 
ATOM   423  O O   . GLU A 1 62  ? -13.016 -25.742 -14.462 1.00 40.82 ? 90  GLU A O   1 
ATOM   424  C CB  . GLU A 1 62  ? -10.385 -26.483 -13.253 1.00 43.24 ? 90  GLU A CB  1 
ATOM   425  C CG  . GLU A 1 62  ? -8.895  -26.727 -13.436 1.00 46.49 ? 90  GLU A CG  1 
ATOM   426  C CD  . GLU A 1 62  ? -8.362  -26.682 -14.871 1.00 53.49 ? 90  GLU A CD  1 
ATOM   427  O OE1 . GLU A 1 62  ? -9.170  -26.860 -15.819 1.00 57.76 ? 90  GLU A OE1 1 
ATOM   428  O OE2 . GLU A 1 62  ? -7.112  -26.449 -15.047 1.00 60.64 ? 90  GLU A OE2 1 
ATOM   429  N N   . ASN A 1 63  ? -12.957 -24.057 -12.910 1.00 37.50 ? 91  ASN A N   1 
ATOM   430  C CA  . ASN A 1 63  ? -14.425 -23.849 -12.762 1.00 39.02 ? 91  ASN A CA  1 
ATOM   431  C C   . ASN A 1 63  ? -15.098 -25.142 -12.273 1.00 39.07 ? 91  ASN A C   1 
ATOM   432  O O   . ASN A 1 63  ? -16.199 -25.446 -12.734 1.00 42.53 ? 91  ASN A O   1 
ATOM   433  C CB  . ASN A 1 63  ? -15.102 -23.364 -14.061 1.00 44.11 ? 91  ASN A CB  1 
ATOM   434  C CG  . ASN A 1 63  ? -14.642 -21.979 -14.478 1.00 46.59 ? 91  ASN A CG  1 
ATOM   435  O OD1 . ASN A 1 63  ? -14.391 -21.100 -13.642 1.00 47.52 ? 91  ASN A OD1 1 
ATOM   436  N ND2 . ASN A 1 63  ? -14.481 -21.777 -15.774 1.00 52.36 ? 91  ASN A ND2 1 
ATOM   437  N N   . THR A 1 64  ? -14.437 -25.910 -11.405 1.00 35.34 ? 92  THR A N   1 
ATOM   438  C CA  . THR A 1 64  ? -14.953 -27.179 -10.832 1.00 35.39 ? 92  THR A CA  1 
ATOM   439  C C   . THR A 1 64  ? -15.145 -27.030 -9.323  1.00 32.52 ? 92  THR A C   1 
ATOM   440  O O   . THR A 1 64  ? -15.766 -27.883 -8.738  1.00 33.48 ? 92  THR A O   1 
ATOM   441  C CB  . THR A 1 64  ? -13.983 -28.340 -11.116 1.00 35.76 ? 92  THR A CB  1 
ATOM   442  O OG1 . THR A 1 64  ? -12.724 -27.943 -10.574 1.00 33.99 ? 92  THR A OG1 1 
ATOM   443  C CG2 . THR A 1 64  ? -13.861 -28.643 -12.597 1.00 38.27 ? 92  THR A CG2 1 
ATOM   444  N N   . GLY A 1 65  ? -14.587 -26.006 -8.712  1.00 29.66 ? 93  GLY A N   1 
ATOM   445  C CA  . GLY A 1 65  ? -14.544 -25.894 -7.236  1.00 27.47 ? 93  GLY A CA  1 
ATOM   446  C C   . GLY A 1 65  ? -13.536 -26.857 -6.631  1.00 26.42 ? 93  GLY A C   1 
ATOM   447  O O   . GLY A 1 65  ? -13.484 -26.958 -5.381  1.00 24.82 ? 93  GLY A O   1 
ATOM   448  N N   . ALA A 1 66  ? -12.692 -27.491 -7.444  1.00 26.51 ? 94  ALA A N   1 
ATOM   449  C CA  . ALA A 1 66  ? -11.741 -28.515 -6.938  1.00 27.04 ? 94  ALA A CA  1 
ATOM   450  C C   . ALA A 1 66  ? -10.737 -27.840 -6.013  1.00 24.15 ? 94  ALA A C   1 
ATOM   451  O O   . ALA A 1 66  ? -10.323 -28.503 -5.077  1.00 25.55 ? 94  ALA A O   1 
ATOM   452  C CB  . ALA A 1 66  ? -11.027 -29.258 -8.055  1.00 28.47 ? 94  ALA A CB  1 
ATOM   453  N N   . ASP A 1 67  ? -10.367 -26.585 -6.247  1.00 22.36 ? 95  ASP A N   1 
ATOM   454  C CA  . ASP A 1 67  ? -9.388  -25.861 -5.404  1.00 21.30 ? 95  ASP A CA  1 
ATOM   455  C C   . ASP A 1 67  ? -9.893  -25.729 -3.962  1.00 20.56 ? 95  ASP A C   1 
ATOM   456  O O   . ASP A 1 67  ? -9.050  -25.510 -3.088  1.00 20.14 ? 95  ASP A O   1 
ATOM   457  C CB  . ASP A 1 67  ? -8.955  -24.513 -5.972  1.00 21.04 ? 95  ASP A CB  1 
ATOM   458  C CG  . ASP A 1 67  ? -10.049 -23.492 -6.244  1.00 22.29 ? 95  ASP A CG  1 
ATOM   459  O OD1 . ASP A 1 67  ? -11.236 -23.796 -5.965  1.00 23.44 ? 95  ASP A OD1 1 
ATOM   460  O OD2 . ASP A 1 67  ? -9.673  -22.410 -6.746  1.00 23.14 ? 95  ASP A OD2 1 
ATOM   461  N N   . ARG A 1 68  ? -11.166 -25.972 -3.703  1.00 21.80 ? 96  ARG A N   1 
ATOM   462  C CA  . ARG A 1 68  ? -11.689 -25.850 -2.308  1.00 22.08 ? 96  ARG A CA  1 
ATOM   463  C C   . ARG A 1 68  ? -11.510 -27.143 -1.498  1.00 22.17 ? 96  ARG A C   1 
ATOM   464  O O   . ARG A 1 68  ? -11.655 -27.072 -0.250  1.00 21.67 ? 96  ARG A O   1 
ATOM   465  C CB  . ARG A 1 68  ? -13.151 -25.446 -2.416  1.00 24.40 ? 96  ARG A CB  1 
ATOM   466  C CG  . ARG A 1 68  ? -13.239 -23.959 -2.720  1.00 24.54 ? 96  ARG A CG  1 
ATOM   467  C CD  . ARG A 1 68  ? -14.586 -23.548 -2.948  1.00 26.90 ? 96  ARG A CD  1 
ATOM   468  N NE  . ARG A 1 68  ? -14.690 -22.182 -3.405  1.00 27.20 ? 96  ARG A NE  1 
ATOM   469  C CZ  . ARG A 1 68  ? -14.749 -21.099 -2.649  1.00 25.87 ? 96  ARG A CZ  1 
ATOM   470  N NH1 . ARG A 1 68  ? -14.650 -21.138 -1.325  1.00 23.48 ? 96  ARG A NH1 1 
ATOM   471  N NH2 . ARG A 1 68  ? -14.976 -19.954 -3.271  1.00 25.51 ? 96  ARG A NH2 1 
ATOM   472  N N   . LEU A 1 69  ? -11.271 -28.266 -2.164  1.00 22.15 ? 97  LEU A N   1 
ATOM   473  C CA  . LEU A 1 69  ? -11.251 -29.593 -1.537  1.00 23.10 ? 97  LEU A CA  1 
ATOM   474  C C   . LEU A 1 69  ? -9.854  -29.862 -1.014  1.00 22.20 ? 97  LEU A C   1 
ATOM   475  O O   . LEU A 1 69  ? -8.885  -29.825 -1.801  1.00 21.23 ? 97  LEU A O   1 
ATOM   476  C CB  . LEU A 1 69  ? -11.682 -30.634 -2.557  1.00 25.89 ? 97  LEU A CB  1 
ATOM   477  C CG  . LEU A 1 69  ? -13.177 -30.617 -2.858  1.00 28.02 ? 97  LEU A CG  1 
ATOM   478  C CD1 . LEU A 1 69  ? -13.445 -31.467 -4.074  1.00 30.53 ? 97  LEU A CD1 1 
ATOM   479  C CD2 . LEU A 1 69  ? -14.007 -31.121 -1.680  1.00 30.02 ? 97  LEU A CD2 1 
ATOM   480  N N   . MET A 1 70  ? -9.747  -30.126 0.278   1.00 21.76 ? 98  MET A N   1 
ATOM   481  C CA  . MET A 1 70  ? -8.426  -30.180 0.928   1.00 20.08 ? 98  MET A CA  1 
ATOM   482  C C   . MET A 1 70  ? -8.552  -31.068 2.174   1.00 20.60 ? 98  MET A C   1 
ATOM   483  O O   . MET A 1 70  ? -9.652  -31.377 2.626   1.00 20.48 ? 98  MET A O   1 
ATOM   484  C CB  . MET A 1 70  ? -7.907  -28.784 1.260   1.00 18.61 ? 98  MET A CB  1 
ATOM   485  C CG  . MET A 1 70  ? -8.760  -28.011 2.273   1.00 19.31 ? 98  MET A CG  1 
ATOM   486  S SD  . MET A 1 70  ? -8.261  -26.295 2.393   1.00 18.11 ? 98  MET A SD  1 
ATOM   487  C CE  . MET A 1 70  ? -8.667  -25.699 0.728   1.00 17.55 ? 98  MET A CE  1 
ATOM   488  N N   . THR A 1 71  ? -7.417  -31.488 2.697   1.00 20.19 ? 99  THR A N   1 
ATOM   489  C CA  . THR A 1 71  ? -7.406  -32.336 3.907   1.00 21.16 ? 99  THR A CA  1 
ATOM   490  C C   . THR A 1 71  ? -7.782  -31.472 5.103   1.00 20.89 ? 99  THR A C   1 
ATOM   491  O O   . THR A 1 71  ? -7.733  -30.227 5.026   1.00 18.04 ? 99  THR A O   1 
ATOM   492  C CB  . THR A 1 71  ? -6.049  -32.986 4.135   1.00 20.89 ? 99  THR A CB  1 
ATOM   493  O OG1 . THR A 1 71  ? -5.140  -31.926 4.425   1.00 18.93 ? 99  THR A OG1 1 
ATOM   494  C CG2 . THR A 1 71  ? -5.666  -33.868 2.955   1.00 21.93 ? 99  THR A CG2 1 
ATOM   495  N N   . GLN A 1 72  ? -8.142  -32.142 6.197   1.00 22.95 ? 100 GLN A N   1 
ATOM   496  C CA  . GLN A 1 72  ? -8.536  -31.459 7.454   1.00 23.91 ? 100 GLN A CA  1 
ATOM   497  C C   . GLN A 1 72  ? -7.422  -30.512 7.918   1.00 21.49 ? 100 GLN A C   1 
ATOM   498  O O   . GLN A 1 72  ? -7.717  -29.347 8.207   1.00 19.80 ? 100 GLN A O   1 
ATOM   499  C CB  . GLN A 1 72  ? -8.878  -32.479 8.551   1.00 27.80 ? 100 GLN A CB  1 
ATOM   500  C CG  . GLN A 1 72  ? -9.454  -31.793 9.787   1.00 30.84 ? 100 GLN A CG  1 
ATOM   501  C CD  . GLN A 1 72  ? -10.724 -31.052 9.423   1.00 32.61 ? 100 GLN A CD  1 
ATOM   502  O OE1 . GLN A 1 72  ? -11.675 -31.674 8.950   1.00 36.19 ? 100 GLN A OE1 1 
ATOM   503  N NE2 . GLN A 1 72  ? -10.722 -29.724 9.541   1.00 32.52 ? 100 GLN A NE2 1 
ATOM   504  N N   . ARG A 1 73  ? -6.167  -30.948 7.898   1.00 21.37 ? 101 ARG A N   1 
ATOM   505  C CA  . ARG A 1 73  ? -5.065  -30.109 8.415   1.00 20.18 ? 101 ARG A CA  1 
ATOM   506  C C   . ARG A 1 73  ? -4.892  -28.904 7.485   1.00 18.68 ? 101 ARG A C   1 
ATOM   507  O O   . ARG A 1 73  ? -4.618  -27.783 7.957   1.00 17.93 ? 101 ARG A O   1 
ATOM   508  C CB  . ARG A 1 73  ? -3.779  -30.925 8.512   1.00 20.51 ? 101 ARG A CB  1 
ATOM   509  C CG  . ARG A 1 73  ? -2.647  -30.149 9.160   1.00 20.00 ? 101 ARG A CG  1 
ATOM   510  C CD  . ARG A 1 73  ? -1.497  -31.076 9.404   1.00 20.60 ? 101 ARG A CD  1 
ATOM   511  N NE  . ARG A 1 73  ? -0.331  -30.396 9.952   1.00 21.00 ? 101 ARG A NE  1 
ATOM   512  C CZ  . ARG A 1 73  ? -0.128  -30.171 11.247  1.00 22.19 ? 101 ARG A CZ  1 
ATOM   513  N NH1 . ARG A 1 73  ? -1.090  -30.468 12.123  1.00 22.83 ? 101 ARG A NH1 1 
ATOM   514  N NH2 . ARG A 1 73  ? 0.952   -29.530 11.647  1.00 21.44 ? 101 ARG A NH2 1 
ATOM   515  N N   . CYS A 1 74  ? -5.033  -29.129 6.173   1.00 18.58 ? 102 CYS A N   1 
ATOM   516  C CA  . CYS A 1 74  ? -4.879  -28.054 5.169   1.00 16.98 ? 102 CYS A CA  1 
ATOM   517  C C   . CYS A 1 74  ? -5.958  -26.998 5.455   1.00 16.98 ? 102 CYS A C   1 
ATOM   518  O O   . CYS A 1 74  ? -5.631  -25.819 5.528   1.00 16.29 ? 102 CYS A O   1 
ATOM   519  C CB  . CYS A 1 74  ? -4.943  -28.600 3.747   1.00 17.58 ? 102 CYS A CB  1 
ATOM   520  S SG  . CYS A 1 74  ? -4.412  -27.347 2.553   1.00 17.87 ? 102 CYS A SG  1 
ATOM   521  N N   . LYS A 1 75  ? -7.195  -27.415 5.681   1.00 18.41 ? 103 LYS A N   1 
ATOM   522  C CA  . LYS A 1 75  ? -8.345  -26.513 5.980   1.00 19.35 ? 103 LYS A CA  1 
ATOM   523  C C   . LYS A 1 75  ? -8.026  -25.703 7.255   1.00 18.46 ? 103 LYS A C   1 
ATOM   524  O O   . LYS A 1 75  ? -8.201  -24.507 7.277   1.00 16.97 ? 103 LYS A O   1 
ATOM   525  C CB  . LYS A 1 75  ? -9.621  -27.355 6.119   1.00 22.17 ? 103 LYS A CB  1 
ATOM   526  C CG  . LYS A 1 75  ? -10.799 -26.575 6.639   1.00 24.54 ? 103 LYS A CG  1 
ATOM   527  C CD  . LYS A 1 75  ? -12.065 -27.433 6.711   1.00 26.25 ? 103 LYS A CD  1 
ATOM   528  C CE  . LYS A 1 75  ? -12.754 -27.497 5.366   1.00 26.98 ? 103 LYS A CE  1 
ATOM   529  N NZ  . LYS A 1 75  ? -14.118 -28.064 5.570   1.00 30.06 ? 103 LYS A NZ  1 
ATOM   530  N N   . ASP A 1 76  ? -7.514  -26.357 8.287   1.00 19.51 ? 104 ASP A N   1 
ATOM   531  C CA  . ASP A 1 76  ? -7.249  -25.725 9.603   1.00 19.39 ? 104 ASP A CA  1 
ATOM   532  C C   . ASP A 1 76  ? -6.175  -24.658 9.440   1.00 18.34 ? 104 ASP A C   1 
ATOM   533  O O   . ASP A 1 76  ? -6.409  -23.521 9.869   1.00 17.27 ? 104 ASP A O   1 
ATOM   534  C CB  . ASP A 1 76  ? -6.893  -26.806 10.621  1.00 21.46 ? 104 ASP A CB  1 
ATOM   535  C CG  . ASP A 1 76  ? -8.008  -27.790 10.972  1.00 23.39 ? 104 ASP A CG  1 
ATOM   536  O OD1 . ASP A 1 76  ? -9.171  -27.589 10.573  1.00 23.67 ? 104 ASP A OD1 1 
ATOM   537  O OD2 . ASP A 1 76  ? -7.676  -28.810 11.685  1.00 25.85 ? 104 ASP A OD2 1 
ATOM   538  N N   . LYS A 1 77  ? -5.074  -24.972 8.747   1.00 16.97 ? 105 LYS A N   1 
ATOM   539  C CA  . LYS A 1 77  ? -3.963  -23.977 8.637   1.00 16.34 ? 105 LYS A CA  1 
ATOM   540  C C   . LYS A 1 77  ? -4.394  -22.825 7.693   1.00 15.90 ? 105 LYS A C   1 
ATOM   541  O O   . LYS A 1 77  ? -4.127  -21.641 7.977   1.00 14.69 ? 105 LYS A O   1 
ATOM   542  C CB  . LYS A 1 77  ? -2.697  -24.662 8.153   1.00 15.94 ? 105 LYS A CB  1 
ATOM   543  C CG  . LYS A 1 77  ? -2.123  -25.786 9.036   1.00 18.24 ? 105 LYS A CG  1 
ATOM   544  C CD  . LYS A 1 77  ? -2.393  -25.687 10.483  1.00 20.33 ? 105 LYS A CD  1 
ATOM   545  C CE  . LYS A 1 77  ? -1.539  -26.667 11.265  1.00 21.74 ? 105 LYS A CE  1 
ATOM   546  N NZ  . LYS A 1 77  ? -2.083  -26.789 12.611  1.00 23.44 ? 105 LYS A NZ  1 
ATOM   547  N N   . LEU A 1 78  ? -5.140  -23.162 6.631   1.00 15.60 ? 106 LEU A N   1 
ATOM   548  C CA  . LEU A 1 78  ? -5.647  -22.161 5.672   1.00 15.08 ? 106 LEU A CA  1 
ATOM   549  C C   . LEU A 1 78  ? -6.609  -21.216 6.369   1.00 15.80 ? 106 LEU A C   1 
ATOM   550  O O   . LEU A 1 78  ? -6.526  -19.991 6.160   1.00 15.06 ? 106 LEU A O   1 
ATOM   551  C CB  . LEU A 1 78  ? -6.313  -22.841 4.473   1.00 14.93 ? 106 LEU A CB  1 
ATOM   552  C CG  . LEU A 1 78  ? -6.446  -21.912 3.255   1.00 14.79 ? 106 LEU A CG  1 
ATOM   553  C CD1 . LEU A 1 78  ? -5.100  -21.657 2.606   1.00 14.26 ? 106 LEU A CD1 1 
ATOM   554  C CD2 . LEU A 1 78  ? -7.416  -22.484 2.247   1.00 15.64 ? 106 LEU A CD2 1 
ATOM   555  N N   . ASN A 1 79  ? -7.515  -21.739 7.194   1.00 16.32 ? 107 ASN A N   1 
ATOM   556  C CA  . ASN A 1 79  ? -8.419  -20.855 7.963   1.00 17.64 ? 107 ASN A CA  1 
ATOM   557  C C   . ASN A 1 79  ? -7.663  -19.958 8.935   1.00 17.56 ? 107 ASN A C   1 
ATOM   558  O O   . ASN A 1 79  ? -8.126  -18.825 9.091   1.00 17.91 ? 107 ASN A O   1 
ATOM   559  C CB  . ASN A 1 79  ? -9.529  -21.658 8.647   1.00 19.25 ? 107 ASN A CB  1 
ATOM   560  C CG  . ASN A 1 79  ? -10.579 -22.169 7.682   1.00 19.69 ? 107 ASN A CG  1 
ATOM   561  O OD1 . ASN A 1 79  ? -10.809 -21.557 6.626   1.00 19.75 ? 107 ASN A OD1 1 
ATOM   562  N ND2 . ASN A 1 79  ? -11.163 -23.328 7.966   1.00 20.77 ? 107 ASN A ND2 1 
ATOM   563  N N   . ALA A 1 80  ? -6.650  -20.428 9.658   1.00 18.54 ? 108 ALA A N   1 
ATOM   564  C CA  . ALA A 1 80  ? -5.821  -19.543 10.526  1.00 18.97 ? 108 ALA A CA  1 
ATOM   565  C C   . ALA A 1 80  ? -5.158  -18.442 9.665   1.00 18.47 ? 108 ALA A C   1 
ATOM   566  O O   . ALA A 1 80  ? -5.090  -17.270 10.099  1.00 19.39 ? 108 ALA A O   1 
ATOM   567  C CB  . ALA A 1 80  ? -4.766  -20.334 11.276  1.00 19.98 ? 108 ALA A CB  1 
ATOM   568  N N   . LEU A 1 81  ? -4.600  -18.808 8.517   1.00 17.11 ? 109 LEU A N   1 
ATOM   569  C CA  . LEU A 1 81  ? -3.921  -17.811 7.633   1.00 16.75 ? 109 LEU A CA  1 
ATOM   570  C C   . LEU A 1 81  ? -4.938  -16.766 7.155   1.00 16.03 ? 109 LEU A C   1 
ATOM   571  O O   . LEU A 1 81  ? -4.592  -15.560 7.044   1.00 16.14 ? 109 LEU A O   1 
ATOM   572  C CB  . LEU A 1 81  ? -3.309  -18.578 6.451   1.00 15.20 ? 109 LEU A CB  1 
ATOM   573  C CG  . LEU A 1 81  ? -2.510  -17.735 5.474   1.00 15.53 ? 109 LEU A CG  1 
ATOM   574  C CD1 . LEU A 1 81  ? -1.453  -16.899 6.193   1.00 16.69 ? 109 LEU A CD1 1 
ATOM   575  C CD2 . LEU A 1 81  ? -1.880  -18.620 4.437   1.00 14.53 ? 109 LEU A CD2 1 
ATOM   576  N N   . ALA A 1 82  ? -6.181  -17.172 6.898   1.00 15.88 ? 110 ALA A N   1 
ATOM   577  C CA  . ALA A 1 82  ? -7.228  -16.225 6.436   1.00 16.65 ? 110 ALA A CA  1 
ATOM   578  C C   . ALA A 1 82  ? -7.399  -15.095 7.457   1.00 18.39 ? 110 ALA A C   1 
ATOM   579  O O   . ALA A 1 82  ? -7.541  -13.916 7.089   1.00 18.20 ? 110 ALA A O   1 
ATOM   580  C CB  . ALA A 1 82  ? -8.537  -16.948 6.172   1.00 16.99 ? 110 ALA A CB  1 
ATOM   581  N N   . ILE A 1 83  ? -7.351  -15.459 8.744   1.00 19.53 ? 111 ILE A N   1 
ATOM   582  C CA  . ILE A 1 83  ? -7.466  -14.463 9.827   1.00 21.34 ? 111 ILE A CA  1 
ATOM   583  C C   . ILE A 1 83  ? -6.233  -13.548 9.834   1.00 21.03 ? 111 ILE A C   1 
ATOM   584  O O   . ILE A 1 83  ? -6.436  -12.329 9.881   1.00 21.23 ? 111 ILE A O   1 
ATOM   585  C CB  . ILE A 1 83  ? -7.734  -15.152 11.192  1.00 23.45 ? 111 ILE A CB  1 
ATOM   586  C CG1 . ILE A 1 83  ? -9.105  -15.827 11.148  1.00 25.17 ? 111 ILE A CG1 1 
ATOM   587  C CG2 . ILE A 1 83  ? -7.628  -14.111 12.285  1.00 26.09 ? 111 ILE A CG2 1 
ATOM   588  C CD1 . ILE A 1 83  ? -9.345  -16.849 12.242  1.00 26.31 ? 111 ILE A CD1 1 
ATOM   589  N N   . SER A 1 84  ? -5.027  -14.093 9.783   1.00 20.57 ? 112 SER A N   1 
ATOM   590  C CA  . SER A 1 84  ? -3.783  -13.276 9.918   1.00 21.74 ? 112 SER A CA  1 
ATOM   591  C C   . SER A 1 84  ? -3.604  -12.385 8.694   1.00 20.73 ? 112 SER A C   1 
ATOM   592  O O   . SER A 1 84  ? -3.157  -11.229 8.875   1.00 21.78 ? 112 SER A O   1 
ATOM   593  C CB  . SER A 1 84  ? -2.558  -14.098 10.232  1.00 22.03 ? 112 SER A CB  1 
ATOM   594  O OG  . SER A 1 84  ? -2.282  -14.933 9.185   1.00 21.24 ? 112 SER A OG  1 
ATOM   595  N N   . VAL A 1 85  ? -4.071  -12.826 7.516   1.00 19.25 ? 113 VAL A N   1 
ATOM   596  C CA  . VAL A 1 85  ? -3.999  -11.947 6.322   1.00 19.77 ? 113 VAL A CA  1 
ATOM   597  C C   . VAL A 1 85  ? -4.872  -10.709 6.522   1.00 21.81 ? 113 VAL A C   1 
ATOM   598  O O   . VAL A 1 85  ? -4.341  -9.596  6.297   1.00 23.63 ? 113 VAL A O   1 
ATOM   599  C CB  . VAL A 1 85  ? -4.280  -12.690 5.012   1.00 18.50 ? 113 VAL A CB  1 
ATOM   600  C CG1 . VAL A 1 85  ? -4.408  -11.717 3.845   1.00 19.53 ? 113 VAL A CG1 1 
ATOM   601  C CG2 . VAL A 1 85  ? -3.247  -13.771 4.739   1.00 16.96 ? 113 VAL A CG2 1 
ATOM   602  N N   . MET A 1 86  ? -6.126  -10.859 6.980   1.00 22.27 ? 114 MET A N   1 
ATOM   603  C CA  . MET A 1 86  ? -7.058  -9.724  7.196   1.00 25.88 ? 114 MET A CA  1 
ATOM   604  C C   . MET A 1 86  ? -6.495  -8.777  8.268   1.00 27.52 ? 114 MET A C   1 
ATOM   605  O O   . MET A 1 86  ? -6.641  -7.577  8.109   1.00 27.19 ? 114 MET A O   1 
ATOM   606  C CB  . MET A 1 86  ? -8.449  -10.239 7.577   1.00 26.98 ? 114 MET A CB  1 
ATOM   607  C CG  . MET A 1 86  ? -9.094  -10.948 6.391   1.00 25.56 ? 114 MET A CG  1 
ATOM   608  S SD  . MET A 1 86  ? -10.820 -11.288 6.631   1.00 29.54 ? 114 MET A SD  1 
ATOM   609  C CE  . MET A 1 86  ? -10.799 -12.498 7.956   1.00 29.82 ? 114 MET A CE  1 
ATOM   610  N N   . ASN A 1 87  ? -5.843  -9.314  9.305   1.00 27.97 ? 115 ASN A N   1 
ATOM   611  C CA  . ASN A 1 87  ? -5.227  -8.483  10.392  1.00 31.82 ? 115 ASN A CA  1 
ATOM   612  C C   . ASN A 1 87  ? -4.004  -7.715  9.854   1.00 30.40 ? 115 ASN A C   1 
ATOM   613  O O   . ASN A 1 87  ? -3.784  -6.513  10.217  1.00 30.56 ? 115 ASN A O   1 
ATOM   614  C CB  . ASN A 1 87  ? -4.806  -9.347  11.582  1.00 33.61 ? 115 ASN A CB  1 
ATOM   615  C CG  . ASN A 1 87  ? -5.985  -9.850  12.384  1.00 37.50 ? 115 ASN A CG  1 
ATOM   616  O OD1 . ASN A 1 87  ? -7.069  -9.256  12.338  1.00 40.89 ? 115 ASN A OD1 1 
ATOM   617  N ND2 . ASN A 1 87  ? -5.773  -10.930 13.139  1.00 39.33 ? 115 ASN A ND2 1 
ATOM   618  N N   . GLN A 1 88  ? -3.227  -8.364  9.001   1.00 27.47 ? 116 GLN A N   1 
ATOM   619  C CA  . GLN A 1 88  ? -1.986  -7.752  8.457   1.00 27.71 ? 116 GLN A CA  1 
ATOM   620  C C   . GLN A 1 88  ? -2.330  -6.546  7.583   1.00 28.48 ? 116 GLN A C   1 
ATOM   621  O O   . GLN A 1 88  ? -1.689  -5.490  7.749   1.00 29.92 ? 116 GLN A O   1 
ATOM   622  C CB  . GLN A 1 88  ? -1.188  -8.754  7.638   1.00 26.32 ? 116 GLN A CB  1 
ATOM   623  C CG  . GLN A 1 88  ? 0.221   -8.289  7.317   1.00 27.53 ? 116 GLN A CG  1 
ATOM   624  C CD  . GLN A 1 88  ? 1.155   -8.180  8.503   1.00 30.05 ? 116 GLN A CD  1 
ATOM   625  O OE1 . GLN A 1 88  ? 0.971   -8.829  9.543   1.00 31.85 ? 116 GLN A OE1 1 
ATOM   626  N NE2 . GLN A 1 88  ? 2.163   -7.342  8.347   1.00 30.15 ? 116 GLN A NE2 1 
ATOM   627  N N   . TRP A 1 89  ? -3.337  -6.666  6.730   1.00 27.09 ? 117 TRP A N   1 
ATOM   628  C CA  . TRP A 1 89  ? -3.657  -5.674  5.662   1.00 28.24 ? 117 TRP A CA  1 
ATOM   629  C C   . TRP A 1 89  ? -5.168  -5.528  5.588   1.00 29.05 ? 117 TRP A C   1 
ATOM   630  O O   . TRP A 1 89  ? -5.872  -6.296  4.917   1.00 27.79 ? 117 TRP A O   1 
ATOM   631  C CB  . TRP A 1 89  ? -3.085  -6.136  4.311   1.00 27.16 ? 117 TRP A CB  1 
ATOM   632  C CG  . TRP A 1 89  ? -1.613  -6.366  4.207   1.00 26.51 ? 117 TRP A CG  1 
ATOM   633  C CD1 . TRP A 1 89  ? -0.600  -5.452  4.115   1.00 28.50 ? 117 TRP A CD1 1 
ATOM   634  C CD2 . TRP A 1 89  ? -0.998  -7.644  4.037   1.00 24.53 ? 117 TRP A CD2 1 
ATOM   635  N NE1 . TRP A 1 89  ? 0.597   -6.096  3.921   1.00 27.25 ? 117 TRP A NE1 1 
ATOM   636  C CE2 . TRP A 1 89  ? 0.380   -7.438  3.861   1.00 24.57 ? 117 TRP A CE2 1 
ATOM   637  C CE3 . TRP A 1 89  ? -1.508  -8.934  3.973   1.00 22.66 ? 117 TRP A CE3 1 
ATOM   638  C CZ2 . TRP A 1 89  ? 1.276   -8.497  3.666   1.00 23.35 ? 117 TRP A CZ2 1 
ATOM   639  C CZ3 . TRP A 1 89  ? -0.634  -9.980  3.807   1.00 21.26 ? 117 TRP A CZ3 1 
ATOM   640  C CH2 . TRP A 1 89  ? 0.732   -9.763  3.654   1.00 22.43 ? 117 TRP A CH2 1 
ATOM   641  N N   . PRO A 1 90  ? -5.758  -4.645  6.411   1.00 32.41 ? 118 PRO A N   1 
ATOM   642  C CA  . PRO A 1 90  ? -7.204  -4.509  6.434   1.00 33.74 ? 118 PRO A CA  1 
ATOM   643  C C   . PRO A 1 90  ? -7.718  -4.285  5.003   1.00 33.80 ? 118 PRO A C   1 
ATOM   644  O O   . PRO A 1 90  ? -7.094  -3.563  4.255   1.00 36.14 ? 118 PRO A O   1 
ATOM   645  C CB  . PRO A 1 90  ? -7.445  -3.352  7.415   1.00 37.30 ? 118 PRO A CB  1 
ATOM   646  C CG  . PRO A 1 90  ? -6.252  -3.459  8.365   1.00 37.73 ? 118 PRO A CG  1 
ATOM   647  C CD  . PRO A 1 90  ? -5.089  -3.908  7.499   1.00 34.81 ? 118 PRO A CD  1 
ATOM   648  N N   . GLY A 1 91  ? -8.808  -4.951  4.645   1.00 32.20 ? 119 GLY A N   1 
ATOM   649  C CA  . GLY A 1 91  ? -9.413  -4.869  3.298   1.00 32.42 ? 119 GLY A CA  1 
ATOM   650  C C   . GLY A 1 91  ? -8.854  -5.955  2.383   1.00 29.83 ? 119 GLY A C   1 
ATOM   651  O O   . GLY A 1 91  ? -9.384  -6.125  1.289   1.00 31.19 ? 119 GLY A O   1 
ATOM   652  N N   . VAL A 1 92  ? -7.807  -6.654  2.779   1.00 27.58 ? 120 VAL A N   1 
ATOM   653  C CA  . VAL A 1 92  ? -7.176  -7.661  1.889   1.00 25.26 ? 120 VAL A CA  1 
ATOM   654  C C   . VAL A 1 92  ? -7.525  -9.044  2.403   1.00 24.02 ? 120 VAL A C   1 
ATOM   655  O O   . VAL A 1 92  ? -7.722  -9.223  3.623   1.00 26.12 ? 120 VAL A O   1 
ATOM   656  C CB  . VAL A 1 92  ? -5.669  -7.388  1.797   1.00 25.78 ? 120 VAL A CB  1 
ATOM   657  C CG1 . VAL A 1 92  ? -4.897  -8.504  1.079   1.00 24.07 ? 120 VAL A CG1 1 
ATOM   658  C CG2 . VAL A 1 92  ? -5.414  -6.011  1.195   1.00 28.17 ? 120 VAL A CG2 1 
ATOM   659  N N   . LYS A 1 93  ? -7.657  -10.017 1.517   1.00 22.17 ? 121 LYS A N   1 
ATOM   660  C CA  A LYS A 1 93  ? -7.987  -11.410 1.902   0.50 21.02 ? 121 LYS A CA  1 
ATOM   661  C CA  B LYS A 1 93  ? -7.984  -11.408 1.906   0.50 20.57 ? 121 LYS A CA  1 
ATOM   662  C C   . LYS A 1 93  ? -6.937  -12.375 1.374   1.00 18.95 ? 121 LYS A C   1 
ATOM   663  O O   . LYS A 1 93  ? -6.218  -12.053 0.347   1.00 18.49 ? 121 LYS A O   1 
ATOM   664  C CB  A LYS A 1 93  ? -9.373  -11.784 1.375   0.50 22.61 ? 121 LYS A CB  1 
ATOM   665  C CB  B LYS A 1 93  ? -9.367  -11.800 1.381   0.50 21.45 ? 121 LYS A CB  1 
ATOM   666  C CG  A LYS A 1 93  ? -10.436 -10.744 1.673   0.50 25.02 ? 121 LYS A CG  1 
ATOM   667  C CG  B LYS A 1 93  ? -10.536 -11.126 2.077   0.50 22.98 ? 121 LYS A CG  1 
ATOM   668  C CD  A LYS A 1 93  ? -11.850 -11.233 1.593   0.50 26.40 ? 121 LYS A CD  1 
ATOM   669  C CD  B LYS A 1 93  ? -11.874 -11.673 1.626   0.50 23.39 ? 121 LYS A CD  1 
ATOM   670  C CE  A LYS A 1 93  ? -12.844 -10.175 2.045   0.50 28.32 ? 121 LYS A CE  1 
ATOM   671  C CE  B LYS A 1 93  ? -13.065 -10.948 2.241   0.50 24.83 ? 121 LYS A CE  1 
ATOM   672  N NZ  A LYS A 1 93  ? -12.560 -9.690  3.415   0.50 29.32 ? 121 LYS A NZ  1 
ATOM   673  N NZ  B LYS A 1 93  ? -14.339 -11.358 1.592   0.50 24.74 ? 121 LYS A NZ  1 
ATOM   674  N N   . LEU A 1 94  ? -6.846  -13.523 2.021   1.00 17.09 ? 122 LEU A N   1 
ATOM   675  C CA  . LEU A 1 94  ? -6.087  -14.648 1.478   1.00 15.28 ? 122 LEU A CA  1 
ATOM   676  C C   . LEU A 1 94  ? -6.749  -15.094 0.160   1.00 15.06 ? 122 LEU A C   1 
ATOM   677  O O   . LEU A 1 94  ? -7.992  -15.064 0.094   1.00 15.03 ? 122 LEU A O   1 
ATOM   678  C CB  . LEU A 1 94  ? -6.119  -15.783 2.501   1.00 15.28 ? 122 LEU A CB  1 
ATOM   679  C CG  . LEU A 1 94  ? -5.482  -17.083 2.070   1.00 14.38 ? 122 LEU A CG  1 
ATOM   680  C CD1 . LEU A 1 94  ? -3.982  -16.891 1.812   1.00 14.38 ? 122 LEU A CD1 1 
ATOM   681  C CD2 . LEU A 1 94  ? -5.669  -18.113 3.171   1.00 15.31 ? 122 LEU A CD2 1 
ATOM   682  N N   . ARG A 1 95  ? -5.938  -15.476 -0.848  1.00 13.89 ? 123 ARG A N   1 
ATOM   683  C CA  . ARG A 1 95  ? -6.420  -15.974 -2.165  1.00 14.82 ? 123 ARG A CA  1 
ATOM   684  C C   . ARG A 1 95  ? -5.667  -17.259 -2.511  1.00 13.73 ? 123 ARG A C   1 
ATOM   685  O O   . ARG A 1 95  ? -4.433  -17.338 -2.307  1.00 13.21 ? 123 ARG A O   1 
ATOM   686  C CB  . ARG A 1 95  ? -6.230  -14.900 -3.246  1.00 15.51 ? 123 ARG A CB  1 
ATOM   687  C CG  . ARG A 1 95  ? -6.533  -15.321 -4.674  1.00 15.71 ? 123 ARG A CG  1 
ATOM   688  C CD  . ARG A 1 95  ? -6.669  -14.101 -5.558  1.00 17.22 ? 123 ARG A CD  1 
ATOM   689  N NE  . ARG A 1 95  ? -6.779  -14.449 -6.981  1.00 17.79 ? 123 ARG A NE  1 
ATOM   690  C CZ  . ARG A 1 95  ? -5.696  -14.623 -7.771  1.00 17.43 ? 123 ARG A CZ  1 
ATOM   691  N NH1 . ARG A 1 95  ? -4.477  -14.546 -7.286  1.00 17.21 ? 123 ARG A NH1 1 
ATOM   692  N NH2 . ARG A 1 95  ? -5.875  -14.879 -9.056  1.00 18.40 ? 123 ARG A NH2 1 
ATOM   693  N N   . VAL A 1 96  ? -6.405  -18.248 -2.949  1.00 13.49 ? 124 VAL A N   1 
ATOM   694  C CA  . VAL A 1 96  ? -5.835  -19.545 -3.393  1.00 13.27 ? 124 VAL A CA  1 
ATOM   695  C C   . VAL A 1 96  ? -5.894  -19.586 -4.920  1.00 14.19 ? 124 VAL A C   1 
ATOM   696  O O   . VAL A 1 96  ? -6.986  -19.472 -5.509  1.00 14.56 ? 124 VAL A O   1 
ATOM   697  C CB  . VAL A 1 96  ? -6.596  -20.733 -2.806  1.00 13.37 ? 124 VAL A CB  1 
ATOM   698  C CG1 . VAL A 1 96  ? -6.145  -22.040 -3.415  1.00 14.30 ? 124 VAL A CG1 1 
ATOM   699  C CG2 . VAL A 1 96  ? -6.490  -20.772 -1.299  1.00 13.71 ? 124 VAL A CG2 1 
ATOM   700  N N   . THR A 1 97  ? -4.743  -19.725 -5.556  1.00 14.42 ? 125 THR A N   1 
ATOM   701  C CA  . THR A 1 97  ? -4.709  -19.862 -7.015  1.00 15.30 ? 125 THR A CA  1 
ATOM   702  C C   . THR A 1 97  ? -4.840  -21.314 -7.420  1.00 16.45 ? 125 THR A C   1 
ATOM   703  O O   . THR A 1 97  ? -5.478  -21.529 -8.485  1.00 18.04 ? 125 THR A O   1 
ATOM   704  C CB  . THR A 1 97  ? -3.469  -19.222 -7.650  1.00 15.68 ? 125 THR A CB  1 
ATOM   705  O OG1 . THR A 1 97  ? -2.357  -19.836 -7.046  1.00 14.67 ? 125 THR A OG1 1 
ATOM   706  C CG2 . THR A 1 97  ? -3.450  -17.738 -7.413  1.00 15.35 ? 125 THR A CG2 1 
ATOM   707  N N   . GLU A 1 98  ? -4.261  -22.251 -6.677  1.00 16.00 ? 126 GLU A N   1 
ATOM   708  C CA  . GLU A 1 98  ? -4.305  -23.684 -7.060  1.00 18.80 ? 126 GLU A CA  1 
ATOM   709  C C   . GLU A 1 98  ? -4.400  -24.459 -5.754  1.00 17.30 ? 126 GLU A C   1 
ATOM   710  O O   . GLU A 1 98  ? -3.645  -24.099 -4.814  1.00 17.92 ? 126 GLU A O   1 
ATOM   711  C CB  . GLU A 1 98  ? -3.050  -24.030 -7.918  1.00 21.21 ? 126 GLU A CB  1 
ATOM   712  C CG  . GLU A 1 98  ? -3.058  -23.382 -9.306  1.00 25.90 ? 126 GLU A CG  1 
ATOM   713  C CD  . GLU A 1 98  ? -2.098  -23.867 -10.392 1.00 30.38 ? 126 GLU A CD  1 
ATOM   714  O OE1 . GLU A 1 98  ? -1.143  -24.581 -10.042 1.00 31.03 ? 126 GLU A OE1 1 
ATOM   715  O OE2 . GLU A 1 98  ? -2.293  -23.539 -11.604 1.00 34.73 ? 126 GLU A OE2 1 
ATOM   716  N N   . GLY A 1 99  ? -5.304  -25.433 -5.666  1.00 17.89 ? 127 GLY A N   1 
ATOM   717  C CA  . GLY A 1 99  ? -5.377  -26.370 -4.536  1.00 17.79 ? 127 GLY A CA  1 
ATOM   718  C C   . GLY A 1 99  ? -5.247  -27.784 -5.019  1.00 18.96 ? 127 GLY A C   1 
ATOM   719  O O   . GLY A 1 99  ? -4.299  -28.082 -5.784  1.00 20.57 ? 127 GLY A O   1 
ATOM   720  N N   . TRP A 1 100 ? -6.241  -28.605 -4.722  1.00 19.50 ? 128 TRP A N   1 
ATOM   721  C CA  . TRP A 1 100 ? -6.280  -30.003 -5.172  1.00 21.17 ? 128 TRP A CA  1 
ATOM   722  C C   . TRP A 1 100 ? -6.292  -30.078 -6.700  1.00 23.32 ? 128 TRP A C   1 
ATOM   723  O O   . TRP A 1 100 ? -7.043  -29.314 -7.350  1.00 21.85 ? 128 TRP A O   1 
ATOM   724  C CB  . TRP A 1 100 ? -7.432  -30.760 -4.531  1.00 22.07 ? 128 TRP A CB  1 
ATOM   725  C CG  . TRP A 1 100 ? -7.579  -32.160 -5.044  1.00 24.06 ? 128 TRP A CG  1 
ATOM   726  C CD1 . TRP A 1 100 ? -6.677  -33.190 -5.018  1.00 24.95 ? 128 TRP A CD1 1 
ATOM   727  C CD2 . TRP A 1 100 ? -8.785  -32.707 -5.573  1.00 26.15 ? 128 TRP A CD2 1 
ATOM   728  N NE1 . TRP A 1 100 ? -7.210  -34.314 -5.566  1.00 27.03 ? 128 TRP A NE1 1 
ATOM   729  C CE2 . TRP A 1 100 ? -8.517  -34.056 -5.897  1.00 28.35 ? 128 TRP A CE2 1 
ATOM   730  C CE3 . TRP A 1 100 ? -10.054 -32.179 -5.803  1.00 26.61 ? 128 TRP A CE3 1 
ATOM   731  C CZ2 . TRP A 1 100 ? -9.483  -34.872 -6.448  1.00 30.89 ? 128 TRP A CZ2 1 
ATOM   732  C CZ3 . TRP A 1 100 ? -11.007 -32.982 -6.369  1.00 29.11 ? 128 TRP A CZ3 1 
ATOM   733  C CH2 . TRP A 1 100 ? -10.723 -34.313 -6.681  1.00 31.47 ? 128 TRP A CH2 1 
ATOM   734  N N   . ASP A 1 101 ? -5.419  -30.929 -7.233  1.00 24.90 ? 129 ASP A N   1 
ATOM   735  C CA  . ASP A 1 101 ? -5.154  -30.999 -8.695  1.00 28.60 ? 129 ASP A CA  1 
ATOM   736  C C   . ASP A 1 101 ? -5.679  -32.349 -9.183  1.00 31.49 ? 129 ASP A C   1 
ATOM   737  O O   . ASP A 1 101 ? -5.083  -33.366 -8.817  1.00 30.69 ? 129 ASP A O   1 
ATOM   738  C CB  . ASP A 1 101 ? -3.658  -30.824 -9.020  1.00 29.62 ? 129 ASP A CB  1 
ATOM   739  C CG  . ASP A 1 101 ? -3.304  -30.731 -10.508 1.00 32.55 ? 129 ASP A CG  1 
ATOM   740  O OD1 . ASP A 1 101 ? -4.163  -30.990 -11.362 1.00 34.93 ? 129 ASP A OD1 1 
ATOM   741  O OD2 . ASP A 1 101 ? -2.128  -30.416 -10.782 1.00 36.80 ? 129 ASP A OD2 1 
ATOM   742  N N   . GLU A 1 102 ? -6.771  -32.351 -9.931  1.00 34.27 ? 130 GLU A N   1 
ATOM   743  C CA  . GLU A 1 102 ? -7.279  -33.577 -10.597 1.00 40.29 ? 130 GLU A CA  1 
ATOM   744  C C   . GLU A 1 102 ? -6.546  -33.825 -11.930 1.00 45.42 ? 130 GLU A C   1 
ATOM   745  O O   . GLU A 1 102 ? -6.676  -34.964 -12.417 1.00 50.39 ? 130 GLU A O   1 
ATOM   746  C CB  . GLU A 1 102 ? -8.779  -33.519 -10.892 1.00 41.57 ? 130 GLU A CB  1 
ATOM   747  C CG  . GLU A 1 102 ? -9.628  -33.062 -9.727  1.00 39.35 ? 130 GLU A CG  1 
ATOM   748  C CD  . GLU A 1 102 ? -11.113 -33.154 -10.055 1.00 40.60 ? 130 GLU A CD  1 
ATOM   749  O OE1 . GLU A 1 102 ? -11.612 -34.266 -10.107 1.00 41.55 ? 130 GLU A OE1 1 
ATOM   750  O OE2 . GLU A 1 102 ? -11.740 -32.100 -10.257 1.00 39.48 ? 130 GLU A OE2 1 
ATOM   751  N N   . ASP A 1 103 ? -5.768  -32.845 -12.449 1.00 48.95 ? 131 ASP A N   1 
ATOM   752  C CA  . ASP A 1 103 ? -5.437  -32.633 -13.904 1.00 53.59 ? 131 ASP A CA  1 
ATOM   753  C C   . ASP A 1 103 ? -3.940  -32.761 -14.300 1.00 53.39 ? 131 ASP A C   1 
ATOM   754  O O   . ASP A 1 103 ? -3.618  -32.440 -15.463 1.00 55.19 ? 131 ASP A O   1 
ATOM   755  C CB  . ASP A 1 103 ? -5.888  -31.214 -14.293 1.00 55.23 ? 131 ASP A CB  1 
ATOM   756  C CG  . ASP A 1 103 ? -7.384  -30.971 -14.075 1.00 57.01 ? 131 ASP A CG  1 
ATOM   757  O OD1 . ASP A 1 103 ? -8.211  -31.571 -14.847 1.00 59.44 ? 131 ASP A OD1 1 
ATOM   758  O OD2 . ASP A 1 103 ? -7.709  -30.234 -13.112 1.00 57.17 ? 131 ASP A OD2 1 
ATOM   759  N N   . GLY A 1 104 ? -3.034  -33.159 -13.409 1.00 50.65 ? 132 GLY A N   1 
ATOM   760  C CA  . GLY A 1 104 ? -1.588  -33.198 -13.713 1.00 52.29 ? 132 GLY A CA  1 
ATOM   761  C C   . GLY A 1 104 ? -0.955  -31.833 -14.055 1.00 49.92 ? 132 GLY A C   1 
ATOM   762  O O   . GLY A 1 104 ? -0.065  -31.815 -14.946 1.00 52.88 ? 132 GLY A O   1 
ATOM   763  N N   . HIS A 1 105 ? -1.304  -30.748 -13.356 1.00 46.69 ? 133 HIS A N   1 
ATOM   764  C CA  . HIS A 1 105 ? -0.810  -29.350 -13.559 1.00 45.16 ? 133 HIS A CA  1 
ATOM   765  C C   . HIS A 1 105 ? 0.392   -29.003 -12.675 1.00 43.79 ? 133 HIS A C   1 
ATOM   766  O O   . HIS A 1 105 ? 0.659   -27.793 -12.456 1.00 42.54 ? 133 HIS A O   1 
ATOM   767  C CB  . HIS A 1 105 ? -1.878  -28.343 -13.169 1.00 44.54 ? 133 HIS A CB  1 
ATOM   768  C CG  . HIS A 1 105 ? -2.987  -28.215 -14.162 1.00 49.35 ? 133 HIS A CG  1 
ATOM   769  N ND1 . HIS A 1 105 ? -3.040  -28.978 -15.324 1.00 54.05 ? 133 HIS A ND1 1 
ATOM   770  C CD2 . HIS A 1 105 ? -4.082  -27.423 -14.164 1.00 50.87 ? 133 HIS A CD2 1 
ATOM   771  C CE1 . HIS A 1 105 ? -4.116  -28.648 -16.022 1.00 54.46 ? 133 HIS A CE1 1 
ATOM   772  N NE2 . HIS A 1 105 ? -4.782  -27.700 -15.315 1.00 54.84 ? 133 HIS A NE2 1 
ATOM   773  N N   . HIS A 1 106 ? 0.958   -29.992 -12.014 1.00 40.85 ? 134 HIS A N   1 
ATOM   774  C CA  . HIS A 1 106 ? 2.054   -29.789 -11.045 1.00 39.42 ? 134 HIS A CA  1 
ATOM   775  C C   . HIS A 1 106 ? 3.011   -30.896 -11.418 1.00 43.10 ? 134 HIS A C   1 
ATOM   776  O O   . HIS A 1 106 ? 2.569   -31.814 -12.105 1.00 43.68 ? 134 HIS A O   1 
ATOM   777  C CB  . HIS A 1 106 ? 1.580   -29.864 -9.588  1.00 35.54 ? 134 HIS A CB  1 
ATOM   778  C CG  . HIS A 1 106 ? 0.893   -28.633 -9.113  1.00 33.08 ? 134 HIS A CG  1 
ATOM   779  N ND1 . HIS A 1 106 ? -0.485  -28.476 -9.203  1.00 34.75 ? 134 HIS A ND1 1 
ATOM   780  C CD2 . HIS A 1 106 ? 1.373   -27.488 -8.599  1.00 31.89 ? 134 HIS A CD2 1 
ATOM   781  C CE1 . HIS A 1 106 ? -0.820  -27.296 -8.715  1.00 31.97 ? 134 HIS A CE1 1 
ATOM   782  N NE2 . HIS A 1 106 ? 0.302   -26.658 -8.328  1.00 32.61 ? 134 HIS A NE2 1 
ATOM   783  N N   . SER A 1 107 ? 4.225   -30.867 -10.918 1.00 44.70 ? 135 SER A N   1 
ATOM   784  C CA  . SER A 1 107 ? 5.196   -31.914 -11.292 1.00 51.16 ? 135 SER A CA  1 
ATOM   785  C C   . SER A 1 107 ? 4.754   -33.223 -10.608 1.00 49.80 ? 135 SER A C   1 
ATOM   786  O O   . SER A 1 107 ? 3.915   -33.163 -9.666  1.00 42.38 ? 135 SER A O   1 
ATOM   787  C CB  . SER A 1 107 ? 6.602   -31.424 -10.951 1.00 53.30 ? 135 SER A CB  1 
ATOM   788  O OG  . SER A 1 107 ? 7.059   -30.512 -11.967 1.00 58.52 ? 135 SER A OG  1 
ATOM   789  N N   . GLU A 1 108 ? 5.321   -34.356 -11.011 1.00 50.52 ? 136 GLU A N   1 
ATOM   790  C CA  . GLU A 1 108 ? 5.028   -35.684 -10.404 1.00 52.42 ? 136 GLU A CA  1 
ATOM   791  C C   . GLU A 1 108 ? 5.239   -35.617 -8.888  1.00 46.81 ? 136 GLU A C   1 
ATOM   792  O O   . GLU A 1 108 ? 6.105   -34.822 -8.427  1.00 44.92 ? 136 GLU A O   1 
ATOM   793  C CB  . GLU A 1 108 ? 5.895   -36.779 -11.034 1.00 58.93 ? 136 GLU A CB  1 
ATOM   794  C CG  . GLU A 1 108 ? 5.363   -37.197 -12.391 1.00 65.44 ? 136 GLU A CG  1 
ATOM   795  C CD  . GLU A 1 108 ? 6.417   -37.393 -13.466 1.00 72.83 ? 136 GLU A CD  1 
ATOM   796  O OE1 . GLU A 1 108 ? 7.301   -38.281 -13.282 1.00 77.97 ? 136 GLU A OE1 1 
ATOM   797  O OE2 . GLU A 1 108 ? 6.345   -36.674 -14.502 1.00 77.83 ? 136 GLU A OE2 1 
ATOM   798  N N   . GLU A 1 109 ? 4.428   -36.406 -8.176  1.00 44.45 ? 137 GLU A N   1 
ATOM   799  C CA  . GLU A 1 109 ? 4.367   -36.565 -6.703  1.00 42.47 ? 137 GLU A CA  1 
ATOM   800  C C   . GLU A 1 109 ? 4.136   -35.218 -5.998  1.00 37.34 ? 137 GLU A C   1 
ATOM   801  O O   . GLU A 1 109 ? 4.481   -35.089 -4.787  1.00 34.55 ? 137 GLU A O   1 
ATOM   802  C CB  . GLU A 1 109 ? 5.620   -37.317 -6.265  1.00 46.09 ? 137 GLU A CB  1 
ATOM   803  C CG  . GLU A 1 109 ? 5.701   -38.681 -6.926  1.00 50.78 ? 137 GLU A CG  1 
ATOM   804  C CD  . GLU A 1 109 ? 6.348   -39.763 -6.078  1.00 55.82 ? 137 GLU A CD  1 
ATOM   805  O OE1 . GLU A 1 109 ? 5.822   -40.910 -6.050  1.00 61.15 ? 137 GLU A OE1 1 
ATOM   806  O OE2 . GLU A 1 109 ? 7.385   -39.464 -5.472  1.00 56.71 ? 137 GLU A OE2 1 
ATOM   807  N N   . SER A 1 110 ? 3.448   -34.274 -6.664  1.00 33.13 ? 138 SER A N   1 
ATOM   808  C CA  . SER A 1 110 ? 2.988   -33.027 -6.026  1.00 28.40 ? 138 SER A CA  1 
ATOM   809  C C   . SER A 1 110 ? 2.031   -33.346 -4.877  1.00 25.79 ? 138 SER A C   1 
ATOM   810  O O   . SER A 1 110 ? 1.061   -34.099 -5.035  1.00 25.79 ? 138 SER A O   1 
ATOM   811  C CB  . SER A 1 110 ? 2.294   -32.126 -6.998  1.00 28.80 ? 138 SER A CB  1 
ATOM   812  O OG  . SER A 1 110 ? 1.983   -30.906 -6.387  1.00 26.43 ? 138 SER A OG  1 
ATOM   813  N N   . LEU A 1 111 ? 2.195   -32.635 -3.787  1.00 23.06 ? 139 LEU A N   1 
ATOM   814  C CA  . LEU A 1 111 ? 1.236   -32.742 -2.673  1.00 22.63 ? 139 LEU A CA  1 
ATOM   815  C C   . LEU A 1 111 ? -0.101  -32.110 -3.093  1.00 21.32 ? 139 LEU A C   1 
ATOM   816  O O   . LEU A 1 111 ? -1.106  -32.390 -2.436  1.00 21.44 ? 139 LEU A O   1 
ATOM   817  C CB  . LEU A 1 111 ? 1.821   -32.119 -1.413  1.00 21.27 ? 139 LEU A CB  1 
ATOM   818  C CG  . LEU A 1 111 ? 3.049   -32.817 -0.827  1.00 23.27 ? 139 LEU A CG  1 
ATOM   819  C CD1 . LEU A 1 111 ? 3.313   -32.282 0.575   1.00 21.97 ? 139 LEU A CD1 1 
ATOM   820  C CD2 . LEU A 1 111 ? 2.890   -34.330 -0.829  1.00 25.41 ? 139 LEU A CD2 1 
ATOM   821  N N   . HIS A 1 112 ? -0.147  -31.350 -4.187  1.00 21.06 ? 140 HIS A N   1 
ATOM   822  C CA  . HIS A 1 112 ? -1.453  -30.888 -4.758  1.00 21.50 ? 140 HIS A CA  1 
ATOM   823  C C   . HIS A 1 112 ? -2.339  -32.089 -5.091  1.00 23.30 ? 140 HIS A C   1 
ATOM   824  O O   . HIS A 1 112 ? -3.562  -31.970 -5.040  1.00 22.75 ? 140 HIS A O   1 
ATOM   825  C CB  . HIS A 1 112 ? -1.268  -29.946 -5.970  1.00 21.47 ? 140 HIS A CB  1 
ATOM   826  C CG  . HIS A 1 112 ? -0.737  -28.618 -5.575  1.00 20.31 ? 140 HIS A CG  1 
ATOM   827  N ND1 . HIS A 1 112 ? -1.572  -27.549 -5.248  1.00 19.89 ? 140 HIS A ND1 1 
ATOM   828  C CD2 . HIS A 1 112 ? 0.529   -28.157 -5.453  1.00 20.61 ? 140 HIS A CD2 1 
ATOM   829  C CE1 . HIS A 1 112 ? -0.851  -26.494 -4.921  1.00 18.78 ? 140 HIS A CE1 1 
ATOM   830  N NE2 . HIS A 1 112 ? 0.461   -26.857 -5.011  1.00 19.29 ? 140 HIS A NE2 1 
ATOM   831  N N   . TYR A 1 113 ? -1.773  -33.220 -5.489  1.00 25.20 ? 141 TYR A N   1 
ATOM   832  C CA  . TYR A 1 113 ? -2.584  -34.384 -5.927  1.00 28.92 ? 141 TYR A CA  1 
ATOM   833  C C   . TYR A 1 113 ? -3.276  -35.059 -4.727  1.00 28.99 ? 141 TYR A C   1 
ATOM   834  O O   . TYR A 1 113 ? -4.183  -35.897 -4.957  1.00 30.17 ? 141 TYR A O   1 
ATOM   835  C CB  . TYR A 1 113 ? -1.719  -35.374 -6.711  1.00 32.34 ? 141 TYR A CB  1 
ATOM   836  C CG  . TYR A 1 113 ? -1.092  -34.832 -7.971  1.00 34.88 ? 141 TYR A CG  1 
ATOM   837  C CD1 . TYR A 1 113 ? -1.773  -33.979 -8.809  1.00 36.00 ? 141 TYR A CD1 1 
ATOM   838  C CD2 . TYR A 1 113 ? 0.191   -35.192 -8.356  1.00 37.96 ? 141 TYR A CD2 1 
ATOM   839  C CE1 . TYR A 1 113 ? -1.211  -33.485 -9.975  1.00 38.61 ? 141 TYR A CE1 1 
ATOM   840  C CE2 . TYR A 1 113 ? 0.780   -34.708 -9.516  1.00 39.84 ? 141 TYR A CE2 1 
ATOM   841  C CZ  . TYR A 1 113 ? 0.080   -33.834 -10.325 1.00 40.49 ? 141 TYR A CZ  1 
ATOM   842  O OH  . TYR A 1 113 ? 0.616   -33.354 -11.481 1.00 43.04 ? 141 TYR A OH  1 
ATOM   843  N N   . GLU A 1 114 ? -2.843  -34.704 -3.498  1.00 28.07 ? 142 GLU A N   1 
ATOM   844  C CA  . GLU A 1 114 ? -3.276  -35.305 -2.222  1.00 28.83 ? 142 GLU A CA  1 
ATOM   845  C C   . GLU A 1 114 ? -4.179  -34.316 -1.459  1.00 25.75 ? 142 GLU A C   1 
ATOM   846  O O   . GLU A 1 114 ? -4.611  -34.672 -0.337  1.00 25.10 ? 142 GLU A O   1 
ATOM   847  C CB  . GLU A 1 114 ? -2.040  -35.660 -1.367  1.00 30.08 ? 142 GLU A CB  1 
ATOM   848  C CG  . GLU A 1 114 ? -1.097  -36.646 -2.018  1.00 35.22 ? 142 GLU A CG  1 
ATOM   849  C CD  . GLU A 1 114 ? -0.263  -37.487 -1.059  1.00 37.36 ? 142 GLU A CD  1 
ATOM   850  O OE1 . GLU A 1 114 ? -0.086  -37.075 0.059   1.00 38.22 ? 142 GLU A OE1 1 
ATOM   851  O OE2 . GLU A 1 114 ? 0.172   -38.593 -1.440  1.00 44.76 ? 142 GLU A OE2 1 
ATOM   852  N N   . GLY A 1 115 ? -4.478  -33.120 -1.995  1.00 23.78 ? 143 GLY A N   1 
ATOM   853  C CA  . GLY A 1 115 ? -5.262  -32.104 -1.280  1.00 22.07 ? 143 GLY A CA  1 
ATOM   854  C C   . GLY A 1 115 ? -4.565  -31.548 -0.062  1.00 21.42 ? 143 GLY A C   1 
ATOM   855  O O   . GLY A 1 115 ? -5.240  -31.120 0.849   1.00 20.64 ? 143 GLY A O   1 
ATOM   856  N N   . ARG A 1 116 ? -3.233  -31.547 -0.060  1.00 20.74 ? 144 ARG A N   1 
ATOM   857  C CA  . ARG A 1 116 ? -2.417  -31.198 1.119   1.00 20.81 ? 144 ARG A CA  1 
ATOM   858  C C   . ARG A 1 116 ? -1.613  -29.960 0.775   1.00 18.40 ? 144 ARG A C   1 
ATOM   859  O O   . ARG A 1 116 ? -0.670  -29.649 1.533   1.00 17.02 ? 144 ARG A O   1 
ATOM   860  C CB  . ARG A 1 116 ? -1.383  -32.274 1.483   1.00 24.20 ? 144 ARG A CB  1 
ATOM   861  C CG  . ARG A 1 116 ? -1.948  -33.588 1.971   1.00 29.57 ? 144 ARG A CG  1 
ATOM   862  C CD  . ARG A 1 116 ? -0.819  -34.283 2.695   1.00 31.01 ? 144 ARG A CD  1 
ATOM   863  N NE  . ARG A 1 116 ? 0.134   -35.012 1.906   1.00 33.97 ? 144 ARG A NE  1 
ATOM   864  C CZ  . ARG A 1 116 ? 1.418   -35.222 2.229   1.00 34.81 ? 144 ARG A CZ  1 
ATOM   865  N NH1 . ARG A 1 116 ? 2.122   -36.070 1.494   1.00 36.94 ? 144 ARG A NH1 1 
ATOM   866  N NH2 . ARG A 1 116 ? 2.033   -34.577 3.207   1.00 31.43 ? 144 ARG A NH2 1 
ATOM   867  N N   . ALA A 1 117 ? -1.905  -29.265 -0.316  1.00 17.50 ? 145 ALA A N   1 
ATOM   868  C CA  . ALA A 1 117 ? -1.080  -28.109 -0.713  1.00 16.67 ? 145 ALA A CA  1 
ATOM   869  C C   . ALA A 1 117 ? -1.918  -27.046 -1.408  1.00 16.00 ? 145 ALA A C   1 
ATOM   870  O O   . ALA A 1 117 ? -2.806  -27.407 -2.204  1.00 16.07 ? 145 ALA A O   1 
ATOM   871  C CB  . ALA A 1 117 ? 0.051   -28.497 -1.631  1.00 17.66 ? 145 ALA A CB  1 
ATOM   872  N N   . VAL A 1 118 ? -1.571  -25.804 -1.148  1.00 14.18 ? 146 VAL A N   1 
ATOM   873  C CA  . VAL A 1 118 ? -2.209  -24.649 -1.813  1.00 15.27 ? 146 VAL A CA  1 
ATOM   874  C C   . VAL A 1 118 ? -1.122  -23.690 -2.315  1.00 14.37 ? 146 VAL A C   1 
ATOM   875  O O   . VAL A 1 118 ? -0.055  -23.503 -1.654  1.00 15.06 ? 146 VAL A O   1 
ATOM   876  C CB  . VAL A 1 118 ? -3.166  -23.904 -0.870  1.00 14.53 ? 146 VAL A CB  1 
ATOM   877  C CG1 . VAL A 1 118 ? -4.442  -24.718 -0.670  1.00 16.01 ? 146 VAL A CG1 1 
ATOM   878  C CG2 . VAL A 1 118 ? -2.471  -23.546 0.434   1.00 14.58 ? 146 VAL A CG2 1 
ATOM   879  N N   . ASP A 1 119 ? -1.365  -23.107 -3.485  1.00 13.96 ? 147 ASP A N   1 
ATOM   880  C CA  . ASP A 1 119 ? -0.604  -21.954 -3.971  1.00 13.81 ? 147 ASP A CA  1 
ATOM   881  C C   . ASP A 1 119 ? -1.453  -20.733 -3.670  1.00 13.01 ? 147 ASP A C   1 
ATOM   882  O O   . ASP A 1 119 ? -2.643  -20.787 -3.951  1.00 12.50 ? 147 ASP A O   1 
ATOM   883  C CB  . ASP A 1 119 ? -0.266  -22.110 -5.455  1.00 15.17 ? 147 ASP A CB  1 
ATOM   884  C CG  . ASP A 1 119 ? 0.689   -23.297 -5.707  1.00 16.45 ? 147 ASP A CG  1 
ATOM   885  O OD1 . ASP A 1 119 ? 1.412   -23.726 -4.792  1.00 16.33 ? 147 ASP A OD1 1 
ATOM   886  O OD2 . ASP A 1 119 ? 0.560   -23.847 -6.744  1.00 17.19 ? 147 ASP A OD2 1 
ATOM   887  N N   . ILE A 1 120 ? -0.841  -19.693 -3.110  1.00 12.86 ? 148 ILE A N   1 
ATOM   888  C CA  . ILE A 1 120 ? -1.580  -18.549 -2.564  1.00 12.96 ? 148 ILE A CA  1 
ATOM   889  C C   . ILE A 1 120 ? -0.993  -17.211 -2.980  1.00 13.45 ? 148 ILE A C   1 
ATOM   890  O O   . ILE A 1 120 ? 0.212   -17.114 -3.299  1.00 13.60 ? 148 ILE A O   1 
ATOM   891  C CB  . ILE A 1 120 ? -1.699  -18.618 -1.019  1.00 13.48 ? 148 ILE A CB  1 
ATOM   892  C CG1 . ILE A 1 120 ? -0.325  -18.611 -0.321  1.00 14.17 ? 148 ILE A CG1 1 
ATOM   893  C CG2 . ILE A 1 120 ? -2.506  -19.821 -0.617  1.00 12.95 ? 148 ILE A CG2 1 
ATOM   894  C CD1 . ILE A 1 120 ? -0.370  -18.424 1.195   1.00 14.85 ? 148 ILE A CD1 1 
ATOM   895  N N   . THR A 1 121 ? -1.866  -16.203 -2.860  1.00 13.19 ? 149 THR A N   1 
ATOM   896  C CA  . THR A 1 121 ? -1.536  -14.775 -3.031  1.00 14.41 ? 149 THR A CA  1 
ATOM   897  C C   . THR A 1 121 ? -2.377  -14.002 -2.043  1.00 14.79 ? 149 THR A C   1 
ATOM   898  O O   . THR A 1 121 ? -3.212  -14.624 -1.355  1.00 14.68 ? 149 THR A O   1 
ATOM   899  C CB  . THR A 1 121 ? -1.813  -14.245 -4.446  1.00 15.74 ? 149 THR A CB  1 
ATOM   900  O OG1 . THR A 1 121 ? -3.219  -14.128 -4.657  1.00 15.69 ? 149 THR A OG1 1 
ATOM   901  C CG2 . THR A 1 121 ? -1.243  -15.109 -5.546  1.00 15.67 ? 149 THR A CG2 1 
ATOM   902  N N   . THR A 1 122 ? -2.203  -12.688 -2.029  1.00 16.10 ? 150 THR A N   1 
ATOM   903  C CA  . THR A 1 122 ? -3.195  -11.768 -1.450  1.00 16.86 ? 150 THR A CA  1 
ATOM   904  C C   . THR A 1 122 ? -4.242  -11.466 -2.518  1.00 17.92 ? 150 THR A C   1 
ATOM   905  O O   . THR A 1 122 ? -3.950  -11.633 -3.746  1.00 17.72 ? 150 THR A O   1 
ATOM   906  C CB  . THR A 1 122 ? -2.542  -10.511 -0.878  1.00 18.45 ? 150 THR A CB  1 
ATOM   907  O OG1 . THR A 1 122 ? -1.705  -9.946  -1.889  1.00 19.70 ? 150 THR A OG1 1 
ATOM   908  C CG2 . THR A 1 122 ? -1.681  -10.761 0.340   1.00 17.88 ? 150 THR A CG2 1 
ATOM   909  N N   . SER A 1 123 ? -5.441  -11.088 -2.095  1.00 17.02 ? 151 SER A N   1 
ATOM   910  C CA  . SER A 1 123 ? -6.606  -10.850 -2.977  1.00 18.31 ? 151 SER A CA  1 
ATOM   911  C C   . SER A 1 123 ? -6.298  -9.707  -3.956  1.00 20.08 ? 151 SER A C   1 
ATOM   912  O O   . SER A 1 123 ? -6.893  -9.698  -5.089  1.00 21.18 ? 151 SER A O   1 
ATOM   913  C CB  . SER A 1 123 ? -7.847  -10.541 -2.139  1.00 19.56 ? 151 SER A CB  1 
ATOM   914  O OG  . SER A 1 123 ? -7.625  -9.451  -1.264  1.00 19.48 ? 151 SER A OG  1 
ATOM   915  N N   . ASP A 1 124 ? -5.402  -8.789  -3.567  1.00 20.89 ? 152 ASP A N   1 
ATOM   916  C CA  . ASP A 1 124 ? -5.097  -7.586  -4.404  1.00 23.69 ? 152 ASP A CA  1 
ATOM   917  C C   . ASP A 1 124 ? -3.984  -7.904  -5.408  1.00 23.62 ? 152 ASP A C   1 
ATOM   918  O O   . ASP A 1 124 ? -3.648  -6.993  -6.172  1.00 24.52 ? 152 ASP A O   1 
ATOM   919  C CB  . ASP A 1 124 ? -4.720  -6.366  -3.559  1.00 25.24 ? 152 ASP A CB  1 
ATOM   920  C CG  . ASP A 1 124 ? -3.526  -6.591  -2.656  1.00 24.62 ? 152 ASP A CG  1 
ATOM   921  O OD1 . ASP A 1 124 ? -2.986  -7.729  -2.660  1.00 23.86 ? 152 ASP A OD1 1 
ATOM   922  O OD2 . ASP A 1 124 ? -3.158  -5.618  -1.949  1.00 25.68 ? 152 ASP A OD2 1 
ATOM   923  N N   . ARG A 1 125 ? -3.425  -9.114  -5.373  1.00 22.17 ? 153 ARG A N   1 
ATOM   924  C CA  . ARG A 1 125 ? -2.316  -9.594  -6.252  1.00 23.27 ? 153 ARG A CA  1 
ATOM   925  C C   . ARG A 1 125 ? -1.160  -8.589  -6.238  1.00 24.94 ? 153 ARG A C   1 
ATOM   926  O O   . ARG A 1 125 ? -0.494  -8.411  -7.266  1.00 25.23 ? 153 ARG A O   1 
ATOM   927  C CB  . ARG A 1 125 ? -2.890  -9.862  -7.649  1.00 25.12 ? 153 ARG A CB  1 
ATOM   928  C CG  . ARG A 1 125 ? -3.840  -11.044 -7.604  1.00 25.72 ? 153 ARG A CG  1 
ATOM   929  C CD  . ARG A 1 125 ? -4.823  -11.128 -8.766  1.00 28.56 ? 153 ARG A CD  1 
ATOM   930  N NE  . ARG A 1 125 ? -4.160  -11.939 -9.786  1.00 29.64 ? 153 ARG A NE  1 
ATOM   931  C CZ  . ARG A 1 125 ? -4.752  -12.289 -10.942 1.00 32.94 ? 153 ARG A CZ  1 
ATOM   932  N NH1 . ARG A 1 125 ? -4.086  -13.030 -11.832 1.00 32.89 ? 153 ARG A NH1 1 
ATOM   933  N NH2 . ARG A 1 125 ? -5.986  -11.864 -11.177 1.00 31.44 ? 153 ARG A NH2 1 
ATOM   934  N N   . ASP A 1 126 ? -0.878  -8.043  -5.060  1.00 24.39 ? 154 ASP A N   1 
ATOM   935  C CA  . ASP A 1 126 ? 0.277   -7.160  -4.795  1.00 26.44 ? 154 ASP A CA  1 
ATOM   936  C C   . ASP A 1 126 ? 1.501   -8.024  -4.494  1.00 25.43 ? 154 ASP A C   1 
ATOM   937  O O   . ASP A 1 126 ? 1.648   -8.469  -3.340  1.00 22.99 ? 154 ASP A O   1 
ATOM   938  C CB  . ASP A 1 126 ? -0.025  -6.194  -3.665  1.00 27.58 ? 154 ASP A CB  1 
ATOM   939  C CG  . ASP A 1 126 ? 1.153   -5.295  -3.309  1.00 29.40 ? 154 ASP A CG  1 
ATOM   940  O OD1 . ASP A 1 126 ? 2.201   -5.391  -3.977  1.00 30.40 ? 154 ASP A OD1 1 
ATOM   941  O OD2 . ASP A 1 126 ? 0.973   -4.512  -2.368  1.00 30.94 ? 154 ASP A OD2 1 
ATOM   942  N N   . ARG A 1 127 ? 2.335   -8.235  -5.518  1.00 25.42 ? 155 ARG A N   1 
ATOM   943  C CA  . ARG A 1 127 ? 3.455   -9.190  -5.443  1.00 25.94 ? 155 ARG A CA  1 
ATOM   944  C C   . ARG A 1 127 ? 4.356   -8.788  -4.286  1.00 25.72 ? 155 ARG A C   1 
ATOM   945  O O   . ARG A 1 127 ? 5.005   -9.667  -3.734  1.00 24.77 ? 155 ARG A O   1 
ATOM   946  C CB  . ARG A 1 127 ? 4.207   -9.257  -6.766  1.00 27.47 ? 155 ARG A CB  1 
ATOM   947  C CG  . ARG A 1 127 ? 3.421   -9.920  -7.895  1.00 28.99 ? 155 ARG A CG  1 
ATOM   948  C CD  . ARG A 1 127 ? 4.312   -9.961  -9.122  1.00 31.45 ? 155 ARG A CD  1 
ATOM   949  N NE  . ARG A 1 127 ? 3.832   -10.876 -10.163 1.00 33.50 ? 155 ARG A NE  1 
ATOM   950  C CZ  . ARG A 1 127 ? 4.469   -11.156 -11.308 1.00 37.04 ? 155 ARG A CZ  1 
ATOM   951  N NH1 . ARG A 1 127 ? 5.631   -10.549 -11.587 1.00 38.08 ? 155 ARG A NH1 1 
ATOM   952  N NH2 . ARG A 1 127 ? 3.905   -11.987 -12.200 1.00 38.73 ? 155 ARG A NH2 1 
ATOM   953  N N   . SER A 1 128 ? 4.361   -7.517  -3.906  1.00 26.58 ? 156 SER A N   1 
ATOM   954  C CA  . SER A 1 128 ? 5.270   -7.002  -2.856  1.00 27.54 ? 156 SER A CA  1 
ATOM   955  C C   . SER A 1 128 ? 4.835   -7.535  -1.482  1.00 26.58 ? 156 SER A C   1 
ATOM   956  O O   . SER A 1 128 ? 5.669   -7.485  -0.547  1.00 26.50 ? 156 SER A O   1 
ATOM   957  C CB  . SER A 1 128 ? 5.381   -5.493  -2.864  1.00 29.76 ? 156 SER A CB  1 
ATOM   958  O OG  . SER A 1 128 ? 4.164   -4.886  -2.436  1.00 29.86 ? 156 SER A OG  1 
ATOM   959  N N   . LYS A 1 129 ? 3.613   -8.052  -1.353  1.00 25.05 ? 157 LYS A N   1 
ATOM   960  C CA  . LYS A 1 129 ? 3.096   -8.578  -0.049  1.00 23.07 ? 157 LYS A CA  1 
ATOM   961  C C   . LYS A 1 129 ? 3.490   -10.043 0.125   1.00 21.21 ? 157 LYS A C   1 
ATOM   962  O O   . LYS A 1 129 ? 3.256   -10.597 1.233   1.00 21.36 ? 157 LYS A O   1 
ATOM   963  C CB  . LYS A 1 129 ? 1.573   -8.420  0.035   1.00 23.21 ? 157 LYS A CB  1 
ATOM   964  C CG  . LYS A 1 129 ? 1.083   -6.991  0.221   1.00 25.38 ? 157 LYS A CG  1 
ATOM   965  C CD  . LYS A 1 129 ? -0.409  -6.877  0.441   1.00 25.90 ? 157 LYS A CD  1 
ATOM   966  C CE  . LYS A 1 129 ? -0.898  -5.446  0.602   1.00 28.07 ? 157 LYS A CE  1 
ATOM   967  N NZ  . LYS A 1 129 ? -1.141  -4.780  -0.687  1.00 29.29 ? 157 LYS A NZ  1 
ATOM   968  N N   . TYR A 1 130 ? 4.023   -10.701 -0.890  1.00 19.25 ? 158 TYR A N   1 
ATOM   969  C CA  . TYR A 1 130 ? 4.037   -12.202 -0.894  1.00 17.47 ? 158 TYR A CA  1 
ATOM   970  C C   . TYR A 1 130 ? 5.074   -12.740 0.101   1.00 17.26 ? 158 TYR A C   1 
ATOM   971  O O   . TYR A 1 130 ? 4.815   -13.831 0.662   1.00 16.69 ? 158 TYR A O   1 
ATOM   972  C CB  . TYR A 1 130 ? 4.223   -12.732 -2.324  1.00 16.77 ? 158 TYR A CB  1 
ATOM   973  C CG  . TYR A 1 130 ? 3.036   -12.529 -3.231  1.00 16.92 ? 158 TYR A CG  1 
ATOM   974  C CD1 . TYR A 1 130 ? 1.892   -11.819 -2.847  1.00 16.56 ? 158 TYR A CD1 1 
ATOM   975  C CD2 . TYR A 1 130 ? 3.122   -12.911 -4.556  1.00 17.05 ? 158 TYR A CD2 1 
ATOM   976  C CE1 . TYR A 1 130 ? 0.855   -11.577 -3.728  1.00 17.34 ? 158 TYR A CE1 1 
ATOM   977  C CE2 . TYR A 1 130 ? 2.094   -12.673 -5.453  1.00 17.41 ? 158 TYR A CE2 1 
ATOM   978  C CZ  . TYR A 1 130 ? 0.952   -11.998 -5.053  1.00 17.41 ? 158 TYR A CZ  1 
ATOM   979  O OH  . TYR A 1 130 ? -0.061  -11.750 -5.935  1.00 18.91 ? 158 TYR A OH  1 
ATOM   980  N N   . GLY A 1 131 ? 6.232   -12.092 0.266   1.00 18.53 ? 159 GLY A N   1 
ATOM   981  C CA  . GLY A 1 131 ? 7.218   -12.482 1.290   1.00 18.70 ? 159 GLY A CA  1 
ATOM   982  C C   . GLY A 1 131 ? 6.577   -12.520 2.670   1.00 19.37 ? 159 GLY A C   1 
ATOM   983  O O   . GLY A 1 131 ? 6.804   -13.488 3.402   1.00 18.92 ? 159 GLY A O   1 
ATOM   984  N N   . MET A 1 132 ? 5.838   -11.484 3.012   1.00 19.91 ? 160 MET A N   1 
ATOM   985  C CA  . MET A 1 132 ? 5.149   -11.424 4.327   1.00 21.28 ? 160 MET A CA  1 
ATOM   986  C C   . MET A 1 132 ? 4.016   -12.445 4.350   1.00 19.40 ? 160 MET A C   1 
ATOM   987  O O   . MET A 1 132 ? 3.861   -13.158 5.369   1.00 19.72 ? 160 MET A O   1 
ATOM   988  C CB  . MET A 1 132 ? 4.589   -10.028 4.617   1.00 23.77 ? 160 MET A CB  1 
ATOM   989  C CG  . MET A 1 132 ? 3.905   -9.971  5.975   1.00 25.99 ? 160 MET A CG  1 
ATOM   990  S SD  . MET A 1 132 ? 5.084   -10.357 7.330   1.00 29.38 ? 160 MET A SD  1 
ATOM   991  C CE  . MET A 1 132 ? 6.267   -9.056  7.046   1.00 32.71 ? 160 MET A CE  1 
ATOM   992  N N   . LEU A 1 133 ? 3.295   -12.657 3.230   1.00 17.80 ? 161 LEU A N   1 
ATOM   993  C CA  . LEU A 1 133 ? 2.245   -13.684 3.203   1.00 15.59 ? 161 LEU A CA  1 
ATOM   994  C C   . LEU A 1 133 ? 2.873   -15.019 3.588   1.00 15.35 ? 161 LEU A C   1 
ATOM   995  O O   . LEU A 1 133 ? 2.233   -15.837 4.299   1.00 14.85 ? 161 LEU A O   1 
ATOM   996  C CB  . LEU A 1 133 ? 1.606   -13.737 1.808   1.00 15.34 ? 161 LEU A CB  1 
ATOM   997  C CG  . LEU A 1 133 ? 0.540   -14.796 1.545   1.00 14.21 ? 161 LEU A CG  1 
ATOM   998  C CD1 . LEU A 1 133 ? -0.715  -14.543 2.376   1.00 14.29 ? 161 LEU A CD1 1 
ATOM   999  C CD2 . LEU A 1 133 ? 0.177   -14.794 0.050   1.00 14.33 ? 161 LEU A CD2 1 
ATOM   1000 N N   . ALA A 1 134 ? 4.018   -15.322 3.028   1.00 14.72 ? 162 ALA A N   1 
ATOM   1001 C CA  . ALA A 1 134 ? 4.694   -16.618 3.292   1.00 14.88 ? 162 ALA A CA  1 
ATOM   1002 C C   . ALA A 1 134 ? 5.016   -16.735 4.797   1.00 15.74 ? 162 ALA A C   1 
ATOM   1003 O O   . ALA A 1 134 ? 4.819   -17.833 5.389   1.00 15.02 ? 162 ALA A O   1 
ATOM   1004 C CB  . ALA A 1 134 ? 5.912   -16.701 2.436   1.00 15.05 ? 162 ALA A CB  1 
ATOM   1005 N N   . ARG A 1 135 ? 5.471   -15.649 5.410   1.00 16.62 ? 163 ARG A N   1 
ATOM   1006 C CA  . ARG A 1 135 ? 5.797   -15.627 6.864   1.00 16.94 ? 163 ARG A CA  1 
ATOM   1007 C C   . ARG A 1 135 ? 4.505   -15.911 7.629   1.00 17.16 ? 163 ARG A C   1 
ATOM   1008 O O   . ARG A 1 135 ? 4.507   -16.738 8.548   1.00 16.86 ? 163 ARG A O   1 
ATOM   1009 C CB  . ARG A 1 135 ? 6.427   -14.304 7.304   1.00 18.61 ? 163 ARG A CB  1 
ATOM   1010 C CG  . ARG A 1 135 ? 6.559   -14.179 8.823   1.00 20.63 ? 163 ARG A CG  1 
ATOM   1011 C CD  . ARG A 1 135 ? 7.303   -15.312 9.511   1.00 21.50 ? 163 ARG A CD  1 
ATOM   1012 N NE  . ARG A 1 135 ? 8.649   -15.504 9.044   1.00 22.09 ? 163 ARG A NE  1 
ATOM   1013 C CZ  . ARG A 1 135 ? 9.380   -16.561 9.316   1.00 23.22 ? 163 ARG A CZ  1 
ATOM   1014 N NH1 . ARG A 1 135 ? 8.912   -17.525 10.097  1.00 25.09 ? 163 ARG A NH1 1 
ATOM   1015 N NH2 . ARG A 1 135 ? 10.603  -16.628 8.866   1.00 24.31 ? 163 ARG A NH2 1 
ATOM   1016 N N   . LEU A 1 136 ? 3.415   -15.275 7.208   1.00 16.82 ? 164 LEU A N   1 
ATOM   1017 C CA  . LEU A 1 136 ? 2.124   -15.538 7.851   1.00 17.75 ? 164 LEU A CA  1 
ATOM   1018 C C   . LEU A 1 136 ? 1.755   -17.021 7.716   1.00 16.06 ? 164 LEU A C   1 
ATOM   1019 O O   . LEU A 1 136 ? 1.140   -17.548 8.685   1.00 16.45 ? 164 LEU A O   1 
ATOM   1020 C CB  . LEU A 1 136 ? 1.062   -14.582 7.315   1.00 18.50 ? 164 LEU A CB  1 
ATOM   1021 C CG  . LEU A 1 136 ? 1.286   -13.106 7.619   1.00 20.96 ? 164 LEU A CG  1 
ATOM   1022 C CD1 . LEU A 1 136 ? 0.199   -12.304 6.930   1.00 21.06 ? 164 LEU A CD1 1 
ATOM   1023 C CD2 . LEU A 1 136 ? 1.251   -12.812 9.100   1.00 22.76 ? 164 LEU A CD2 1 
ATOM   1024 N N   . ALA A 1 137 ? 2.002   -17.644 6.573   1.00 14.18 ? 165 ALA A N   1 
ATOM   1025 C CA  . ALA A 1 137 ? 1.676   -19.070 6.336   1.00 13.72 ? 165 ALA A CA  1 
ATOM   1026 C C   . ALA A 1 137 ? 2.485   -19.954 7.320   1.00 14.45 ? 165 ALA A C   1 
ATOM   1027 O O   . ALA A 1 137 ? 1.959   -20.960 7.880   1.00 14.25 ? 165 ALA A O   1 
ATOM   1028 C CB  . ALA A 1 137 ? 1.891   -19.452 4.880   1.00 13.36 ? 165 ALA A CB  1 
ATOM   1029 N N   . VAL A 1 138 ? 3.737   -19.590 7.536   1.00 15.69 ? 166 VAL A N   1 
ATOM   1030 C CA  . VAL A 1 138 ? 4.585   -20.337 8.513   1.00 16.47 ? 166 VAL A CA  1 
ATOM   1031 C C   . VAL A 1 138 ? 3.928   -20.179 9.894   1.00 17.64 ? 166 VAL A C   1 
ATOM   1032 O O   . VAL A 1 138 ? 3.756   -21.238 10.606  1.00 17.87 ? 166 VAL A O   1 
ATOM   1033 C CB  . VAL A 1 138 ? 6.032   -19.841 8.492   1.00 16.25 ? 166 VAL A CB  1 
ATOM   1034 C CG1 . VAL A 1 138 ? 6.841   -20.497 9.615   1.00 16.75 ? 166 VAL A CG1 1 
ATOM   1035 C CG2 . VAL A 1 138 ? 6.678   -20.127 7.152   1.00 15.48 ? 166 VAL A CG2 1 
ATOM   1036 N N   . GLU A 1 139 ? 3.578   -18.945 10.269  1.00 18.53 ? 167 GLU A N   1 
ATOM   1037 C CA  . GLU A 1 139 ? 3.020   -18.723 11.630  1.00 20.62 ? 167 GLU A CA  1 
ATOM   1038 C C   . GLU A 1 139 ? 1.669   -19.446 11.771  1.00 19.88 ? 167 GLU A C   1 
ATOM   1039 O O   . GLU A 1 139 ? 1.339   -19.827 12.925  1.00 20.64 ? 167 GLU A O   1 
ATOM   1040 C CB  . GLU A 1 139 ? 2.970   -17.225 11.974  1.00 23.44 ? 167 GLU A CB  1 
ATOM   1041 C CG  . GLU A 1 139 ? 4.352   -16.554 11.934  1.00 25.45 ? 167 GLU A CG  1 
ATOM   1042 C CD  . GLU A 1 139 ? 5.491   -17.194 12.756  1.00 29.57 ? 167 GLU A CD  1 
ATOM   1043 O OE1 . GLU A 1 139 ? 5.261   -17.460 13.916  1.00 31.60 ? 167 GLU A OE1 1 
ATOM   1044 O OE2 . GLU A 1 139 ? 6.591   -17.484 12.218  1.00 32.32 ? 167 GLU A OE2 1 
ATOM   1045 N N   . ALA A 1 140 ? 0.855   -19.553 10.715  1.00 17.62 ? 168 ALA A N   1 
ATOM   1046 C CA  . ALA A 1 140 ? -0.446  -20.254 10.700  1.00 18.29 ? 168 ALA A CA  1 
ATOM   1047 C C   . ALA A 1 140 ? -0.247  -21.776 10.857  1.00 18.14 ? 168 ALA A C   1 
ATOM   1048 O O   . ALA A 1 140 ? -1.241  -22.456 11.108  1.00 18.98 ? 168 ALA A O   1 
ATOM   1049 C CB  . ALA A 1 140 ? -1.181  -19.960 9.416   1.00 17.48 ? 168 ALA A CB  1 
ATOM   1050 N N   . GLY A 1 141 ? 0.970   -22.275 10.689  1.00 18.10 ? 169 GLY A N   1 
ATOM   1051 C CA  . GLY A 1 141 ? 1.316   -23.678 10.982  1.00 18.83 ? 169 GLY A CA  1 
ATOM   1052 C C   . GLY A 1 141 ? 1.400   -24.567 9.759   1.00 17.85 ? 169 GLY A C   1 
ATOM   1053 O O   . GLY A 1 141 ? 1.477   -25.821 9.947   1.00 16.55 ? 169 GLY A O   1 
ATOM   1054 N N   . PHE A 1 142 ? 1.453   -23.998 8.550   1.00 16.94 ? 170 PHE A N   1 
ATOM   1055 C CA  . PHE A 1 142 ? 1.802   -24.840 7.369   1.00 15.62 ? 170 PHE A CA  1 
ATOM   1056 C C   . PHE A 1 142 ? 3.152   -25.538 7.614   1.00 15.80 ? 170 PHE A C   1 
ATOM   1057 O O   . PHE A 1 142 ? 4.102   -24.894 8.146   1.00 15.99 ? 170 PHE A O   1 
ATOM   1058 C CB  . PHE A 1 142 ? 1.740   -24.041 6.075   1.00 14.84 ? 170 PHE A CB  1 
ATOM   1059 C CG  . PHE A 1 142 ? 0.347   -23.825 5.568   1.00 13.59 ? 170 PHE A CG  1 
ATOM   1060 C CD1 . PHE A 1 142 ? -0.266  -24.788 4.788   1.00 13.46 ? 170 PHE A CD1 1 
ATOM   1061 C CD2 . PHE A 1 142 ? -0.339  -22.655 5.840   1.00 14.24 ? 170 PHE A CD2 1 
ATOM   1062 C CE1 . PHE A 1 142 ? -1.540  -24.609 4.287   1.00 13.31 ? 170 PHE A CE1 1 
ATOM   1063 C CE2 . PHE A 1 142 ? -1.600  -22.462 5.311   1.00 13.66 ? 170 PHE A CE2 1 
ATOM   1064 C CZ  . PHE A 1 142 ? -2.198  -23.443 4.565   1.00 13.24 ? 170 PHE A CZ  1 
ATOM   1065 N N   . ASP A 1 143 ? 3.229   -26.839 7.300   1.00 16.28 ? 171 ASP A N   1 
ATOM   1066 C CA  . ASP A 1 143 ? 4.390   -27.699 7.554   1.00 16.57 ? 171 ASP A CA  1 
ATOM   1067 C C   . ASP A 1 143 ? 5.531   -27.377 6.585   1.00 15.75 ? 171 ASP A C   1 
ATOM   1068 O O   . ASP A 1 143 ? 6.687   -27.750 6.878   1.00 16.68 ? 171 ASP A O   1 
ATOM   1069 C CB  . ASP A 1 143 ? 3.968   -29.153 7.559   1.00 18.25 ? 171 ASP A CB  1 
ATOM   1070 C CG  . ASP A 1 143 ? 2.898   -29.373 8.629   1.00 19.82 ? 171 ASP A CG  1 
ATOM   1071 O OD1 . ASP A 1 143 ? 3.221   -29.121 9.802   1.00 19.53 ? 171 ASP A OD1 1 
ATOM   1072 O OD2 . ASP A 1 143 ? 1.755   -29.773 8.291   1.00 19.45 ? 171 ASP A OD2 1 
ATOM   1073 N N   . TRP A 1 144 ? 5.207   -26.764 5.452   1.00 14.87 ? 172 TRP A N   1 
ATOM   1074 C CA  . TRP A 1 144 ? 6.233   -26.356 4.490   1.00 14.20 ? 172 TRP A CA  1 
ATOM   1075 C C   . TRP A 1 144 ? 5.735   -25.155 3.727   1.00 13.82 ? 172 TRP A C   1 
ATOM   1076 O O   . TRP A 1 144 ? 4.559   -25.158 3.259   1.00 13.53 ? 172 TRP A O   1 
ATOM   1077 C CB  . TRP A 1 144 ? 6.637   -27.487 3.528   1.00 15.02 ? 172 TRP A CB  1 
ATOM   1078 C CG  . TRP A 1 144 ? 7.960   -27.277 2.848   1.00 14.65 ? 172 TRP A CG  1 
ATOM   1079 C CD1 . TRP A 1 144 ? 9.215   -27.322 3.418   1.00 15.30 ? 172 TRP A CD1 1 
ATOM   1080 C CD2 . TRP A 1 144 ? 8.199   -27.070 1.432   1.00 15.10 ? 172 TRP A CD2 1 
ATOM   1081 N NE1 . TRP A 1 144 ? 10.199  -27.141 2.474   1.00 16.04 ? 172 TRP A NE1 1 
ATOM   1082 C CE2 . TRP A 1 144 ? 9.597   -26.983 1.244   1.00 15.72 ? 172 TRP A CE2 1 
ATOM   1083 C CE3 . TRP A 1 144 ? 7.340   -26.902 0.329   1.00 14.91 ? 172 TRP A CE3 1 
ATOM   1084 C CZ2 . TRP A 1 144 ? 10.180  -26.785 0.010   1.00 16.59 ? 172 TRP A CZ2 1 
ATOM   1085 C CZ3 . TRP A 1 144 ? 7.924   -26.712 -0.906  1.00 15.73 ? 172 TRP A CZ3 1 
ATOM   1086 C CH2 . TRP A 1 144 ? 9.304   -26.662 -1.060  1.00 16.49 ? 172 TRP A CH2 1 
ATOM   1087 N N   . VAL A 1 145 ? 6.587   -24.158 3.634   1.00 13.66 ? 173 VAL A N   1 
ATOM   1088 C CA  . VAL A 1 145 ? 6.246   -22.901 2.949   1.00 13.35 ? 173 VAL A CA  1 
ATOM   1089 C C   . VAL A 1 145 ? 7.401   -22.517 2.030   1.00 14.08 ? 173 VAL A C   1 
ATOM   1090 O O   . VAL A 1 145 ? 8.576   -22.429 2.527   1.00 15.67 ? 173 VAL A O   1 
ATOM   1091 C CB  . VAL A 1 145 ? 5.858   -21.756 3.909   1.00 13.50 ? 173 VAL A CB  1 
ATOM   1092 C CG1 . VAL A 1 145 ? 5.616   -20.461 3.145   1.00 13.40 ? 173 VAL A CG1 1 
ATOM   1093 C CG2 . VAL A 1 145 ? 4.649   -22.095 4.778   1.00 13.44 ? 173 VAL A CG2 1 
ATOM   1094 N N   . TYR A 1 146 ? 7.062   -22.203 0.756   1.00 13.19 ? 174 TYR A N   1 
ATOM   1095 C CA  . TYR A 1 146 ? 8.077   -22.033 -0.304  1.00 13.59 ? 174 TYR A CA  1 
ATOM   1096 C C   . TYR A 1 146 ? 7.692   -20.804 -1.148  1.00 13.80 ? 174 TYR A C   1 
ATOM   1097 O O   . TYR A 1 146 ? 6.596   -20.780 -1.728  1.00 13.66 ? 174 TYR A O   1 
ATOM   1098 C CB  . TYR A 1 146 ? 8.305   -23.304 -1.088  1.00 14.22 ? 174 TYR A CB  1 
ATOM   1099 C CG  . TYR A 1 146 ? 9.161   -23.176 -2.326  1.00 15.08 ? 174 TYR A CG  1 
ATOM   1100 C CD1 . TYR A 1 146 ? 10.364  -22.455 -2.351  1.00 16.31 ? 174 TYR A CD1 1 
ATOM   1101 C CD2 . TYR A 1 146 ? 8.868   -23.952 -3.438  1.00 15.82 ? 174 TYR A CD2 1 
ATOM   1102 C CE1 . TYR A 1 146 ? 11.175  -22.438 -3.488  1.00 17.36 ? 174 TYR A CE1 1 
ATOM   1103 C CE2 . TYR A 1 146 ? 9.671   -23.946 -4.575  1.00 17.37 ? 174 TYR A CE2 1 
ATOM   1104 C CZ  . TYR A 1 146 ? 10.812  -23.165 -4.610  1.00 18.19 ? 174 TYR A CZ  1 
ATOM   1105 O OH  . TYR A 1 146 ? 11.628  -23.227 -5.701  1.00 19.01 ? 174 TYR A OH  1 
ATOM   1106 N N   . TYR A 1 147 ? 8.539   -19.776 -1.124  1.00 14.84 ? 175 TYR A N   1 
ATOM   1107 C CA  . TYR A 1 147 ? 8.355   -18.549 -1.968  1.00 15.59 ? 175 TYR A CA  1 
ATOM   1108 C C   . TYR A 1 147 ? 8.783   -18.938 -3.399  1.00 16.65 ? 175 TYR A C   1 
ATOM   1109 O O   . TYR A 1 147 ? 9.859   -18.638 -3.892  1.00 16.84 ? 175 TYR A O   1 
ATOM   1110 C CB  . TYR A 1 147 ? 9.125   -17.373 -1.370  1.00 16.36 ? 175 TYR A CB  1 
ATOM   1111 C CG  . TYR A 1 147 ? 8.825   -16.004 -1.927  1.00 16.85 ? 175 TYR A CG  1 
ATOM   1112 C CD1 . TYR A 1 147 ? 9.204   -14.885 -1.215  1.00 17.38 ? 175 TYR A CD1 1 
ATOM   1113 C CD2 . TYR A 1 147 ? 8.141   -15.805 -3.125  1.00 16.71 ? 175 TYR A CD2 1 
ATOM   1114 C CE1 . TYR A 1 147 ? 8.895   -13.607 -1.656  1.00 18.63 ? 175 TYR A CE1 1 
ATOM   1115 C CE2 . TYR A 1 147 ? 7.882   -14.523 -3.600  1.00 17.72 ? 175 TYR A CE2 1 
ATOM   1116 C CZ  . TYR A 1 147 ? 8.283   -13.409 -2.870  1.00 18.89 ? 175 TYR A CZ  1 
ATOM   1117 O OH  . TYR A 1 147 ? 8.027   -12.126 -3.309  1.00 19.56 ? 175 TYR A OH  1 
ATOM   1118 N N   . GLU A 1 148 ? 7.893   -19.678 -4.067  1.00 16.04 ? 176 GLU A N   1 
ATOM   1119 C CA  . GLU A 1 148 ? 8.225   -20.482 -5.275  1.00 17.24 ? 176 GLU A CA  1 
ATOM   1120 C C   . GLU A 1 148 ? 8.366   -19.584 -6.515  1.00 18.37 ? 176 GLU A C   1 
ATOM   1121 O O   . GLU A 1 148 ? 9.192   -19.893 -7.387  1.00 18.90 ? 176 GLU A O   1 
ATOM   1122 C CB  . GLU A 1 148 ? 7.156   -21.537 -5.517  1.00 17.01 ? 176 GLU A CB  1 
ATOM   1123 C CG  . GLU A 1 148 ? 7.348   -22.373 -6.769  1.00 19.19 ? 176 GLU A CG  1 
ATOM   1124 C CD  . GLU A 1 148 ? 6.519   -23.651 -6.801  1.00 20.31 ? 176 GLU A CD  1 
ATOM   1125 O OE1 . GLU A 1 148 ? 5.399   -23.647 -6.272  1.00 20.96 ? 176 GLU A OE1 1 
ATOM   1126 O OE2 . GLU A 1 148 ? 7.052   -24.673 -7.286  1.00 23.49 ? 176 GLU A OE2 1 
ATOM   1127 N N   . SER A 1 149 ? 7.599   -18.509 -6.613  1.00 17.84 ? 177 SER A N   1 
ATOM   1128 C CA  . SER A 1 149 ? 7.655   -17.613 -7.778  1.00 19.63 ? 177 SER A CA  1 
ATOM   1129 C C   . SER A 1 149 ? 7.325   -16.207 -7.326  1.00 18.62 ? 177 SER A C   1 
ATOM   1130 O O   . SER A 1 149 ? 6.754   -16.037 -6.269  1.00 18.44 ? 177 SER A O   1 
ATOM   1131 C CB  . SER A 1 149 ? 6.756   -18.124 -8.897  1.00 20.45 ? 177 SER A CB  1 
ATOM   1132 O OG  . SER A 1 149 ? 5.475   -17.549 -8.839  1.00 19.80 ? 177 SER A OG  1 
ATOM   1133 N N   . LYS A 1 150 ? 7.534   -15.237 -8.205  1.00 20.55 ? 178 LYS A N   1 
ATOM   1134 C CA  . LYS A 1 150 ? 7.080   -13.847 -7.962  1.00 22.04 ? 178 LYS A CA  1 
ATOM   1135 C C   . LYS A 1 150 ? 5.570   -13.778 -7.851  1.00 20.09 ? 178 LYS A C   1 
ATOM   1136 O O   . LYS A 1 150 ? 5.055   -12.808 -7.246  1.00 20.11 ? 178 LYS A O   1 
ATOM   1137 C CB  . LYS A 1 150 ? 7.532   -12.934 -9.100  1.00 26.00 ? 178 LYS A CB  1 
ATOM   1138 C CG  . LYS A 1 150 ? 9.025   -12.738 -9.158  1.00 30.37 ? 178 LYS A CG  1 
ATOM   1139 C CD  . LYS A 1 150 ? 9.377   -11.682 -10.181 1.00 35.54 ? 178 LYS A CD  1 
ATOM   1140 C CE  . LYS A 1 150 ? 10.831  -11.294 -10.100 1.00 41.05 ? 178 LYS A CE  1 
ATOM   1141 N NZ  . LYS A 1 150 ? 11.741  -12.422 -10.386 1.00 42.69 ? 178 LYS A NZ  1 
ATOM   1142 N N   . ALA A 1 151 ? 4.872   -14.761 -8.418  1.00 19.43 ? 179 ALA A N   1 
ATOM   1143 C CA  . ALA A 1 151 ? 3.404   -14.750 -8.593  1.00 18.11 ? 179 ALA A CA  1 
ATOM   1144 C C   . ALA A 1 151 ? 2.677   -15.526 -7.475  1.00 16.49 ? 179 ALA A C   1 
ATOM   1145 O O   . ALA A 1 151 ? 1.457   -15.447 -7.432  1.00 15.93 ? 179 ALA A O   1 
ATOM   1146 C CB  . ALA A 1 151 ? 3.056   -15.316 -9.975  1.00 19.16 ? 179 ALA A CB  1 
ATOM   1147 N N   . HIS A 1 152 ? 3.370   -16.311 -6.653  1.00 16.29 ? 180 HIS A N   1 
ATOM   1148 C CA  . HIS A 1 152 ? 2.689   -17.157 -5.640  1.00 15.14 ? 180 HIS A CA  1 
ATOM   1149 C C   . HIS A 1 152 ? 3.652   -17.710 -4.598  1.00 14.04 ? 180 HIS A C   1 
ATOM   1150 O O   . HIS A 1 152 ? 4.861   -17.858 -4.849  1.00 14.46 ? 180 HIS A O   1 
ATOM   1151 C CB  . HIS A 1 152 ? 1.903   -18.309 -6.292  1.00 15.12 ? 180 HIS A CB  1 
ATOM   1152 C CG  . HIS A 1 152 ? 2.742   -19.474 -6.663  1.00 15.98 ? 180 HIS A CG  1 
ATOM   1153 N ND1 . HIS A 1 152 ? 3.513   -19.457 -7.809  1.00 16.96 ? 180 HIS A ND1 1 
ATOM   1154 C CD2 . HIS A 1 152 ? 2.953   -20.662 -6.049  1.00 15.08 ? 180 HIS A CD2 1 
ATOM   1155 C CE1 . HIS A 1 152 ? 4.185   -20.603 -7.857  1.00 18.34 ? 180 HIS A CE1 1 
ATOM   1156 N NE2 . HIS A 1 152 ? 3.833   -21.371 -6.784  1.00 16.16 ? 180 HIS A NE2 1 
ATOM   1157 N N   . ILE A 1 153 ? 3.048   -18.067 -3.461  1.00 14.10 ? 181 ILE A N   1 
ATOM   1158 C CA  . ILE A 1 153 ? 3.671   -18.836 -2.344  1.00 13.48 ? 181 ILE A CA  1 
ATOM   1159 C C   . ILE A 1 153 ? 3.040   -20.224 -2.311  1.00 13.64 ? 181 ILE A C   1 
ATOM   1160 O O   . ILE A 1 153 ? 1.807   -20.366 -2.563  1.00 14.32 ? 181 ILE A O   1 
ATOM   1161 C CB  . ILE A 1 153 ? 3.410   -18.139 -1.018  1.00 13.47 ? 181 ILE A CB  1 
ATOM   1162 C CG1 . ILE A 1 153 ? 3.815   -16.676 -1.026  1.00 14.16 ? 181 ILE A CG1 1 
ATOM   1163 C CG2 . ILE A 1 153 ? 4.046   -18.948 0.137   1.00 14.19 ? 181 ILE A CG2 1 
ATOM   1164 C CD1 . ILE A 1 153 ? 5.269   -16.444 -1.352  1.00 14.91 ? 181 ILE A CD1 1 
ATOM   1165 N N   . HIS A 1 154 ? 3.866   -21.229 -2.173  1.00 13.91 ? 182 HIS A N   1 
ATOM   1166 C CA  . HIS A 1 154 ? 3.435   -22.632 -2.146  1.00 13.82 ? 182 HIS A CA  1 
ATOM   1167 C C   . HIS A 1 154 ? 3.472   -23.083 -0.685  1.00 13.85 ? 182 HIS A C   1 
ATOM   1168 O O   . HIS A 1 154 ? 4.528   -22.935 -0.036  1.00 13.94 ? 182 HIS A O   1 
ATOM   1169 C CB  . HIS A 1 154 ? 4.281   -23.534 -3.033  1.00 15.49 ? 182 HIS A CB  1 
ATOM   1170 C CG  . HIS A 1 154 ? 4.035   -24.982 -2.744  1.00 16.53 ? 182 HIS A CG  1 
ATOM   1171 N ND1 . HIS A 1 154 ? 3.071   -25.740 -3.417  1.00 20.06 ? 182 HIS A ND1 1 
ATOM   1172 C CD2 . HIS A 1 154 ? 4.592   -25.822 -1.867  1.00 16.99 ? 182 HIS A CD2 1 
ATOM   1173 C CE1 . HIS A 1 154 ? 3.118   -26.990 -2.970  1.00 20.39 ? 182 HIS A CE1 1 
ATOM   1174 N NE2 . HIS A 1 154 ? 4.100   -27.093 -2.080  1.00 17.85 ? 182 HIS A NE2 1 
ATOM   1175 N N   . CYS A 1 155 ? 2.352   -23.619 -0.201  1.00 13.40 ? 183 CYS A N   1 
ATOM   1176 C CA  . CYS A 1 155 ? 2.202   -24.066 1.201   1.00 13.40 ? 183 CYS A CA  1 
ATOM   1177 C C   . CYS A 1 155 ? 1.696   -25.480 1.241   1.00 14.22 ? 183 CYS A C   1 
ATOM   1178 O O   . CYS A 1 155 ? 0.781   -25.826 0.470   1.00 14.83 ? 183 CYS A O   1 
ATOM   1179 C CB  . CYS A 1 155 ? 1.252   -23.216 2.026   1.00 13.80 ? 183 CYS A CB  1 
ATOM   1180 S SG  . CYS A 1 155 ? 1.592   -21.445 1.885   1.00 15.99 ? 183 CYS A SG  1 
ATOM   1181 N N   . SER A 1 156 ? 2.221   -26.309 2.127   1.00 13.83 ? 184 SER A N   1 
ATOM   1182 C CA  . SER A 1 156 ? 1.676   -27.679 2.256   1.00 14.69 ? 184 SER A CA  1 
ATOM   1183 C C   . SER A 1 156 ? 1.639   -28.122 3.717   1.00 15.31 ? 184 SER A C   1 
ATOM   1184 O O   . SER A 1 156 ? 2.247   -27.466 4.609   1.00 15.56 ? 184 SER A O   1 
ATOM   1185 C CB  . SER A 1 156 ? 2.419   -28.672 1.391   1.00 15.36 ? 184 SER A CB  1 
ATOM   1186 O OG  . SER A 1 156 ? 3.788   -28.771 1.828   1.00 15.69 ? 184 SER A OG  1 
ATOM   1187 N N   . VAL A 1 157 ? 0.939   -29.220 3.921   1.00 16.89 ? 185 VAL A N   1 
ATOM   1188 C CA  . VAL A 1 157 ? 0.806   -29.821 5.275   1.00 17.06 ? 185 VAL A CA  1 
ATOM   1189 C C   . VAL A 1 157 ? 1.149   -31.293 5.245   1.00 19.07 ? 185 VAL A C   1 
ATOM   1190 O O   . VAL A 1 157 ? 0.939   -32.023 4.212   1.00 18.72 ? 185 VAL A O   1 
ATOM   1191 C CB  . VAL A 1 157 ? -0.586  -29.609 5.887   1.00 17.03 ? 185 VAL A CB  1 
ATOM   1192 C CG1 . VAL A 1 157 ? -0.885  -28.128 6.134   1.00 15.69 ? 185 VAL A CG1 1 
ATOM   1193 C CG2 . VAL A 1 157 ? -1.689  -30.292 5.044   1.00 17.59 ? 185 VAL A CG2 1 
ATOM   1194 N N   . LYS A 1 158 ? 1.503   -31.763 6.439   1.00 19.48 ? 186 LYS A N   1 
ATOM   1195 C CA  . LYS A 1 158 ? 1.612   -33.210 6.709   1.00 22.47 ? 186 LYS A CA  1 
ATOM   1196 C C   . LYS A 1 158 ? 0.275   -33.901 6.438   1.00 23.41 ? 186 LYS A C   1 
ATOM   1197 O O   . LYS A 1 158 ? -0.794  -33.295 6.551   1.00 21.72 ? 186 LYS A O   1 
ATOM   1198 C CB  . LYS A 1 158 ? 2.068   -33.423 8.156   1.00 24.23 ? 186 LYS A CB  1 
ATOM   1199 C CG  . LYS A 1 158 ? 3.445   -32.891 8.449   1.00 25.66 ? 186 LYS A CG  1 
ATOM   1200 C CD  . LYS A 1 158 ? 3.689   -32.819 9.975   1.00 28.93 ? 186 LYS A CD  1 
ATOM   1201 C CE  . LYS A 1 158 ? 5.056   -32.258 10.334  1.00 30.08 ? 186 LYS A CE  1 
ATOM   1202 N NZ  . LYS A 1 158 ? 6.163   -33.128 9.848   1.00 31.53 ? 186 LYS A NZ  1 
ATOM   1203 N N   . ALA A 1 159 ? 0.355   -35.179 6.140   1.00 26.77 ? 187 ALA A N   1 
ATOM   1204 C CA  . ALA A 1 159 ? -0.796  -36.105 6.055   1.00 30.28 ? 187 ALA A CA  1 
ATOM   1205 C C   . ALA A 1 159 ? -1.495  -36.288 7.418   1.00 31.90 ? 187 ALA A C   1 
ATOM   1206 O O   . ALA A 1 159 ? -0.858  -36.133 8.463   1.00 32.10 ? 187 ALA A O   1 
ATOM   1207 C CB  . ALA A 1 159 ? -0.304  -37.439 5.538   1.00 31.99 ? 187 ALA A CB  1 
ATOM   1208 N N   . GLU A 1 160 ? -2.775  -36.666 7.371   1.00 34.36 ? 188 GLU A N   1 
ATOM   1209 C CA  . GLU A 1 160 ? -3.600  -37.085 8.532   1.00 36.37 ? 188 GLU A CA  1 
ATOM   1210 C C   . GLU A 1 160 ? -3.077  -38.469 8.994   1.00 39.60 ? 188 GLU A C   1 
ATOM   1211 O O   . GLU A 1 160 ? -2.575  -38.349 10.061  1.00 41.57 ? 188 GLU A O   1 
ATOM   1212 C CB  . GLU A 1 160 ? -5.094  -37.205 8.173   1.00 36.75 ? 188 GLU A CB  1 
ATOM   1213 C CG  . GLU A 1 160 ? -5.736  -36.034 7.426   1.00 34.94 ? 188 GLU A CG  1 
ATOM   1214 C CD  . GLU A 1 160 ? -5.758  -34.707 8.190   1.00 33.34 ? 188 GLU A CD  1 
ATOM   1215 O OE1 . GLU A 1 160 ? -6.124  -34.741 9.408   1.00 35.49 ? 188 GLU A OE1 1 
ATOM   1216 O OE2 . GLU A 1 160 ? -5.394  -33.652 7.616   1.00 28.09 ? 188 GLU A OE2 1 
ATOM   1217 N N   . GLN B 2 1   ? -11.002 -24.996 -23.781 1.00 46.91 ? 1   GLN H N   1 
ATOM   1218 C CA  . GLN B 2 1   ? -9.732  -24.804 -24.582 1.00 44.59 ? 1   GLN H CA  1 
ATOM   1219 C C   . GLN B 2 1   ? -9.311  -23.317 -24.632 1.00 39.57 ? 1   GLN H C   1 
ATOM   1220 O O   . GLN B 2 1   ? -9.999  -22.478 -25.237 1.00 36.09 ? 1   GLN H O   1 
ATOM   1221 C CB  . GLN B 2 1   ? -9.910  -25.348 -25.998 1.00 48.59 ? 1   GLN H CB  1 
ATOM   1222 C CG  . GLN B 2 1   ? -8.754  -25.008 -26.938 1.00 51.54 ? 1   GLN H CG  1 
ATOM   1223 C CD  . GLN B 2 1   ? -7.451  -25.585 -26.434 1.00 55.44 ? 1   GLN H CD  1 
ATOM   1224 O OE1 . GLN B 2 1   ? -7.409  -26.719 -25.947 1.00 62.20 ? 1   GLN H OE1 1 
ATOM   1225 N NE2 . GLN B 2 1   ? -6.383  -24.805 -26.544 1.00 54.35 ? 1   GLN H NE2 1 
ATOM   1226 N N   . VAL B 2 2   ? -8.153  -22.987 -24.074 1.00 35.04 ? 2   VAL H N   1 
ATOM   1227 C CA  . VAL B 2 2   ? -7.655  -21.590 -24.093 1.00 30.05 ? 2   VAL H CA  1 
ATOM   1228 C C   . VAL B 2 2   ? -7.248  -21.284 -25.526 1.00 26.33 ? 2   VAL H C   1 
ATOM   1229 O O   . VAL B 2 2   ? -6.589  -22.121 -26.142 1.00 26.97 ? 2   VAL H O   1 
ATOM   1230 C CB  . VAL B 2 2   ? -6.450  -21.407 -23.162 1.00 29.41 ? 2   VAL H CB  1 
ATOM   1231 C CG1 . VAL B 2 2   ? -5.849  -20.048 -23.386 1.00 28.16 ? 2   VAL H CG1 1 
ATOM   1232 C CG2 . VAL B 2 2   ? -6.846  -21.634 -21.719 1.00 31.03 ? 2   VAL H CG2 1 
ATOM   1233 N N   . GLN B 2 3   ? -7.605  -20.115 -26.034 1.00 24.36 ? 3   GLN H N   1 
ATOM   1234 C CA  A GLN B 2 3   ? -7.177  -19.684 -27.386 0.50 22.75 ? 3   GLN H CA  1 
ATOM   1235 C CA  B GLN B 2 3   ? -7.166  -19.689 -27.385 0.50 23.27 ? 3   GLN H CA  1 
ATOM   1236 C C   . GLN B 2 3   ? -6.915  -18.182 -27.371 1.00 20.88 ? 3   GLN H C   1 
ATOM   1237 O O   . GLN B 2 3   ? -7.721  -17.479 -26.807 1.00 20.55 ? 3   GLN H O   1 
ATOM   1238 C CB  A GLN B 2 3   ? -8.256  -20.010 -28.420 0.50 24.30 ? 3   GLN H CB  1 
ATOM   1239 C CB  B GLN B 2 3   ? -8.189  -20.030 -28.478 0.50 25.59 ? 3   GLN H CB  1 
ATOM   1240 C CG  A GLN B 2 3   ? -8.351  -21.491 -28.708 0.50 26.05 ? 3   GLN H CG  1 
ATOM   1241 C CG  B GLN B 2 3   ? -7.533  -20.040 -29.847 0.50 26.17 ? 3   GLN H CG  1 
ATOM   1242 C CD  A GLN B 2 3   ? -9.278  -21.736 -29.873 0.50 27.20 ? 3   GLN H CD  1 
ATOM   1243 C CD  B GLN B 2 3   ? -8.426  -19.733 -31.020 0.50 28.37 ? 3   GLN H CD  1 
ATOM   1244 O OE1 A GLN B 2 3   ? -9.105  -21.165 -30.953 0.50 27.59 ? 3   GLN H OE1 1 
ATOM   1245 O OE1 B GLN B 2 3   ? -9.627  -19.503 -30.879 0.50 31.57 ? 3   GLN H OE1 1 
ATOM   1246 N NE2 A GLN B 2 3   ? -10.180 -22.677 -29.682 0.50 29.16 ? 3   GLN H NE2 1 
ATOM   1247 N NE2 B GLN B 2 3   ? -7.809  -19.711 -32.199 0.50 28.45 ? 3   GLN H NE2 1 
ATOM   1248 N N   . LEU B 2 4   ? -5.830  -17.770 -27.983 1.00 18.50 ? 4   LEU H N   1 
ATOM   1249 C CA  . LEU B 2 4   ? -5.534  -16.358 -28.272 1.00 18.40 ? 4   LEU H CA  1 
ATOM   1250 C C   . LEU B 2 4   ? -5.575  -16.215 -29.794 1.00 18.22 ? 4   LEU H C   1 
ATOM   1251 O O   . LEU B 2 4   ? -4.718  -16.788 -30.460 1.00 18.46 ? 4   LEU H O   1 
ATOM   1252 C CB  . LEU B 2 4   ? -4.158  -16.006 -27.702 1.00 17.81 ? 4   LEU H CB  1 
ATOM   1253 C CG  . LEU B 2 4   ? -4.129  -16.064 -26.176 1.00 18.94 ? 4   LEU H CG  1 
ATOM   1254 C CD1 . LEU B 2 4   ? -2.723  -15.688 -25.676 1.00 18.90 ? 4   LEU H CD1 1 
ATOM   1255 C CD2 . LEU B 2 4   ? -5.178  -15.177 -25.559 1.00 20.54 ? 4   LEU H CD2 1 
ATOM   1256 N N   . GLN B 2 5   ? -6.503  -15.405 -30.261 1.00 19.69 ? 5   GLN H N   1 
ATOM   1257 C CA  . GLN B 2 5   ? -6.702  -15.159 -31.716 1.00 20.92 ? 5   GLN H CA  1 
ATOM   1258 C C   . GLN B 2 5   ? -6.222  -13.763 -32.078 1.00 18.16 ? 5   GLN H C   1 
ATOM   1259 O O   . GLN B 2 5   ? -6.858  -12.780 -31.646 1.00 17.34 ? 5   GLN H O   1 
ATOM   1260 C CB  . GLN B 2 5   ? -8.181  -15.407 -32.047 1.00 24.21 ? 5   GLN H CB  1 
ATOM   1261 C CG  . GLN B 2 5   ? -8.487  -15.242 -33.532 1.00 28.95 ? 5   GLN H CG  1 
ATOM   1262 C CD  . GLN B 2 5   ? -7.752  -16.247 -34.400 1.00 33.98 ? 5   GLN H CD  1 
ATOM   1263 O OE1 . GLN B 2 5   ? -7.298  -17.312 -33.928 1.00 34.86 ? 5   GLN H OE1 1 
ATOM   1264 N NE2 . GLN B 2 5   ? -7.608  -15.888 -35.680 1.00 34.16 ? 5   GLN H NE2 1 
ATOM   1265 N N   . GLN B 2 6   ? -5.192  -13.692 -32.903 1.00 15.62 ? 6   GLN H N   1 
ATOM   1266 C CA  . GLN B 2 6   ? -4.649  -12.396 -33.315 1.00 15.33 ? 6   GLN H CA  1 
ATOM   1267 C C   . GLN B 2 6   ? -5.265  -11.954 -34.657 1.00 16.54 ? 6   GLN H C   1 
ATOM   1268 O O   . GLN B 2 6   ? -5.702  -12.813 -35.469 1.00 17.04 ? 6   GLN H O   1 
ATOM   1269 C CB  . GLN B 2 6   ? -3.152  -12.435 -33.390 1.00 15.23 ? 6   GLN H CB  1 
ATOM   1270 C CG  . GLN B 2 6   ? -2.522  -12.596 -31.990 1.00 15.51 ? 6   GLN H CG  1 
ATOM   1271 C CD  . GLN B 2 6   ? -1.014  -12.587 -31.978 1.00 15.16 ? 6   GLN H CD  1 
ATOM   1272 O OE1 . GLN B 2 6   ? -0.375  -13.573 -31.633 1.00 14.86 ? 6   GLN H OE1 1 
ATOM   1273 N NE2 . GLN B 2 6   ? -0.437  -11.461 -32.349 1.00 16.08 ? 6   GLN H NE2 1 
ATOM   1274 N N   . SER B 2 7   ? -5.180  -10.671 -34.867 1.00 16.52 ? 7   SER H N   1 
ATOM   1275 C CA  . SER B 2 7   ? -5.591  -10.010 -36.126 1.00 16.72 ? 7   SER H CA  1 
ATOM   1276 C C   . SER B 2 7   ? -4.584  -10.373 -37.235 1.00 16.46 ? 7   SER H C   1 
ATOM   1277 O O   . SER B 2 7   ? -3.466  -10.897 -36.968 1.00 15.02 ? 7   SER H O   1 
ATOM   1278 C CB  . SER B 2 7   ? -5.760  -8.521  -35.905 1.00 17.27 ? 7   SER H CB  1 
ATOM   1279 O OG  . SER B 2 7   ? -4.550  -7.995  -35.366 1.00 16.11 ? 7   SER H OG  1 
ATOM   1280 N N   . GLY B 2 8   ? -5.044  -10.153 -38.477 1.00 16.50 ? 8   GLY H N   1 
ATOM   1281 C CA  . GLY B 2 8   ? -4.311  -10.576 -39.663 1.00 16.81 ? 8   GLY H CA  1 
ATOM   1282 C C   . GLY B 2 8   ? -3.048  -9.785  -39.897 1.00 16.65 ? 8   GLY H C   1 
ATOM   1283 O O   . GLY B 2 8   ? -2.755  -8.750  -39.269 1.00 17.18 ? 8   GLY H O   1 
ATOM   1284 N N   . PRO B 2 9   ? -2.336  -10.170 -40.973 1.00 16.55 ? 9   PRO H N   1 
ATOM   1285 C CA  . PRO B 2 9   ? -1.086  -9.523  -41.350 1.00 16.30 ? 9   PRO H CA  1 
ATOM   1286 C C   . PRO B 2 9   ? -1.344  -8.078  -41.783 1.00 17.40 ? 9   PRO H C   1 
ATOM   1287 O O   . PRO B 2 9   ? -2.410  -7.770  -42.296 1.00 19.53 ? 9   PRO H O   1 
ATOM   1288 C CB  . PRO B 2 9   ? -0.536  -10.368 -42.529 1.00 16.23 ? 9   PRO H CB  1 
ATOM   1289 C CG  . PRO B 2 9   ? -1.764  -11.019 -43.061 1.00 16.45 ? 9   PRO H CG  1 
ATOM   1290 C CD  . PRO B 2 9   ? -2.710  -11.259 -41.889 1.00 16.91 ? 9   PRO H CD  1 
ATOM   1291 N N   . GLU B 2 10  ? -0.345  -7.232  -41.651 1.00 17.86 ? 10  GLU H N   1 
ATOM   1292 C CA  . GLU B 2 10  ? -0.493  -5.767  -41.876 1.00 20.35 ? 10  GLU H CA  1 
ATOM   1293 C C   . GLU B 2 10  ? 0.646   -5.301  -42.776 1.00 19.93 ? 10  GLU H C   1 
ATOM   1294 O O   . GLU B 2 10  ? 1.813   -5.597  -42.468 1.00 20.65 ? 10  GLU H O   1 
ATOM   1295 C CB  . GLU B 2 10  ? -0.368  -4.993  -40.570 1.00 20.80 ? 10  GLU H CB  1 
ATOM   1296 C CG  . GLU B 2 10  ? -1.458  -5.370  -39.604 1.00 22.51 ? 10  GLU H CG  1 
ATOM   1297 C CD  . GLU B 2 10  ? -2.750  -4.617  -39.759 1.00 26.48 ? 10  GLU H CD  1 
ATOM   1298 O OE1 . GLU B 2 10  ? -2.860  -3.736  -40.659 1.00 26.11 ? 10  GLU H OE1 1 
ATOM   1299 O OE2 . GLU B 2 10  ? -3.628  -4.859  -38.913 1.00 27.65 ? 10  GLU H OE2 1 
ATOM   1300 N N   . LEU B 2 11  ? 0.317   -4.537  -43.790 1.00 18.74 ? 11  LEU H N   1 
ATOM   1301 C CA  . LEU B 2 11  ? 1.299   -3.759  -44.535 1.00 19.30 ? 11  LEU H CA  1 
ATOM   1302 C C   . LEU B 2 11  ? 1.145   -2.330  -44.047 1.00 20.21 ? 11  LEU H C   1 
ATOM   1303 O O   . LEU B 2 11  ? 0.021   -1.792  -44.139 1.00 20.64 ? 11  LEU H O   1 
ATOM   1304 C CB  . LEU B 2 11  ? 0.984   -3.855  -46.021 1.00 19.32 ? 11  LEU H CB  1 
ATOM   1305 C CG  . LEU B 2 11  ? 1.775   -2.881  -46.884 1.00 21.29 ? 11  LEU H CG  1 
ATOM   1306 C CD1 . LEU B 2 11  ? 3.270   -3.258  -46.880 1.00 20.92 ? 11  LEU H CD1 1 
ATOM   1307 C CD2 . LEU B 2 11  ? 1.204   -2.880  -48.285 1.00 21.58 ? 11  LEU H CD2 1 
ATOM   1308 N N   . VAL B 2 12  ? 2.220   -1.718  -43.613 1.00 20.02 ? 12  VAL H N   1 
ATOM   1309 C CA  A VAL B 2 12  ? 2.149   -0.338  -43.084 0.50 22.13 ? 12  VAL H CA  1 
ATOM   1310 C CA  B VAL B 2 12  ? 2.183   -0.346  -43.034 0.50 21.44 ? 12  VAL H CA  1 
ATOM   1311 C C   . VAL B 2 12  ? 3.285   0.523   -43.634 1.00 23.57 ? 12  VAL H C   1 
ATOM   1312 O O   . VAL B 2 12  ? 4.428   0.059   -43.671 1.00 22.36 ? 12  VAL H O   1 
ATOM   1313 C CB  A VAL B 2 12  ? 2.111   -0.438  -41.559 0.50 22.49 ? 12  VAL H CB  1 
ATOM   1314 C CB  B VAL B 2 12  ? 2.313   -0.359  -41.503 0.50 20.96 ? 12  VAL H CB  1 
ATOM   1315 C CG1 A VAL B 2 12  ? 0.719   -0.884  -41.136 0.50 22.39 ? 12  VAL H CG1 1 
ATOM   1316 C CG1 B VAL B 2 12  ? 1.628   0.884   -40.943 0.50 21.73 ? 12  VAL H CG1 1 
ATOM   1317 C CG2 A VAL B 2 12  ? 3.176   -1.400  -41.056 0.50 21.42 ? 12  VAL H CG2 1 
ATOM   1318 C CG2 B VAL B 2 12  ? 1.771   -1.648  -40.883 0.50 18.89 ? 12  VAL H CG2 1 
ATOM   1319 N N   . ARG B 2 13  ? 2.957   1.770   -44.007 1.00 25.41 ? 13  ARG H N   1 
ATOM   1320 C CA  A ARG B 2 13  ? 3.965   2.723   -44.525 0.50 28.38 ? 13  ARG H CA  1 
ATOM   1321 C CA  B ARG B 2 13  ? 3.954   2.738   -44.523 0.50 28.52 ? 13  ARG H CA  1 
ATOM   1322 C C   . ARG B 2 13  ? 4.829   3.168   -43.350 1.00 28.18 ? 13  ARG H C   1 
ATOM   1323 O O   . ARG B 2 13  ? 4.344   3.305   -42.235 1.00 27.47 ? 13  ARG H O   1 
ATOM   1324 C CB  A ARG B 2 13  ? 3.366   3.989   -45.159 0.50 31.44 ? 13  ARG H CB  1 
ATOM   1325 C CB  B ARG B 2 13  ? 3.347   4.031   -45.097 0.50 31.78 ? 13  ARG H CB  1 
ATOM   1326 C CG  A ARG B 2 13  ? 2.571   3.765   -46.439 0.50 33.89 ? 13  ARG H CG  1 
ATOM   1327 C CG  B ARG B 2 13  ? 2.376   3.862   -46.259 0.50 34.50 ? 13  ARG H CG  1 
ATOM   1328 C CD  A ARG B 2 13  ? 2.316   5.087   -47.161 0.50 37.01 ? 13  ARG H CD  1 
ATOM   1329 C CD  B ARG B 2 13  ? 1.745   5.209   -46.635 0.50 37.65 ? 13  ARG H CD  1 
ATOM   1330 N NE  A ARG B 2 13  ? 3.551   5.841   -47.352 0.50 38.56 ? 13  ARG H NE  1 
ATOM   1331 N NE  B ARG B 2 13  ? 2.575   6.331   -46.207 0.50 39.65 ? 13  ARG H NE  1 
ATOM   1332 C CZ  A ARG B 2 13  ? 4.367   5.649   -48.370 0.50 38.87 ? 13  ARG H CZ  1 
ATOM   1333 C CZ  B ARG B 2 13  ? 2.171   7.350   -45.459 0.50 41.04 ? 13  ARG H CZ  1 
ATOM   1334 N NH1 A ARG B 2 13  ? 4.046   4.775   -49.309 0.50 38.14 ? 13  ARG H NH1 1 
ATOM   1335 N NH1 B ARG B 2 13  ? 0.909   7.457   -45.072 0.50 41.57 ? 13  ARG H NH1 1 
ATOM   1336 N NH2 A ARG B 2 13  ? 5.491   6.330   -48.449 0.50 40.34 ? 13  ARG H NH2 1 
ATOM   1337 N NH2 B ARG B 2 13  ? 3.047   8.260   -45.102 0.50 42.48 ? 13  ARG H NH2 1 
ATOM   1338 N N   . PRO B 2 14  ? 6.108   3.464   -43.591 1.00 28.91 ? 14  PRO H N   1 
ATOM   1339 C CA  . PRO B 2 14  ? 6.970   4.053   -42.575 1.00 29.82 ? 14  PRO H CA  1 
ATOM   1340 C C   . PRO B 2 14  ? 6.369   5.375   -42.075 1.00 31.14 ? 14  PRO H C   1 
ATOM   1341 O O   . PRO B 2 14  ? 5.871   6.122   -42.918 1.00 31.17 ? 14  PRO H O   1 
ATOM   1342 C CB  . PRO B 2 14  ? 8.287   4.385   -43.301 1.00 32.32 ? 14  PRO H CB  1 
ATOM   1343 C CG  . PRO B 2 14  ? 8.232   3.603   -44.579 1.00 32.26 ? 14  PRO H CG  1 
ATOM   1344 C CD  . PRO B 2 14  ? 6.782   3.265   -44.872 1.00 30.57 ? 14  PRO H CD  1 
ATOM   1345 N N   . GLY B 2 15  ? 6.498   5.675   -40.783 1.00 30.20 ? 15  GLY H N   1 
ATOM   1346 C CA  . GLY B 2 15  ? 5.992   6.910   -40.151 1.00 32.15 ? 15  GLY H CA  1 
ATOM   1347 C C   . GLY B 2 15  ? 4.594   6.724   -39.574 1.00 32.17 ? 15  GLY H C   1 
ATOM   1348 O O   . GLY B 2 15  ? 4.212   7.490   -38.699 1.00 34.54 ? 15  GLY H O   1 
ATOM   1349 N N   . VAL B 2 16  ? 3.851   5.755   -40.071 1.00 31.24 ? 16  VAL H N   1 
ATOM   1350 C CA  . VAL B 2 16  ? 2.423   5.513   -39.739 1.00 32.48 ? 16  VAL H CA  1 
ATOM   1351 C C   . VAL B 2 16  ? 2.376   4.594   -38.503 1.00 30.54 ? 16  VAL H C   1 
ATOM   1352 O O   . VAL B 2 16  ? 3.396   3.931   -38.196 1.00 30.59 ? 16  VAL H O   1 
ATOM   1353 C CB  . VAL B 2 16  ? 1.783   4.923   -41.019 1.00 33.81 ? 16  VAL H CB  1 
ATOM   1354 C CG1 . VAL B 2 16  ? 0.409   4.345   -40.798 1.00 34.02 ? 16  VAL H CG1 1 
ATOM   1355 C CG2 . VAL B 2 16  ? 1.766   5.963   -42.150 1.00 36.54 ? 16  VAL H CG2 1 
ATOM   1356 N N   . SER B 2 17  ? 1.280   4.578   -37.750 1.00 28.23 ? 17  SER H N   1 
ATOM   1357 C CA  A SER B 2 17  ? 1.093   3.624   -36.644 0.50 26.39 ? 17  SER H CA  1 
ATOM   1358 C CA  B SER B 2 17  ? 1.059   3.629   -36.635 0.50 26.95 ? 17  SER H CA  1 
ATOM   1359 C C   . SER B 2 17  ? 0.280   2.408   -37.116 1.00 25.30 ? 17  SER H C   1 
ATOM   1360 O O   . SER B 2 17  ? -0.359  2.492   -38.160 1.00 25.90 ? 17  SER H O   1 
ATOM   1361 C CB  A SER B 2 17  ? 0.521   4.352   -35.460 0.50 26.73 ? 17  SER H CB  1 
ATOM   1362 C CB  B SER B 2 17  ? 0.338   4.262   -35.492 0.50 27.77 ? 17  SER H CB  1 
ATOM   1363 O OG  A SER B 2 17  ? 1.301   5.532   -35.207 0.50 26.38 ? 17  SER H OG  1 
ATOM   1364 O OG  B SER B 2 17  ? -1.012  4.499   -35.836 0.50 28.27 ? 17  SER H OG  1 
ATOM   1365 N N   . VAL B 2 18  ? 0.329   1.318   -36.360 1.00 22.78 ? 18  VAL H N   1 
ATOM   1366 C CA  . VAL B 2 18  ? -0.532  0.137   -36.589 1.00 21.96 ? 18  VAL H CA  1 
ATOM   1367 C C   . VAL B 2 18  ? -1.015  -0.337  -35.223 1.00 22.14 ? 18  VAL H C   1 
ATOM   1368 O O   . VAL B 2 18  ? -0.242  -0.248  -34.234 1.00 21.29 ? 18  VAL H O   1 
ATOM   1369 C CB  . VAL B 2 18  ? 0.228   -0.952  -37.368 1.00 21.45 ? 18  VAL H CB  1 
ATOM   1370 C CG1 . VAL B 2 18  ? 1.306   -1.587  -36.538 1.00 20.53 ? 18  VAL H CG1 1 
ATOM   1371 C CG2 . VAL B 2 18  ? -0.713  -2.019  -37.940 1.00 22.19 ? 18  VAL H CG2 1 
ATOM   1372 N N   . LYS B 2 19  ? -2.223  -0.871  -35.175 1.00 22.46 ? 19  LYS H N   1 
ATOM   1373 C CA  . LYS B 2 19  ? -2.790  -1.400  -33.923 1.00 22.06 ? 19  LYS H CA  1 
ATOM   1374 C C   . LYS B 2 19  ? -3.228  -2.817  -34.209 1.00 20.87 ? 19  LYS H C   1 
ATOM   1375 O O   . LYS B 2 19  ? -4.102  -3.024  -35.112 1.00 21.77 ? 19  LYS H O   1 
ATOM   1376 C CB  . LYS B 2 19  ? -3.916  -0.509  -33.416 1.00 25.13 ? 19  LYS H CB  1 
ATOM   1377 C CG  . LYS B 2 19  ? -4.558  -0.952  -32.113 1.00 26.42 ? 19  LYS H CG  1 
ATOM   1378 C CD  . LYS B 2 19  ? -5.569  0.097   -31.723 1.00 30.92 ? 19  LYS H CD  1 
ATOM   1379 C CE  . LYS B 2 19  ? -6.548  -0.303  -30.652 1.00 35.03 ? 19  LYS H CE  1 
ATOM   1380 N NZ  . LYS B 2 19  ? -7.596  0.751   -30.455 1.00 38.57 ? 19  LYS H NZ  1 
ATOM   1381 N N   . ILE B 2 20  ? -2.702  -3.754  -33.457 1.00 19.23 ? 20  ILE H N   1 
ATOM   1382 C CA  . ILE B 2 20  ? -2.988  -5.184  -33.691 1.00 18.79 ? 20  ILE H CA  1 
ATOM   1383 C C   . ILE B 2 20  ? -3.691  -5.751  -32.464 1.00 18.86 ? 20  ILE H C   1 
ATOM   1384 O O   . ILE B 2 20  ? -3.565  -5.166  -31.334 1.00 18.34 ? 20  ILE H O   1 
ATOM   1385 C CB  . ILE B 2 20  ? -1.711  -5.903  -34.101 1.00 20.08 ? 20  ILE H CB  1 
ATOM   1386 C CG1 . ILE B 2 20  ? -0.692  -5.962  -32.977 1.00 21.32 ? 20  ILE H CG1 1 
ATOM   1387 C CG2 . ILE B 2 20  ? -1.107  -5.230  -35.319 1.00 21.69 ? 20  ILE H CG2 1 
ATOM   1388 C CD1 . ILE B 2 20  ? 0.608   -6.656  -33.423 1.00 22.17 ? 20  ILE H CD1 1 
ATOM   1389 N N   . SER B 2 21  ? -4.487  -6.798  -32.635 1.00 17.16 ? 21  SER H N   1 
ATOM   1390 C CA  . SER B 2 21  ? -5.443  -7.233  -31.596 1.00 17.21 ? 21  SER H CA  1 
ATOM   1391 C C   . SER B 2 21  ? -5.193  -8.705  -31.280 1.00 16.77 ? 21  SER H C   1 
ATOM   1392 O O   . SER B 2 21  ? -4.642  -9.493  -32.115 1.00 16.40 ? 21  SER H O   1 
ATOM   1393 C CB  . SER B 2 21  ? -6.872  -6.936  -32.001 1.00 17.99 ? 21  SER H CB  1 
ATOM   1394 O OG  . SER B 2 21  ? -7.301  -7.782  -33.034 1.00 19.28 ? 21  SER H OG  1 
ATOM   1395 N N   . CYS B 2 22  ? -5.616  -9.064  -30.086 1.00 15.96 ? 22  CYS H N   1 
ATOM   1396 C CA  . CYS B 2 22  ? -5.466  -10.399 -29.478 1.00 16.27 ? 22  CYS H CA  1 
ATOM   1397 C C   . CYS B 2 22  ? -6.659  -10.720 -28.618 1.00 17.39 ? 22  CYS H C   1 
ATOM   1398 O O   . CYS B 2 22  ? -6.835  -10.104 -27.572 1.00 17.38 ? 22  CYS H O   1 
ATOM   1399 C CB  . CYS B 2 22  ? -4.189  -10.446 -28.662 1.00 16.62 ? 22  CYS H CB  1 
ATOM   1400 S SG  . CYS B 2 22  ? -3.963  -11.982 -27.738 1.00 17.05 ? 22  CYS H SG  1 
ATOM   1401 N N   . LYS B 2 23  ? -7.501  -11.634 -29.072 1.00 18.44 ? 23  LYS H N   1 
ATOM   1402 C CA  . LYS B 2 23  ? -8.771  -11.945 -28.393 1.00 19.78 ? 23  LYS H CA  1 
ATOM   1403 C C   . LYS B 2 23  ? -8.599  -13.276 -27.670 1.00 19.29 ? 23  LYS H C   1 
ATOM   1404 O O   . LYS B 2 23  ? -8.264  -14.325 -28.307 1.00 17.93 ? 23  LYS H O   1 
ATOM   1405 C CB  . LYS B 2 23  ? -9.945  -11.984 -29.371 1.00 22.76 ? 23  LYS H CB  1 
ATOM   1406 C CG  . LYS B 2 23  ? -11.300 -12.218 -28.706 1.00 26.41 ? 23  LYS H CG  1 
ATOM   1407 C CD  . LYS B 2 23  ? -12.445 -12.172 -29.674 1.00 30.88 ? 23  LYS H CD  1 
ATOM   1408 C CE  . LYS B 2 23  ? -13.687 -12.772 -29.069 1.00 36.68 ? 23  LYS H CE  1 
ATOM   1409 N NZ  . LYS B 2 23  ? -14.750 -11.746 -28.920 1.00 41.24 ? 23  LYS H NZ  1 
ATOM   1410 N N   . GLY B 2 24  ? -8.915  -13.278 -26.400 1.00 20.18 ? 24  GLY H N   1 
ATOM   1411 C CA  . GLY B 2 24  ? -8.798  -14.489 -25.580 1.00 21.04 ? 24  GLY H CA  1 
ATOM   1412 C C   . GLY B 2 24  ? -10.144 -15.135 -25.409 1.00 23.26 ? 24  GLY H C   1 
ATOM   1413 O O   . GLY B 2 24  ? -11.123 -14.428 -25.143 1.00 25.81 ? 24  GLY H O   1 
ATOM   1414 N N   . SER B 2 25  ? -10.164 -16.448 -25.426 1.00 22.54 ? 25  SER H N   1 
ATOM   1415 C CA  . SER B 2 25  ? -11.351 -17.238 -25.130 1.00 24.69 ? 25  SER H CA  1 
ATOM   1416 C C   . SER B 2 25  ? -10.929 -18.470 -24.351 1.00 24.96 ? 25  SER H C   1 
ATOM   1417 O O   . SER B 2 25  ? -9.770  -18.834 -24.417 1.00 22.68 ? 25  SER H O   1 
ATOM   1418 C CB  . SER B 2 25  ? -12.072 -17.559 -26.442 1.00 25.03 ? 25  SER H CB  1 
ATOM   1419 O OG  . SER B 2 25  ? -11.216 -18.273 -27.285 1.00 24.68 ? 25  SER H OG  1 
ATOM   1420 N N   . GLY B 2 26  ? -11.893 -19.119 -23.693 1.00 27.52 ? 26  GLY H N   1 
ATOM   1421 C CA  . GLY B 2 26  ? -11.628 -20.427 -23.068 1.00 29.94 ? 26  GLY H CA  1 
ATOM   1422 C C   . GLY B 2 26  ? -11.092 -20.289 -21.644 1.00 31.48 ? 26  GLY H C   1 
ATOM   1423 O O   . GLY B 2 26  ? -10.656 -21.287 -21.073 1.00 34.63 ? 26  GLY H O   1 
ATOM   1424 N N   . TYR B 2 27  ? -11.125 -19.082 -21.103 1.00 31.37 ? 27  TYR H N   1 
ATOM   1425 C CA  . TYR B 2 27  ? -10.685 -18.744 -19.732 1.00 32.56 ? 27  TYR H CA  1 
ATOM   1426 C C   . TYR B 2 27  ? -11.274 -17.377 -19.418 1.00 32.79 ? 27  TYR H C   1 
ATOM   1427 O O   . TYR B 2 27  ? -11.794 -16.721 -20.314 1.00 31.57 ? 27  TYR H O   1 
ATOM   1428 C CB  . TYR B 2 27  ? -9.162  -18.803 -19.630 1.00 31.61 ? 27  TYR H CB  1 
ATOM   1429 C CG  . TYR B 2 27  ? -8.401  -17.675 -20.283 1.00 30.14 ? 27  TYR H CG  1 
ATOM   1430 C CD1 . TYR B 2 27  ? -7.808  -16.684 -19.521 1.00 29.32 ? 27  TYR H CD1 1 
ATOM   1431 C CD2 . TYR B 2 27  ? -8.203  -17.610 -21.658 1.00 27.77 ? 27  TYR H CD2 1 
ATOM   1432 C CE1 . TYR B 2 27  ? -7.040  -15.675 -20.089 1.00 28.41 ? 27  TYR H CE1 1 
ATOM   1433 C CE2 . TYR B 2 27  ? -7.445  -16.604 -22.240 1.00 27.23 ? 27  TYR H CE2 1 
ATOM   1434 C CZ  . TYR B 2 27  ? -6.835  -15.638 -21.460 1.00 27.63 ? 27  TYR H CZ  1 
ATOM   1435 O OH  . TYR B 2 27  ? -6.067  -14.643 -22.007 1.00 27.58 ? 27  TYR H OH  1 
ATOM   1436 N N   . THR B 2 28  ? -11.285 -16.999 -18.147 1.00 34.75 ? 28  THR H N   1 
ATOM   1437 C CA  . THR B 2 28  ? -11.746 -15.655 -17.737 1.00 36.12 ? 28  THR H CA  1 
ATOM   1438 C C   . THR B 2 28  ? -10.659 -14.667 -18.124 1.00 33.88 ? 28  THR H C   1 
ATOM   1439 O O   . THR B 2 28  ? -9.638  -14.644 -17.411 1.00 32.35 ? 28  THR H O   1 
ATOM   1440 C CB  . THR B 2 28  ? -12.032 -15.605 -16.243 1.00 37.91 ? 28  THR H CB  1 
ATOM   1441 O OG1 . THR B 2 28  ? -12.642 -16.872 -15.991 1.00 42.55 ? 28  THR H OG1 1 
ATOM   1442 C CG2 . THR B 2 28  ? -12.920 -14.430 -15.881 1.00 39.12 ? 28  THR H CG2 1 
ATOM   1443 N N   . PHE B 2 29  ? -10.870 -13.938 -19.219 1.00 34.57 ? 29  PHE H N   1 
ATOM   1444 C CA  . PHE B 2 29  ? -9.890  -13.024 -19.861 1.00 34.58 ? 29  PHE H CA  1 
ATOM   1445 C C   . PHE B 2 29  ? -9.294  -12.026 -18.853 1.00 34.11 ? 29  PHE H C   1 
ATOM   1446 O O   . PHE B 2 29  ? -8.037  -11.821 -18.833 1.00 32.17 ? 29  PHE H O   1 
ATOM   1447 C CB  . PHE B 2 29  ? -10.590 -12.218 -20.941 1.00 35.80 ? 29  PHE H CB  1 
ATOM   1448 C CG  . PHE B 2 29  ? -9.642  -11.358 -21.716 1.00 34.93 ? 29  PHE H CG  1 
ATOM   1449 C CD1 . PHE B 2 29  ? -8.651  -11.929 -22.461 1.00 32.91 ? 29  PHE H CD1 1 
ATOM   1450 C CD2 . PHE B 2 29  ? -9.713  -9.981  -21.630 1.00 36.98 ? 29  PHE H CD2 1 
ATOM   1451 C CE1 . PHE B 2 29  ? -7.772  -11.137 -23.172 1.00 34.49 ? 29  PHE H CE1 1 
ATOM   1452 C CE2 . PHE B 2 29  ? -8.829  -9.196  -22.342 1.00 35.59 ? 29  PHE H CE2 1 
ATOM   1453 C CZ  . PHE B 2 29  ? -7.902  -9.771  -23.145 1.00 32.96 ? 29  PHE H CZ  1 
ATOM   1454 N N   . ILE B 2 30  ? -10.142 -11.436 -18.015 1.00 34.14 ? 30  ILE H N   1 
ATOM   1455 C CA  . ILE B 2 30  ? -9.715  -10.363 -17.058 1.00 35.16 ? 30  ILE H CA  1 
ATOM   1456 C C   . ILE B 2 30  ? -8.658  -10.868 -16.064 1.00 33.37 ? 30  ILE H C   1 
ATOM   1457 O O   . ILE B 2 30  ? -7.809  -10.058 -15.640 1.00 34.23 ? 30  ILE H O   1 
ATOM   1458 C CB  . ILE B 2 30  ? -10.916 -9.760  -16.324 1.00 36.81 ? 30  ILE H CB  1 
ATOM   1459 C CG1 . ILE B 2 30  ? -10.525 -8.449  -15.635 1.00 39.03 ? 30  ILE H CG1 1 
ATOM   1460 C CG2 . ILE B 2 30  ? -11.565 -10.735 -15.336 1.00 38.86 ? 30  ILE H CG2 1 
ATOM   1461 C CD1 . ILE B 2 30  ? -11.737 -7.576  -15.264 1.00 39.92 ? 30  ILE H CD1 1 
ATOM   1462 N N   . ASP B 2 31  ? -8.689  -12.146 -15.730 1.00 33.21 ? 31  ASP H N   1 
ATOM   1463 C CA  . ASP B 2 31  ? -7.911  -12.762 -14.629 1.00 33.63 ? 31  ASP H CA  1 
ATOM   1464 C C   . ASP B 2 31  ? -6.433  -12.998 -14.978 1.00 30.33 ? 31  ASP H C   1 
ATOM   1465 O O   . ASP B 2 31  ? -5.697  -13.188 -14.038 1.00 29.98 ? 31  ASP H O   1 
ATOM   1466 C CB  . ASP B 2 31  ? -8.473  -14.140 -14.280 1.00 37.34 ? 31  ASP H CB  1 
ATOM   1467 C CG  . ASP B 2 31  ? -9.677  -14.162 -13.350 1.00 42.82 ? 31  ASP H CG  1 
ATOM   1468 O OD1 . ASP B 2 31  ? -10.315 -13.056 -13.099 1.00 42.50 ? 31  ASP H OD1 1 
ATOM   1469 O OD2 . ASP B 2 31  ? -9.994  -15.324 -12.903 1.00 45.90 ? 31  ASP H OD2 1 
ATOM   1470 N N   . GLU B 2 32  ? -6.000  -13.041 -16.252 1.00 26.32 ? 32  GLU H N   1 
ATOM   1471 C CA  . GLU B 2 32  ? -4.588  -13.374 -16.545 1.00 25.27 ? 32  GLU H CA  1 
ATOM   1472 C C   . GLU B 2 32  ? -3.912  -12.193 -17.209 1.00 23.39 ? 32  GLU H C   1 
ATOM   1473 O O   . GLU B 2 32  ? -4.569  -11.471 -17.979 1.00 24.22 ? 32  GLU H O   1 
ATOM   1474 C CB  . GLU B 2 32  ? -4.465  -14.668 -17.370 1.00 24.97 ? 32  GLU H CB  1 
ATOM   1475 C CG  . GLU B 2 32  ? -5.122  -15.894 -16.719 1.00 26.25 ? 32  GLU H CG  1 
ATOM   1476 C CD  . GLU B 2 32  ? -4.609  -16.362 -15.351 1.00 27.46 ? 32  GLU H CD  1 
ATOM   1477 O OE1 . GLU B 2 32  ? -3.587  -15.835 -14.851 1.00 26.30 ? 32  GLU H OE1 1 
ATOM   1478 O OE2 . GLU B 2 32  ? -5.237  -17.288 -14.773 1.00 30.14 ? 32  GLU H OE2 1 
ATOM   1479 N N   . ALA B 2 33  ? -2.617  -12.033 -16.934 1.00 22.66 ? 33  ALA H N   1 
ATOM   1480 C CA  . ALA B 2 33  ? -1.779  -11.039 -17.611 1.00 21.35 ? 33  ALA H CA  1 
ATOM   1481 C C   . ALA B 2 33  ? -1.581  -11.487 -19.055 1.00 21.49 ? 33  ALA H C   1 
ATOM   1482 O O   . ALA B 2 33  ? -1.416  -12.718 -19.314 1.00 22.25 ? 33  ALA H O   1 
ATOM   1483 C CB  . ALA B 2 33  ? -0.481  -10.905 -16.879 1.00 21.87 ? 33  ALA H CB  1 
ATOM   1484 N N   . LEU B 2 34  ? -1.505  -10.509 -19.938 1.00 19.88 ? 34  LEU H N   1 
ATOM   1485 C CA  A LEU B 2 34  ? -1.278  -10.719 -21.381 0.60 19.43 ? 34  LEU H CA  1 
ATOM   1486 C CA  B LEU B 2 34  ? -1.292  -10.711 -21.393 0.40 18.56 ? 34  LEU H CA  1 
ATOM   1487 C C   . LEU B 2 34  ? 0.007   -10.003 -21.755 1.00 18.06 ? 34  LEU H C   1 
ATOM   1488 O O   . LEU B 2 34  ? 0.071   -8.742  -21.555 1.00 17.35 ? 34  LEU H O   1 
ATOM   1489 C CB  A LEU B 2 34  ? -2.467  -10.109 -22.106 0.60 19.98 ? 34  LEU H CB  1 
ATOM   1490 C CB  B LEU B 2 34  ? -2.492  -10.124 -22.142 0.40 18.09 ? 34  LEU H CB  1 
ATOM   1491 C CG  A LEU B 2 34  ? -3.151  -10.917 -23.195 0.60 21.20 ? 34  LEU H CG  1 
ATOM   1492 C CG  B LEU B 2 34  ? -2.635  -10.415 -23.636 0.40 17.46 ? 34  LEU H CG  1 
ATOM   1493 C CD1 A LEU B 2 34  ? -3.088  -12.427 -22.986 0.60 21.21 ? 34  LEU H CD1 1 
ATOM   1494 C CD1 B LEU B 2 34  ? -1.694  -9.578  -24.478 0.40 16.33 ? 34  LEU H CD1 1 
ATOM   1495 C CD2 A LEU B 2 34  ? -4.585  -10.458 -23.299 0.60 22.58 ? 34  LEU H CD2 1 
ATOM   1496 C CD2 B LEU B 2 34  ? -2.483  -11.914 -23.937 0.40 17.52 ? 34  LEU H CD2 1 
ATOM   1497 N N   . HIS B 2 35  ? 0.940   -10.750 -22.324 1.00 16.57 ? 35  HIS H N   1 
ATOM   1498 C CA  . HIS B 2 35  ? 2.246   -10.237 -22.752 1.00 15.47 ? 35  HIS H CA  1 
ATOM   1499 C C   . HIS B 2 35  ? 2.351   -10.135 -24.274 1.00 15.12 ? 35  HIS H C   1 
ATOM   1500 O O   . HIS B 2 35  ? 1.629   -10.864 -24.958 1.00 15.23 ? 35  HIS H O   1 
ATOM   1501 C CB  . HIS B 2 35  ? 3.335   -11.173 -22.263 1.00 15.89 ? 35  HIS H CB  1 
ATOM   1502 C CG  . HIS B 2 35  ? 3.310   -11.432 -20.802 1.00 15.67 ? 35  HIS H CG  1 
ATOM   1503 N ND1 . HIS B 2 35  ? 4.308   -10.989 -19.962 1.00 16.11 ? 35  HIS H ND1 1 
ATOM   1504 C CD2 . HIS B 2 35  ? 2.439   -12.161 -20.068 1.00 16.04 ? 35  HIS H CD2 1 
ATOM   1505 C CE1 . HIS B 2 35  ? 3.991   -11.393 -18.738 1.00 16.70 ? 35  HIS H CE1 1 
ATOM   1506 N NE2 . HIS B 2 35  ? 2.864   -12.126 -18.772 1.00 16.62 ? 35  HIS H NE2 1 
ATOM   1507 N N   . TRP B 2 36  ? 3.227   -9.262  -24.757 1.00 14.83 ? 36  TRP H N   1 
ATOM   1508 C CA  . TRP B 2 36  ? 3.528   -9.138  -26.194 1.00 14.54 ? 36  TRP H CA  1 
ATOM   1509 C C   . TRP B 2 36  ? 4.984   -9.404  -26.428 1.00 14.65 ? 36  TRP H C   1 
ATOM   1510 O O   . TRP B 2 36  ? 5.819   -8.959  -25.624 1.00 15.00 ? 36  TRP H O   1 
ATOM   1511 C CB  . TRP B 2 36  ? 3.086   -7.770  -26.654 1.00 15.18 ? 36  TRP H CB  1 
ATOM   1512 C CG  . TRP B 2 36  ? 1.622   -7.538  -26.564 1.00 14.97 ? 36  TRP H CG  1 
ATOM   1513 C CD1 . TRP B 2 36  ? 0.952   -7.018  -25.505 1.00 15.90 ? 36  TRP H CD1 1 
ATOM   1514 C CD2 . TRP B 2 36  ? 0.646   -7.769  -27.593 1.00 15.35 ? 36  TRP H CD2 1 
ATOM   1515 N NE1 . TRP B 2 36  ? -0.374  -6.874  -25.830 1.00 17.23 ? 36  TRP H NE1 1 
ATOM   1516 C CE2 . TRP B 2 36  ? -0.605  -7.386  -27.079 1.00 15.94 ? 36  TRP H CE2 1 
ATOM   1517 C CE3 . TRP B 2 36  ? 0.707   -8.330  -28.887 1.00 15.46 ? 36  TRP H CE3 1 
ATOM   1518 C CZ2 . TRP B 2 36  ? -1.775  -7.438  -27.851 1.00 16.62 ? 36  TRP H CZ2 1 
ATOM   1519 C CZ3 . TRP B 2 36  ? -0.451  -8.418  -29.643 1.00 14.96 ? 36  TRP H CZ3 1 
ATOM   1520 C CH2 . TRP B 2 36  ? -1.672  -7.964  -29.122 1.00 15.48 ? 36  TRP H CH2 1 
ATOM   1521 N N   . VAL B 2 37  ? 5.283   -10.138 -27.491 1.00 14.46 ? 37  VAL H N   1 
ATOM   1522 C CA  . VAL B 2 37  ? 6.616   -10.659 -27.834 1.00 15.11 ? 37  VAL H CA  1 
ATOM   1523 C C   . VAL B 2 37  ? 6.857   -10.402 -29.313 1.00 15.40 ? 37  VAL H C   1 
ATOM   1524 O O   . VAL B 2 37  ? 5.949   -10.694 -30.111 1.00 15.63 ? 37  VAL H O   1 
ATOM   1525 C CB  . VAL B 2 37  ? 6.730   -12.162 -27.529 1.00 15.40 ? 37  VAL H CB  1 
ATOM   1526 C CG1 . VAL B 2 37  ? 8.065   -12.723 -28.006 1.00 15.86 ? 37  VAL H CG1 1 
ATOM   1527 C CG2 . VAL B 2 37  ? 6.526   -12.438 -26.051 1.00 15.98 ? 37  VAL H CG2 1 
ATOM   1528 N N   . LYS B 2 38  ? 7.979   -9.811  -29.629 1.00 15.63 ? 38  LYS H N   1 
ATOM   1529 C CA  . LYS B 2 38  ? 8.395   -9.550  -31.023 1.00 16.16 ? 38  LYS H CA  1 
ATOM   1530 C C   . LYS B 2 38  ? 9.361   -10.648 -31.464 1.00 17.54 ? 38  LYS H C   1 
ATOM   1531 O O   . LYS B 2 38  ? 10.280  -11.018 -30.692 1.00 17.40 ? 38  LYS H O   1 
ATOM   1532 C CB  . LYS B 2 38  ? 9.021   -8.176  -31.092 1.00 16.38 ? 38  LYS H CB  1 
ATOM   1533 C CG  . LYS B 2 38  ? 9.653   -7.772  -32.405 1.00 16.40 ? 38  LYS H CG  1 
ATOM   1534 C CD  . LYS B 2 38  ? 10.276  -6.419  -32.390 1.00 16.60 ? 38  LYS H CD  1 
ATOM   1535 C CE  . LYS B 2 38  ? 10.924  -6.004  -33.702 1.00 17.69 ? 38  LYS H CE  1 
ATOM   1536 N NZ  . LYS B 2 38  ? 11.494  -4.647  -33.631 1.00 18.50 ? 38  LYS H NZ  1 
ATOM   1537 N N   . GLN B 2 39  ? 9.198   -11.103 -32.716 1.00 18.03 ? 39  GLN H N   1 
ATOM   1538 C CA  . GLN B 2 39  ? 10.153  -12.064 -33.293 1.00 18.49 ? 39  GLN H CA  1 
ATOM   1539 C C   . GLN B 2 39  ? 10.601  -11.481 -34.623 1.00 19.69 ? 39  GLN H C   1 
ATOM   1540 O O   . GLN B 2 39  ? 9.808   -11.493 -35.565 1.00 17.61 ? 39  GLN H O   1 
ATOM   1541 C CB  . GLN B 2 39  ? 9.544   -13.452 -33.456 1.00 18.70 ? 39  GLN H CB  1 
ATOM   1542 C CG  . GLN B 2 39  ? 10.534  -14.439 -34.045 1.00 20.06 ? 39  GLN H CG  1 
ATOM   1543 C CD  . GLN B 2 39  ? 10.150  -15.875 -33.773 1.00 20.94 ? 39  GLN H CD  1 
ATOM   1544 O OE1 . GLN B 2 39  ? 9.018   -16.275 -33.923 1.00 17.83 ? 39  GLN H OE1 1 
ATOM   1545 N NE2 . GLN B 2 39  ? 11.132  -16.665 -33.388 1.00 22.23 ? 39  GLN H NE2 1 
ATOM   1546 N N   . SER B 2 40  ? 11.850  -11.068 -34.687 1.00 21.63 ? 40  SER H N   1 
ATOM   1547 C CA  . SER B 2 40  ? 12.422  -10.585 -35.974 1.00 26.60 ? 40  SER H CA  1 
ATOM   1548 C C   . SER B 2 40  ? 13.555  -11.518 -36.393 1.00 32.71 ? 40  SER H C   1 
ATOM   1549 O O   . SER B 2 40  ? 14.168  -12.162 -35.519 1.00 36.60 ? 40  SER H O   1 
ATOM   1550 C CB  . SER B 2 40  ? 12.862  -9.148  -35.794 1.00 27.11 ? 40  SER H CB  1 
ATOM   1551 O OG  . SER B 2 40  ? 13.753  -8.979  -34.712 1.00 28.90 ? 40  SER H OG  1 
ATOM   1552 N N   . HIS B 2 41  ? 14.067  -11.384 -37.618 1.00 43.28 ? 41  HIS H N   1 
ATOM   1553 C CA  . HIS B 2 41  ? 15.403  -11.982 -37.960 1.00 44.85 ? 41  HIS H CA  1 
ATOM   1554 C C   . HIS B 2 41  ? 16.507  -11.423 -37.029 1.00 46.56 ? 41  HIS H C   1 
ATOM   1555 O O   . HIS B 2 41  ? 17.186  -12.251 -36.308 1.00 48.84 ? 41  HIS H O   1 
ATOM   1556 C CB  . HIS B 2 41  ? 15.709  -11.749 -39.460 1.00 54.25 ? 41  HIS H CB  1 
ATOM   1557 C CG  . HIS B 2 41  ? 14.846  -12.557 -40.386 1.00 59.19 ? 41  HIS H CG  1 
ATOM   1558 N ND1 . HIS B 2 41  ? 13.453  -12.374 -40.483 1.00 63.71 ? 41  HIS H ND1 1 
ATOM   1559 C CD2 . HIS B 2 41  ? 15.157  -13.551 -41.253 1.00 63.95 ? 41  HIS H CD2 1 
ATOM   1560 C CE1 . HIS B 2 41  ? 12.953  -13.235 -41.345 1.00 64.04 ? 41  HIS H CE1 1 
ATOM   1561 N NE2 . HIS B 2 41  ? 13.983  -13.968 -41.841 1.00 68.04 ? 41  HIS H NE2 1 
ATOM   1562 N N   . ALA B 2 42  ? 16.629  -10.078 -36.976 1.00 46.54 ? 42  ALA H N   1 
ATOM   1563 C CA  . ALA B 2 42  ? 17.734  -9.285  -36.358 1.00 48.02 ? 42  ALA H CA  1 
ATOM   1564 C C   . ALA B 2 42  ? 17.887  -9.536  -34.841 1.00 47.81 ? 42  ALA H C   1 
ATOM   1565 O O   . ALA B 2 42  ? 19.036  -9.509  -34.392 1.00 43.29 ? 42  ALA H O   1 
ATOM   1566 C CB  . ALA B 2 42  ? 17.552  -7.801  -36.635 1.00 48.08 ? 42  ALA H CB  1 
ATOM   1567 N N   . GLU B 2 43  ? 16.797  -9.742  -34.072 1.00 47.13 ? 43  GLU H N   1 
ATOM   1568 C CA  . GLU B 2 43  ? 16.842  -9.777  -32.568 1.00 50.48 ? 43  GLU H CA  1 
ATOM   1569 C C   . GLU B 2 43  ? 16.141  -11.030 -31.931 1.00 47.49 ? 43  GLU H C   1 
ATOM   1570 O O   . GLU B 2 43  ? 16.060  -11.021 -30.677 1.00 48.90 ? 43  GLU H O   1 
ATOM   1571 C CB  . GLU B 2 43  ? 16.264  -8.439  -32.045 1.00 52.06 ? 43  GLU H CB  1 
ATOM   1572 C CG  . GLU B 2 43  ? 17.078  -7.186  -32.403 1.00 56.30 ? 43  GLU H CG  1 
ATOM   1573 C CD  . GLU B 2 43  ? 18.257  -6.841  -31.483 1.00 60.91 ? 43  GLU H CD  1 
ATOM   1574 O OE1 . GLU B 2 43  ? 18.203  -7.195  -30.271 1.00 61.15 ? 43  GLU H OE1 1 
ATOM   1575 O OE2 . GLU B 2 43  ? 19.228  -6.194  -31.955 1.00 63.45 ? 43  GLU H OE2 1 
ATOM   1576 N N   . SER B 2 44  ? 15.798  -12.111 -32.699 1.00 39.89 ? 44  SER H N   1 
ATOM   1577 C CA  . SER B 2 44  ? 15.050  -13.355 -32.308 1.00 34.35 ? 44  SER H CA  1 
ATOM   1578 C C   . SER B 2 44  ? 13.853  -12.898 -31.439 1.00 30.34 ? 44  SER H C   1 
ATOM   1579 O O   . SER B 2 44  ? 13.135  -11.901 -31.891 1.00 32.05 ? 44  SER H O   1 
ATOM   1580 C CB  . SER B 2 44  ? 15.811  -14.473 -31.590 1.00 36.92 ? 44  SER H CB  1 
ATOM   1581 O OG  . SER B 2 44  ? 16.782  -15.191 -32.374 1.00 41.99 ? 44  SER H OG  1 
ATOM   1582 N N   . LEU B 2 45  ? 13.696  -13.459 -30.225 1.00 23.83 ? 45  LEU H N   1 
ATOM   1583 C CA  . LEU B 2 45  ? 12.485  -13.193 -29.399 1.00 21.22 ? 45  LEU H CA  1 
ATOM   1584 C C   . LEU B 2 45  ? 12.765  -12.054 -28.395 1.00 20.21 ? 45  LEU H C   1 
ATOM   1585 O O   . LEU B 2 45  ? 13.810  -12.087 -27.702 1.00 19.56 ? 45  LEU H O   1 
ATOM   1586 C CB  . LEU B 2 45  ? 12.053  -14.465 -28.672 1.00 21.25 ? 45  LEU H CB  1 
ATOM   1587 C CG  . LEU B 2 45  ? 11.467  -15.590 -29.528 1.00 20.61 ? 45  LEU H CG  1 
ATOM   1588 C CD1 . LEU B 2 45  ? 11.278  -16.861 -28.679 1.00 21.71 ? 45  LEU H CD1 1 
ATOM   1589 C CD2 . LEU B 2 45  ? 10.118  -15.155 -30.119 1.00 19.21 ? 45  LEU H CD2 1 
ATOM   1590 N N   . GLU B 2 46  ? 11.878  -11.077 -28.337 1.00 18.60 ? 46  GLU H N   1 
ATOM   1591 C CA  . GLU B 2 46  ? 12.042  -9.926  -27.440 1.00 19.56 ? 46  GLU H CA  1 
ATOM   1592 C C   . GLU B 2 46  ? 10.711  -9.693  -26.739 1.00 17.98 ? 46  GLU H C   1 
ATOM   1593 O O   . GLU B 2 46  ? 9.678   -9.601  -27.424 1.00 15.96 ? 46  GLU H O   1 
ATOM   1594 C CB  . GLU B 2 46  ? 12.494  -8.679  -28.178 1.00 21.54 ? 46  GLU H CB  1 
ATOM   1595 C CG  . GLU B 2 46  ? 13.874  -8.693  -28.797 1.00 23.79 ? 46  GLU H CG  1 
ATOM   1596 C CD  . GLU B 2 46  ? 14.119  -7.308  -29.424 1.00 26.49 ? 46  GLU H CD  1 
ATOM   1597 O OE1 . GLU B 2 46  ? 13.531  -7.065  -30.507 1.00 28.73 ? 46  GLU H OE1 1 
ATOM   1598 O OE2 . GLU B 2 46  ? 14.810  -6.474  -28.822 1.00 28.40 ? 46  GLU H OE2 1 
ATOM   1599 N N   . TRP B 2 47  ? 10.742  -9.566  -25.415 1.00 17.17 ? 47  TRP H N   1 
ATOM   1600 C CA  . TRP B 2 47  ? 9.524   -9.229  -24.657 1.00 17.31 ? 47  TRP H CA  1 
ATOM   1601 C C   . TRP B 2 47  ? 9.239   -7.725  -24.734 1.00 17.19 ? 47  TRP H C   1 
ATOM   1602 O O   . TRP B 2 47  ? 10.152  -6.939  -24.425 1.00 17.68 ? 47  TRP H O   1 
ATOM   1603 C CB  . TRP B 2 47  ? 9.714   -9.691  -23.229 1.00 17.64 ? 47  TRP H CB  1 
ATOM   1604 C CG  . TRP B 2 47  ? 8.557   -9.489  -22.331 1.00 16.97 ? 47  TRP H CG  1 
ATOM   1605 C CD1 . TRP B 2 47  ? 7.544   -10.353 -22.079 1.00 17.23 ? 47  TRP H CD1 1 
ATOM   1606 C CD2 . TRP B 2 47  ? 8.384   -8.391  -21.435 1.00 17.49 ? 47  TRP H CD2 1 
ATOM   1607 N NE1 . TRP B 2 47  ? 6.726   -9.857  -21.126 1.00 17.46 ? 47  TRP H NE1 1 
ATOM   1608 C CE2 . TRP B 2 47  ? 7.241   -8.665  -20.683 1.00 17.82 ? 47  TRP H CE2 1 
ATOM   1609 C CE3 . TRP B 2 47  ? 9.098   -7.217  -21.187 1.00 18.49 ? 47  TRP H CE3 1 
ATOM   1610 C CZ2 . TRP B 2 47  ? 6.798   -7.807  -19.687 1.00 18.24 ? 47  TRP H CZ2 1 
ATOM   1611 C CZ3 . TRP B 2 47  ? 8.654   -6.361  -20.203 1.00 19.09 ? 47  TRP H CZ3 1 
ATOM   1612 C CH2 . TRP B 2 47  ? 7.536   -6.664  -19.448 1.00 18.82 ? 47  TRP H CH2 1 
ATOM   1613 N N   . ILE B 2 48  ? 8.049   -7.349  -25.144 1.00 16.25 ? 48  ILE H N   1 
ATOM   1614 C CA  . ILE B 2 48  ? 7.692   -5.909  -25.302 1.00 16.80 ? 48  ILE H CA  1 
ATOM   1615 C C   . ILE B 2 48  ? 7.093   -5.384  -24.006 1.00 17.02 ? 48  ILE H C   1 
ATOM   1616 O O   . ILE B 2 48  ? 7.432   -4.252  -23.565 1.00 18.08 ? 48  ILE H O   1 
ATOM   1617 C CB  . ILE B 2 48  ? 6.671   -5.742  -26.462 1.00 16.06 ? 48  ILE H CB  1 
ATOM   1618 C CG1 . ILE B 2 48  ? 7.300   -6.171  -27.778 1.00 16.22 ? 48  ILE H CG1 1 
ATOM   1619 C CG2 . ILE B 2 48  ? 6.155   -4.305  -26.517 1.00 16.64 ? 48  ILE H CG2 1 
ATOM   1620 C CD1 . ILE B 2 48  ? 6.305   -6.361  -28.902 1.00 15.48 ? 48  ILE H CD1 1 
ATOM   1621 N N   . GLY B 2 49  ? 6.197   -6.152  -23.420 1.00 17.15 ? 49  GLY H N   1 
ATOM   1622 C CA  . GLY B 2 49  ? 5.484   -5.664  -22.232 1.00 17.06 ? 49  GLY H CA  1 
ATOM   1623 C C   . GLY B 2 49  ? 4.377   -6.579  -21.806 1.00 16.87 ? 49  GLY H C   1 
ATOM   1624 O O   . GLY B 2 49  ? 4.097   -7.606  -22.482 1.00 15.83 ? 49  GLY H O   1 
ATOM   1625 N N   . VAL B 2 50  ? 3.712   -6.179  -20.725 1.00 17.10 ? 50  VAL H N   1 
ATOM   1626 C CA  . VAL B 2 50  ? 2.574   -6.911  -20.140 1.00 16.98 ? 50  VAL H CA  1 
ATOM   1627 C C   . VAL B 2 50  ? 1.477   -5.944  -19.742 1.00 17.98 ? 50  VAL H C   1 
ATOM   1628 O O   . VAL B 2 50  ? 1.802   -4.888  -19.224 1.00 19.52 ? 50  VAL H O   1 
ATOM   1629 C CB  . VAL B 2 50  ? 2.996   -7.826  -18.985 1.00 17.09 ? 50  VAL H CB  1 
ATOM   1630 C CG1 . VAL B 2 50  ? 3.673   -7.042  -17.893 1.00 18.03 ? 50  VAL H CG1 1 
ATOM   1631 C CG2 . VAL B 2 50  ? 1.859   -8.659  -18.452 1.00 17.49 ? 50  VAL H CG2 1 
ATOM   1632 N N   . ILE B 2 51  ? 0.246   -6.371  -19.931 1.00 17.32 ? 51  ILE H N   1 
ATOM   1633 C CA  . ILE B 2 51  ? -0.915  -5.680  -19.366 1.00 18.57 ? 51  ILE H CA  1 
ATOM   1634 C C   . ILE B 2 51  ? -1.633  -6.681  -18.465 1.00 19.77 ? 51  ILE H C   1 
ATOM   1635 O O   . ILE B 2 51  ? -1.873  -7.865  -18.849 1.00 18.46 ? 51  ILE H O   1 
ATOM   1636 C CB  . ILE B 2 51  ? -1.768  -5.066  -20.494 1.00 18.66 ? 51  ILE H CB  1 
ATOM   1637 C CG1 . ILE B 2 51  ? -2.801  -4.102  -19.950 1.00 19.83 ? 51  ILE H CG1 1 
ATOM   1638 C CG2 . ILE B 2 51  ? -2.366  -6.154  -21.396 1.00 18.43 ? 51  ILE H CG2 1 
ATOM   1639 C CD1 . ILE B 2 51  ? -3.454  -3.187  -20.979 1.00 19.83 ? 51  ILE H CD1 1 
ATOM   1640 N N   . ARG B 2 52  ? -2.055  -6.177  -17.331 1.00 20.74 ? 52  ARG H N   1 
ATOM   1641 C CA  A ARG B 2 52  ? -2.856  -6.919  -16.330 0.50 22.62 ? 52  ARG H CA  1 
ATOM   1642 C CA  B ARG B 2 52  ? -2.862  -6.933  -16.349 0.50 22.37 ? 52  ARG H CA  1 
ATOM   1643 C C   . ARG B 2 52  ? -4.274  -6.371  -16.398 1.00 22.76 ? 52  ARG H C   1 
ATOM   1644 O O   . ARG B 2 52  ? -4.551  -5.345  -15.794 1.00 24.76 ? 52  ARG H O   1 
ATOM   1645 C CB  A ARG B 2 52  ? -2.269  -6.762  -14.914 0.50 23.74 ? 52  ARG H CB  1 
ATOM   1646 C CB  B ARG B 2 52  ? -2.194  -6.857  -14.967 0.50 23.20 ? 52  ARG H CB  1 
ATOM   1647 C CG  A ARG B 2 52  ? -0.822  -7.221  -14.805 0.50 25.07 ? 52  ARG H CG  1 
ATOM   1648 C CG  B ARG B 2 52  ? -0.743  -7.311  -15.048 0.50 23.87 ? 52  ARG H CG  1 
ATOM   1649 C CD  A ARG B 2 52  ? -0.152  -7.047  -13.433 0.50 26.57 ? 52  ARG H CD  1 
ATOM   1650 C CD  B ARG B 2 52  ? -0.054  -7.665  -13.726 0.50 25.15 ? 52  ARG H CD  1 
ATOM   1651 N NE  A ARG B 2 52  ? 1.311   -7.049  -13.561 0.50 27.70 ? 52  ARG H NE  1 
ATOM   1652 N NE  B ARG B 2 52  ? 1.049   -8.566  -14.070 0.50 25.76 ? 52  ARG H NE  1 
ATOM   1653 C CZ  A ARG B 2 52  ? 2.064   -8.131  -13.824 0.50 28.34 ? 52  ARG H CZ  1 
ATOM   1654 C CZ  B ARG B 2 52  ? 2.278   -8.170  -14.412 0.50 25.48 ? 52  ARG H CZ  1 
ATOM   1655 N NH1 A ARG B 2 52  ? 1.517   -9.334  -13.940 0.50 28.10 ? 52  ARG H NH1 1 
ATOM   1656 N NH1 B ARG B 2 52  ? 2.579   -6.878  -14.380 0.50 25.81 ? 52  ARG H NH1 1 
ATOM   1657 N NH2 A ARG B 2 52  ? 3.374   -8.007  -13.962 0.50 29.24 ? 52  ARG H NH2 1 
ATOM   1658 N NH2 B ARG B 2 52  ? 3.207   -9.069  -14.725 0.50 25.40 ? 52  ARG H NH2 1 
ATOM   1659 N N   . PRO B 2 53  ? -5.194  -7.055  -17.094 1.00 23.89 ? 53  PRO H N   1 
ATOM   1660 C CA  . PRO B 2 53  ? -6.523  -6.524  -17.328 1.00 25.76 ? 53  PRO H CA  1 
ATOM   1661 C C   . PRO B 2 53  ? -7.254  -6.222  -16.019 1.00 28.24 ? 53  PRO H C   1 
ATOM   1662 O O   . PRO B 2 53  ? -8.019  -5.304  -15.976 1.00 30.54 ? 53  PRO H O   1 
ATOM   1663 C CB  . PRO B 2 53  ? -7.191  -7.632  -18.151 1.00 25.74 ? 53  PRO H CB  1 
ATOM   1664 C CG  . PRO B 2 53  ? -6.052  -8.286  -18.871 1.00 25.34 ? 53  PRO H CG  1 
ATOM   1665 C CD  . PRO B 2 53  ? -4.937  -8.305  -17.841 1.00 24.14 ? 53  PRO H CD  1 
ATOM   1666 N N   . TYR B 2 54  ? -6.988  -7.017  -14.997 1.00 28.19 ? 54  TYR H N   1 
ATOM   1667 C CA  . TYR B 2 54  ? -7.727  -6.996  -13.704 1.00 29.79 ? 54  TYR H CA  1 
ATOM   1668 C C   . TYR B 2 54  ? -7.417  -5.698  -12.958 1.00 33.92 ? 54  TYR H C   1 
ATOM   1669 O O   . TYR B 2 54  ? -8.292  -5.272  -12.170 1.00 35.57 ? 54  TYR H O   1 
ATOM   1670 C CB  . TYR B 2 54  ? -7.358  -8.216  -12.854 1.00 28.98 ? 54  TYR H CB  1 
ATOM   1671 C CG  . TYR B 2 54  ? -5.898  -8.582  -12.700 1.00 27.77 ? 54  TYR H CG  1 
ATOM   1672 C CD1 . TYR B 2 54  ? -5.117  -8.069  -11.669 1.00 28.91 ? 54  TYR H CD1 1 
ATOM   1673 C CD2 . TYR B 2 54  ? -5.308  -9.509  -13.536 1.00 26.29 ? 54  TYR H CD2 1 
ATOM   1674 C CE1 . TYR B 2 54  ? -3.787  -8.419  -11.534 1.00 28.21 ? 54  TYR H CE1 1 
ATOM   1675 C CE2 . TYR B 2 54  ? -3.983  -9.883  -13.405 1.00 26.32 ? 54  TYR H CE2 1 
ATOM   1676 C CZ  . TYR B 2 54  ? -3.237  -9.377  -12.346 1.00 27.79 ? 54  TYR H CZ  1 
ATOM   1677 O OH  . TYR B 2 54  ? -1.929  -9.750  -12.220 1.00 29.81 ? 54  TYR H OH  1 
ATOM   1678 N N   . SER B 2 55  ? -6.235  -5.094  -13.170 1.00 33.36 ? 55  SER H N   1 
ATOM   1679 C CA  . SER B 2 55  ? -5.794  -3.842  -12.489 1.00 34.38 ? 55  SER H CA  1 
ATOM   1680 C C   . SER B 2 55  ? -5.613  -2.684  -13.484 1.00 36.05 ? 55  SER H C   1 
ATOM   1681 O O   . SER B 2 55  ? -5.521  -1.583  -12.992 1.00 40.36 ? 55  SER H O   1 
ATOM   1682 C CB  . SER B 2 55  ? -4.518  -4.076  -11.734 1.00 34.38 ? 55  SER H CB  1 
ATOM   1683 O OG  . SER B 2 55  ? -3.447  -4.366  -12.644 1.00 33.15 ? 55  SER H OG  1 
ATOM   1684 N N   . GLY B 2 56  ? -5.500  -2.910  -14.795 1.00 33.89 ? 56  GLY H N   1 
ATOM   1685 C CA  . GLY B 2 56  ? -5.098  -1.914  -15.815 1.00 32.69 ? 56  GLY H CA  1 
ATOM   1686 C C   . GLY B 2 56  ? -3.605  -1.591  -15.734 1.00 31.70 ? 56  GLY H C   1 
ATOM   1687 O O   . GLY B 2 56  ? -3.123  -0.794  -16.515 1.00 33.26 ? 56  GLY H O   1 
ATOM   1688 N N   . GLU B 2 57  ? -2.858  -2.270  -14.884 1.00 30.40 ? 57  GLU H N   1 
ATOM   1689 C CA  . GLU B 2 57  ? -1.395  -2.097  -14.800 1.00 28.94 ? 57  GLU H CA  1 
ATOM   1690 C C   . GLU B 2 57  ? -0.732  -2.474  -16.142 1.00 26.27 ? 57  GLU H C   1 
ATOM   1691 O O   . GLU B 2 57  ? -1.124  -3.446  -16.739 1.00 23.26 ? 57  GLU H O   1 
ATOM   1692 C CB  . GLU B 2 57  ? -0.878  -2.996  -13.690 1.00 31.47 ? 57  GLU H CB  1 
ATOM   1693 C CG  . GLU B 2 57  ? 0.618   -2.843  -13.462 1.00 35.28 ? 57  GLU H CG  1 
ATOM   1694 C CD  . GLU B 2 57  ? 1.129   -3.537  -12.224 1.00 37.90 ? 57  GLU H CD  1 
ATOM   1695 O OE1 . GLU B 2 57  ? 0.544   -3.283  -11.140 1.00 40.36 ? 57  GLU H OE1 1 
ATOM   1696 O OE2 . GLU B 2 57  ? 2.057   -4.354  -12.372 1.00 40.44 ? 57  GLU H OE2 1 
ATOM   1697 N N   . THR B 2 58  ? 0.256   -1.698  -16.585 1.00 24.79 ? 58  THR H N   1 
ATOM   1698 C CA  . THR B 2 58  ? 1.105   -2.008  -17.751 1.00 24.01 ? 58  THR H CA  1 
ATOM   1699 C C   . THR B 2 58  ? 2.559   -1.915  -17.323 1.00 24.32 ? 58  THR H C   1 
ATOM   1700 O O   . THR B 2 58  ? 2.893   -1.058  -16.477 1.00 25.66 ? 58  THR H O   1 
ATOM   1701 C CB  . THR B 2 58  ? 0.859   -1.064  -18.923 1.00 24.09 ? 58  THR H CB  1 
ATOM   1702 O OG1 . THR B 2 58  ? 0.934   0.280   -18.431 1.00 24.56 ? 58  THR H OG1 1 
ATOM   1703 C CG2 . THR B 2 58  ? -0.459  -1.314  -19.620 1.00 23.76 ? 58  THR H CG2 1 
ATOM   1704 N N   . ASN B 2 59  ? 3.398   -2.782  -17.853 1.00 23.27 ? 59  ASN H N   1 
ATOM   1705 C CA  A ASN B 2 59  ? 4.864   -2.718  -17.636 0.50 23.60 ? 59  ASN H CA  1 
ATOM   1706 C CA  B ASN B 2 59  ? 4.861   -2.686  -17.648 0.50 23.58 ? 59  ASN H CA  1 
ATOM   1707 C C   . ASN B 2 59  ? 5.474   -2.872  -19.026 1.00 22.41 ? 59  ASN H C   1 
ATOM   1708 O O   . ASN B 2 59  ? 5.102   -3.893  -19.703 1.00 21.12 ? 59  ASN H O   1 
ATOM   1709 C CB  A ASN B 2 59  ? 5.368   -3.781  -16.648 0.50 24.80 ? 59  ASN H CB  1 
ATOM   1710 C CB  B ASN B 2 59  ? 5.377   -3.689  -16.617 0.50 24.78 ? 59  ASN H CB  1 
ATOM   1711 C CG  A ASN B 2 59  ? 4.831   -3.647  -15.233 0.50 26.28 ? 59  ASN H CG  1 
ATOM   1712 C CG  B ASN B 2 59  ? 6.845   -3.511  -16.298 0.50 26.21 ? 59  ASN H CG  1 
ATOM   1713 O OD1 A ASN B 2 59  ? 5.368   -2.880  -14.439 0.50 29.23 ? 59  ASN H OD1 1 
ATOM   1714 O OD1 B ASN B 2 59  ? 7.706   -3.734  -17.147 0.50 27.57 ? 59  ASN H OD1 1 
ATOM   1715 N ND2 A ASN B 2 59  ? 3.795   -4.407  -14.892 0.50 26.11 ? 59  ASN H ND2 1 
ATOM   1716 N ND2 B ASN B 2 59  ? 7.135   -3.104  -15.071 0.50 27.94 ? 59  ASN H ND2 1 
ATOM   1717 N N   . TYR B 2 60  ? 6.267   -1.890  -19.449 1.00 22.27 ? 60  TYR H N   1 
ATOM   1718 C CA  . TYR B 2 60  ? 6.887   -1.901  -20.780 1.00 21.41 ? 60  TYR H CA  1 
ATOM   1719 C C   . TYR B 2 60  ? 8.368   -2.194  -20.614 1.00 21.64 ? 60  TYR H C   1 
ATOM   1720 O O   . TYR B 2 60  ? 9.045   -1.571  -19.793 1.00 22.22 ? 60  TYR H O   1 
ATOM   1721 C CB  . TYR B 2 60  ? 6.708   -0.572  -21.506 1.00 22.31 ? 60  TYR H CB  1 
ATOM   1722 C CG  . TYR B 2 60  ? 5.290   -0.231  -21.865 1.00 22.45 ? 60  TYR H CG  1 
ATOM   1723 C CD1 . TYR B 2 60  ? 4.437   0.337   -20.929 1.00 23.04 ? 60  TYR H CD1 1 
ATOM   1724 C CD2 . TYR B 2 60  ? 4.790   -0.545  -23.131 1.00 21.72 ? 60  TYR H CD2 1 
ATOM   1725 C CE1 . TYR B 2 60  ? 3.126   0.641   -21.259 1.00 22.64 ? 60  TYR H CE1 1 
ATOM   1726 C CE2 . TYR B 2 60  ? 3.490   -0.224  -23.479 1.00 21.51 ? 60  TYR H CE2 1 
ATOM   1727 C CZ  . TYR B 2 60  ? 2.660   0.380   -22.545 1.00 22.33 ? 60  TYR H CZ  1 
ATOM   1728 O OH  . TYR B 2 60  ? 1.348   0.687   -22.823 1.00 21.24 ? 60  TYR H OH  1 
ATOM   1729 N N   . ASN B 2 61  ? 8.903   -3.039  -21.484 1.00 20.71 ? 61  ASN H N   1 
ATOM   1730 C CA  . ASN B 2 61  ? 10.350  -3.040  -21.783 1.00 22.00 ? 61  ASN H CA  1 
ATOM   1731 C C   . ASN B 2 61  ? 10.803  -1.623  -22.166 1.00 23.44 ? 61  ASN H C   1 
ATOM   1732 O O   . ASN B 2 61  ? 10.211  -1.026  -23.090 1.00 21.78 ? 61  ASN H O   1 
ATOM   1733 C CB  . ASN B 2 61  ? 10.661  -4.016  -22.913 1.00 20.81 ? 61  ASN H CB  1 
ATOM   1734 C CG  . ASN B 2 61  ? 12.134  -4.239  -23.125 1.00 20.64 ? 61  ASN H CG  1 
ATOM   1735 O OD1 . ASN B 2 61  ? 12.986  -3.417  -22.790 1.00 22.39 ? 61  ASN H OD1 1 
ATOM   1736 N ND2 . ASN B 2 61  ? 12.441  -5.368  -23.719 1.00 20.68 ? 61  ASN H ND2 1 
ATOM   1737 N N   . GLN B 2 62  ? 11.837  -1.098  -21.498 1.00 25.90 ? 62  GLN H N   1 
ATOM   1738 C CA  . GLN B 2 62  ? 12.274  0.291   -21.780 1.00 29.33 ? 62  GLN H CA  1 
ATOM   1739 C C   . GLN B 2 62  ? 12.594  0.438   -23.262 1.00 27.77 ? 62  GLN H C   1 
ATOM   1740 O O   . GLN B 2 62  ? 12.421  1.535   -23.750 1.00 28.59 ? 62  GLN H O   1 
ATOM   1741 C CB  . GLN B 2 62  ? 13.457  0.733   -20.902 1.00 34.30 ? 62  GLN H CB  1 
ATOM   1742 C CG  . GLN B 2 62  ? 12.983  1.258   -19.566 1.00 40.04 ? 62  GLN H CG  1 
ATOM   1743 C CD  . GLN B 2 62  ? 12.422  2.668   -19.552 1.00 44.93 ? 62  GLN H CD  1 
ATOM   1744 O OE1 . GLN B 2 62  ? 11.347  2.905   -19.000 1.00 48.61 ? 62  GLN H OE1 1 
ATOM   1745 N NE2 . GLN B 2 62  ? 13.174  3.628   -20.089 1.00 50.39 ? 62  GLN H NE2 1 
ATOM   1746 N N   . LYS B 2 63  ? 13.070  -0.612  -23.945 1.00 26.47 ? 63  LYS H N   1 
ATOM   1747 C CA  . LYS B 2 63  ? 13.441  -0.567  -25.380 1.00 27.14 ? 63  LYS H CA  1 
ATOM   1748 C C   . LYS B 2 63  ? 12.206  -0.226  -26.236 1.00 24.93 ? 63  LYS H C   1 
ATOM   1749 O O   . LYS B 2 63  ? 12.428  0.257   -27.347 1.00 25.82 ? 63  LYS H O   1 
ATOM   1750 C CB  . LYS B 2 63  ? 14.088  -1.883  -25.842 1.00 27.32 ? 63  LYS H CB  1 
ATOM   1751 C CG  . LYS B 2 63  ? 15.460  -2.117  -25.203 1.00 30.49 ? 63  LYS H CG  1 
ATOM   1752 C CD  . LYS B 2 63  ? 16.217  -3.312  -25.774 1.00 31.20 ? 63  LYS H CD  1 
ATOM   1753 C CE  . LYS B 2 63  ? 17.444  -3.713  -24.962 1.00 32.86 ? 63  LYS H CE  1 
ATOM   1754 N NZ  . LYS B 2 63  ? 18.064  -4.895  -25.617 1.00 33.75 ? 63  LYS H NZ  1 
ATOM   1755 N N   . PHE B 2 64  ? 10.993  -0.452  -25.736 1.00 23.09 ? 64  PHE H N   1 
ATOM   1756 C CA  . PHE B 2 64  ? 9.718   -0.286  -26.494 1.00 22.86 ? 64  PHE H CA  1 
ATOM   1757 C C   . PHE B 2 64  ? 8.897   0.875   -25.936 1.00 25.07 ? 64  PHE H C   1 
ATOM   1758 O O   . PHE B 2 64  ? 7.802   1.097   -26.430 1.00 23.15 ? 64  PHE H O   1 
ATOM   1759 C CB  . PHE B 2 64  ? 8.890   -1.578  -26.504 1.00 21.36 ? 64  PHE H CB  1 
ATOM   1760 C CG  . PHE B 2 64  ? 9.545   -2.643  -27.362 1.00 21.23 ? 64  PHE H CG  1 
ATOM   1761 C CD1 . PHE B 2 64  ? 9.407   -2.644  -28.734 1.00 21.11 ? 64  PHE H CD1 1 
ATOM   1762 C CD2 . PHE B 2 64  ? 10.391  -3.584  -26.814 1.00 20.77 ? 64  PHE H CD2 1 
ATOM   1763 C CE1 . PHE B 2 64  ? 10.079  -3.568  -29.523 1.00 20.79 ? 64  PHE H CE1 1 
ATOM   1764 C CE2 . PHE B 2 64  ? 11.040  -4.524  -27.587 1.00 21.35 ? 64  PHE H CE2 1 
ATOM   1765 C CZ  . PHE B 2 64  ? 10.882  -4.518  -28.955 1.00 21.24 ? 64  PHE H CZ  1 
ATOM   1766 N N   . LYS B 2 65  ? 9.390   1.571   -24.918 1.00 27.03 ? 65  LYS H N   1 
ATOM   1767 C CA  . LYS B 2 65  ? 8.568   2.581   -24.225 1.00 31.41 ? 65  LYS H CA  1 
ATOM   1768 C C   . LYS B 2 65  ? 8.058   3.649   -25.212 1.00 30.83 ? 65  LYS H C   1 
ATOM   1769 O O   . LYS B 2 65  ? 6.900   4.105   -25.012 1.00 31.40 ? 65  LYS H O   1 
ATOM   1770 C CB  . LYS B 2 65  ? 9.370   3.228   -23.100 1.00 34.76 ? 65  LYS H CB  1 
ATOM   1771 C CG  . LYS B 2 65  ? 8.632   4.370   -22.441 1.00 41.84 ? 65  LYS H CG  1 
ATOM   1772 C CD  . LYS B 2 65  ? 9.273   4.912   -21.197 1.00 46.47 ? 65  LYS H CD  1 
ATOM   1773 C CE  . LYS B 2 65  ? 8.488   6.073   -20.607 1.00 50.54 ? 65  LYS H CE  1 
ATOM   1774 N NZ  . LYS B 2 65  ? 8.603   6.065   -19.131 1.00 52.83 ? 65  LYS H NZ  1 
ATOM   1775 N N   . ASP B 2 66  ? 8.860   4.064   -26.189 1.00 31.09 ? 66  ASP H N   1 
ATOM   1776 C CA  . ASP B 2 66  ? 8.433   5.141   -27.133 1.00 33.80 ? 66  ASP H CA  1 
ATOM   1777 C C   . ASP B 2 66  ? 7.693   4.573   -28.355 1.00 31.00 ? 66  ASP H C   1 
ATOM   1778 O O   . ASP B 2 66  ? 7.337   5.340   -29.240 1.00 36.12 ? 66  ASP H O   1 
ATOM   1779 C CB  . ASP B 2 66  ? 9.627   6.007   -27.542 1.00 36.93 ? 66  ASP H CB  1 
ATOM   1780 C CG  . ASP B 2 66  ? 10.086  6.881   -26.403 1.00 40.00 ? 66  ASP H CG  1 
ATOM   1781 O OD1 . ASP B 2 66  ? 9.225   7.255   -25.566 1.00 40.27 ? 66  ASP H OD1 1 
ATOM   1782 O OD2 . ASP B 2 66  ? 11.291  7.143   -26.339 1.00 43.20 ? 66  ASP H OD2 1 
ATOM   1783 N N   . LYS B 2 67  ? 7.529   3.286   -28.449 1.00 27.14 ? 67  LYS H N   1 
ATOM   1784 C CA  . LYS B 2 67  ? 7.097   2.588   -29.683 1.00 26.16 ? 67  LYS H CA  1 
ATOM   1785 C C   . LYS B 2 67  ? 5.718   1.996   -29.414 1.00 24.16 ? 67  LYS H C   1 
ATOM   1786 O O   . LYS B 2 67  ? 4.873   2.040   -30.314 1.00 24.09 ? 67  LYS H O   1 
ATOM   1787 C CB  . LYS B 2 67  ? 8.082   1.452   -30.025 1.00 25.60 ? 67  LYS H CB  1 
ATOM   1788 C CG  . LYS B 2 67  ? 7.780   0.578   -31.270 1.00 25.05 ? 67  LYS H CG  1 
ATOM   1789 C CD  . LYS B 2 67  ? 7.723   1.340   -32.591 1.00 25.78 ? 67  LYS H CD  1 
ATOM   1790 C CE  . LYS B 2 67  ? 8.977   2.121   -32.916 1.00 26.67 ? 67  LYS H CE  1 
ATOM   1791 N NZ  . LYS B 2 67  ? 8.908   2.696   -34.272 1.00 26.32 ? 67  LYS H NZ  1 
ATOM   1792 N N   . ALA B 2 68  ? 5.578   1.313   -28.277 1.00 21.89 ? 68  ALA H N   1 
ATOM   1793 C CA  . ALA B 2 68  ? 4.414   0.452   -28.007 1.00 20.52 ? 68  ALA H CA  1 
ATOM   1794 C C   . ALA B 2 68  ? 3.427   1.096   -27.028 1.00 20.14 ? 68  ALA H C   1 
ATOM   1795 O O   . ALA B 2 68  ? 3.812   1.751   -26.041 1.00 21.61 ? 68  ALA H O   1 
ATOM   1796 C CB  . ALA B 2 68  ? 4.884   -0.875  -27.491 1.00 19.82 ? 68  ALA H CB  1 
ATOM   1797 N N   . THR B 2 69  ? 2.150   0.855   -27.264 1.00 19.55 ? 69  THR H N   1 
ATOM   1798 C CA  . THR B 2 69  ? 1.065   1.124   -26.290 1.00 19.75 ? 69  THR H CA  1 
ATOM   1799 C C   . THR B 2 69  ? 0.181   -0.117  -26.163 1.00 18.48 ? 69  THR H C   1 
ATOM   1800 O O   . THR B 2 69  ? -0.364  -0.548  -27.190 1.00 17.88 ? 69  THR H O   1 
ATOM   1801 C CB  . THR B 2 69  ? 0.232   2.334   -26.697 1.00 20.83 ? 69  THR H CB  1 
ATOM   1802 O OG1 . THR B 2 69  ? 1.098   3.461   -26.890 1.00 21.63 ? 69  THR H OG1 1 
ATOM   1803 C CG2 . THR B 2 69  ? -0.793  2.691   -25.630 1.00 21.92 ? 69  THR H CG2 1 
ATOM   1804 N N   . MET B 2 70  ? -0.013  -0.617  -24.942 1.00 17.95 ? 70  MET H N   1 
ATOM   1805 C CA  . MET B 2 70  ? -0.905  -1.775  -24.656 1.00 17.21 ? 70  MET H CA  1 
ATOM   1806 C C   . MET B 2 70  ? -2.206  -1.273  -24.036 1.00 18.09 ? 70  MET H C   1 
ATOM   1807 O O   . MET B 2 70  ? -2.167  -0.442  -23.102 1.00 18.41 ? 70  MET H O   1 
ATOM   1808 C CB  . MET B 2 70  ? -0.224  -2.783  -23.714 1.00 17.68 ? 70  MET H CB  1 
ATOM   1809 C CG  . MET B 2 70  ? 1.005   -3.449  -24.358 1.00 17.07 ? 70  MET H CG  1 
ATOM   1810 S SD  . MET B 2 70  ? 1.897   -4.389  -23.094 1.00 18.37 ? 70  MET H SD  1 
ATOM   1811 C CE  . MET B 2 70  ? 2.319   -3.152  -21.861 1.00 20.71 ? 70  MET H CE  1 
ATOM   1812 N N   . THR B 2 71  ? -3.329  -1.727  -24.583 1.00 17.41 ? 71  THR H N   1 
ATOM   1813 C CA  . THR B 2 71  ? -4.660  -1.423  -24.046 1.00 18.47 ? 71  THR H CA  1 
ATOM   1814 C C   . THR B 2 71  ? -5.453  -2.715  -24.010 1.00 18.74 ? 71  THR H C   1 
ATOM   1815 O O   . THR B 2 71  ? -5.033  -3.708  -24.581 1.00 17.45 ? 71  THR H O   1 
ATOM   1816 C CB  . THR B 2 71  ? -5.360  -0.323  -24.839 1.00 18.75 ? 71  THR H CB  1 
ATOM   1817 O OG1 . THR B 2 71  ? -5.430  -0.733  -26.192 1.00 18.59 ? 71  THR H OG1 1 
ATOM   1818 C CG2 . THR B 2 71  ? -4.637  1.000   -24.725 1.00 20.09 ? 71  THR H CG2 1 
ATOM   1819 N N   . VAL B 2 72  ? -6.602  -2.680  -23.356 1.00 20.81 ? 72  VAL H N   1 
ATOM   1820 C CA  . VAL B 2 72  ? -7.505  -3.859  -23.383 1.00 22.78 ? 72  VAL H CA  1 
ATOM   1821 C C   . VAL B 2 72  ? -8.932  -3.341  -23.459 1.00 25.68 ? 72  VAL H C   1 
ATOM   1822 O O   . VAL B 2 72  ? -9.229  -2.255  -22.834 1.00 27.98 ? 72  VAL H O   1 
ATOM   1823 C CB  . VAL B 2 72  ? -7.217  -4.717  -22.148 1.00 24.63 ? 72  VAL H CB  1 
ATOM   1824 C CG1 . VAL B 2 72  ? -7.683  -4.038  -20.860 1.00 27.04 ? 72  VAL H CG1 1 
ATOM   1825 C CG2 . VAL B 2 72  ? -7.756  -6.106  -22.239 1.00 25.32 ? 72  VAL H CG2 1 
ATOM   1826 N N   . ASP B 2 73  ? -9.795  -4.076  -24.147 1.00 24.63 ? 73  ASP H N   1 
ATOM   1827 C CA  . ASP B 2 73  ? -11.257 -3.904  -24.036 1.00 27.42 ? 73  ASP H CA  1 
ATOM   1828 C C   . ASP B 2 73  ? -11.810 -5.143  -23.323 1.00 26.88 ? 73  ASP H C   1 
ATOM   1829 O O   . ASP B 2 73  ? -11.835 -6.225  -23.953 1.00 26.55 ? 73  ASP H O   1 
ATOM   1830 C CB  . ASP B 2 73  ? -11.837 -3.706  -25.434 1.00 28.37 ? 73  ASP H CB  1 
ATOM   1831 C CG  . ASP B 2 73  ? -13.324 -3.462  -25.335 1.00 32.85 ? 73  ASP H CG  1 
ATOM   1832 O OD1 . ASP B 2 73  ? -13.918 -3.840  -24.308 1.00 35.55 ? 73  ASP H OD1 1 
ATOM   1833 O OD2 . ASP B 2 73  ? -13.835 -2.870  -26.223 1.00 36.58 ? 73  ASP H OD2 1 
ATOM   1834 N N   . ILE B 2 74  ? -12.213 -5.015  -22.070 1.00 29.02 ? 74  ILE H N   1 
ATOM   1835 C CA  . ILE B 2 74  ? -12.656 -6.171  -21.263 1.00 30.15 ? 74  ILE H CA  1 
ATOM   1836 C C   . ILE B 2 74  ? -13.930 -6.721  -21.901 1.00 30.73 ? 74  ILE H C   1 
ATOM   1837 O O   . ILE B 2 74  ? -14.079 -7.959  -21.971 1.00 30.53 ? 74  ILE H O   1 
ATOM   1838 C CB  . ILE B 2 74  ? -12.858 -5.830  -19.778 1.00 32.53 ? 74  ILE H CB  1 
ATOM   1839 C CG1 . ILE B 2 74  ? -11.556 -5.353  -19.117 1.00 33.48 ? 74  ILE H CG1 1 
ATOM   1840 C CG2 . ILE B 2 74  ? -13.447 -7.035  -19.049 1.00 33.12 ? 74  ILE H CG2 1 
ATOM   1841 C CD1 . ILE B 2 74  ? -10.404 -6.286  -19.344 1.00 33.11 ? 74  ILE H CD1 1 
ATOM   1842 N N   . SER B 2 75  ? -14.808 -5.856  -22.381 1.00 30.79 ? 75  SER H N   1 
ATOM   1843 C CA  . SER B 2 75  ? -16.137 -6.318  -22.839 1.00 32.37 ? 75  SER H CA  1 
ATOM   1844 C C   . SER B 2 75  ? -15.998 -7.191  -24.104 1.00 31.44 ? 75  SER H C   1 
ATOM   1845 O O   . SER B 2 75  ? -16.896 -7.947  -24.350 1.00 32.27 ? 75  SER H O   1 
ATOM   1846 C CB  . SER B 2 75  ? -17.081 -5.163  -23.013 1.00 34.84 ? 75  SER H CB  1 
ATOM   1847 O OG  . SER B 2 75  ? -16.723 -4.446  -24.172 1.00 36.17 ? 75  SER H OG  1 
ATOM   1848 N N   . SER B 2 76  ? -14.938 -7.076  -24.903 1.00 27.99 ? 76  SER H N   1 
ATOM   1849 C CA  . SER B 2 76  ? -14.702 -7.949  -26.085 1.00 27.98 ? 76  SER H CA  1 
ATOM   1850 C C   . SER B 2 76  ? -13.565 -8.952  -25.828 1.00 25.02 ? 76  SER H C   1 
ATOM   1851 O O   . SER B 2 76  ? -13.080 -9.579  -26.791 1.00 24.24 ? 76  SER H O   1 
ATOM   1852 C CB  . SER B 2 76  ? -14.427 -7.108  -27.310 1.00 28.41 ? 76  SER H CB  1 
ATOM   1853 O OG  . SER B 2 76  ? -13.178 -6.413  -27.141 1.00 28.78 ? 76  SER H OG  1 
ATOM   1854 N N   . SER B 2 77  ? -13.059 -9.057  -24.607 1.00 24.47 ? 77  SER H N   1 
ATOM   1855 C CA  . SER B 2 77  ? -11.930 -9.961  -24.272 1.00 24.34 ? 77  SER H CA  1 
ATOM   1856 C C   . SER B 2 77  ? -10.782 -9.775  -25.269 1.00 22.91 ? 77  SER H C   1 
ATOM   1857 O O   . SER B 2 77  ? -10.151 -10.770 -25.681 1.00 22.14 ? 77  SER H O   1 
ATOM   1858 C CB  . SER B 2 77  ? -12.398 -11.405 -24.250 1.00 25.45 ? 77  SER H CB  1 
ATOM   1859 O OG  . SER B 2 77  ? -13.402 -11.591 -23.256 1.00 26.59 ? 77  SER H OG  1 
ATOM   1860 N N   . THR B 2 78  ? -10.426 -8.524  -25.576 1.00 22.58 ? 78  THR H N   1 
ATOM   1861 C CA  . THR B 2 78  ? -9.429  -8.227  -26.624 1.00 20.72 ? 78  THR H CA  1 
ATOM   1862 C C   . THR B 2 78  ? -8.373  -7.274  -26.082 1.00 20.00 ? 78  THR H C   1 
ATOM   1863 O O   . THR B 2 78  ? -8.754  -6.249  -25.507 1.00 21.59 ? 78  THR H O   1 
ATOM   1864 C CB  . THR B 2 78  ? -10.088 -7.658  -27.875 1.00 21.24 ? 78  THR H CB  1 
ATOM   1865 O OG1 . THR B 2 78  ? -11.060 -8.601  -28.356 1.00 21.87 ? 78  THR H OG1 1 
ATOM   1866 C CG2 . THR B 2 78  ? -9.062  -7.353  -28.944 1.00 20.55 ? 78  THR H CG2 1 
ATOM   1867 N N   . ALA B 2 79  ? -7.114  -7.666  -26.212 1.00 19.21 ? 79  ALA H N   1 
ATOM   1868 C CA  . ALA B 2 79  ? -5.918  -6.841  -25.948 1.00 18.06 ? 79  ALA H CA  1 
ATOM   1869 C C   . ALA B 2 79  ? -5.436  -6.240  -27.258 1.00 18.13 ? 79  ALA H C   1 
ATOM   1870 O O   . ALA B 2 79  ? -5.512  -6.920  -28.307 1.00 17.43 ? 79  ALA H O   1 
ATOM   1871 C CB  . ALA B 2 79  ? -4.826  -7.645  -25.307 1.00 17.31 ? 79  ALA H CB  1 
ATOM   1872 N N   . TYR B 2 80  ? -4.882  -5.050  -27.186 1.00 17.60 ? 80  TYR H N   1 
ATOM   1873 C CA  . TYR B 2 80  ? -4.371  -4.332  -28.378 1.00 17.62 ? 80  TYR H CA  1 
ATOM   1874 C C   . TYR B 2 80  ? -2.945  -3.894  -28.103 1.00 17.71 ? 80  TYR H C   1 
ATOM   1875 O O   . TYR B 2 80  ? -2.619  -3.446  -26.970 1.00 17.93 ? 80  TYR H O   1 
ATOM   1876 C CB  . TYR B 2 80  ? -5.236  -3.127  -28.673 1.00 19.47 ? 80  TYR H CB  1 
ATOM   1877 C CG  . TYR B 2 80  ? -6.680  -3.407  -28.990 1.00 21.25 ? 80  TYR H CG  1 
ATOM   1878 C CD1 . TYR B 2 80  ? -7.086  -3.683  -30.284 1.00 22.05 ? 80  TYR H CD1 1 
ATOM   1879 C CD2 . TYR B 2 80  ? -7.634  -3.430  -27.974 1.00 22.86 ? 80  TYR H CD2 1 
ATOM   1880 C CE1 . TYR B 2 80  ? -8.416  -3.903  -30.592 1.00 23.32 ? 80  TYR H CE1 1 
ATOM   1881 C CE2 . TYR B 2 80  ? -8.970  -3.677  -28.267 1.00 24.67 ? 80  TYR H CE2 1 
ATOM   1882 C CZ  . TYR B 2 80  ? -9.342  -3.950  -29.571 1.00 25.24 ? 80  TYR H CZ  1 
ATOM   1883 O OH  . TYR B 2 80  ? -10.626 -4.238  -29.895 1.00 28.35 ? 80  TYR H OH  1 
ATOM   1884 N N   . LEU B 2 81  ? -2.147  -3.939  -29.144 1.00 17.58 ? 81  LEU H N   1 
ATOM   1885 C CA  . LEU B 2 81  ? -0.778  -3.417  -29.173 1.00 18.10 ? 81  LEU H CA  1 
ATOM   1886 C C   . LEU B 2 81  ? -0.716  -2.376  -30.288 1.00 17.94 ? 81  LEU H C   1 
ATOM   1887 O O   . LEU B 2 81  ? -0.933  -2.744  -31.494 1.00 17.78 ? 81  LEU H O   1 
ATOM   1888 C CB  . LEU B 2 81  ? 0.207   -4.557  -29.445 1.00 17.32 ? 81  LEU H CB  1 
ATOM   1889 C CG  . LEU B 2 81  ? 1.657   -4.090  -29.513 1.00 18.10 ? 81  LEU H CG  1 
ATOM   1890 C CD1 . LEU B 2 81  ? 2.148   -3.560  -28.159 1.00 19.06 ? 81  LEU H CD1 1 
ATOM   1891 C CD2 . LEU B 2 81  ? 2.561   -5.237  -29.930 1.00 17.71 ? 81  LEU H CD2 1 
ATOM   1892 N N   . GLU B 2 82  ? -0.463  -1.123  -29.954 1.00 19.06 ? 82  GLU H N   1 
ATOM   1893 C CA  . GLU B 2 82  ? -0.279  -0.078  -30.974 1.00 20.58 ? 82  GLU H CA  1 
ATOM   1894 C C   . GLU B 2 82  ? 1.215   0.176   -31.075 1.00 20.81 ? 82  GLU H C   1 
ATOM   1895 O O   . GLU B 2 82  ? 1.818   0.440   -30.050 1.00 20.99 ? 82  GLU H O   1 
ATOM   1896 C CB  . GLU B 2 82  ? -1.017  1.229   -30.677 1.00 24.02 ? 82  GLU H CB  1 
ATOM   1897 C CG  . GLU B 2 82  ? -1.023  2.160   -31.857 1.00 26.38 ? 82  GLU H CG  1 
ATOM   1898 C CD  . GLU B 2 82  ? -2.045  3.304   -31.777 1.00 32.43 ? 82  GLU H CD  1 
ATOM   1899 O OE1 . GLU B 2 82  ? -2.678  3.479   -30.716 1.00 35.68 ? 82  GLU H OE1 1 
ATOM   1900 O OE2 . GLU B 2 82  ? -2.100  4.089   -32.726 1.00 38.86 ? 82  GLU H OE2 1 
ATOM   1901 N N   . LEU B 2 83  ? 1.736   0.139   -32.285 1.00 19.96 ? 83  LEU H N   1 
ATOM   1902 C CA  . LEU B 2 83  ? 3.141   0.451   -32.611 1.00 21.14 ? 83  LEU H CA  1 
ATOM   1903 C C   . LEU B 2 83  ? 3.166   1.758   -33.418 1.00 21.51 ? 83  LEU H C   1 
ATOM   1904 O O   . LEU B 2 83  ? 2.507   1.836   -34.463 1.00 22.82 ? 83  LEU H O   1 
ATOM   1905 C CB  . LEU B 2 83  ? 3.705   -0.724  -33.399 1.00 21.12 ? 83  LEU H CB  1 
ATOM   1906 C CG  . LEU B 2 83  ? 3.730   -2.085  -32.700 1.00 21.33 ? 83  LEU H CG  1 
ATOM   1907 C CD1 . LEU B 2 83  ? 4.143   -3.177  -33.700 1.00 21.75 ? 83  LEU H CD1 1 
ATOM   1908 C CD2 . LEU B 2 83  ? 4.674   -2.076  -31.528 1.00 21.53 ? 83  LEU H CD2 1 
ATOM   1909 N N   . ALA B 2 84  ? 3.871   2.771   -32.937 1.00 22.92 ? 84  ALA H N   1 
ATOM   1910 C CA  . ALA B 2 84  ? 3.790   4.155   -33.447 1.00 24.64 ? 84  ALA H CA  1 
ATOM   1911 C C   . ALA B 2 84  ? 5.027   4.390   -34.311 1.00 26.16 ? 84  ALA H C   1 
ATOM   1912 O O   . ALA B 2 84  ? 6.049   3.744   -34.052 1.00 24.90 ? 84  ALA H O   1 
ATOM   1913 C CB  . ALA B 2 84  ? 3.686   5.174   -32.320 1.00 26.57 ? 84  ALA H CB  1 
ATOM   1914 N N   . ARG B 2 85  ? 4.901   5.245   -35.316 1.00 28.52 ? 85  ARG H N   1 
ATOM   1915 C CA  . ARG B 2 85  ? 6.047   5.803   -36.074 1.00 31.41 ? 85  ARG H CA  1 
ATOM   1916 C C   . ARG B 2 85  ? 6.914   4.663   -36.612 1.00 28.68 ? 85  ARG H C   1 
ATOM   1917 O O   . ARG B 2 85  ? 8.113   4.684   -36.398 1.00 26.96 ? 85  ARG H O   1 
ATOM   1918 C CB  . ARG B 2 85  ? 6.874   6.734   -35.184 1.00 36.00 ? 85  ARG H CB  1 
ATOM   1919 C CG  . ARG B 2 85  ? 6.213   8.077   -34.888 1.00 41.48 ? 85  ARG H CG  1 
ATOM   1920 C CD  . ARG B 2 85  ? 7.123   8.975   -34.069 1.00 45.70 ? 85  ARG H CD  1 
ATOM   1921 N NE  . ARG B 2 85  ? 7.384   8.362   -32.771 1.00 48.07 ? 85  ARG H NE  1 
ATOM   1922 C CZ  . ARG B 2 85  ? 6.467   8.183   -31.815 1.00 51.85 ? 85  ARG H CZ  1 
ATOM   1923 N NH1 . ARG B 2 85  ? 5.225   8.617   -31.977 1.00 54.39 ? 85  ARG H NH1 1 
ATOM   1924 N NH2 . ARG B 2 85  ? 6.792   7.574   -30.682 1.00 53.23 ? 85  ARG H NH2 1 
ATOM   1925 N N   . LEU B 2 86  ? 6.335   3.762   -37.401 1.00 26.75 ? 86  LEU H N   1 
ATOM   1926 C CA  . LEU B 2 86  ? 7.031   2.534   -37.833 1.00 25.72 ? 86  LEU H CA  1 
ATOM   1927 C C   . LEU B 2 86  ? 8.212   2.850   -38.750 1.00 25.54 ? 86  LEU H C   1 
ATOM   1928 O O   . LEU B 2 86  ? 8.134   3.749   -39.600 1.00 26.83 ? 86  LEU H O   1 
ATOM   1929 C CB  . LEU B 2 86  ? 6.019   1.622   -38.507 1.00 26.11 ? 86  LEU H CB  1 
ATOM   1930 C CG  . LEU B 2 86  ? 4.872   1.267   -37.568 1.00 27.36 ? 86  LEU H CG  1 
ATOM   1931 C CD1 . LEU B 2 86  ? 3.688   0.698   -38.321 1.00 29.22 ? 86  LEU H CD1 1 
ATOM   1932 C CD2 . LEU B 2 86  ? 5.382   0.326   -36.527 1.00 28.19 ? 86  LEU H CD2 1 
ATOM   1933 N N   . THR B 2 87  ? 9.237   2.041   -38.597 1.00 23.88 ? 87  THR H N   1 
ATOM   1934 C CA  . THR B 2 87  ? 10.388  1.959   -39.515 1.00 25.00 ? 87  THR H CA  1 
ATOM   1935 C C   . THR B 2 87  ? 10.583  0.495   -39.917 1.00 23.66 ? 87  THR H C   1 
ATOM   1936 O O   . THR B 2 87  ? 9.904   -0.407  -39.363 1.00 20.30 ? 87  THR H O   1 
ATOM   1937 C CB  . THR B 2 87  ? 11.620  2.518   -38.816 1.00 26.43 ? 87  THR H CB  1 
ATOM   1938 O OG1 . THR B 2 87  ? 11.990  1.526   -37.859 1.00 25.40 ? 87  THR H OG1 1 
ATOM   1939 C CG2 . THR B 2 87  ? 11.355  3.855   -38.151 1.00 28.22 ? 87  THR H CG2 1 
ATOM   1940 N N   . SER B 2 88  ? 11.550  0.242   -40.805 1.00 24.88 ? 88  SER H N   1 
ATOM   1941 C CA  . SER B 2 88  ? 11.809  -1.158  -41.237 1.00 25.30 ? 88  SER H CA  1 
ATOM   1942 C C   . SER B 2 88  ? 12.177  -2.024  -40.029 1.00 23.91 ? 88  SER H C   1 
ATOM   1943 O O   . SER B 2 88  ? 11.922  -3.212  -40.099 1.00 21.86 ? 88  SER H O   1 
ATOM   1944 C CB  . SER B 2 88  ? 12.887  -1.194  -42.290 1.00 27.27 ? 88  SER H CB  1 
ATOM   1945 O OG  . SER B 2 88  ? 14.044  -0.565  -41.812 1.00 32.12 ? 88  SER H OG  1 
ATOM   1946 N N   . GLU B 2 89  ? 12.743  -1.469  -38.958 1.00 26.04 ? 89  GLU H N   1 
ATOM   1947 C CA  . GLU B 2 89  ? 13.158  -2.278  -37.787 1.00 26.97 ? 89  GLU H CA  1 
ATOM   1948 C C   . GLU B 2 89  ? 11.944  -2.827  -37.066 1.00 25.29 ? 89  GLU H C   1 
ATOM   1949 O O   . GLU B 2 89  ? 12.159  -3.695  -36.230 1.00 23.56 ? 89  GLU H O   1 
ATOM   1950 C CB  . GLU B 2 89  ? 13.993  -1.489  -36.791 1.00 31.89 ? 89  GLU H CB  1 
ATOM   1951 C CG  . GLU B 2 89  ? 15.419  -1.332  -37.271 1.00 38.79 ? 89  GLU H CG  1 
ATOM   1952 C CD  . GLU B 2 89  ? 15.660  -0.104  -38.124 1.00 47.10 ? 89  GLU H CD  1 
ATOM   1953 O OE1 . GLU B 2 89  ? 14.697  0.372   -38.809 1.00 54.31 ? 89  GLU H OE1 1 
ATOM   1954 O OE2 . GLU B 2 89  ? 16.815  0.409   -38.094 1.00 56.81 ? 89  GLU H OE2 1 
ATOM   1955 N N   . ASP B 2 90  ? 10.747  -2.277  -37.322 1.00 22.22 ? 90  ASP H N   1 
ATOM   1956 C CA  . ASP B 2 90  ? 9.471   -2.775  -36.760 1.00 19.97 ? 90  ASP H CA  1 
ATOM   1957 C C   . ASP B 2 90  ? 8.892   -3.929  -37.589 1.00 18.21 ? 90  ASP H C   1 
ATOM   1958 O O   . ASP B 2 90  ? 7.980   -4.602  -37.086 1.00 17.12 ? 90  ASP H O   1 
ATOM   1959 C CB  . ASP B 2 90  ? 8.492   -1.611  -36.580 1.00 19.91 ? 90  ASP H CB  1 
ATOM   1960 C CG  . ASP B 2 90  ? 9.022   -0.530  -35.680 1.00 21.76 ? 90  ASP H CG  1 
ATOM   1961 O OD1 . ASP B 2 90  ? 9.602   -0.891  -34.599 1.00 21.06 ? 90  ASP H OD1 1 
ATOM   1962 O OD2 . ASP B 2 90  ? 8.922   0.662   -36.070 1.00 21.80 ? 90  ASP H OD2 1 
ATOM   1963 N N   . SER B 2 91  ? 9.410   -4.267  -38.761 1.00 18.28 ? 91  SER H N   1 
ATOM   1964 C CA  . SER B 2 91  ? 8.893   -5.430  -39.511 1.00 17.48 ? 91  SER H CA  1 
ATOM   1965 C C   . SER B 2 91  ? 9.262   -6.704  -38.726 1.00 17.34 ? 91  SER H C   1 
ATOM   1966 O O   . SER B 2 91  ? 10.430  -6.855  -38.431 1.00 17.43 ? 91  SER H O   1 
ATOM   1967 C CB  . SER B 2 91  ? 9.450   -5.470  -40.871 1.00 18.50 ? 91  SER H CB  1 
ATOM   1968 O OG  . SER B 2 91  ? 9.130   -4.297  -41.620 1.00 18.62 ? 91  SER H OG  1 
ATOM   1969 N N   . ALA B 2 92  ? 8.294   -7.506  -38.370 1.00 16.63 ? 92  ALA H N   1 
ATOM   1970 C CA  . ALA B 2 92  ? 8.445   -8.692  -37.515 1.00 17.16 ? 92  ALA H CA  1 
ATOM   1971 C C   . ALA B 2 92  ? 7.104   -9.385  -37.372 1.00 16.55 ? 92  ALA H C   1 
ATOM   1972 O O   . ALA B 2 92  ? 6.059   -8.866  -37.805 1.00 14.97 ? 92  ALA H O   1 
ATOM   1973 C CB  . ALA B 2 92  ? 8.921   -8.294  -36.124 1.00 18.35 ? 92  ALA H CB  1 
ATOM   1974 N N   . ILE B 2 93  ? 7.146   -10.547 -36.707 1.00 15.57 ? 93  ILE H N   1 
ATOM   1975 C CA  . ILE B 2 93  ? 5.965   -11.225 -36.185 1.00 15.32 ? 93  ILE H CA  1 
ATOM   1976 C C   . ILE B 2 93  ? 5.807   -10.758 -34.759 1.00 14.98 ? 93  ILE H C   1 
ATOM   1977 O O   . ILE B 2 93  ? 6.816   -10.749 -33.974 1.00 16.04 ? 93  ILE H O   1 
ATOM   1978 C CB  . ILE B 2 93  ? 6.121   -12.747 -36.206 1.00 18.84 ? 93  ILE H CB  1 
ATOM   1979 C CG1 . ILE B 2 93  ? 6.342   -13.306 -37.599 1.00 21.51 ? 93  ILE H CG1 1 
ATOM   1980 C CG2 . ILE B 2 93  ? 4.921   -13.341 -35.536 1.00 20.41 ? 93  ILE H CG2 1 
ATOM   1981 C CD1 . ILE B 2 93  ? 6.888   -14.725 -37.573 1.00 24.18 ? 93  ILE H CD1 1 
ATOM   1982 N N   . TYR B 2 94  ? 4.603   -10.386 -34.438 1.00 15.31 ? 94  TYR H N   1 
ATOM   1983 C CA  . TYR B 2 94  ? 4.233   -9.980  -33.071 1.00 14.66 ? 94  TYR H CA  1 
ATOM   1984 C C   . TYR B 2 94  ? 3.310   -11.042 -32.524 1.00 15.19 ? 94  TYR H C   1 
ATOM   1985 O O   . TYR B 2 94  ? 2.250   -11.343 -33.116 1.00 15.38 ? 94  TYR H O   1 
ATOM   1986 C CB  . TYR B 2 94  ? 3.621   -8.596  -33.050 1.00 14.54 ? 94  TYR H CB  1 
ATOM   1987 C CG  . TYR B 2 94  ? 4.592   -7.544  -33.446 1.00 14.45 ? 94  TYR H CG  1 
ATOM   1988 C CD1 . TYR B 2 94  ? 4.834   -7.260  -34.767 1.00 14.31 ? 94  TYR H CD1 1 
ATOM   1989 C CD2 . TYR B 2 94  ? 5.340   -6.878  -32.479 1.00 14.10 ? 94  TYR H CD2 1 
ATOM   1990 C CE1 . TYR B 2 94  ? 5.770   -6.323  -35.124 1.00 14.85 ? 94  TYR H CE1 1 
ATOM   1991 C CE2 . TYR B 2 94  ? 6.253   -5.900  -32.819 1.00 15.03 ? 94  TYR H CE2 1 
ATOM   1992 C CZ  . TYR B 2 94  ? 6.520   -5.673  -34.155 1.00 15.54 ? 94  TYR H CZ  1 
ATOM   1993 O OH  . TYR B 2 94  ? 7.425   -4.744  -34.433 1.00 15.56 ? 94  TYR H OH  1 
ATOM   1994 N N   . TYR B 2 95  ? 3.599   -11.527 -31.314 1.00 14.11 ? 95  TYR H N   1 
ATOM   1995 C CA  . TYR B 2 95  ? 2.748   -12.517 -30.630 1.00 13.74 ? 95  TYR H CA  1 
ATOM   1996 C C   . TYR B 2 95  ? 2.170   -11.880 -29.370 1.00 15.21 ? 95  TYR H C   1 
ATOM   1997 O O   . TYR B 2 95  ? 2.909   -11.056 -28.700 1.00 14.43 ? 95  TYR H O   1 
ATOM   1998 C CB  . TYR B 2 95  ? 3.547   -13.713 -30.121 1.00 15.20 ? 95  TYR H CB  1 
ATOM   1999 C CG  . TYR B 2 95  ? 4.188   -14.545 -31.201 1.00 15.01 ? 95  TYR H CG  1 
ATOM   2000 C CD1 . TYR B 2 95  ? 3.480   -15.509 -31.872 1.00 15.45 ? 95  TYR H CD1 1 
ATOM   2001 C CD2 . TYR B 2 95  ? 5.521   -14.437 -31.472 1.00 16.43 ? 95  TYR H CD2 1 
ATOM   2002 C CE1 . TYR B 2 95  ? 4.059   -16.268 -32.865 1.00 16.57 ? 95  TYR H CE1 1 
ATOM   2003 C CE2 . TYR B 2 95  ? 6.137   -15.198 -32.444 1.00 17.47 ? 95  TYR H CE2 1 
ATOM   2004 C CZ  . TYR B 2 95  ? 5.398   -16.133 -33.138 1.00 17.06 ? 95  TYR H CZ  1 
ATOM   2005 O OH  . TYR B 2 95  ? 5.992   -16.889 -34.105 1.00 19.48 ? 95  TYR H OH  1 
ATOM   2006 N N   . CYS B 2 96  ? 0.936   -12.238 -29.046 1.00 14.68 ? 96  CYS H N   1 
ATOM   2007 C CA  . CYS B 2 96  ? 0.436   -12.108 -27.645 1.00 14.94 ? 96  CYS H CA  1 
ATOM   2008 C C   . CYS B 2 96  ? 0.583   -13.476 -26.991 1.00 15.80 ? 96  CYS H C   1 
ATOM   2009 O O   . CYS B 2 96  ? 0.608   -14.477 -27.664 1.00 15.08 ? 96  CYS H O   1 
ATOM   2010 C CB  . CYS B 2 96  ? -0.980  -11.608 -27.574 1.00 16.08 ? 96  CYS H CB  1 
ATOM   2011 S SG  . CYS B 2 96  ? -2.177  -12.705 -28.399 1.00 16.90 ? 96  CYS H SG  1 
ATOM   2012 N N   . ALA B 2 97  ? 0.741   -13.521 -25.667 1.00 15.38 ? 97  ALA H N   1 
ATOM   2013 C CA  . ALA B 2 97  ? 0.958   -14.769 -24.942 1.00 16.21 ? 97  ALA H CA  1 
ATOM   2014 C C   . ALA B 2 97  ? 0.504   -14.530 -23.510 1.00 16.63 ? 97  ALA H C   1 
ATOM   2015 O O   . ALA B 2 97  ? 0.686   -13.419 -23.009 1.00 17.00 ? 97  ALA H O   1 
ATOM   2016 C CB  . ALA B 2 97  ? 2.385   -15.185 -25.032 1.00 17.57 ? 97  ALA H CB  1 
ATOM   2017 N N   . ARG B 2 98  ? -0.147  -15.497 -22.922 1.00 17.31 ? 98  ARG H N   1 
ATOM   2018 C CA  . ARG B 2 98  ? -0.599  -15.301 -21.540 1.00 18.07 ? 98  ARG H CA  1 
ATOM   2019 C C   . ARG B 2 98  ? 0.371   -16.010 -20.592 1.00 18.45 ? 98  ARG H C   1 
ATOM   2020 O O   . ARG B 2 98  ? 1.035   -16.958 -21.001 1.00 17.87 ? 98  ARG H O   1 
ATOM   2021 C CB  . ARG B 2 98  ? -2.011  -15.797 -21.358 1.00 19.89 ? 98  ARG H CB  1 
ATOM   2022 C CG  . ARG B 2 98  ? -2.108  -17.291 -21.252 1.00 21.66 ? 98  ARG H CG  1 
ATOM   2023 C CD  . ARG B 2 98  ? -3.365  -17.619 -20.493 1.00 23.04 ? 98  ARG H CD  1 
ATOM   2024 N NE  . ARG B 2 98  ? -3.251  -19.004 -20.067 1.00 24.60 ? 98  ARG H NE  1 
ATOM   2025 C CZ  . ARG B 2 98  ? -4.210  -19.678 -19.460 1.00 26.37 ? 98  ARG H CZ  1 
ATOM   2026 N NH1 . ARG B 2 98  ? -5.372  -19.079 -19.229 1.00 26.35 ? 98  ARG H NH1 1 
ATOM   2027 N NH2 . ARG B 2 98  ? -4.012  -20.946 -19.109 1.00 27.54 ? 98  ARG H NH2 1 
ATOM   2028 N N   . ASP B 2 99  ? 0.391   -15.555 -19.351 1.00 18.75 ? 99  ASP H N   1 
ATOM   2029 C CA  . ASP B 2 99  ? 0.964   -16.366 -18.252 1.00 20.00 ? 99  ASP H CA  1 
ATOM   2030 C C   . ASP B 2 99  ? -0.210  -16.964 -17.457 1.00 20.72 ? 99  ASP H C   1 
ATOM   2031 O O   . ASP B 2 99  ? -1.368  -16.579 -17.723 1.00 21.68 ? 99  ASP H O   1 
ATOM   2032 C CB  . ASP B 2 99  ? 1.958   -15.548 -17.423 1.00 20.43 ? 99  ASP H CB  1 
ATOM   2033 C CG  . ASP B 2 99  ? 1.399   -14.533 -16.433 1.00 20.84 ? 99  ASP H CG  1 
ATOM   2034 O OD1 . ASP B 2 99  ? 0.745   -14.921 -15.520 1.00 22.46 ? 99  ASP H OD1 1 
ATOM   2035 O OD2 . ASP B 2 99  ? 1.741   -13.385 -16.548 1.00 20.95 ? 99  ASP H OD2 1 
ATOM   2036 N N   . TRP B 2 100 ? 0.038   -17.855 -16.513 1.00 21.07 ? 100 TRP H N   1 
ATOM   2037 C CA  . TRP B 2 100 ? -1.065  -18.413 -15.717 1.00 22.32 ? 100 TRP H CA  1 
ATOM   2038 C C   . TRP B 2 100 ? -0.723  -18.302 -14.239 1.00 22.28 ? 100 TRP H C   1 
ATOM   2039 O O   . TRP B 2 100 ? -1.195  -19.091 -13.468 1.00 23.81 ? 100 TRP H O   1 
ATOM   2040 C CB  . TRP B 2 100 ? -1.399  -19.834 -16.180 1.00 24.48 ? 100 TRP H CB  1 
ATOM   2041 C CG  . TRP B 2 100 ? -0.477  -20.959 -15.832 1.00 26.09 ? 100 TRP H CG  1 
ATOM   2042 C CD1 . TRP B 2 100 ? -0.690  -21.957 -14.941 1.00 28.90 ? 100 TRP H CD1 1 
ATOM   2043 C CD2 . TRP B 2 100 ? 0.747   -21.281 -16.494 1.00 26.19 ? 100 TRP H CD2 1 
ATOM   2044 N NE1 . TRP B 2 100 ? 0.357   -22.832 -14.940 1.00 29.21 ? 100 TRP H NE1 1 
ATOM   2045 C CE2 . TRP B 2 100 ? 1.245   -22.446 -15.885 1.00 28.09 ? 100 TRP H CE2 1 
ATOM   2046 C CE3 . TRP B 2 100 ? 1.504   -20.657 -17.473 1.00 24.65 ? 100 TRP H CE3 1 
ATOM   2047 C CZ2 . TRP B 2 100 ? 2.441   -23.030 -16.267 1.00 28.56 ? 100 TRP H CZ2 1 
ATOM   2048 C CZ3 . TRP B 2 100 ? 2.674   -21.256 -17.868 1.00 25.47 ? 100 TRP H CZ3 1 
ATOM   2049 C CH2 . TRP B 2 100 ? 3.148   -22.392 -17.238 1.00 26.85 ? 100 TRP H CH2 1 
ATOM   2050 N N   . GLU B 2 101 ? -0.065  -17.218 -13.904 1.00 21.11 ? 101 GLU H N   1 
ATOM   2051 C CA  . GLU B 2 101 ? 0.107   -16.769 -12.499 1.00 21.71 ? 101 GLU H CA  1 
ATOM   2052 C C   . GLU B 2 101 ? 1.134   -17.699 -11.819 1.00 22.99 ? 101 GLU H C   1 
ATOM   2053 O O   . GLU B 2 101 ? 1.055   -17.932 -10.601 1.00 23.33 ? 101 GLU H O   1 
ATOM   2054 C CB  . GLU B 2 101 ? -1.256  -16.591 -11.816 1.00 22.14 ? 101 GLU H CB  1 
ATOM   2055 C CG  . GLU B 2 101 ? -1.173  -15.643 -10.677 1.00 22.74 ? 101 GLU H CG  1 
ATOM   2056 C CD  . GLU B 2 101 ? -2.480  -15.251 -9.956  1.00 22.94 ? 101 GLU H CD  1 
ATOM   2057 O OE1 . GLU B 2 101 ? -2.358  -14.391 -9.104  1.00 22.49 ? 101 GLU H OE1 1 
ATOM   2058 O OE2 . GLU B 2 101 ? -3.565  -15.736 -10.334 1.00 23.39 ? 101 GLU H OE2 1 
ATOM   2059 N N   . ARG B 2 102 ? 2.138   -18.143 -12.601 1.00 23.47 ? 102 ARG H N   1 
ATOM   2060 C CA  . ARG B 2 102 ? 3.281   -18.920 -12.032 1.00 25.78 ? 102 ARG H CA  1 
ATOM   2061 C C   . ARG B 2 102 ? 4.616   -18.198 -12.297 1.00 25.43 ? 102 ARG H C   1 
ATOM   2062 O O   . ARG B 2 102 ? 5.680   -18.756 -11.906 1.00 27.53 ? 102 ARG H O   1 
ATOM   2063 C CB  . ARG B 2 102 ? 3.375   -20.315 -12.638 1.00 26.86 ? 102 ARG H CB  1 
ATOM   2064 C CG  . ARG B 2 102 ? 2.080   -21.079 -12.813 1.00 27.69 ? 102 ARG H CG  1 
ATOM   2065 C CD  . ARG B 2 102 ? 1.448   -21.306 -11.505 1.00 28.82 ? 102 ARG H CD  1 
ATOM   2066 N NE  . ARG B 2 102 ? 2.152   -22.377 -10.832 1.00 31.10 ? 102 ARG H NE  1 
ATOM   2067 C CZ  . ARG B 2 102 ? 1.824   -22.842 -9.650  1.00 32.51 ? 102 ARG H CZ  1 
ATOM   2068 N NH1 . ARG B 2 102 ? 2.521   -23.843 -9.139  1.00 34.23 ? 102 ARG H NH1 1 
ATOM   2069 N NH2 . ARG B 2 102 ? 0.845   -22.264 -8.959  1.00 32.38 ? 102 ARG H NH2 1 
ATOM   2070 N N   . GLY B 2 103 ? 4.568   -16.990 -12.784 1.00 24.61 ? 103 GLY H N   1 
ATOM   2071 C CA  . GLY B 2 103 ? 5.733   -16.267 -13.334 1.00 24.65 ? 103 GLY H CA  1 
ATOM   2072 C C   . GLY B 2 103 ? 5.539   -15.771 -14.724 1.00 23.49 ? 103 GLY H C   1 
ATOM   2073 O O   . GLY B 2 103 ? 4.494   -16.050 -15.369 1.00 23.77 ? 103 GLY H O   1 
ATOM   2074 N N   . ASP B 2 104 ? 6.479   -14.941 -15.188 1.00 22.95 ? 104 ASP H N   1 
ATOM   2075 C CA  . ASP B 2 104 ? 6.411   -14.266 -16.477 1.00 22.91 ? 104 ASP H CA  1 
ATOM   2076 C C   . ASP B 2 104 ? 6.923   -15.254 -17.552 1.00 21.11 ? 104 ASP H C   1 
ATOM   2077 O O   . ASP B 2 104 ? 8.028   -15.065 -18.086 1.00 21.12 ? 104 ASP H O   1 
ATOM   2078 C CB  . ASP B 2 104 ? 7.130   -12.923 -16.364 1.00 24.58 ? 104 ASP H CB  1 
ATOM   2079 C CG  . ASP B 2 104 ? 6.399   -11.970 -15.427 1.00 26.93 ? 104 ASP H CG  1 
ATOM   2080 O OD1 . ASP B 2 104 ? 5.334   -11.524 -15.819 1.00 28.91 ? 104 ASP H OD1 1 
ATOM   2081 O OD2 . ASP B 2 104 ? 6.894   -11.700 -14.338 1.00 28.06 ? 104 ASP H OD2 1 
ATOM   2082 N N   . PHE B 2 105 ? 6.188   -16.341 -17.807 1.00 20.51 ? 105 PHE H N   1 
ATOM   2083 C CA  . PHE B 2 105 ? 6.481   -17.317 -18.892 1.00 19.10 ? 105 PHE H CA  1 
ATOM   2084 C C   . PHE B 2 105 ? 5.117   -17.845 -19.372 1.00 18.96 ? 105 PHE H C   1 
ATOM   2085 O O   . PHE B 2 105 ? 4.116   -17.739 -18.613 1.00 18.18 ? 105 PHE H O   1 
ATOM   2086 C CB  . PHE B 2 105 ? 7.445   -18.423 -18.437 1.00 20.69 ? 105 PHE H CB  1 
ATOM   2087 C CG  . PHE B 2 105 ? 7.090   -19.100 -17.151 1.00 21.13 ? 105 PHE H CG  1 
ATOM   2088 C CD1 . PHE B 2 105 ? 6.120   -20.103 -17.087 1.00 21.26 ? 105 PHE H CD1 1 
ATOM   2089 C CD2 . PHE B 2 105 ? 7.743   -18.746 -15.966 1.00 22.07 ? 105 PHE H CD2 1 
ATOM   2090 C CE1 . PHE B 2 105 ? 5.813   -20.704 -15.881 1.00 22.71 ? 105 PHE H CE1 1 
ATOM   2091 C CE2 . PHE B 2 105 ? 7.375   -19.309 -14.750 1.00 23.14 ? 105 PHE H CE2 1 
ATOM   2092 C CZ  . PHE B 2 105 ? 6.446   -20.331 -14.707 1.00 23.72 ? 105 PHE H CZ  1 
ATOM   2093 N N   . PHE B 2 106 ? 5.047   -18.379 -20.577 1.00 18.05 ? 106 PHE H N   1 
ATOM   2094 C CA  . PHE B 2 106 ? 3.809   -18.236 -21.411 1.00 17.67 ? 106 PHE H CA  1 
ATOM   2095 C C   . PHE B 2 106 ? 3.387   -19.625 -21.921 1.00 19.11 ? 106 PHE H C   1 
ATOM   2096 O O   . PHE B 2 106 ? 4.120   -20.264 -22.693 1.00 18.74 ? 106 PHE H O   1 
ATOM   2097 C CB  . PHE B 2 106 ? 4.032   -17.208 -22.513 1.00 16.94 ? 106 PHE H CB  1 
ATOM   2098 C CG  . PHE B 2 106 ? 4.809   -16.003 -22.030 1.00 17.22 ? 106 PHE H CG  1 
ATOM   2099 C CD1 . PHE B 2 106 ? 4.355   -15.243 -20.952 1.00 17.23 ? 106 PHE H CD1 1 
ATOM   2100 C CD2 . PHE B 2 106 ? 6.022   -15.679 -22.583 1.00 17.76 ? 106 PHE H CD2 1 
ATOM   2101 C CE1 . PHE B 2 106 ? 5.108   -14.185 -20.442 1.00 17.43 ? 106 PHE H CE1 1 
ATOM   2102 C CE2 . PHE B 2 106 ? 6.783   -14.622 -22.089 1.00 18.32 ? 106 PHE H CE2 1 
ATOM   2103 C CZ  . PHE B 2 106 ? 6.312   -13.860 -21.034 1.00 18.55 ? 106 PHE H CZ  1 
ATOM   2104 N N   . ASP B 2 107 ? 2.245   -20.118 -21.446 1.00 20.50 ? 107 ASP H N   1 
ATOM   2105 C CA  . ASP B 2 107 ? 1.708   -21.434 -21.850 1.00 21.90 ? 107 ASP H CA  1 
ATOM   2106 C C   . ASP B 2 107 ? 0.956   -21.293 -23.185 1.00 21.66 ? 107 ASP H C   1 
ATOM   2107 O O   . ASP B 2 107 ? 1.075   -22.249 -23.999 1.00 24.46 ? 107 ASP H O   1 
ATOM   2108 C CB  . ASP B 2 107 ? 0.888   -22.077 -20.731 1.00 24.30 ? 107 ASP H CB  1 
ATOM   2109 C CG  . ASP B 2 107 ? -0.321  -21.321 -20.237 1.00 24.41 ? 107 ASP H CG  1 
ATOM   2110 O OD1 . ASP B 2 107 ? -0.421  -20.124 -20.471 1.00 22.82 ? 107 ASP H OD1 1 
ATOM   2111 O OD2 . ASP B 2 107 ? -1.073  -21.918 -19.501 1.00 28.27 ? 107 ASP H OD2 1 
ATOM   2112 N N   . TYR B 2 108 ? 0.134   -20.272 -23.339 1.00 19.25 ? 108 TYR H N   1 
ATOM   2113 C CA  . TYR B 2 108 ? -0.719  -20.095 -24.550 1.00 18.68 ? 108 TYR H CA  1 
ATOM   2114 C C   . TYR B 2 108 ? -0.268  -18.852 -25.274 1.00 17.61 ? 108 TYR H C   1 
ATOM   2115 O O   . TYR B 2 108 ? -0.099  -17.801 -24.669 1.00 15.74 ? 108 TYR H O   1 
ATOM   2116 C CB  . TYR B 2 108 ? -2.214  -20.053 -24.252 1.00 19.20 ? 108 TYR H CB  1 
ATOM   2117 C CG  . TYR B 2 108 ? -2.702  -21.416 -23.872 1.00 21.60 ? 108 TYR H CG  1 
ATOM   2118 C CD1 . TYR B 2 108 ? -3.018  -22.353 -24.843 1.00 22.84 ? 108 TYR H CD1 1 
ATOM   2119 C CD2 . TYR B 2 108 ? -2.812  -21.779 -22.528 1.00 23.68 ? 108 TYR H CD2 1 
ATOM   2120 C CE1 . TYR B 2 108 ? -3.352  -23.641 -24.505 1.00 25.03 ? 108 TYR H CE1 1 
ATOM   2121 C CE2 . TYR B 2 108 ? -3.227  -23.044 -22.165 1.00 26.11 ? 108 TYR H CE2 1 
ATOM   2122 C CZ  . TYR B 2 108 ? -3.468  -23.974 -23.166 1.00 27.01 ? 108 TYR H CZ  1 
ATOM   2123 O OH  . TYR B 2 108 ? -3.876  -25.220 -22.831 1.00 31.12 ? 108 TYR H OH  1 
ATOM   2124 N N   . TRP B 2 109 ? -0.083  -18.992 -26.589 1.00 16.34 ? 109 TRP H N   1 
ATOM   2125 C CA  . TRP B 2 109 ? 0.392   -17.937 -27.485 1.00 15.22 ? 109 TRP H CA  1 
ATOM   2126 C C   . TRP B 2 109 ? -0.623  -17.747 -28.617 1.00 15.66 ? 109 TRP H C   1 
ATOM   2127 O O   . TRP B 2 109 ? -1.233  -18.737 -29.018 1.00 15.70 ? 109 TRP H O   1 
ATOM   2128 C CB  . TRP B 2 109 ? 1.727   -18.324 -28.114 1.00 15.55 ? 109 TRP H CB  1 
ATOM   2129 C CG  . TRP B 2 109 ? 2.883   -18.468 -27.181 1.00 15.45 ? 109 TRP H CG  1 
ATOM   2130 C CD1 . TRP B 2 109 ? 3.058   -19.409 -26.226 1.00 16.79 ? 109 TRP H CD1 1 
ATOM   2131 C CD2 . TRP B 2 109 ? 4.077   -17.683 -27.224 1.00 15.24 ? 109 TRP H CD2 1 
ATOM   2132 N NE1 . TRP B 2 109 ? 4.284   -19.234 -25.626 1.00 16.73 ? 109 TRP H NE1 1 
ATOM   2133 C CE2 . TRP B 2 109 ? 4.929   -18.190 -26.227 1.00 15.78 ? 109 TRP H CE2 1 
ATOM   2134 C CE3 . TRP B 2 109 ? 4.521   -16.613 -28.009 1.00 14.59 ? 109 TRP H CE3 1 
ATOM   2135 C CZ2 . TRP B 2 109 ? 6.201   -17.662 -26.009 1.00 15.76 ? 109 TRP H CZ2 1 
ATOM   2136 C CZ3 . TRP B 2 109 ? 5.778   -16.096 -27.816 1.00 14.93 ? 109 TRP H CZ3 1 
ATOM   2137 C CH2 . TRP B 2 109 ? 6.613   -16.615 -26.808 1.00 15.52 ? 109 TRP H CH2 1 
ATOM   2138 N N   . GLY B 2 110 ? -0.796  -16.508 -29.062 1.00 14.97 ? 110 GLY H N   1 
ATOM   2139 C CA  . GLY B 2 110 ? -1.475  -16.235 -30.336 1.00 14.93 ? 110 GLY H CA  1 
ATOM   2140 C C   . GLY B 2 110 ? -0.688  -16.840 -31.491 1.00 15.71 ? 110 GLY H C   1 
ATOM   2141 O O   . GLY B 2 110 ? 0.471   -17.231 -31.334 1.00 14.74 ? 110 GLY H O   1 
ATOM   2142 N N   . GLN B 2 111 ? -1.325  -16.864 -32.676 1.00 16.21 ? 111 GLN H N   1 
ATOM   2143 C CA  . GLN B 2 111 ? -0.676  -17.429 -33.883 1.00 16.26 ? 111 GLN H CA  1 
ATOM   2144 C C   . GLN B 2 111 ? 0.317   -16.437 -34.472 1.00 14.60 ? 111 GLN H C   1 
ATOM   2145 O O   . GLN B 2 111 ? 1.062   -16.815 -35.395 1.00 14.38 ? 111 GLN H O   1 
ATOM   2146 C CB  . GLN B 2 111 ? -1.774  -17.872 -34.892 1.00 17.63 ? 111 GLN H CB  1 
ATOM   2147 C CG  . GLN B 2 111 ? -2.318  -16.729 -35.739 1.00 17.61 ? 111 GLN H CG  1 
ATOM   2148 C CD  . GLN B 2 111 ? -3.403  -15.912 -35.105 1.00 18.48 ? 111 GLN H CD  1 
ATOM   2149 O OE1 . GLN B 2 111 ? -3.599  -15.866 -33.874 1.00 17.36 ? 111 GLN H OE1 1 
ATOM   2150 N NE2 . GLN B 2 111 ? -4.190  -15.255 -35.975 1.00 18.73 ? 111 GLN H NE2 1 
ATOM   2151 N N   . GLY B 2 112 ? 0.436   -15.204 -33.981 1.00 13.82 ? 112 GLY H N   1 
ATOM   2152 C CA  . GLY B 2 112 ? 1.350   -14.223 -34.513 1.00 13.24 ? 112 GLY H CA  1 
ATOM   2153 C C   . GLY B 2 112 ? 0.711   -13.383 -35.606 1.00 14.09 ? 112 GLY H C   1 
ATOM   2154 O O   . GLY B 2 112 ? -0.213  -13.916 -36.322 1.00 14.63 ? 112 GLY H O   1 
ATOM   2155 N N   . THR B 2 113 ? 1.068   -12.112 -35.632 1.00 13.64 ? 113 THR H N   1 
ATOM   2156 C CA  . THR B 2 113 ? 0.711   -11.123 -36.685 1.00 13.61 ? 113 THR H CA  1 
ATOM   2157 C C   . THR B 2 113 ? 1.989   -10.652 -37.347 1.00 13.93 ? 113 THR H C   1 
ATOM   2158 O O   . THR B 2 113 ? 2.889   -10.042 -36.666 1.00 14.46 ? 113 THR H O   1 
ATOM   2159 C CB  . THR B 2 113 ? -0.081  -9.956  -36.058 1.00 14.14 ? 113 THR H CB  1 
ATOM   2160 O OG1 . THR B 2 113 ? -1.278  -10.397 -35.410 1.00 15.10 ? 113 THR H OG1 1 
ATOM   2161 C CG2 . THR B 2 113 ? -0.399  -8.898  -37.085 1.00 14.63 ? 113 THR H CG2 1 
ATOM   2162 N N   . LEU B 2 114 ? 2.065   -10.835 -38.661 1.00 14.13 ? 114 LEU H N   1 
ATOM   2163 C CA  . LEU B 2 114 ? 3.197   -10.362 -39.427 1.00 14.73 ? 114 LEU H CA  1 
ATOM   2164 C C   . LEU B 2 114 ? 2.931   -8.925  -39.820 1.00 15.50 ? 114 LEU H C   1 
ATOM   2165 O O   . LEU B 2 114 ? 2.021   -8.675  -40.596 1.00 16.55 ? 114 LEU H O   1 
ATOM   2166 C CB  . LEU B 2 114 ? 3.413   -11.230 -40.659 1.00 14.99 ? 114 LEU H CB  1 
ATOM   2167 C CG  . LEU B 2 114 ? 4.692   -10.960 -41.426 1.00 16.32 ? 114 LEU H CG  1 
ATOM   2168 C CD1 . LEU B 2 114 ? 5.976   -11.274 -40.643 1.00 16.52 ? 114 LEU H CD1 1 
ATOM   2169 C CD2 . LEU B 2 114 ? 4.702   -11.777 -42.719 1.00 17.04 ? 114 LEU H CD2 1 
ATOM   2170 N N   . VAL B 2 115 ? 3.849   -8.074  -39.456 1.00 14.73 ? 115 VAL H N   1 
ATOM   2171 C CA  . VAL B 2 115 ? 3.821   -6.644  -39.806 1.00 16.25 ? 115 VAL H CA  1 
ATOM   2172 C C   . VAL B 2 115 ? 4.977   -6.425  -40.770 1.00 17.22 ? 115 VAL H C   1 
ATOM   2173 O O   . VAL B 2 115 ? 6.174   -6.701  -40.408 1.00 17.33 ? 115 VAL H O   1 
ATOM   2174 C CB  . VAL B 2 115 ? 3.901   -5.757  -38.552 1.00 16.42 ? 115 VAL H CB  1 
ATOM   2175 C CG1 . VAL B 2 115 ? 4.049   -4.304  -38.925 1.00 17.63 ? 115 VAL H CG1 1 
ATOM   2176 C CG2 . VAL B 2 115 ? 2.710   -5.982  -37.642 1.00 16.19 ? 115 VAL H CG2 1 
ATOM   2177 N N   . THR B 2 116 ? 4.654   -5.925  -41.975 1.00 15.85 ? 116 THR H N   1 
ATOM   2178 C CA  . THR B 2 116 ? 5.667   -5.516  -42.965 1.00 16.94 ? 116 THR H CA  1 
ATOM   2179 C C   . THR B 2 116 ? 5.621   -3.994  -43.151 1.00 17.74 ? 116 THR H C   1 
ATOM   2180 O O   . THR B 2 116 ? 4.587   -3.475  -43.533 1.00 19.11 ? 116 THR H O   1 
ATOM   2181 C CB  . THR B 2 116 ? 5.484   -6.207  -44.325 1.00 15.69 ? 116 THR H CB  1 
ATOM   2182 O OG1 . THR B 2 116 ? 5.495   -7.629  -44.134 1.00 15.64 ? 116 THR H OG1 1 
ATOM   2183 C CG2 . THR B 2 116 ? 6.519   -5.729  -45.331 1.00 17.34 ? 116 THR H CG2 1 
ATOM   2184 N N   . VAL B 2 117 ? 6.719   -3.324  -42.844 1.00 18.07 ? 117 VAL H N   1 
ATOM   2185 C CA  . VAL B 2 117 ? 6.823   -1.852  -42.992 1.00 19.06 ? 117 VAL H CA  1 
ATOM   2186 C C   . VAL B 2 117 ? 7.449   -1.589  -44.333 1.00 20.66 ? 117 VAL H C   1 
ATOM   2187 O O   . VAL B 2 117 ? 8.604   -2.034  -44.582 1.00 21.16 ? 117 VAL H O   1 
ATOM   2188 C CB  . VAL B 2 117 ? 7.608   -1.197  -41.841 1.00 19.45 ? 117 VAL H CB  1 
ATOM   2189 C CG1 . VAL B 2 117 ? 7.648   0.327   -42.049 1.00 20.76 ? 117 VAL H CG1 1 
ATOM   2190 C CG2 . VAL B 2 117 ? 6.989   -1.560  -40.498 1.00 18.36 ? 117 VAL H CG2 1 
ATOM   2191 N N   . SER B 2 118 ? 6.714   -0.885  -45.200 1.00 21.32 ? 118 SER H N   1 
ATOM   2192 C CA  . SER B 2 118 ? 7.136   -0.697  -46.608 1.00 21.79 ? 118 SER H CA  1 
ATOM   2193 C C   . SER B 2 118 ? 6.304   0.425   -47.226 1.00 23.20 ? 118 SER H C   1 
ATOM   2194 O O   . SER B 2 118 ? 5.102   0.476   -46.916 1.00 22.62 ? 118 SER H O   1 
ATOM   2195 C CB  . SER B 2 118 ? 6.948   -1.993  -47.392 1.00 21.28 ? 118 SER H CB  1 
ATOM   2196 O OG  . SER B 2 118 ? 7.223   -1.815  -48.778 1.00 22.00 ? 118 SER H OG  1 
ATOM   2197 N N   . SER B 2 119 ? 6.901   1.165   -48.151 1.00 24.87 ? 119 SER H N   1 
ATOM   2198 C CA  . SER B 2 119 ? 6.214   2.127   -49.046 1.00 27.44 ? 119 SER H CA  1 
ATOM   2199 C C   . SER B 2 119 ? 5.493   1.431   -50.199 1.00 26.68 ? 119 SER H C   1 
ATOM   2200 O O   . SER B 2 119 ? 4.732   2.131   -50.916 1.00 29.91 ? 119 SER H O   1 
ATOM   2201 C CB  . SER B 2 119 ? 7.220   3.106   -49.585 1.00 29.69 ? 119 SER H CB  1 
ATOM   2202 O OG  . SER B 2 119 ? 7.739   3.839   -48.481 1.00 33.68 ? 119 SER H OG  1 
ATOM   2203 N N   . ALA B 2 120 ? 5.793   0.178   -50.497 1.00 25.24 ? 120 ALA H N   1 
ATOM   2204 C CA  . ALA B 2 120 ? 5.243   -0.474  -51.702 1.00 24.42 ? 120 ALA H CA  1 
ATOM   2205 C C   . ALA B 2 120 ? 3.775   -0.849  -51.456 1.00 23.57 ? 120 ALA H C   1 
ATOM   2206 O O   . ALA B 2 120 ? 3.384   -1.091  -50.305 1.00 22.50 ? 120 ALA H O   1 
ATOM   2207 C CB  . ALA B 2 120 ? 6.053   -1.657  -52.153 1.00 23.58 ? 120 ALA H CB  1 
ATOM   2208 N N   . SER B 2 121 ? 3.001   -0.878  -52.538 1.00 25.22 ? 121 SER H N   1 
ATOM   2209 C CA  . SER B 2 121 ? 1.547   -1.151  -52.478 1.00 26.08 ? 121 SER H CA  1 
ATOM   2210 C C   . SER B 2 121 ? 1.358   -2.650  -52.360 1.00 23.27 ? 121 SER H C   1 
ATOM   2211 O O   . SER B 2 121 ? 2.184   -3.405  -52.882 1.00 23.45 ? 121 SER H O   1 
ATOM   2212 C CB  . SER B 2 121 ? 0.817   -0.627  -53.713 1.00 29.09 ? 121 SER H CB  1 
ATOM   2213 O OG  . SER B 2 121 ? 0.858   0.765   -53.716 1.00 33.71 ? 121 SER H OG  1 
ATOM   2214 N N   . THR B 2 122 ? 0.275   -3.054  -51.734 1.00 22.78 ? 122 THR H N   1 
ATOM   2215 C CA  . THR B 2 122 ? -0.120  -4.469  -51.752 1.00 21.26 ? 122 THR H CA  1 
ATOM   2216 C C   . THR B 2 122 ? -0.455  -4.901  -53.186 1.00 21.79 ? 122 THR H C   1 
ATOM   2217 O O   . THR B 2 122 ? -0.997  -4.126  -54.003 1.00 20.58 ? 122 THR H O   1 
ATOM   2218 C CB  . THR B 2 122 ? -1.275  -4.695  -50.781 1.00 22.22 ? 122 THR H CB  1 
ATOM   2219 O OG1 . THR B 2 122 ? -1.285  -6.110  -50.572 1.00 24.57 ? 122 THR H OG1 1 
ATOM   2220 C CG2 . THR B 2 122 ? -2.612  -4.198  -51.278 1.00 23.36 ? 122 THR H CG2 1 
ATOM   2221 N N   . LYS B 2 123 ? -0.200  -6.160  -53.475 1.00 20.65 ? 123 LYS H N   1 
ATOM   2222 C CA  . LYS B 2 123 ? -0.563  -6.805  -54.737 1.00 21.62 ? 123 LYS H CA  1 
ATOM   2223 C C   . LYS B 2 123 ? -0.974  -8.239  -54.416 1.00 19.28 ? 123 LYS H C   1 
ATOM   2224 O O   . LYS B 2 123 ? -0.204  -8.983  -53.761 1.00 17.92 ? 123 LYS H O   1 
ATOM   2225 C CB  . LYS B 2 123 ? 0.603   -6.731  -55.711 1.00 23.38 ? 123 LYS H CB  1 
ATOM   2226 C CG  . LYS B 2 123 ? 0.249   -7.259  -57.083 1.00 25.95 ? 123 LYS H CG  1 
ATOM   2227 C CD  . LYS B 2 123 ? 1.381   -7.085  -58.042 1.00 30.18 ? 123 LYS H CD  1 
ATOM   2228 C CE  . LYS B 2 123 ? 1.182   -7.900  -59.299 1.00 32.79 ? 123 LYS H CE  1 
ATOM   2229 N NZ  . LYS B 2 123 ? 0.004   -7.406  -60.045 1.00 37.69 ? 123 LYS H NZ  1 
ATOM   2230 N N   . GLY B 2 124 ? -2.141  -8.605  -54.884 1.00 19.29 ? 124 GLY H N   1 
ATOM   2231 C CA  . GLY B 2 124 ? -2.663  -9.956  -54.716 1.00 19.33 ? 124 GLY H CA  1 
ATOM   2232 C C   . GLY B 2 124 ? -2.013  -10.891 -55.716 1.00 19.17 ? 124 GLY H C   1 
ATOM   2233 O O   . GLY B 2 124 ? -1.681  -10.505 -56.831 1.00 19.84 ? 124 GLY H O   1 
ATOM   2234 N N   . PRO B 2 125 ? -1.859  -12.181 -55.361 1.00 19.33 ? 125 PRO H N   1 
ATOM   2235 C CA  . PRO B 2 125 ? -1.240  -13.126 -56.269 1.00 19.21 ? 125 PRO H CA  1 
ATOM   2236 C C   . PRO B 2 125 ? -2.173  -13.525 -57.425 1.00 20.81 ? 125 PRO H C   1 
ATOM   2237 O O   . PRO B 2 125 ? -3.374  -13.494 -57.316 1.00 19.95 ? 125 PRO H O   1 
ATOM   2238 C CB  . PRO B 2 125 ? -0.970  -14.353 -55.396 1.00 18.75 ? 125 PRO H CB  1 
ATOM   2239 C CG  . PRO B 2 125 ? -2.072  -14.269 -54.371 1.00 18.89 ? 125 PRO H CG  1 
ATOM   2240 C CD  . PRO B 2 125 ? -2.221  -12.777 -54.072 1.00 18.71 ? 125 PRO H CD  1 
ATOM   2241 N N   . SER B 2 126 ? -1.550  -13.958 -58.497 1.00 22.11 ? 126 SER H N   1 
ATOM   2242 C CA  . SER B 2 126 ? -2.177  -14.779 -59.551 1.00 22.96 ? 126 SER H CA  1 
ATOM   2243 C C   . SER B 2 126 ? -1.972  -16.240 -59.177 1.00 22.13 ? 126 SER H C   1 
ATOM   2244 O O   . SER B 2 126 ? -0.859  -16.591 -58.750 1.00 22.31 ? 126 SER H O   1 
ATOM   2245 C CB  . SER B 2 126 ? -1.546  -14.435 -60.874 1.00 25.66 ? 126 SER H CB  1 
ATOM   2246 O OG  . SER B 2 126 ? -1.904  -13.099 -61.233 1.00 28.40 ? 126 SER H OG  1 
ATOM   2247 N N   . VAL B 2 127 ? -2.978  -17.077 -59.342 1.00 21.52 ? 127 VAL H N   1 
ATOM   2248 C CA  . VAL B 2 127 ? -2.888  -18.489 -58.941 1.00 21.66 ? 127 VAL H CA  1 
ATOM   2249 C C   . VAL B 2 127 ? -3.037  -19.332 -60.204 1.00 22.91 ? 127 VAL H C   1 
ATOM   2250 O O   . VAL B 2 127 ? -4.076  -19.281 -60.893 1.00 24.01 ? 127 VAL H O   1 
ATOM   2251 C CB  . VAL B 2 127 ? -3.910  -18.797 -57.843 1.00 21.71 ? 127 VAL H CB  1 
ATOM   2252 C CG1 . VAL B 2 127 ? -3.837  -20.264 -57.471 1.00 22.49 ? 127 VAL H CG1 1 
ATOM   2253 C CG2 . VAL B 2 127 ? -3.726  -17.903 -56.652 1.00 20.42 ? 127 VAL H CG2 1 
ATOM   2254 N N   . PHE B 2 128 ? -2.011  -20.097 -60.525 1.00 22.13 ? 128 PHE H N   1 
ATOM   2255 C CA  . PHE B 2 128 ? -1.979  -20.938 -61.733 1.00 23.05 ? 128 PHE H CA  1 
ATOM   2256 C C   . PHE B 2 128 ? -1.878  -22.402 -61.352 1.00 23.36 ? 128 PHE H C   1 
ATOM   2257 O O   . PHE B 2 128 ? -1.198  -22.759 -60.391 1.00 21.74 ? 128 PHE H O   1 
ATOM   2258 C CB  . PHE B 2 128 ? -0.804  -20.544 -62.610 1.00 23.14 ? 128 PHE H CB  1 
ATOM   2259 C CG  . PHE B 2 128 ? -0.776  -19.110 -63.027 1.00 23.05 ? 128 PHE H CG  1 
ATOM   2260 C CD1 . PHE B 2 128 ? -1.776  -18.571 -63.815 1.00 24.13 ? 128 PHE H CD1 1 
ATOM   2261 C CD2 . PHE B 2 128 ? 0.251   -18.286 -62.633 1.00 22.63 ? 128 PHE H CD2 1 
ATOM   2262 C CE1 . PHE B 2 128 ? -1.724  -17.247 -64.205 1.00 24.78 ? 128 PHE H CE1 1 
ATOM   2263 C CE2 . PHE B 2 128 ? 0.296   -16.956 -63.010 1.00 23.44 ? 128 PHE H CE2 1 
ATOM   2264 C CZ  . PHE B 2 128 ? -0.697  -16.427 -63.793 1.00 23.98 ? 128 PHE H CZ  1 
ATOM   2265 N N   . PRO B 2 129 ? -2.499  -23.317 -62.119 1.00 24.00 ? 129 PRO H N   1 
ATOM   2266 C CA  . PRO B 2 129 ? -2.375  -24.733 -61.815 1.00 25.08 ? 129 PRO H CA  1 
ATOM   2267 C C   . PRO B 2 129 ? -1.003  -25.274 -62.258 1.00 25.03 ? 129 PRO H C   1 
ATOM   2268 O O   . PRO B 2 129 ? -0.428  -24.830 -63.276 1.00 25.08 ? 129 PRO H O   1 
ATOM   2269 C CB  . PRO B 2 129 ? -3.477  -25.357 -62.660 1.00 26.62 ? 129 PRO H CB  1 
ATOM   2270 C CG  . PRO B 2 129 ? -3.512  -24.493 -63.888 1.00 27.09 ? 129 PRO H CG  1 
ATOM   2271 C CD  . PRO B 2 129 ? -3.248  -23.096 -63.371 1.00 25.84 ? 129 PRO H CD  1 
ATOM   2272 N N   . LEU B 2 130 ? -0.537  -26.227 -61.463 1.00 26.02 ? 130 LEU H N   1 
ATOM   2273 C CA  . LEU B 2 130 ? 0.560   -27.176 -61.788 1.00 27.30 ? 130 LEU H CA  1 
ATOM   2274 C C   . LEU B 2 130 ? -0.117  -28.526 -62.041 1.00 29.35 ? 130 LEU H C   1 
ATOM   2275 O O   . LEU B 2 130 ? -0.426  -29.253 -61.082 1.00 28.69 ? 130 LEU H O   1 
ATOM   2276 C CB  . LEU B 2 130 ? 1.527   -27.193 -60.594 1.00 26.02 ? 130 LEU H CB  1 
ATOM   2277 C CG  . LEU B 2 130 ? 2.218   -25.864 -60.279 1.00 24.85 ? 130 LEU H CG  1 
ATOM   2278 C CD1 . LEU B 2 130 ? 2.902   -25.934 -58.938 1.00 23.95 ? 130 LEU H CD1 1 
ATOM   2279 C CD2 . LEU B 2 130 ? 3.236   -25.481 -61.348 1.00 24.83 ? 130 LEU H CD2 1 
ATOM   2280 N N   . ALA B 2 131 ? -0.452  -28.758 -63.302 1.00 33.60 ? 131 ALA H N   1 
ATOM   2281 C CA  . ALA B 2 131 ? -1.369  -29.830 -63.772 1.00 37.21 ? 131 ALA H CA  1 
ATOM   2282 C C   . ALA B 2 131 ? -0.651  -31.169 -63.695 1.00 37.61 ? 131 ALA H C   1 
ATOM   2283 O O   . ALA B 2 131 ? 0.446   -31.276 -64.219 1.00 38.09 ? 131 ALA H O   1 
ATOM   2284 C CB  . ALA B 2 131 ? -1.807  -29.544 -65.182 1.00 38.05 ? 131 ALA H CB  1 
ATOM   2285 N N   . PRO B 2 132 ? -1.255  -32.207 -63.071 1.00 40.42 ? 132 PRO H N   1 
ATOM   2286 C CA  . PRO B 2 132 ? -0.815  -33.588 -63.256 1.00 42.84 ? 132 PRO H CA  1 
ATOM   2287 C C   . PRO B 2 132 ? -1.354  -34.116 -64.585 1.00 44.82 ? 132 PRO H C   1 
ATOM   2288 O O   . PRO B 2 132 ? -0.472  -34.338 -65.358 1.00 50.12 ? 132 PRO H O   1 
ATOM   2289 C CB  . PRO B 2 132 ? -1.476  -34.344 -62.112 1.00 44.13 ? 132 PRO H CB  1 
ATOM   2290 C CG  . PRO B 2 132 ? -2.770  -33.580 -61.862 1.00 43.46 ? 132 PRO H CG  1 
ATOM   2291 C CD  . PRO B 2 132 ? -2.487  -32.147 -62.272 1.00 40.99 ? 132 PRO H CD  1 
ATOM   2292 N N   . GLY B 2 139 ? 4.807   -45.291 -61.972 1.00 58.60 ? 139 GLY H N   1 
ATOM   2293 C CA  . GLY B 2 139 ? 4.758   -44.837 -60.555 1.00 57.49 ? 139 GLY H CA  1 
ATOM   2294 C C   . GLY B 2 139 ? 3.288   -44.741 -60.087 1.00 58.38 ? 139 GLY H C   1 
ATOM   2295 O O   . GLY B 2 139 ? 2.384   -44.498 -60.969 1.00 60.12 ? 139 GLY H O   1 
ATOM   2296 N N   . GLY B 2 140 ? 3.054   -45.083 -58.785 1.00 57.43 ? 140 GLY H N   1 
ATOM   2297 C CA  . GLY B 2 140 ? 1.701   -45.101 -58.170 1.00 56.98 ? 140 GLY H CA  1 
ATOM   2298 C C   . GLY B 2 140 ? 1.290   -43.724 -57.657 1.00 53.94 ? 140 GLY H C   1 
ATOM   2299 O O   . GLY B 2 140 ? 0.122   -43.567 -57.184 1.00 53.98 ? 140 GLY H O   1 
ATOM   2300 N N   . THR B 2 141 ? 2.196   -42.738 -57.776 1.00 50.62 ? 141 THR H N   1 
ATOM   2301 C CA  . THR B 2 141 ? 2.040   -41.383 -57.158 1.00 47.67 ? 141 THR H CA  1 
ATOM   2302 C C   . THR B 2 141 ? 2.112   -40.321 -58.249 1.00 45.34 ? 141 THR H C   1 
ATOM   2303 O O   . THR B 2 141 ? 3.067   -40.413 -59.138 1.00 47.16 ? 141 THR H O   1 
ATOM   2304 C CB  . THR B 2 141 ? 3.123   -41.137 -56.096 1.00 46.41 ? 141 THR H CB  1 
ATOM   2305 O OG1 . THR B 2 141 ? 2.976   -42.149 -55.080 1.00 47.69 ? 141 THR H OG1 1 
ATOM   2306 C CG2 . THR B 2 141 ? 3.059   -39.762 -55.467 1.00 43.60 ? 141 THR H CG2 1 
ATOM   2307 N N   . ALA B 2 142 ? 1.144   -39.327 -58.138 1.00 43.33 ? 142 ALA H N   1 
ATOM   2308 C CA  . ALA B 2 142 ? 1.064   -38.162 -59.036 1.00 40.13 ? 142 ALA H CA  1 
ATOM   2309 C C   . ALA B 2 142 ? 1.298   -36.896 -58.206 1.00 36.44 ? 142 ALA H C   1 
ATOM   2310 O O   . ALA B 2 142 ? 1.030   -36.880 -57.020 1.00 37.17 ? 142 ALA H O   1 
ATOM   2311 C CB  . ALA B 2 142 ? -0.262  -38.106 -59.732 1.00 41.03 ? 142 ALA H CB  1 
ATOM   2312 N N   . ALA B 2 143 ? 1.821   -35.874 -58.823 1.00 33.71 ? 143 ALA H N   1 
ATOM   2313 C CA  . ALA B 2 143 ? 2.002   -34.595 -58.129 1.00 30.74 ? 143 ALA H CA  1 
ATOM   2314 C C   . ALA B 2 143 ? 1.196   -33.555 -58.872 1.00 29.11 ? 143 ALA H C   1 
ATOM   2315 O O   . ALA B 2 143 ? 1.159   -33.582 -60.118 1.00 28.78 ? 143 ALA H O   1 
ATOM   2316 C CB  . ALA B 2 143 ? 3.455   -34.232 -58.042 1.00 30.27 ? 143 ALA H CB  1 
ATOM   2317 N N   . LEU B 2 144 ? 0.576   -32.677 -58.089 1.00 28.23 ? 144 LEU H N   1 
ATOM   2318 C CA  . LEU B 2 144 ? -0.135  -31.500 -58.630 1.00 27.84 ? 144 LEU H CA  1 
ATOM   2319 C C   . LEU B 2 144 ? 0.100   -30.320 -57.711 1.00 25.27 ? 144 LEU H C   1 
ATOM   2320 O O   . LEU B 2 144 ? 0.610   -30.489 -56.569 1.00 25.46 ? 144 LEU H O   1 
ATOM   2321 C CB  . LEU B 2 144 ? -1.626  -31.824 -58.796 1.00 29.57 ? 144 LEU H CB  1 
ATOM   2322 C CG  . LEU B 2 144 ? -2.326  -32.360 -57.557 1.00 30.52 ? 144 LEU H CG  1 
ATOM   2323 C CD1 . LEU B 2 144 ? -3.210  -31.307 -56.925 1.00 30.15 ? 144 LEU H CD1 1 
ATOM   2324 C CD2 . LEU B 2 144 ? -3.176  -33.560 -57.935 1.00 33.64 ? 144 LEU H CD2 1 
ATOM   2325 N N   . GLY B 2 145 ? -0.287  -29.137 -58.154 1.00 24.66 ? 145 GLY H N   1 
ATOM   2326 C CA  . GLY B 2 145 ? -0.133  -27.977 -57.265 1.00 22.85 ? 145 GLY H CA  1 
ATOM   2327 C C   . GLY B 2 145 ? -0.723  -26.704 -57.811 1.00 22.28 ? 145 GLY H C   1 
ATOM   2328 O O   . GLY B 2 145 ? -1.357  -26.735 -58.850 1.00 23.05 ? 145 GLY H O   1 
ATOM   2329 N N   . CYS B 2 146 ? -0.394  -25.616 -57.104 1.00 21.70 ? 146 CYS H N   1 
ATOM   2330 C CA  . CYS B 2 146 ? -0.746  -24.235 -57.438 1.00 20.97 ? 146 CYS H CA  1 
ATOM   2331 C C   . CYS B 2 146 ? 0.516   -23.381 -57.376 1.00 19.34 ? 146 CYS H C   1 
ATOM   2332 O O   . CYS B 2 146 ? 1.244   -23.434 -56.378 1.00 19.84 ? 146 CYS H O   1 
ATOM   2333 C CB  . CYS B 2 146 ? -1.821  -23.752 -56.482 1.00 20.72 ? 146 CYS H CB  1 
ATOM   2334 S SG  . CYS B 2 146 ? -3.393  -24.472 -57.008 1.00 24.65 ? 146 CYS H SG  1 
ATOM   2335 N N   . LEU B 2 147 ? 0.769   -22.659 -58.438 1.00 19.73 ? 147 LEU H N   1 
ATOM   2336 C CA  . LEU B 2 147 ? 1.780   -21.595 -58.433 1.00 19.01 ? 147 LEU H CA  1 
ATOM   2337 C C   . LEU B 2 147 ? 1.084   -20.310 -57.975 1.00 18.78 ? 147 LEU H C   1 
ATOM   2338 O O   . LEU B 2 147 ? 0.130   -19.864 -58.653 1.00 19.48 ? 147 LEU H O   1 
ATOM   2339 C CB  . LEU B 2 147 ? 2.369   -21.494 -59.828 1.00 19.43 ? 147 LEU H CB  1 
ATOM   2340 C CG  . LEU B 2 147 ? 3.319   -20.329 -60.041 1.00 19.72 ? 147 LEU H CG  1 
ATOM   2341 C CD1 . LEU B 2 147 ? 4.494   -20.466 -59.081 1.00 19.90 ? 147 LEU H CD1 1 
ATOM   2342 C CD2 . LEU B 2 147 ? 3.756   -20.246 -61.510 1.00 20.59 ? 147 LEU H CD2 1 
ATOM   2343 N N   . VAL B 2 148 ? 1.577   -19.710 -56.900 1.00 17.27 ? 148 VAL H N   1 
ATOM   2344 C CA  . VAL B 2 148 ? 1.017   -18.485 -56.286 1.00 17.54 ? 148 VAL H CA  1 
ATOM   2345 C C   . VAL B 2 148 ? 2.016   -17.356 -56.555 1.00 18.21 ? 148 VAL H C   1 
ATOM   2346 O O   . VAL B 2 148 ? 2.986   -17.192 -55.809 1.00 16.84 ? 148 VAL H O   1 
ATOM   2347 C CB  . VAL B 2 148 ? 0.742   -18.693 -54.788 1.00 17.60 ? 148 VAL H CB  1 
ATOM   2348 C CG1 . VAL B 2 148 ? 0.134   -17.482 -54.127 1.00 17.16 ? 148 VAL H CG1 1 
ATOM   2349 C CG2 . VAL B 2 148 ? -0.198  -19.857 -54.568 1.00 18.98 ? 148 VAL H CG2 1 
ATOM   2350 N N   . LYS B 2 149 ? 1.756   -16.587 -57.590 1.00 18.74 ? 149 LYS H N   1 
ATOM   2351 C CA  . LYS B 2 149 ? 2.811   -15.750 -58.198 1.00 19.30 ? 149 LYS H CA  1 
ATOM   2352 C C   . LYS B 2 149 ? 2.465   -14.275 -58.047 1.00 19.14 ? 149 LYS H C   1 
ATOM   2353 O O   . LYS B 2 149 ? 1.307   -13.870 -58.335 1.00 18.68 ? 149 LYS H O   1 
ATOM   2354 C CB  . LYS B 2 149 ? 2.972   -16.112 -59.663 1.00 21.45 ? 149 LYS H CB  1 
ATOM   2355 C CG  . LYS B 2 149 ? 4.202   -15.506 -60.309 1.00 22.47 ? 149 LYS H CG  1 
ATOM   2356 C CD  . LYS B 2 149 ? 4.574   -16.127 -61.559 1.00 23.54 ? 149 LYS H CD  1 
ATOM   2357 C CE  . LYS B 2 149 ? 5.270   -15.155 -62.464 1.00 24.27 ? 149 LYS H CE  1 
ATOM   2358 N NZ  . LYS B 2 149 ? 6.576   -14.731 -61.974 1.00 24.67 ? 149 LYS H NZ  1 
ATOM   2359 N N   . ASP B 2 150 ? 3.494   -13.502 -57.760 1.00 18.69 ? 150 ASP H N   1 
ATOM   2360 C CA  . ASP B 2 150 ? 3.514   -12.027 -57.913 1.00 19.65 ? 150 ASP H CA  1 
ATOM   2361 C C   . ASP B 2 150 ? 2.628   -11.346 -56.853 1.00 18.84 ? 150 ASP H C   1 
ATOM   2362 O O   . ASP B 2 150 ? 1.683   -10.655 -57.205 1.00 19.61 ? 150 ASP H O   1 
ATOM   2363 C CB  . ASP B 2 150 ? 3.175   -11.611 -59.334 1.00 21.92 ? 150 ASP H CB  1 
ATOM   2364 C CG  . ASP B 2 150 ? 4.264   -11.907 -60.350 1.00 23.23 ? 150 ASP H CG  1 
ATOM   2365 O OD1 . ASP B 2 150 ? 5.422   -12.137 -59.957 1.00 24.60 ? 150 ASP H OD1 1 
ATOM   2366 O OD2 . ASP B 2 150 ? 3.956   -11.802 -61.534 1.00 25.58 ? 150 ASP H OD2 1 
ATOM   2367 N N   . TYR B 2 151 ? 2.970   -11.504 -55.575 1.00 18.44 ? 151 TYR H N   1 
ATOM   2368 C CA  . TYR B 2 151 ? 2.199   -10.886 -54.482 1.00 17.48 ? 151 TYR H CA  1 
ATOM   2369 C C   . TYR B 2 151 ? 3.156   -10.122 -53.568 1.00 17.53 ? 151 TYR H C   1 
ATOM   2370 O O   . TYR B 2 151 ? 4.377   -10.356 -53.551 1.00 17.88 ? 151 TYR H O   1 
ATOM   2371 C CB  . TYR B 2 151 ? 1.367   -11.899 -53.718 1.00 17.04 ? 151 TYR H CB  1 
ATOM   2372 C CG  . TYR B 2 151 ? 2.179   -12.917 -52.954 1.00 15.99 ? 151 TYR H CG  1 
ATOM   2373 C CD1 . TYR B 2 151 ? 2.534   -14.146 -53.497 1.00 15.85 ? 151 TYR H CD1 1 
ATOM   2374 C CD2 . TYR B 2 151 ? 2.568   -12.661 -51.657 1.00 15.74 ? 151 TYR H CD2 1 
ATOM   2375 C CE1 . TYR B 2 151 ? 3.289   -15.062 -52.779 1.00 15.03 ? 151 TYR H CE1 1 
ATOM   2376 C CE2 . TYR B 2 151 ? 3.255   -13.587 -50.900 1.00 15.14 ? 151 TYR H CE2 1 
ATOM   2377 C CZ  . TYR B 2 151 ? 3.655   -14.778 -51.472 1.00 15.34 ? 151 TYR H CZ  1 
ATOM   2378 O OH  . TYR B 2 151 ? 4.338   -15.671 -50.669 1.00 16.56 ? 151 TYR H OH  1 
ATOM   2379 N N   . PHE B 2 152 ? 2.555   -9.245  -52.784 1.00 16.95 ? 152 PHE H N   1 
ATOM   2380 C CA  . PHE B 2 152 ? 3.284   -8.408  -51.816 1.00 16.99 ? 152 PHE H CA  1 
ATOM   2381 C C   . PHE B 2 152 ? 2.287   -7.841  -50.822 1.00 16.84 ? 152 PHE H C   1 
ATOM   2382 O O   . PHE B 2 152 ? 1.177   -7.395  -51.181 1.00 17.66 ? 152 PHE H O   1 
ATOM   2383 C CB  . PHE B 2 152 ? 4.035   -7.281  -52.537 1.00 18.19 ? 152 PHE H CB  1 
ATOM   2384 C CG  . PHE B 2 152 ? 4.914   -6.533  -51.583 1.00 18.46 ? 152 PHE H CG  1 
ATOM   2385 C CD1 . PHE B 2 152 ? 6.115   -7.071  -51.213 1.00 18.71 ? 152 PHE H CD1 1 
ATOM   2386 C CD2 . PHE B 2 152 ? 4.486   -5.386  -50.948 1.00 19.38 ? 152 PHE H CD2 1 
ATOM   2387 C CE1 . PHE B 2 152 ? 6.900   -6.462  -50.240 1.00 19.85 ? 152 PHE H CE1 1 
ATOM   2388 C CE2 . PHE B 2 152 ? 5.261   -4.778  -49.973 1.00 20.40 ? 152 PHE H CE2 1 
ATOM   2389 C CZ  . PHE B 2 152 ? 6.486   -5.299  -49.630 1.00 19.84 ? 152 PHE H CZ  1 
ATOM   2390 N N   . PRO B 2 153 ? 2.626   -7.771  -49.525 1.00 16.58 ? 153 PRO H N   1 
ATOM   2391 C CA  . PRO B 2 153 ? 3.786   -8.417  -48.915 1.00 15.93 ? 153 PRO H CA  1 
ATOM   2392 C C   . PRO B 2 153 ? 3.525   -9.912  -48.568 1.00 14.95 ? 153 PRO H C   1 
ATOM   2393 O O   . PRO B 2 153 ? 2.483   -10.442 -48.904 1.00 14.20 ? 153 PRO H O   1 
ATOM   2394 C CB  . PRO B 2 153 ? 3.852   -7.625  -47.618 1.00 16.14 ? 153 PRO H CB  1 
ATOM   2395 C CG  . PRO B 2 153 ? 2.421   -7.498  -47.221 1.00 16.58 ? 153 PRO H CG  1 
ATOM   2396 C CD  . PRO B 2 153 ? 1.727   -7.181  -48.534 1.00 16.90 ? 153 PRO H CD  1 
ATOM   2397 N N   . GLU B 2 154 ? 4.414   -10.543 -47.812 1.00 15.25 ? 154 GLU H N   1 
ATOM   2398 C CA  . GLU B 2 154 ? 4.046   -11.805 -47.119 1.00 16.12 ? 154 GLU H CA  1 
ATOM   2399 C C   . GLU B 2 154 ? 2.955   -11.482 -46.098 1.00 15.84 ? 154 GLU H C   1 
ATOM   2400 O O   . GLU B 2 154 ? 2.856   -10.347 -45.657 1.00 15.94 ? 154 GLU H O   1 
ATOM   2401 C CB  . GLU B 2 154 ? 5.280   -12.382 -46.436 1.00 17.72 ? 154 GLU H CB  1 
ATOM   2402 C CG  . GLU B 2 154 ? 6.245   -12.965 -47.458 1.00 20.56 ? 154 GLU H CG  1 
ATOM   2403 C CD  . GLU B 2 154 ? 5.949   -14.439 -47.700 1.00 24.53 ? 154 GLU H CD  1 
ATOM   2404 O OE1 . GLU B 2 154 ? 6.866   -15.178 -47.372 1.00 24.43 ? 154 GLU H OE1 1 
ATOM   2405 O OE2 . GLU B 2 154 ? 4.776   -14.879 -48.162 1.00 22.25 ? 154 GLU H OE2 1 
ATOM   2406 N N   . PRO B 2 155 ? 2.177   -12.462 -45.621 1.00 16.13 ? 155 PRO H N   1 
ATOM   2407 C CA  . PRO B 2 155 ? 2.221   -13.862 -46.047 1.00 15.22 ? 155 PRO H CA  1 
ATOM   2408 C C   . PRO B 2 155 ? 1.034   -14.219 -46.950 1.00 16.33 ? 155 PRO H C   1 
ATOM   2409 O O   . PRO B 2 155 ? 0.080   -13.462 -47.063 1.00 16.21 ? 155 PRO H O   1 
ATOM   2410 C CB  . PRO B 2 155 ? 2.014   -14.623 -44.725 1.00 16.48 ? 155 PRO H CB  1 
ATOM   2411 C CG  . PRO B 2 155 ? 0.991   -13.734 -44.027 1.00 16.03 ? 155 PRO H CG  1 
ATOM   2412 C CD  . PRO B 2 155 ? 1.308   -12.322 -44.436 1.00 16.77 ? 155 PRO H CD  1 
ATOM   2413 N N   . VAL B 2 156 ? 1.042   -15.464 -47.454 1.00 16.88 ? 156 VAL H N   1 
ATOM   2414 C CA  . VAL B 2 156 ? -0.124  -16.109 -48.113 1.00 18.57 ? 156 VAL H CA  1 
ATOM   2415 C C   . VAL B 2 156 ? -0.377  -17.424 -47.389 1.00 19.18 ? 156 VAL H C   1 
ATOM   2416 O O   . VAL B 2 156 ? 0.597   -17.977 -46.872 1.00 19.40 ? 156 VAL H O   1 
ATOM   2417 C CB  . VAL B 2 156 ? 0.027   -16.414 -49.619 1.00 21.32 ? 156 VAL H CB  1 
ATOM   2418 C CG1 . VAL B 2 156 ? 0.063   -15.150 -50.436 1.00 22.93 ? 156 VAL H CG1 1 
ATOM   2419 C CG2 . VAL B 2 156 ? 1.177   -17.310 -49.900 1.00 21.82 ? 156 VAL H CG2 1 
ATOM   2420 N N   . THR B 2 157 ? -1.625  -17.816 -47.271 1.00 19.19 ? 157 THR H N   1 
ATOM   2421 C CA  . THR B 2 157 ? -1.949  -19.187 -46.835 1.00 20.22 ? 157 THR H CA  1 
ATOM   2422 C C   . THR B 2 157 ? -2.456  -20.017 -48.001 1.00 19.81 ? 157 THR H C   1 
ATOM   2423 O O   . THR B 2 157 ? -3.114  -19.457 -48.893 1.00 19.91 ? 157 THR H O   1 
ATOM   2424 C CB  . THR B 2 157 ? -2.946  -19.123 -45.698 1.00 21.57 ? 157 THR H CB  1 
ATOM   2425 O OG1 . THR B 2 157 ? -4.151  -18.492 -46.103 1.00 22.09 ? 157 THR H OG1 1 
ATOM   2426 C CG2 . THR B 2 157 ? -2.355  -18.414 -44.505 1.00 22.48 ? 157 THR H CG2 1 
ATOM   2427 N N   . VAL B 2 158 ? -2.144  -21.306 -47.986 1.00 19.28 ? 158 VAL H N   1 
ATOM   2428 C CA  . VAL B 2 158 ? -2.638  -22.249 -49.001 1.00 21.00 ? 158 VAL H CA  1 
ATOM   2429 C C   . VAL B 2 158 ? -3.171  -23.453 -48.253 1.00 21.88 ? 158 VAL H C   1 
ATOM   2430 O O   . VAL B 2 158 ? -2.404  -23.988 -47.445 1.00 23.39 ? 158 VAL H O   1 
ATOM   2431 C CB  . VAL B 2 158 ? -1.549  -22.662 -50.009 1.00 20.26 ? 158 VAL H CB  1 
ATOM   2432 C CG1 . VAL B 2 158 ? -2.109  -23.570 -51.049 1.00 21.10 ? 158 VAL H CG1 1 
ATOM   2433 C CG2 . VAL B 2 158 ? -0.912  -21.441 -50.633 1.00 19.13 ? 158 VAL H CG2 1 
ATOM   2434 N N   . SER B 2 159 ? -4.424  -23.783 -48.494 1.00 24.14 ? 159 SER H N   1 
ATOM   2435 C CA  . SER B 2 159 ? -4.994  -25.060 -48.027 1.00 26.27 ? 159 SER H CA  1 
ATOM   2436 C C   . SER B 2 159 ? -5.366  -25.828 -49.285 1.00 26.35 ? 159 SER H C   1 
ATOM   2437 O O   . SER B 2 159 ? -5.360  -25.253 -50.436 1.00 25.97 ? 159 SER H O   1 
ATOM   2438 C CB  . SER B 2 159 ? -6.147  -24.812 -47.037 1.00 27.06 ? 159 SER H CB  1 
ATOM   2439 O OG  . SER B 2 159 ? -7.272  -24.373 -47.791 1.00 30.34 ? 159 SER H OG  1 
ATOM   2440 N N   . TRP B 2 160 ? -5.642  -27.117 -49.111 1.00 27.65 ? 160 TRP H N   1 
ATOM   2441 C CA  . TRP B 2 160 ? -6.166  -28.001 -50.160 1.00 28.49 ? 160 TRP H CA  1 
ATOM   2442 C C   . TRP B 2 160 ? -7.506  -28.594 -49.675 1.00 29.58 ? 160 TRP H C   1 
ATOM   2443 O O   . TRP B 2 160 ? -7.567  -29.095 -48.515 1.00 30.57 ? 160 TRP H O   1 
ATOM   2444 C CB  . TRP B 2 160 ? -5.145  -29.103 -50.502 1.00 28.21 ? 160 TRP H CB  1 
ATOM   2445 C CG  . TRP B 2 160 ? -3.976  -28.563 -51.286 1.00 26.07 ? 160 TRP H CG  1 
ATOM   2446 C CD1 . TRP B 2 160 ? -2.834  -28.015 -50.776 1.00 24.93 ? 160 TRP H CD1 1 
ATOM   2447 C CD2 . TRP B 2 160 ? -3.872  -28.450 -52.703 1.00 24.93 ? 160 TRP H CD2 1 
ATOM   2448 N NE1 . TRP B 2 160 ? -1.993  -27.640 -51.788 1.00 23.07 ? 160 TRP H NE1 1 
ATOM   2449 C CE2 . TRP B 2 160 ? -2.629  -27.828 -52.976 1.00 23.89 ? 160 TRP H CE2 1 
ATOM   2450 C CE3 . TRP B 2 160 ? -4.698  -28.758 -53.767 1.00 26.18 ? 160 TRP H CE3 1 
ATOM   2451 C CZ2 . TRP B 2 160 ? -2.202  -27.566 -54.262 1.00 23.23 ? 160 TRP H CZ2 1 
ATOM   2452 C CZ3 . TRP B 2 160 ? -4.274  -28.502 -55.048 1.00 26.38 ? 160 TRP H CZ3 1 
ATOM   2453 C CH2 . TRP B 2 160 ? -3.027  -27.919 -55.298 1.00 24.78 ? 160 TRP H CH2 1 
ATOM   2454 N N   . ASN B 2 161 ? -8.510  -28.510 -50.522 1.00 31.66 ? 161 ASN H N   1 
ATOM   2455 C CA  . ASN B 2 161 ? -9.860  -29.112 -50.298 1.00 35.44 ? 161 ASN H CA  1 
ATOM   2456 C C   . ASN B 2 161 ? -10.345 -28.644 -48.910 1.00 36.14 ? 161 ASN H C   1 
ATOM   2457 O O   . ASN B 2 161 ? -10.780 -29.476 -48.050 1.00 35.20 ? 161 ASN H O   1 
ATOM   2458 C CB  . ASN B 2 161 ? -9.824  -30.633 -50.584 1.00 37.40 ? 161 ASN H CB  1 
ATOM   2459 C CG  . ASN B 2 161 ? -9.546  -31.001 -52.031 1.00 38.31 ? 161 ASN H CG  1 
ATOM   2460 O OD1 . ASN B 2 161 ? -9.674  -30.188 -52.954 1.00 38.75 ? 161 ASN H OD1 1 
ATOM   2461 N ND2 . ASN B 2 161 ? -9.268  -32.291 -52.273 1.00 40.46 ? 161 ASN H ND2 1 
ATOM   2462 N N   . SER B 2 162 ? -10.130 -27.347 -48.637 1.00 35.76 ? 162 SER H N   1 
ATOM   2463 C CA  . SER B 2 162 ? -10.559 -26.612 -47.423 1.00 37.03 ? 162 SER H CA  1 
ATOM   2464 C C   . SER B 2 162 ? -10.007 -27.242 -46.151 1.00 39.38 ? 162 SER H C   1 
ATOM   2465 O O   . SER B 2 162 ? -10.669 -27.153 -45.091 1.00 40.43 ? 162 SER H O   1 
ATOM   2466 C CB  . SER B 2 162 ? -12.035 -26.520 -47.333 1.00 38.31 ? 162 SER H CB  1 
ATOM   2467 O OG  . SER B 2 162 ? -12.575 -26.197 -48.603 1.00 39.08 ? 162 SER H OG  1 
ATOM   2468 N N   . GLY B 2 163 ? -8.820  -27.815 -46.219 1.00 38.07 ? 163 GLY H N   1 
ATOM   2469 C CA  . GLY B 2 163 ? -8.139  -28.316 -45.010 1.00 38.81 ? 163 GLY H CA  1 
ATOM   2470 C C   . GLY B 2 163 ? -8.367  -29.802 -44.846 1.00 39.63 ? 163 GLY H C   1 
ATOM   2471 O O   . GLY B 2 163 ? -7.763  -30.341 -43.943 1.00 43.63 ? 163 GLY H O   1 
ATOM   2472 N N   . ALA B 2 164 ? -9.155  -30.397 -45.733 1.00 40.14 ? 164 ALA H N   1 
ATOM   2473 C CA  . ALA B 2 164 ? -9.469  -31.842 -45.835 1.00 43.87 ? 164 ALA H CA  1 
ATOM   2474 C C   . ALA B 2 164 ? -8.215  -32.637 -46.239 1.00 43.68 ? 164 ALA H C   1 
ATOM   2475 O O   . ALA B 2 164 ? -8.127  -33.816 -45.864 1.00 44.44 ? 164 ALA H O   1 
ATOM   2476 C CB  . ALA B 2 164 ? -10.564 -32.053 -46.853 1.00 45.72 ? 164 ALA H CB  1 
ATOM   2477 N N   . LEU B 2 165 ? -7.272  -32.029 -46.971 1.00 39.58 ? 165 LEU H N   1 
ATOM   2478 C CA  . LEU B 2 165 ? -6.082  -32.747 -47.518 1.00 38.07 ? 165 LEU H CA  1 
ATOM   2479 C C   . LEU B 2 165 ? -4.827  -32.124 -46.944 1.00 35.98 ? 165 LEU H C   1 
ATOM   2480 O O   . LEU B 2 165 ? -4.611  -30.925 -47.178 1.00 33.99 ? 165 LEU H O   1 
ATOM   2481 C CB  . LEU B 2 165 ? -6.156  -32.689 -49.036 1.00 37.98 ? 165 LEU H CB  1 
ATOM   2482 C CG  . LEU B 2 165 ? -4.966  -33.252 -49.821 1.00 37.66 ? 165 LEU H CG  1 
ATOM   2483 C CD1 . LEU B 2 165 ? -4.698  -34.721 -49.487 1.00 40.08 ? 165 LEU H CD1 1 
ATOM   2484 C CD2 . LEU B 2 165 ? -5.248  -33.099 -51.306 1.00 36.92 ? 165 LEU H CD2 1 
ATOM   2485 N N   . THR B 2 166 ? -4.138  -32.829 -46.062 1.00 35.78 ? 166 THR H N   1 
ATOM   2486 C CA  . THR B 2 166 ? -2.950  -32.278 -45.365 1.00 35.79 ? 166 THR H CA  1 
ATOM   2487 C C   . THR B 2 166 ? -1.774  -33.227 -45.596 1.00 36.41 ? 166 THR H C   1 
ATOM   2488 O O   . THR B 2 166 ? -0.672  -32.741 -45.629 1.00 37.31 ? 166 THR H O   1 
ATOM   2489 C CB  . THR B 2 166 ? -3.233  -31.932 -43.898 1.00 36.20 ? 166 THR H CB  1 
ATOM   2490 O OG1 . THR B 2 166 ? -3.539  -33.129 -43.184 1.00 38.38 ? 166 THR H OG1 1 
ATOM   2491 C CG2 . THR B 2 166 ? -4.348  -30.903 -43.754 1.00 36.17 ? 166 THR H CG2 1 
ATOM   2492 N N   . SER B 2 167 ? -2.010  -34.529 -45.726 1.00 38.07 ? 167 SER H N   1 
ATOM   2493 C CA  . SER B 2 167 ? -0.939  -35.531 -45.978 1.00 38.88 ? 167 SER H CA  1 
ATOM   2494 C C   . SER B 2 167 ? -0.365  -35.355 -47.411 1.00 36.57 ? 167 SER H C   1 
ATOM   2495 O O   . SER B 2 167 ? -1.122  -35.315 -48.421 1.00 34.16 ? 167 SER H O   1 
ATOM   2496 C CB  . SER B 2 167 ? -1.411  -36.958 -45.707 1.00 41.41 ? 167 SER H CB  1 
ATOM   2497 O OG  . SER B 2 167 ? -1.779  -37.595 -46.921 1.00 43.63 ? 167 SER H OG  1 
ATOM   2498 N N   . GLY B 2 168 ? 0.960   -35.245 -47.505 1.00 36.12 ? 168 GLY H N   1 
ATOM   2499 C CA  . GLY B 2 168 ? 1.628   -35.142 -48.827 1.00 34.41 ? 168 GLY H CA  1 
ATOM   2500 C C   . GLY B 2 168 ? 1.669   -33.689 -49.345 1.00 31.53 ? 168 GLY H C   1 
ATOM   2501 O O   . GLY B 2 168 ? 2.218   -33.470 -50.427 1.00 29.81 ? 168 GLY H O   1 
ATOM   2502 N N   . VAL B 2 169 ? 1.110   -32.729 -48.621 1.00 29.12 ? 169 VAL H N   1 
ATOM   2503 C CA  . VAL B 2 169 ? 1.152   -31.296 -49.048 1.00 27.03 ? 169 VAL H CA  1 
ATOM   2504 C C   . VAL B 2 169 ? 2.524   -30.715 -48.712 1.00 25.54 ? 169 VAL H C   1 
ATOM   2505 O O   . VAL B 2 169 ? 3.021   -30.914 -47.578 1.00 26.56 ? 169 VAL H O   1 
ATOM   2506 C CB  . VAL B 2 169 ? 0.048   -30.484 -48.359 1.00 26.41 ? 169 VAL H CB  1 
ATOM   2507 C CG1 . VAL B 2 169 ? 0.219   -28.969 -48.586 1.00 25.19 ? 169 VAL H CG1 1 
ATOM   2508 C CG2 . VAL B 2 169 ? -1.293  -30.933 -48.868 1.00 26.99 ? 169 VAL H CG2 1 
ATOM   2509 N N   . HIS B 2 170 ? 3.106   -29.958 -49.643 1.00 24.24 ? 170 HIS H N   1 
ATOM   2510 C CA  . HIS B 2 170 ? 4.314   -29.152 -49.363 1.00 22.43 ? 170 HIS H CA  1 
ATOM   2511 C C   . HIS B 2 170 ? 4.068   -27.768 -49.936 1.00 20.92 ? 170 HIS H C   1 
ATOM   2512 O O   . HIS B 2 170 ? 3.962   -27.649 -51.167 1.00 20.23 ? 170 HIS H O   1 
ATOM   2513 C CB  . HIS B 2 170 ? 5.570   -29.740 -50.008 1.00 23.46 ? 170 HIS H CB  1 
ATOM   2514 C CG  . HIS B 2 170 ? 6.017   -31.049 -49.440 1.00 24.89 ? 170 HIS H CG  1 
ATOM   2515 N ND1 . HIS B 2 170 ? 6.406   -31.192 -48.108 1.00 25.32 ? 170 HIS H ND1 1 
ATOM   2516 C CD2 . HIS B 2 170 ? 6.131   -32.250 -50.015 1.00 26.41 ? 170 HIS H CD2 1 
ATOM   2517 C CE1 . HIS B 2 170 ? 6.749   -32.466 -47.918 1.00 27.01 ? 170 HIS H CE1 1 
ATOM   2518 N NE2 . HIS B 2 170 ? 6.605   -33.127 -49.077 1.00 27.56 ? 170 HIS H NE2 1 
ATOM   2519 N N   . THR B 2 171 ? 3.982   -26.794 -49.058 1.00 20.50 ? 171 THR H N   1 
ATOM   2520 C CA  . THR B 2 171 ? 3.884   -25.360 -49.425 1.00 18.91 ? 171 THR H CA  1 
ATOM   2521 C C   . THR B 2 171 ? 5.275   -24.791 -49.237 1.00 18.38 ? 171 THR H C   1 
ATOM   2522 O O   . THR B 2 171 ? 5.767   -24.767 -48.110 1.00 19.10 ? 171 THR H O   1 
ATOM   2523 C CB  . THR B 2 171 ? 2.829   -24.644 -48.604 1.00 18.06 ? 171 THR H CB  1 
ATOM   2524 O OG1 . THR B 2 171 ? 1.646   -25.347 -48.967 1.00 18.97 ? 171 THR H OG1 1 
ATOM   2525 C CG2 . THR B 2 171 ? 2.745   -23.175 -48.954 1.00 18.14 ? 171 THR H CG2 1 
ATOM   2526 N N   . PHE B 2 172 ? 5.909   -24.372 -50.307 1.00 16.69 ? 172 PHE H N   1 
ATOM   2527 C CA  . PHE B 2 172 ? 7.303   -23.920 -50.288 1.00 16.62 ? 172 PHE H CA  1 
ATOM   2528 C C   . PHE B 2 172 ? 7.408   -22.539 -49.672 1.00 16.61 ? 172 PHE H C   1 
ATOM   2529 O O   . PHE B 2 172 ? 6.505   -21.724 -49.844 1.00 16.13 ? 172 PHE H O   1 
ATOM   2530 C CB  . PHE B 2 172 ? 7.853   -23.942 -51.706 1.00 16.58 ? 172 PHE H CB  1 
ATOM   2531 C CG  . PHE B 2 172 ? 8.130   -25.355 -52.145 1.00 16.77 ? 172 PHE H CG  1 
ATOM   2532 C CD1 . PHE B 2 172 ? 9.289   -25.990 -51.768 1.00 17.39 ? 172 PHE H CD1 1 
ATOM   2533 C CD2 . PHE B 2 172 ? 7.181   -26.092 -52.848 1.00 17.29 ? 172 PHE H CD2 1 
ATOM   2534 C CE1 . PHE B 2 172 ? 9.528   -27.307 -52.147 1.00 18.38 ? 172 PHE H CE1 1 
ATOM   2535 C CE2 . PHE B 2 172 ? 7.400   -27.415 -53.201 1.00 18.38 ? 172 PHE H CE2 1 
ATOM   2536 C CZ  . PHE B 2 172 ? 8.594   -28.030 -52.861 1.00 19.00 ? 172 PHE H CZ  1 
ATOM   2537 N N   . PRO B 2 173 ? 8.537   -22.217 -49.037 1.00 17.76 ? 173 PRO H N   1 
ATOM   2538 C CA  . PRO B 2 173 ? 8.822   -20.824 -48.689 1.00 18.06 ? 173 PRO H CA  1 
ATOM   2539 C C   . PRO B 2 173 ? 8.771   -19.947 -49.955 1.00 17.73 ? 173 PRO H C   1 
ATOM   2540 O O   . PRO B 2 173 ? 9.226   -20.397 -51.003 1.00 17.93 ? 173 PRO H O   1 
ATOM   2541 C CB  . PRO B 2 173 ? 10.213  -20.836 -48.072 1.00 18.27 ? 173 PRO H CB  1 
ATOM   2542 C CG  . PRO B 2 173 ? 10.446  -22.278 -47.653 1.00 19.57 ? 173 PRO H CG  1 
ATOM   2543 C CD  . PRO B 2 173 ? 9.574   -23.137 -48.543 1.00 18.78 ? 173 PRO H CD  1 
ATOM   2544 N N   . ALA B 2 174 ? 8.245   -18.742 -49.801 1.00 17.79 ? 174 ALA H N   1 
ATOM   2545 C CA  . ALA B 2 174 ? 8.245   -17.722 -50.848 1.00 19.12 ? 174 ALA H CA  1 
ATOM   2546 C C   . ALA B 2 174 ? 9.682   -17.384 -51.232 1.00 20.21 ? 174 ALA H C   1 
ATOM   2547 O O   . ALA B 2 174 ? 10.548  -17.402 -50.348 1.00 19.91 ? 174 ALA H O   1 
ATOM   2548 C CB  . ALA B 2 174 ? 7.498   -16.476 -50.414 1.00 20.25 ? 174 ALA H CB  1 
ATOM   2549 N N   . VAL B 2 175 ? 9.890   -17.083 -52.501 1.00 21.28 ? 175 VAL H N   1 
ATOM   2550 C CA  . VAL B 2 175 ? 11.132  -16.430 -52.994 1.00 23.00 ? 175 VAL H CA  1 
ATOM   2551 C C   . VAL B 2 175 ? 10.757  -15.005 -53.393 1.00 22.20 ? 175 VAL H C   1 
ATOM   2552 O O   . VAL B 2 175 ? 9.727   -14.819 -54.029 1.00 19.80 ? 175 VAL H O   1 
ATOM   2553 C CB  . VAL B 2 175 ? 11.796  -17.169 -54.170 1.00 26.39 ? 175 VAL H CB  1 
ATOM   2554 C CG1 . VAL B 2 175 ? 12.215  -18.569 -53.724 1.00 27.62 ? 175 VAL H CG1 1 
ATOM   2555 C CG2 . VAL B 2 175 ? 10.957  -17.206 -55.461 1.00 27.69 ? 175 VAL H CG2 1 
ATOM   2556 N N   . LEU B 2 176 ? 11.631  -14.059 -53.083 1.00 23.39 ? 176 LEU H N   1 
ATOM   2557 C CA  . LEU B 2 176 ? 11.493  -12.659 -53.572 1.00 24.72 ? 176 LEU H CA  1 
ATOM   2558 C C   . LEU B 2 176 ? 12.078  -12.577 -54.972 1.00 25.36 ? 176 LEU H C   1 
ATOM   2559 O O   . LEU B 2 176 ? 13.248  -12.930 -55.130 1.00 26.47 ? 176 LEU H O   1 
ATOM   2560 C CB  . LEU B 2 176 ? 12.216  -11.786 -52.536 1.00 26.50 ? 176 LEU H CB  1 
ATOM   2561 C CG  . LEU B 2 176 ? 12.226  -10.288 -52.808 1.00 28.76 ? 176 LEU H CG  1 
ATOM   2562 C CD1 . LEU B 2 176 ? 10.799  -9.753  -52.903 1.00 28.83 ? 176 LEU H CD1 1 
ATOM   2563 C CD2 . LEU B 2 176 ? 13.007  -9.603  -51.696 1.00 29.85 ? 176 LEU H CD2 1 
ATOM   2564 N N   . GLN B 2 177 ? 11.277  -12.182 -55.962 1.00 25.04 ? 177 GLN H N   1 
ATOM   2565 C CA  . GLN B 2 177 ? 11.675  -11.984 -57.370 1.00 26.05 ? 177 GLN H CA  1 
ATOM   2566 C C   . GLN B 2 177 ? 12.330  -10.609 -57.501 1.00 27.73 ? 177 GLN H C   1 
ATOM   2567 O O   . GLN B 2 177 ? 12.183  -9.785  -56.603 1.00 26.40 ? 177 GLN H O   1 
ATOM   2568 C CB  . GLN B 2 177 ? 10.457  -12.114 -58.285 1.00 26.10 ? 177 GLN H CB  1 
ATOM   2569 C CG  . GLN B 2 177 ? 9.813   -13.499 -58.153 1.00 25.60 ? 177 GLN H CG  1 
ATOM   2570 C CD  . GLN B 2 177 ? 8.456   -13.523 -58.804 1.00 26.14 ? 177 GLN H CD  1 
ATOM   2571 O OE1 . GLN B 2 177 ? 8.350   -14.067 -59.879 1.00 26.46 ? 177 GLN H OE1 1 
ATOM   2572 N NE2 . GLN B 2 177 ? 7.440   -12.894 -58.202 1.00 25.47 ? 177 GLN H NE2 1 
ATOM   2573 N N   . SER B 2 178 ? 13.004  -10.387 -58.614 1.00 31.49 ? 178 SER H N   1 
ATOM   2574 C CA  . SER B 2 178 ? 13.725  -9.120  -58.870 1.00 33.44 ? 178 SER H CA  1 
ATOM   2575 C C   . SER B 2 178 ? 12.696  -7.992  -59.006 1.00 34.08 ? 178 SER H C   1 
ATOM   2576 O O   . SER B 2 178 ? 13.069  -6.824  -58.861 1.00 37.48 ? 178 SER H O   1 
ATOM   2577 C CB  . SER B 2 178 ? 14.587  -9.272  -60.078 1.00 35.22 ? 178 SER H CB  1 
ATOM   2578 O OG  . SER B 2 178 ? 13.785  -9.411  -61.235 1.00 37.39 ? 178 SER H OG  1 
ATOM   2579 N N   . SER B 2 179 ? 11.464  -8.316  -59.387 1.00 31.99 ? 179 SER H N   1 
ATOM   2580 C CA  . SER B 2 179 ? 10.322  -7.368  -59.438 1.00 30.66 ? 179 SER H CA  1 
ATOM   2581 C C   . SER B 2 179 ? 10.018  -6.830  -58.042 1.00 29.42 ? 179 SER H C   1 
ATOM   2582 O O   . SER B 2 179 ? 9.255   -5.846  -57.954 1.00 31.90 ? 179 SER H O   1 
ATOM   2583 C CB  . SER B 2 179 ? 9.096   -8.055  -60.000 1.00 30.75 ? 179 SER H CB  1 
ATOM   2584 O OG  . SER B 2 179 ? 8.686   -9.117  -59.093 1.00 28.41 ? 179 SER H OG  1 
ATOM   2585 N N   . GLY B 2 180 ? 10.505  -7.459  -56.980 1.00 25.87 ? 180 GLY H N   1 
ATOM   2586 C CA  . GLY B 2 180 ? 10.132  -7.098  -55.605 1.00 25.28 ? 180 GLY H CA  1 
ATOM   2587 C C   . GLY B 2 180 ? 8.816   -7.743  -55.183 1.00 23.65 ? 180 GLY H C   1 
ATOM   2588 O O   . GLY B 2 180 ? 8.249   -7.351  -54.136 1.00 24.23 ? 180 GLY H O   1 
ATOM   2589 N N   . LEU B 2 181 ? 8.307   -8.667  -55.980 1.00 22.23 ? 181 LEU H N   1 
ATOM   2590 C CA  . LEU B 2 181 ? 7.109   -9.451  -55.619 1.00 20.34 ? 181 LEU H CA  1 
ATOM   2591 C C   . LEU B 2 181 ? 7.548   -10.867 -55.226 1.00 20.06 ? 181 LEU H C   1 
ATOM   2592 O O   . LEU B 2 181 ? 8.525   -11.398 -55.763 1.00 20.21 ? 181 LEU H O   1 
ATOM   2593 C CB  . LEU B 2 181 ? 6.138   -9.470  -56.774 1.00 20.15 ? 181 LEU H CB  1 
ATOM   2594 C CG  . LEU B 2 181 ? 5.697   -8.099  -57.314 1.00 21.25 ? 181 LEU H CG  1 
ATOM   2595 C CD1 . LEU B 2 181 ? 4.831   -8.304  -58.552 1.00 22.17 ? 181 LEU H CD1 1 
ATOM   2596 C CD2 . LEU B 2 181 ? 4.975   -7.248  -56.254 1.00 20.64 ? 181 LEU H CD2 1 
ATOM   2597 N N   . TYR B 2 182 ? 6.774   -11.487 -54.359 1.00 18.87 ? 182 TYR H N   1 
ATOM   2598 C CA  . TYR B 2 182 ? 7.008   -12.881 -53.935 1.00 17.96 ? 182 TYR H CA  1 
ATOM   2599 C C   . TYR B 2 182 ? 6.279   -13.841 -54.862 1.00 17.66 ? 182 TYR H C   1 
ATOM   2600 O O   . TYR B 2 182 ? 5.314   -13.490 -55.529 1.00 17.82 ? 182 TYR H O   1 
ATOM   2601 C CB  . TYR B 2 182 ? 6.499   -13.053 -52.501 1.00 17.41 ? 182 TYR H CB  1 
ATOM   2602 C CG  . TYR B 2 182 ? 7.307   -12.297 -51.480 1.00 17.72 ? 182 TYR H CG  1 
ATOM   2603 C CD1 . TYR B 2 182 ? 8.493   -12.800 -51.002 1.00 19.28 ? 182 TYR H CD1 1 
ATOM   2604 C CD2 . TYR B 2 182 ? 6.926   -11.042 -51.047 1.00 18.83 ? 182 TYR H CD2 1 
ATOM   2605 C CE1 . TYR B 2 182 ? 9.227   -12.143 -50.026 1.00 20.69 ? 182 TYR H CE1 1 
ATOM   2606 C CE2 . TYR B 2 182 ? 7.648   -10.345 -50.096 1.00 20.37 ? 182 TYR H CE2 1 
ATOM   2607 C CZ  . TYR B 2 182 ? 8.829   -10.881 -49.618 1.00 21.89 ? 182 TYR H CZ  1 
ATOM   2608 O OH  . TYR B 2 182 ? 9.542   -10.177 -48.701 1.00 24.67 ? 182 TYR H OH  1 
ATOM   2609 N N   . SER B 2 183 ? 6.745   -15.084 -54.827 1.00 17.83 ? 183 SER H N   1 
ATOM   2610 C CA  . SER B 2 183 ? 6.186   -16.218 -55.577 1.00 18.62 ? 183 SER H CA  1 
ATOM   2611 C C   . SER B 2 183 ? 6.439   -17.495 -54.768 1.00 17.96 ? 183 SER H C   1 
ATOM   2612 O O   . SER B 2 183 ? 7.515   -17.655 -54.168 1.00 17.55 ? 183 SER H O   1 
ATOM   2613 C CB  . SER B 2 183 ? 6.779   -16.318 -56.965 1.00 20.67 ? 183 SER H CB  1 
ATOM   2614 O OG  . SER B 2 183 ? 6.030   -17.207 -57.745 1.00 22.97 ? 183 SER H OG  1 
ATOM   2615 N N   . LEU B 2 184 ? 5.435   -18.335 -54.708 1.00 17.60 ? 184 LEU H N   1 
ATOM   2616 C CA  . LEU B 2 184 ? 5.655   -19.674 -54.156 1.00 18.16 ? 184 LEU H CA  1 
ATOM   2617 C C   . LEU B 2 184 ? 4.754   -20.679 -54.846 1.00 18.07 ? 184 LEU H C   1 
ATOM   2618 O O   . LEU B 2 184 ? 3.830   -20.287 -55.549 1.00 17.56 ? 184 LEU H O   1 
ATOM   2619 C CB  . LEU B 2 184 ? 5.426   -19.682 -52.651 1.00 18.84 ? 184 LEU H CB  1 
ATOM   2620 C CG  . LEU B 2 184 ? 4.009   -19.549 -52.077 1.00 17.84 ? 184 LEU H CG  1 
ATOM   2621 C CD1 . LEU B 2 184 ? 3.128   -20.796 -52.230 1.00 19.08 ? 184 LEU H CD1 1 
ATOM   2622 C CD2 . LEU B 2 184 ? 4.166   -19.235 -50.613 1.00 18.31 ? 184 LEU H CD2 1 
ATOM   2623 N N   . SER B 2 185 ? 5.113   -21.940 -54.688 1.00 17.83 ? 185 SER H N   1 
ATOM   2624 C CA  . SER B 2 185 ? 4.279   -23.075 -55.131 1.00 18.54 ? 185 SER H CA  1 
ATOM   2625 C C   . SER B 2 185 ? 3.815   -23.871 -53.917 1.00 17.48 ? 185 SER H C   1 
ATOM   2626 O O   . SER B 2 185 ? 4.548   -23.953 -52.936 1.00 16.35 ? 185 SER H O   1 
ATOM   2627 C CB  . SER B 2 185 ? 5.024   -23.939 -56.061 1.00 20.78 ? 185 SER H CB  1 
ATOM   2628 O OG  . SER B 2 185 ? 5.007   -23.408 -57.396 1.00 24.18 ? 185 SER H OG  1 
ATOM   2629 N N   . SER B 2 186 ? 2.642   -24.447 -54.031 1.00 17.49 ? 186 SER H N   1 
ATOM   2630 C CA  . SER B 2 186 ? 2.143   -25.459 -53.077 1.00 17.97 ? 186 SER H CA  1 
ATOM   2631 C C   . SER B 2 186 ? 1.848   -26.713 -53.880 1.00 18.79 ? 186 SER H C   1 
ATOM   2632 O O   . SER B 2 186 ? 1.132   -26.592 -54.892 1.00 20.03 ? 186 SER H O   1 
ATOM   2633 C CB  . SER B 2 186 ? 0.924   -24.983 -52.322 1.00 17.55 ? 186 SER H CB  1 
ATOM   2634 O OG  . SER B 2 186 ? 0.510   -26.016 -51.444 1.00 18.00 ? 186 SER H OG  1 
ATOM   2635 N N   . VAL B 2 187 ? 2.412   -27.844 -53.468 1.00 19.48 ? 187 VAL H N   1 
ATOM   2636 C CA  . VAL B 2 187 ? 2.233   -29.118 -54.217 1.00 20.91 ? 187 VAL H CA  1 
ATOM   2637 C C   . VAL B 2 187 ? 1.660   -30.167 -53.288 1.00 22.51 ? 187 VAL H C   1 
ATOM   2638 O O   . VAL B 2 187 ? 1.798   -30.045 -52.067 1.00 22.14 ? 187 VAL H O   1 
ATOM   2639 C CB  . VAL B 2 187 ? 3.547   -29.616 -54.841 1.00 21.41 ? 187 VAL H CB  1 
ATOM   2640 C CG1 . VAL B 2 187 ? 4.108   -28.586 -55.827 1.00 20.49 ? 187 VAL H CG1 1 
ATOM   2641 C CG2 . VAL B 2 187 ? 4.557   -30.024 -53.782 1.00 21.36 ? 187 VAL H CG2 1 
ATOM   2642 N N   . VAL B 2 188 ? 1.103   -31.201 -53.909 1.00 25.15 ? 188 VAL H N   1 
ATOM   2643 C CA  . VAL B 2 188 ? 0.628   -32.354 -53.130 1.00 27.18 ? 188 VAL H CA  1 
ATOM   2644 C C   . VAL B 2 188 ? 0.781   -33.570 -54.026 1.00 28.65 ? 188 VAL H C   1 
ATOM   2645 O O   . VAL B 2 188 ? 0.522   -33.463 -55.233 1.00 27.94 ? 188 VAL H O   1 
ATOM   2646 C CB  . VAL B 2 188 ? -0.805  -32.165 -52.609 1.00 28.45 ? 188 VAL H CB  1 
ATOM   2647 C CG1 . VAL B 2 188 ? -1.793  -32.058 -53.754 1.00 29.63 ? 188 VAL H CG1 1 
ATOM   2648 C CG2 . VAL B 2 188 ? -1.200  -33.278 -51.643 1.00 30.30 ? 188 VAL H CG2 1 
ATOM   2649 N N   . THR B 2 189 ? 1.223   -34.657 -53.402 1.00 30.83 ? 189 THR H N   1 
ATOM   2650 C CA  . THR B 2 189 ? 1.348   -35.980 -54.064 1.00 34.05 ? 189 THR H CA  1 
ATOM   2651 C C   . THR B 2 189 ? 0.116   -36.794 -53.662 1.00 36.62 ? 189 THR H C   1 
ATOM   2652 O O   . THR B 2 189 ? -0.186  -36.802 -52.446 1.00 35.95 ? 189 THR H O   1 
ATOM   2653 C CB  . THR B 2 189 ? 2.665   -36.684 -53.712 1.00 34.66 ? 189 THR H CB  1 
ATOM   2654 O OG1 . THR B 2 189 ? 2.746   -36.847 -52.296 1.00 34.28 ? 189 THR H OG1 1 
ATOM   2655 C CG2 . THR B 2 189 ? 3.852   -35.892 -54.220 1.00 33.26 ? 189 THR H CG2 1 
ATOM   2656 N N   . VAL B 2 190 ? -0.600  -37.275 -54.679 1.00 40.09 ? 190 VAL H N   1 
ATOM   2657 C CA  . VAL B 2 190 ? -1.880  -38.038 -54.552 1.00 43.28 ? 190 VAL H CA  1 
ATOM   2658 C C   . VAL B 2 190 ? -1.732  -39.364 -55.306 1.00 46.76 ? 190 VAL H C   1 
ATOM   2659 O O   . VAL B 2 190 ? -0.877  -39.494 -56.199 1.00 46.81 ? 190 VAL H O   1 
ATOM   2660 C CB  . VAL B 2 190 ? -3.081  -37.210 -55.051 1.00 42.59 ? 190 VAL H CB  1 
ATOM   2661 C CG1 . VAL B 2 190 ? -3.231  -35.912 -54.253 1.00 40.21 ? 190 VAL H CG1 1 
ATOM   2662 C CG2 . VAL B 2 190 ? -3.040  -36.932 -56.548 1.00 42.34 ? 190 VAL H CG2 1 
ATOM   2663 N N   . PRO B 2 191 ? -2.563  -40.382 -54.981 1.00 51.37 ? 191 PRO H N   1 
ATOM   2664 C CA  . PRO B 2 191 ? -2.637  -41.596 -55.801 1.00 54.60 ? 191 PRO H CA  1 
ATOM   2665 C C   . PRO B 2 191 ? -2.947  -41.269 -57.269 1.00 56.66 ? 191 PRO H C   1 
ATOM   2666 O O   . PRO B 2 191 ? -3.865  -40.531 -57.579 1.00 59.30 ? 191 PRO H O   1 
ATOM   2667 C CB  . PRO B 2 191 ? -3.766  -42.451 -55.193 1.00 56.61 ? 191 PRO H CB  1 
ATOM   2668 C CG  . PRO B 2 191 ? -4.415  -41.578 -54.118 1.00 55.65 ? 191 PRO H CG  1 
ATOM   2669 C CD  . PRO B 2 191 ? -3.463  -40.431 -53.813 1.00 52.14 ? 191 PRO H CD  1 
ATOM   2670 N N   . SER B 2 192 ? -2.128  -41.785 -58.177 1.00 59.35 ? 192 SER H N   1 
ATOM   2671 C CA  . SER B 2 192 ? -2.370  -41.624 -59.628 1.00 60.96 ? 192 SER H CA  1 
ATOM   2672 C C   . SER B 2 192 ? -3.851  -41.952 -59.923 1.00 62.37 ? 192 SER H C   1 
ATOM   2673 O O   . SER B 2 192 ? -4.500  -41.240 -60.784 1.00 60.99 ? 192 SER H O   1 
ATOM   2674 C CB  . SER B 2 192 ? -1.429  -42.515 -60.407 1.00 64.58 ? 192 SER H CB  1 
ATOM   2675 O OG  . SER B 2 192 ? -0.426  -41.718 -61.028 1.00 65.55 ? 192 SER H OG  1 
ATOM   2676 N N   . SER B 2 193 ? -4.345  -43.010 -59.230 1.00 64.89 ? 193 SER H N   1 
ATOM   2677 C CA  . SER B 2 193 ? -5.669  -43.654 -59.480 1.00 68.02 ? 193 SER H CA  1 
ATOM   2678 C C   . SER B 2 193 ? -6.749  -42.592 -59.283 1.00 69.53 ? 193 SER H C   1 
ATOM   2679 O O   . SER B 2 193 ? -7.549  -42.371 -60.218 1.00 70.70 ? 193 SER H O   1 
ATOM   2680 C CB  . SER B 2 193 ? -5.914  -44.895 -58.633 1.00 67.78 ? 193 SER H CB  1 
ATOM   2681 O OG  . SER B 2 193 ? -5.808  -44.699 -57.234 1.00 65.02 ? 193 SER H OG  1 
ATOM   2682 N N   . SER B 2 194 ? -6.656  -41.866 -58.172 1.00 70.94 ? 194 SER H N   1 
ATOM   2683 C CA  . SER B 2 194 ? -7.646  -40.845 -57.749 1.00 70.30 ? 194 SER H CA  1 
ATOM   2684 C C   . SER B 2 194 ? -7.456  -39.539 -58.522 1.00 66.86 ? 194 SER H C   1 
ATOM   2685 O O   . SER B 2 194 ? -7.430  -38.525 -57.858 1.00 65.89 ? 194 SER H O   1 
ATOM   2686 C CB  . SER B 2 194 ? -7.544  -40.604 -56.272 1.00 71.27 ? 194 SER H CB  1 
ATOM   2687 O OG  . SER B 2 194 ? -6.508  -39.675 -55.973 1.00 72.05 ? 194 SER H OG  1 
ATOM   2688 N N   . LEU B 2 195 ? -7.353  -39.548 -59.858 1.00 66.46 ? 195 LEU H N   1 
ATOM   2689 C CA  . LEU B 2 195 ? -7.262  -38.294 -60.651 1.00 63.53 ? 195 LEU H CA  1 
ATOM   2690 C C   . LEU B 2 195 ? -8.570  -38.049 -61.409 1.00 67.12 ? 195 LEU H C   1 
ATOM   2691 O O   . LEU B 2 195 ? -9.268  -37.132 -61.026 1.00 67.38 ? 195 LEU H O   1 
ATOM   2692 C CB  . LEU B 2 195 ? -6.022  -38.320 -61.546 1.00 63.34 ? 195 LEU H CB  1 
ATOM   2693 C CG  . LEU B 2 195 ? -4.772  -37.704 -60.907 1.00 61.16 ? 195 LEU H CG  1 
ATOM   2694 C CD1 . LEU B 2 195 ? -3.485  -38.210 -61.547 1.00 60.00 ? 195 LEU H CD1 1 
ATOM   2695 C CD2 . LEU B 2 195 ? -4.821  -36.175 -60.962 1.00 58.78 ? 195 LEU H CD2 1 
ATOM   2696 N N   . GLY B 2 196 ? -8.940  -38.856 -62.406 1.00 73.34 ? 196 GLY H N   1 
ATOM   2697 C CA  . GLY B 2 196 ? -10.281 -38.799 -63.040 1.00 77.11 ? 196 GLY H CA  1 
ATOM   2698 C C   . GLY B 2 196 ? -11.421 -38.648 -62.025 1.00 78.53 ? 196 GLY H C   1 
ATOM   2699 O O   . GLY B 2 196 ? -12.376 -37.907 -62.325 1.00 80.04 ? 196 GLY H O   1 
ATOM   2700 N N   . THR B 2 197 ? -11.311 -39.331 -60.875 1.00 77.31 ? 197 THR H N   1 
ATOM   2701 C CA  . THR B 2 197 ? -12.217 -39.316 -59.688 1.00 75.79 ? 197 THR H CA  1 
ATOM   2702 C C   . THR B 2 197 ? -12.253 -37.936 -58.995 1.00 73.85 ? 197 THR H C   1 
ATOM   2703 O O   . THR B 2 197 ? -13.284 -37.219 -59.120 1.00 71.09 ? 197 THR H O   1 
ATOM   2704 C CB  . THR B 2 197 ? -11.746 -40.377 -58.682 1.00 75.10 ? 197 THR H CB  1 
ATOM   2705 O OG1 . THR B 2 197 ? -12.027 -41.613 -59.331 1.00 78.79 ? 197 THR H OG1 1 
ATOM   2706 C CG2 . THR B 2 197 ? -12.406 -40.326 -57.321 1.00 75.66 ? 197 THR H CG2 1 
ATOM   2707 N N   . GLN B 2 198 ? -11.189 -37.591 -58.255 1.00 69.07 ? 198 GLN H N   1 
ATOM   2708 C CA  . GLN B 2 198 ? -11.298 -36.633 -57.125 1.00 66.13 ? 198 GLN H CA  1 
ATOM   2709 C C   . GLN B 2 198 ? -10.868 -35.233 -57.531 1.00 59.47 ? 198 GLN H C   1 
ATOM   2710 O O   . GLN B 2 198 ? -9.871  -35.087 -58.264 1.00 56.98 ? 198 GLN H O   1 
ATOM   2711 C CB  . GLN B 2 198 ? -10.529 -37.071 -55.889 1.00 66.33 ? 198 GLN H CB  1 
ATOM   2712 C CG  . GLN B 2 198 ? -11.396 -36.907 -54.657 1.00 69.11 ? 198 GLN H CG  1 
ATOM   2713 C CD  . GLN B 2 198 ? -10.588 -36.296 -53.548 1.00 70.12 ? 198 GLN H CD  1 
ATOM   2714 O OE1 . GLN B 2 198 ? -9.433  -36.665 -53.356 1.00 74.80 ? 198 GLN H OE1 1 
ATOM   2715 N NE2 . GLN B 2 198 ? -11.170 -35.341 -52.834 1.00 67.14 ? 198 GLN H NE2 1 
ATOM   2716 N N   . THR B 2 199 ? -11.649 -34.264 -57.042 1.00 56.02 ? 199 THR H N   1 
ATOM   2717 C CA  . THR B 2 199 ? -11.467 -32.813 -57.288 1.00 52.37 ? 199 THR H CA  1 
ATOM   2718 C C   . THR B 2 199 ? -10.327 -32.337 -56.377 1.00 46.53 ? 199 THR H C   1 
ATOM   2719 O O   . THR B 2 199 ? -10.292 -32.662 -55.161 1.00 45.46 ? 199 THR H O   1 
ATOM   2720 C CB  . THR B 2 199 ? -12.806 -32.069 -57.145 1.00 53.10 ? 199 THR H CB  1 
ATOM   2721 O OG1 . THR B 2 199 ? -13.589 -32.450 -58.276 1.00 56.92 ? 199 THR H OG1 1 
ATOM   2722 C CG2 . THR B 2 199 ? -12.693 -30.560 -57.127 1.00 51.50 ? 199 THR H CG2 1 
ATOM   2723 N N   . TYR B 2 200 ? -9.386  -31.614 -56.958 1.00 44.20 ? 200 TYR H N   1 
ATOM   2724 C CA  . TYR B 2 200 ? -8.282  -30.968 -56.213 1.00 40.21 ? 200 TYR H CA  1 
ATOM   2725 C C   . TYR B 2 200 ? -8.414  -29.459 -56.434 1.00 37.14 ? 200 TYR H C   1 
ATOM   2726 O O   . TYR B 2 200 ? -8.386  -29.002 -57.594 1.00 36.88 ? 200 TYR H O   1 
ATOM   2727 C CB  . TYR B 2 200 ? -6.966  -31.640 -56.632 1.00 39.68 ? 200 TYR H CB  1 
ATOM   2728 C CG  . TYR B 2 200 ? -6.828  -33.077 -56.175 1.00 40.66 ? 200 TYR H CG  1 
ATOM   2729 C CD1 . TYR B 2 200 ? -6.641  -33.384 -54.840 1.00 41.03 ? 200 TYR H CD1 1 
ATOM   2730 C CD2 . TYR B 2 200 ? -6.842  -34.134 -57.076 1.00 43.13 ? 200 TYR H CD2 1 
ATOM   2731 C CE1 . TYR B 2 200 ? -6.524  -34.697 -54.399 1.00 43.02 ? 200 TYR H CE1 1 
ATOM   2732 C CE2 . TYR B 2 200 ? -6.702  -35.453 -56.654 1.00 44.29 ? 200 TYR H CE2 1 
ATOM   2733 C CZ  . TYR B 2 200 ? -6.528  -35.742 -55.310 1.00 44.85 ? 200 TYR H CZ  1 
ATOM   2734 O OH  . TYR B 2 200 ? -6.410  -37.052 -54.860 1.00 47.64 ? 200 TYR H OH  1 
ATOM   2735 N N   . ILE B 2 201 ? -8.604  -28.749 -55.326 1.00 36.21 ? 201 ILE H N   1 
ATOM   2736 C CA  . ILE B 2 201 ? -8.775  -27.272 -55.276 1.00 35.04 ? 201 ILE H CA  1 
ATOM   2737 C C   . ILE B 2 201 ? -7.752  -26.717 -54.293 1.00 30.21 ? 201 ILE H C   1 
ATOM   2738 O O   . ILE B 2 201 ? -7.683  -27.157 -53.103 1.00 29.18 ? 201 ILE H O   1 
ATOM   2739 C CB  . ILE B 2 201 ? -10.214 -26.879 -54.866 1.00 38.10 ? 201 ILE H CB  1 
ATOM   2740 C CG1 . ILE B 2 201 ? -11.253 -27.412 -55.859 1.00 41.58 ? 201 ILE H CG1 1 
ATOM   2741 C CG2 . ILE B 2 201 ? -10.293 -25.368 -54.688 1.00 38.06 ? 201 ILE H CG2 1 
ATOM   2742 C CD1 . ILE B 2 201 ? -12.699 -26.989 -55.577 1.00 43.09 ? 201 ILE H CD1 1 
ATOM   2743 N N   . CYS B 2 202 ? -6.950  -25.756 -54.723 1.00 27.61 ? 202 CYS H N   1 
ATOM   2744 C CA  . CYS B 2 202 ? -6.076  -25.061 -53.742 1.00 25.59 ? 202 CYS H CA  1 
ATOM   2745 C C   . CYS B 2 202 ? -6.773  -23.760 -53.284 1.00 24.50 ? 202 CYS H C   1 
ATOM   2746 O O   . CYS B 2 202 ? -7.312  -23.068 -54.166 1.00 24.96 ? 202 CYS H O   1 
ATOM   2747 C CB  . CYS B 2 202 ? -4.683  -24.768 -54.282 1.00 24.74 ? 202 CYS H CB  1 
ATOM   2748 S SG  . CYS B 2 202 ? -4.657  -23.595 -55.651 1.00 24.81 ? 202 CYS H SG  1 
ATOM   2749 N N   . ASN B 2 203 ? -6.819  -23.558 -51.978 1.00 23.81 ? 203 ASN H N   1 
ATOM   2750 C CA  . ASN B 2 203 ? -7.511  -22.413 -51.326 1.00 23.48 ? 203 ASN H CA  1 
ATOM   2751 C C   . ASN B 2 203 ? -6.424  -21.419 -50.973 1.00 20.49 ? 203 ASN H C   1 
ATOM   2752 O O   . ASN B 2 203 ? -5.692  -21.680 -50.033 1.00 21.17 ? 203 ASN H O   1 
ATOM   2753 C CB  . ASN B 2 203 ? -8.331  -22.837 -50.114 1.00 24.95 ? 203 ASN H CB  1 
ATOM   2754 C CG  . ASN B 2 203 ? -9.025  -24.174 -50.332 1.00 27.01 ? 203 ASN H CG  1 
ATOM   2755 O OD1 . ASN B 2 203 ? -8.672  -25.140 -49.678 1.00 30.67 ? 203 ASN H OD1 1 
ATOM   2756 N ND2 . ASN B 2 203 ? -9.929  -24.235 -51.258 1.00 27.81 ? 203 ASN H ND2 1 
ATOM   2757 N N   . VAL B 2 204 ? -6.293  -20.362 -51.763 1.00 20.26 ? 204 VAL H N   1 
ATOM   2758 C CA  . VAL B 2 204 ? -5.236  -19.343 -51.560 1.00 19.01 ? 204 VAL H CA  1 
ATOM   2759 C C   . VAL B 2 204 ? -5.856  -18.103 -50.910 1.00 19.50 ? 204 VAL H C   1 
ATOM   2760 O O   . VAL B 2 204 ? -6.837  -17.578 -51.414 1.00 19.56 ? 204 VAL H O   1 
ATOM   2761 C CB  . VAL B 2 204 ? -4.511  -19.016 -52.874 1.00 19.39 ? 204 VAL H CB  1 
ATOM   2762 C CG1 . VAL B 2 204 ? -3.406  -17.957 -52.676 1.00 19.07 ? 204 VAL H CG1 1 
ATOM   2763 C CG2 . VAL B 2 204 ? -3.948  -20.297 -53.499 1.00 19.49 ? 204 VAL H CG2 1 
ATOM   2764 N N   . ASN B 2 205 ? -5.227  -17.600 -49.855 1.00 19.34 ? 205 ASN H N   1 
ATOM   2765 C CA  . ASN B 2 205 ? -5.658  -16.360 -49.178 1.00 20.82 ? 205 ASN H CA  1 
ATOM   2766 C C   . ASN B 2 205 ? -4.440  -15.446 -49.055 1.00 18.46 ? 205 ASN H C   1 
ATOM   2767 O O   . ASN B 2 205 ? -3.387  -15.866 -48.606 1.00 17.66 ? 205 ASN H O   1 
ATOM   2768 C CB  . ASN B 2 205 ? -6.348  -16.637 -47.840 1.00 25.54 ? 205 ASN H CB  1 
ATOM   2769 C CG  . ASN B 2 205 ? -7.189  -15.472 -47.351 1.00 31.43 ? 205 ASN H CG  1 
ATOM   2770 O OD1 . ASN B 2 205 ? -7.076  -14.335 -47.838 1.00 38.82 ? 205 ASN H OD1 1 
ATOM   2771 N ND2 . ASN B 2 205 ? -8.116  -15.748 -46.448 1.00 34.77 ? 205 ASN H ND2 1 
ATOM   2772 N N   . HIS B 2 206 ? -4.570  -14.222 -49.557 1.00 17.85 ? 206 HIS H N   1 
ATOM   2773 C CA  . HIS B 2 206 ? -3.567  -13.153 -49.345 1.00 16.92 ? 206 HIS H CA  1 
ATOM   2774 C C   . HIS B 2 206 ? -4.331  -12.028 -48.666 1.00 17.61 ? 206 HIS H C   1 
ATOM   2775 O O   . HIS B 2 206 ? -5.016  -11.228 -49.371 1.00 17.63 ? 206 HIS H O   1 
ATOM   2776 C CB  . HIS B 2 206 ? -2.929  -12.672 -50.658 1.00 16.58 ? 206 HIS H CB  1 
ATOM   2777 C CG  . HIS B 2 206 ? -1.893  -11.639 -50.458 1.00 15.96 ? 206 HIS H CG  1 
ATOM   2778 N ND1 . HIS B 2 206 ? -2.026  -10.346 -50.961 1.00 16.59 ? 206 HIS H ND1 1 
ATOM   2779 C CD2 . HIS B 2 206 ? -0.689  -11.705 -49.835 1.00 15.78 ? 206 HIS H CD2 1 
ATOM   2780 C CE1 . HIS B 2 206 ? -0.928  -9.666  -50.659 1.00 16.29 ? 206 HIS H CE1 1 
ATOM   2781 N NE2 . HIS B 2 206 ? -0.068  -10.479 -49.953 1.00 15.46 ? 206 HIS H NE2 1 
ATOM   2782 N N   . LYS B 2 207 ? -4.301  -12.002 -47.333 1.00 17.97 ? 207 LYS H N   1 
ATOM   2783 C CA  . LYS B 2 207 ? -5.157  -11.056 -46.576 1.00 20.50 ? 207 LYS H CA  1 
ATOM   2784 C C   . LYS B 2 207 ? -4.822  -9.601  -46.893 1.00 19.79 ? 207 LYS H C   1 
ATOM   2785 O O   . LYS B 2 207 ? -5.729  -8.815  -46.998 1.00 19.37 ? 207 LYS H O   1 
ATOM   2786 C CB  . LYS B 2 207 ? -5.102  -11.370 -45.080 1.00 23.22 ? 207 LYS H CB  1 
ATOM   2787 C CG  . LYS B 2 207 ? -5.716  -12.721 -44.723 1.00 30.55 ? 207 LYS H CG  1 
ATOM   2788 C CD  . LYS B 2 207 ? -5.928  -13.024 -43.206 1.00 34.27 ? 207 LYS H CD  1 
ATOM   2789 C CE  . LYS B 2 207 ? -6.827  -14.242 -43.091 1.00 39.69 ? 207 LYS H CE  1 
ATOM   2790 N NZ  . LYS B 2 207 ? -7.121  -14.616 -41.685 1.00 42.05 ? 207 LYS H NZ  1 
ATOM   2791 N N   . PRO B 2 208 ? -3.554  -9.172  -47.035 1.00 19.48 ? 208 PRO H N   1 
ATOM   2792 C CA  . PRO B 2 208 ? -3.262  -7.747  -47.270 1.00 20.59 ? 208 PRO H CA  1 
ATOM   2793 C C   . PRO B 2 208 ? -3.955  -7.136  -48.488 1.00 20.65 ? 208 PRO H C   1 
ATOM   2794 O O   . PRO B 2 208 ? -4.222  -5.931  -48.468 1.00 22.49 ? 208 PRO H O   1 
ATOM   2795 C CB  . PRO B 2 208 ? -1.748  -7.715  -47.374 1.00 19.59 ? 208 PRO H CB  1 
ATOM   2796 C CG  . PRO B 2 208 ? -1.354  -8.882  -46.510 1.00 19.29 ? 208 PRO H CG  1 
ATOM   2797 C CD  . PRO B 2 208 ? -2.332  -9.985  -46.876 1.00 18.89 ? 208 PRO H CD  1 
ATOM   2798 N N   . SER B 2 209 ? -4.264  -7.936  -49.513 1.00 19.58 ? 209 SER H N   1 
ATOM   2799 C CA  . SER B 2 209 ? -4.897  -7.461  -50.768 1.00 20.88 ? 209 SER H CA  1 
ATOM   2800 C C   . SER B 2 209 ? -6.359  -7.923  -50.827 1.00 21.64 ? 209 SER H C   1 
ATOM   2801 O O   . SER B 2 209 ? -7.014  -7.691  -51.879 1.00 22.98 ? 209 SER H O   1 
ATOM   2802 C CB  . SER B 2 209 ? -4.146  -7.964  -51.955 1.00 20.58 ? 209 SER H CB  1 
ATOM   2803 O OG  . SER B 2 209 ? -4.269  -9.392  -52.062 1.00 19.45 ? 209 SER H OG  1 
ATOM   2804 N N   . ASN B 2 210 ? -6.843  -8.601  -49.779 1.00 22.07 ? 210 ASN H N   1 
ATOM   2805 C CA  A ASN B 2 210 ? -8.205  -9.209  -49.729 0.60 23.89 ? 210 ASN H CA  1 
ATOM   2806 C CA  B ASN B 2 210 ? -8.224  -9.157  -49.759 0.40 23.22 ? 210 ASN H CA  1 
ATOM   2807 C C   . ASN B 2 210 ? -8.383  -10.112 -50.947 1.00 23.36 ? 210 ASN H C   1 
ATOM   2808 O O   . ASN B 2 210 ? -9.423  -10.073 -51.585 1.00 24.09 ? 210 ASN H O   1 
ATOM   2809 C CB  A ASN B 2 210 ? -9.266  -8.129  -49.556 0.60 26.64 ? 210 ASN H CB  1 
ATOM   2810 C CB  B ASN B 2 210 ? -9.281  -8.050  -49.798 0.40 25.01 ? 210 ASN H CB  1 
ATOM   2811 C CG  A ASN B 2 210 ? -9.146  -7.537  -48.173 0.60 27.60 ? 210 ASN H CG  1 
ATOM   2812 C CG  B ASN B 2 210 ? -10.641 -8.557  -49.371 0.40 26.39 ? 210 ASN H CG  1 
ATOM   2813 O OD1 A ASN B 2 210 ? -8.531  -6.498  -47.995 0.60 32.24 ? 210 ASN H OD1 1 
ATOM   2814 O OD1 B ASN B 2 210 ? -10.746 -9.340  -48.429 0.40 26.63 ? 210 ASN H OD1 1 
ATOM   2815 N ND2 A ASN B 2 210 ? -9.656  -8.227  -47.176 0.60 28.61 ? 210 ASN H ND2 1 
ATOM   2816 N ND2 B ASN B 2 210 ? -11.673 -8.127  -50.064 0.40 27.76 ? 210 ASN H ND2 1 
ATOM   2817 N N   . THR B 2 211 ? -7.339  -10.881 -51.245 1.00 23.08 ? 211 THR H N   1 
ATOM   2818 C CA  . THR B 2 211 ? -7.348  -11.846 -52.355 1.00 23.16 ? 211 THR H CA  1 
ATOM   2819 C C   . THR B 2 211 ? -7.651  -13.235 -51.802 1.00 23.72 ? 211 THR H C   1 
ATOM   2820 O O   . THR B 2 211 ? -6.848  -13.740 -50.980 1.00 22.87 ? 211 THR H O   1 
ATOM   2821 C CB  . THR B 2 211 ? -6.053  -11.815 -53.168 1.00 23.30 ? 211 THR H CB  1 
ATOM   2822 O OG1 . THR B 2 211 ? -5.925  -10.486 -53.648 1.00 22.88 ? 211 THR H OG1 1 
ATOM   2823 C CG2 . THR B 2 211 ? -6.100  -12.779 -54.323 1.00 24.43 ? 211 THR H CG2 1 
ATOM   2824 N N   . LYS B 2 212 ? -8.717  -13.854 -52.303 1.00 23.57 ? 212 LYS H N   1 
ATOM   2825 C CA  . LYS B 2 212 ? -9.066  -15.262 -52.006 1.00 24.51 ? 212 LYS H CA  1 
ATOM   2826 C C   . LYS B 2 212 ? -9.347  -15.950 -53.338 1.00 23.86 ? 212 LYS H C   1 
ATOM   2827 O O   . LYS B 2 212 ? -10.207 -15.446 -54.045 1.00 22.87 ? 212 LYS H O   1 
ATOM   2828 C CB  . LYS B 2 212 ? -10.330 -15.339 -51.161 1.00 28.00 ? 212 LYS H CB  1 
ATOM   2829 C CG  . LYS B 2 212 ? -10.111 -15.601 -49.689 1.00 33.21 ? 212 LYS H CG  1 
ATOM   2830 C CD  . LYS B 2 212 ? -11.380 -15.671 -48.895 1.00 36.87 ? 212 LYS H CD  1 
ATOM   2831 C CE  . LYS B 2 212 ? -11.841 -14.279 -48.514 1.00 42.79 ? 212 LYS H CE  1 
ATOM   2832 N NZ  . LYS B 2 212 ? -13.321 -14.184 -48.368 1.00 47.63 ? 212 LYS H NZ  1 
ATOM   2833 N N   . VAL B 2 213 ? -8.655  -17.029 -53.610 1.00 23.03 ? 213 VAL H N   1 
ATOM   2834 C CA  . VAL B 2 213 ? -8.761  -17.823 -54.863 1.00 25.95 ? 213 VAL H CA  1 
ATOM   2835 C C   . VAL B 2 213 ? -8.922  -19.286 -54.480 1.00 27.96 ? 213 VAL H C   1 
ATOM   2836 O O   . VAL B 2 213 ? -8.112  -19.799 -53.724 1.00 25.51 ? 213 VAL H O   1 
ATOM   2837 C CB  . VAL B 2 213 ? -7.534  -17.618 -55.758 1.00 26.25 ? 213 VAL H CB  1 
ATOM   2838 C CG1 . VAL B 2 213 ? -7.741  -18.341 -57.103 1.00 27.56 ? 213 VAL H CG1 1 
ATOM   2839 C CG2 . VAL B 2 213 ? -7.236  -16.155 -55.942 1.00 26.01 ? 213 VAL H CG2 1 
ATOM   2840 N N   . ASP B 2 214 ? -9.952  -19.948 -54.992 1.00 31.12 ? 214 ASP H N   1 
ATOM   2841 C CA  . ASP B 2 214 ? -10.155 -21.377 -54.645 1.00 33.78 ? 214 ASP H CA  1 
ATOM   2842 C C   . ASP B 2 214 ? -9.998  -22.084 -55.971 1.00 35.21 ? 214 ASP H C   1 
ATOM   2843 O O   . ASP B 2 214 ? -11.025 -22.261 -56.600 1.00 35.67 ? 214 ASP H O   1 
ATOM   2844 C CB  . ASP B 2 214 ? -11.509 -21.694 -53.994 1.00 35.05 ? 214 ASP H CB  1 
ATOM   2845 C CG  . ASP B 2 214 ? -11.634 -21.406 -52.512 1.00 36.95 ? 214 ASP H CG  1 
ATOM   2846 O OD1 . ASP B 2 214 ? -10.639 -21.545 -51.766 1.00 37.66 ? 214 ASP H OD1 1 
ATOM   2847 O OD2 . ASP B 2 214 ? -12.746 -21.023 -52.078 1.00 40.58 ? 214 ASP H OD2 1 
ATOM   2848 N N   . LYS B 2 215 ? -8.766  -22.448 -56.383 1.00 35.04 ? 215 LYS H N   1 
ATOM   2849 C CA  . LYS B 2 215 ? -8.433  -22.791 -57.782 1.00 34.75 ? 215 LYS H CA  1 
ATOM   2850 C C   . LYS B 2 215 ? -8.398  -24.321 -58.058 1.00 35.18 ? 215 LYS H C   1 
ATOM   2851 O O   . LYS B 2 215 ? -7.780  -25.099 -57.276 1.00 32.98 ? 215 LYS H O   1 
ATOM   2852 C CB  . LYS B 2 215 ? -7.098  -22.220 -58.227 1.00 36.07 ? 215 LYS H CB  1 
ATOM   2853 C CG  . LYS B 2 215 ? -6.536  -22.985 -59.400 1.00 38.25 ? 215 LYS H CG  1 
ATOM   2854 C CD  . LYS B 2 215 ? -6.147  -22.153 -60.570 1.00 40.19 ? 215 LYS H CD  1 
ATOM   2855 C CE  . LYS B 2 215 ? -7.093  -22.196 -61.730 1.00 42.07 ? 215 LYS H CE  1 
ATOM   2856 N NZ  . LYS B 2 215 ? -7.247  -20.829 -62.267 1.00 45.11 ? 215 LYS H NZ  1 
ATOM   2857 N N   . LYS B 2 216 ? -9.122  -24.740 -59.108 1.00 36.05 ? 216 LYS H N   1 
ATOM   2858 C CA  . LYS B 2 216 ? -9.316  -26.170 -59.453 1.00 37.02 ? 216 LYS H CA  1 
ATOM   2859 C C   . LYS B 2 216 ? -8.194  -26.592 -60.407 1.00 35.21 ? 216 LYS H C   1 
ATOM   2860 O O   . LYS B 2 216 ? -8.030  -25.984 -61.485 1.00 37.80 ? 216 LYS H O   1 
ATOM   2861 C CB  . LYS B 2 216 ? -10.671 -26.459 -60.122 1.00 39.26 ? 216 LYS H CB  1 
ATOM   2862 C CG  . LYS B 2 216 ? -10.996 -27.939 -60.266 1.00 40.59 ? 216 LYS H CG  1 
ATOM   2863 C CD  . LYS B 2 216 ? -12.358 -28.146 -60.920 1.00 42.81 ? 216 LYS H CD  1 
ATOM   2864 C CE  . LYS B 2 216 ? -12.631 -29.573 -61.344 1.00 45.29 ? 216 LYS H CE  1 
ATOM   2865 N NZ  . LYS B 2 216 ? -13.949 -29.647 -61.997 1.00 47.10 ? 216 LYS H NZ  1 
ATOM   2866 N N   . VAL B 2 217 ? -7.488  -27.637 -60.007 1.00 35.07 ? 217 VAL H N   1 
ATOM   2867 C CA  . VAL B 2 217 ? -6.288  -28.171 -60.697 1.00 34.94 ? 217 VAL H CA  1 
ATOM   2868 C C   . VAL B 2 217 ? -6.700  -29.489 -61.330 1.00 38.69 ? 217 VAL H C   1 
ATOM   2869 O O   . VAL B 2 217 ? -7.044  -30.409 -60.566 1.00 38.94 ? 217 VAL H O   1 
ATOM   2870 C CB  . VAL B 2 217 ? -5.136  -28.392 -59.705 1.00 32.88 ? 217 VAL H CB  1 
ATOM   2871 C CG1 . VAL B 2 217 ? -3.898  -28.959 -60.384 1.00 32.64 ? 217 VAL H CG1 1 
ATOM   2872 C CG2 . VAL B 2 217 ? -4.812  -27.089 -59.009 1.00 31.67 ? 217 VAL H CG2 1 
ATOM   2873 N N   . GLU B 2 218 ? -6.697  -29.546 -62.631 1.00 42.90 ? 218 GLU H N   1 
ATOM   2874 C CA  . GLU B 2 218 ? -7.082  -30.814 -63.308 1.00 51.20 ? 218 GLU H CA  1 
ATOM   2875 C C   . GLU B 2 218 ? -6.067  -31.149 -64.396 1.00 51.88 ? 218 GLU H C   1 
ATOM   2876 O O   . GLU B 2 218 ? -5.440  -30.265 -64.982 1.00 49.74 ? 218 GLU H O   1 
ATOM   2877 C CB  . GLU B 2 218 ? -8.522  -30.741 -63.826 1.00 57.07 ? 218 GLU H CB  1 
ATOM   2878 C CG  . GLU B 2 218 ? -8.782  -29.635 -64.843 1.00 61.16 ? 218 GLU H CG  1 
ATOM   2879 C CD  . GLU B 2 218 ? -10.245 -29.195 -64.910 1.00 65.32 ? 218 GLU H CD  1 
ATOM   2880 O OE1 . GLU B 2 218 ? -11.126 -29.939 -64.415 1.00 65.74 ? 218 GLU H OE1 1 
ATOM   2881 O OE2 . GLU B 2 218 ? -10.497 -28.090 -65.431 1.00 68.25 ? 218 GLU H OE2 1 
ATOM   2882 N N   . PRO B 2 219 ? -5.949  -32.454 -64.737 1.00 57.40 ? 219 PRO H N   1 
ATOM   2883 C CA  . PRO B 2 219 ? -5.103  -32.899 -65.852 1.00 56.70 ? 219 PRO H CA  1 
ATOM   2884 C C   . PRO B 2 219 ? -5.284  -32.105 -67.156 1.00 58.16 ? 219 PRO H C   1 
ATOM   2885 O O   . PRO B 2 219 ? -4.300  -31.914 -67.898 1.00 59.68 ? 219 PRO H O   1 
ATOM   2886 C CB  . PRO B 2 219 ? -5.581  -34.338 -66.049 1.00 60.26 ? 219 PRO H CB  1 
ATOM   2887 C CG  . PRO B 2 219 ? -6.026  -34.791 -64.672 1.00 59.95 ? 219 PRO H CG  1 
ATOM   2888 C CD  . PRO B 2 219 ? -6.645  -33.559 -64.052 1.00 58.78 ? 219 PRO H CD  1 
ATOM   2889 N N   . ASP C 3 1   ? 20.224  -5.024  -18.355 1.00 33.72 ? 1   ASP L N   1 
ATOM   2890 C CA  . ASP C 3 1   ? 19.328  -6.164  -18.845 1.00 31.60 ? 1   ASP L CA  1 
ATOM   2891 C C   . ASP C 3 1   ? 20.122  -7.463  -18.926 1.00 30.04 ? 1   ASP L C   1 
ATOM   2892 O O   . ASP C 3 1   ? 21.300  -7.412  -19.254 1.00 30.47 ? 1   ASP L O   1 
ATOM   2893 C CB  . ASP C 3 1   ? 18.699  -5.962  -20.219 1.00 31.94 ? 1   ASP L CB  1 
ATOM   2894 C CG  . ASP C 3 1   ? 17.668  -4.834  -20.253 1.00 31.67 ? 1   ASP L CG  1 
ATOM   2895 O OD1 . ASP C 3 1   ? 17.512  -4.115  -19.213 1.00 32.15 ? 1   ASP L OD1 1 
ATOM   2896 O OD2 . ASP C 3 1   ? 17.093  -4.667  -21.295 1.00 31.14 ? 1   ASP L OD2 1 
ATOM   2897 N N   . ILE C 3 2   ? 19.492  -8.575  -18.569 1.00 26.25 ? 2   ILE L N   1 
ATOM   2898 C CA  . ILE C 3 2   ? 20.173  -9.883  -18.504 1.00 24.40 ? 2   ILE L CA  1 
ATOM   2899 C C   . ILE C 3 2   ? 20.292  -10.446 -19.900 1.00 23.47 ? 2   ILE L C   1 
ATOM   2900 O O   . ILE C 3 2   ? 19.287  -10.504 -20.664 1.00 21.87 ? 2   ILE L O   1 
ATOM   2901 C CB  . ILE C 3 2   ? 19.476  -10.831 -17.512 1.00 23.04 ? 2   ILE L CB  1 
ATOM   2902 C CG1 . ILE C 3 2   ? 19.359  -10.138 -16.153 1.00 23.33 ? 2   ILE L CG1 1 
ATOM   2903 C CG2 . ILE C 3 2   ? 20.215  -12.186 -17.468 1.00 23.05 ? 2   ILE L CG2 1 
ATOM   2904 C CD1 . ILE C 3 2   ? 18.671  -10.938 -15.100 1.00 23.77 ? 2   ILE L CD1 1 
ATOM   2905 N N   . VAL C 3 3   ? 21.508  -10.913 -20.211 1.00 23.47 ? 3   VAL L N   1 
ATOM   2906 C CA  . VAL C 3 3   ? 21.805  -11.548 -21.500 1.00 23.55 ? 3   VAL L CA  1 
ATOM   2907 C C   . VAL C 3 3   ? 21.893  -13.065 -21.372 1.00 23.13 ? 3   VAL L C   1 
ATOM   2908 O O   . VAL C 3 3   ? 22.655  -13.564 -20.520 1.00 23.54 ? 3   VAL L O   1 
ATOM   2909 C CB  . VAL C 3 3   ? 23.102  -11.003 -22.096 1.00 25.52 ? 3   VAL L CB  1 
ATOM   2910 C CG1 . VAL C 3 3   ? 23.367  -11.675 -23.418 1.00 25.13 ? 3   VAL L CG1 1 
ATOM   2911 C CG2 . VAL C 3 3   ? 23.040  -9.476  -22.151 1.00 26.78 ? 3   VAL L CG2 1 
ATOM   2912 N N   . MET C 3 4   ? 21.126  -13.734 -22.246 1.00 22.75 ? 4   MET L N   1 
ATOM   2913 C CA  . MET C 3 4   ? 21.047  -15.211 -22.314 1.00 22.25 ? 4   MET L CA  1 
ATOM   2914 C C   . MET C 3 4   ? 21.866  -15.691 -23.497 1.00 22.03 ? 4   MET L C   1 
ATOM   2915 O O   . MET C 3 4   ? 21.485  -15.398 -24.609 1.00 21.36 ? 4   MET L O   1 
ATOM   2916 C CB  . MET C 3 4   ? 19.601  -15.694 -22.436 1.00 21.22 ? 4   MET L CB  1 
ATOM   2917 C CG  . MET C 3 4   ? 18.728  -15.271 -21.241 1.00 21.35 ? 4   MET L CG  1 
ATOM   2918 S SD  . MET C 3 4   ? 19.376  -15.637 -19.573 1.00 22.31 ? 4   MET L SD  1 
ATOM   2919 C CE  . MET C 3 4   ? 19.598  -17.408 -19.630 1.00 22.93 ? 4   MET L CE  1 
ATOM   2920 N N   . THR C 3 5   ? 22.965  -16.406 -23.255 1.00 23.45 ? 5   THR L N   1 
ATOM   2921 C CA  . THR C 3 5   ? 23.826  -16.961 -24.328 1.00 24.08 ? 5   THR L CA  1 
ATOM   2922 C C   . THR C 3 5   ? 23.538  -18.448 -24.475 1.00 23.53 ? 5   THR L C   1 
ATOM   2923 O O   . THR C 3 5   ? 23.818  -19.250 -23.530 1.00 23.23 ? 5   THR L O   1 
ATOM   2924 C CB  . THR C 3 5   ? 25.308  -16.692 -24.068 1.00 25.82 ? 5   THR L CB  1 
ATOM   2925 O OG1 . THR C 3 5   ? 25.419  -15.279 -23.869 1.00 27.38 ? 5   THR L OG1 1 
ATOM   2926 C CG2 . THR C 3 5   ? 26.221  -17.191 -25.178 1.00 26.95 ? 5   THR L CG2 1 
ATOM   2927 N N   . GLN C 3 6   ? 22.945  -18.794 -25.581 1.00 22.01 ? 6   GLN L N   1 
ATOM   2928 C CA  . GLN C 3 6   ? 22.525  -20.157 -25.884 1.00 23.65 ? 6   GLN L CA  1 
ATOM   2929 C C   . GLN C 3 6   ? 23.530  -20.805 -26.836 1.00 26.35 ? 6   GLN L C   1 
ATOM   2930 O O   . GLN C 3 6   ? 23.741  -20.257 -27.914 1.00 26.29 ? 6   GLN L O   1 
ATOM   2931 C CB  . GLN C 3 6   ? 21.105  -20.062 -26.403 1.00 24.49 ? 6   GLN L CB  1 
ATOM   2932 C CG  . GLN C 3 6   ? 20.471  -21.411 -26.451 1.00 24.93 ? 6   GLN L CG  1 
ATOM   2933 C CD  . GLN C 3 6   ? 18.996  -21.333 -26.732 1.00 22.30 ? 6   GLN L CD  1 
ATOM   2934 O OE1 . GLN C 3 6   ? 18.293  -20.314 -26.535 1.00 21.52 ? 6   GLN L OE1 1 
ATOM   2935 N NE2 . GLN C 3 6   ? 18.558  -22.439 -27.277 1.00 23.30 ? 6   GLN L NE2 1 
ATOM   2936 N N   . THR C 3 7   ? 24.009  -21.986 -26.491 1.00 26.85 ? 7   THR L N   1 
ATOM   2937 C CA  . THR C 3 7   ? 24.876  -22.793 -27.379 1.00 28.11 ? 7   THR L CA  1 
ATOM   2938 C C   . THR C 3 7   ? 24.427  -24.245 -27.364 1.00 29.58 ? 7   THR L C   1 
ATOM   2939 O O   . THR C 3 7   ? 23.798  -24.718 -26.388 1.00 27.49 ? 7   THR L O   1 
ATOM   2940 C CB  . THR C 3 7   ? 26.344  -22.721 -26.914 1.00 31.01 ? 7   THR L CB  1 
ATOM   2941 O OG1 . THR C 3 7   ? 26.441  -23.134 -25.553 1.00 28.36 ? 7   THR L OG1 1 
ATOM   2942 C CG2 . THR C 3 7   ? 26.944  -21.335 -27.034 1.00 31.36 ? 7   THR L CG2 1 
ATOM   2943 N N   . PRO C 3 8   ? 24.735  -25.019 -28.433 1.00 29.33 ? 8   PRO L N   1 
ATOM   2944 C CA  . PRO C 3 8   ? 25.265  -24.460 -29.691 1.00 30.16 ? 8   PRO L CA  1 
ATOM   2945 C C   . PRO C 3 8   ? 24.161  -23.727 -30.476 1.00 30.97 ? 8   PRO L C   1 
ATOM   2946 O O   . PRO C 3 8   ? 22.969  -23.745 -30.082 1.00 27.97 ? 8   PRO L O   1 
ATOM   2947 C CB  . PRO C 3 8   ? 25.704  -25.728 -30.399 1.00 30.15 ? 8   PRO L CB  1 
ATOM   2948 C CG  . PRO C 3 8   ? 24.640  -26.742 -30.031 1.00 30.31 ? 8   PRO L CG  1 
ATOM   2949 C CD  . PRO C 3 8   ? 24.382  -26.444 -28.562 1.00 29.38 ? 8   PRO L CD  1 
ATOM   2950 N N   . LYS C 3 9   ? 24.498  -23.191 -31.643 1.00 30.63 ? 9   LYS L N   1 
ATOM   2951 C CA  . LYS C 3 9   ? 23.465  -22.561 -32.480 1.00 32.33 ? 9   LYS L CA  1 
ATOM   2952 C C   . LYS C 3 9   ? 22.708  -23.635 -33.239 1.00 29.42 ? 9   LYS L C   1 
ATOM   2953 O O   . LYS C 3 9   ? 21.566  -23.363 -33.586 1.00 27.64 ? 9   LYS L O   1 
ATOM   2954 C CB  . LYS C 3 9   ? 24.062  -21.531 -33.446 1.00 37.91 ? 9   LYS L CB  1 
ATOM   2955 C CG  . LYS C 3 9   ? 24.602  -20.300 -32.736 1.00 42.28 ? 9   LYS L CG  1 
ATOM   2956 C CD  . LYS C 3 9   ? 23.972  -19.022 -33.266 1.00 45.56 ? 9   LYS L CD  1 
ATOM   2957 C CE  . LYS C 3 9   ? 24.564  -17.779 -32.623 1.00 49.36 ? 9   LYS L CE  1 
ATOM   2958 N NZ  . LYS C 3 9   ? 25.849  -17.418 -33.264 1.00 53.66 ? 9   LYS L NZ  1 
ATOM   2959 N N   . PHE C 3 10  ? 23.320  -24.774 -33.567 1.00 29.13 ? 10  PHE L N   1 
ATOM   2960 C CA  . PHE C 3 10  ? 22.550  -25.861 -34.207 1.00 31.16 ? 10  PHE L CA  1 
ATOM   2961 C C   . PHE C 3 10  ? 23.153  -27.217 -33.918 1.00 29.60 ? 10  PHE L C   1 
ATOM   2962 O O   . PHE C 3 10  ? 24.305  -27.263 -33.552 1.00 29.64 ? 10  PHE L O   1 
ATOM   2963 C CB  . PHE C 3 10  ? 22.433  -25.696 -35.717 1.00 38.20 ? 10  PHE L CB  1 
ATOM   2964 C CG  . PHE C 3 10  ? 23.768  -25.710 -36.385 1.00 43.62 ? 10  PHE L CG  1 
ATOM   2965 C CD1 . PHE C 3 10  ? 24.382  -26.915 -36.709 1.00 49.34 ? 10  PHE L CD1 1 
ATOM   2966 C CD2 . PHE C 3 10  ? 24.425  -24.515 -36.649 1.00 49.92 ? 10  PHE L CD2 1 
ATOM   2967 C CE1 . PHE C 3 10  ? 25.641  -26.927 -37.300 1.00 53.03 ? 10  PHE L CE1 1 
ATOM   2968 C CE2 . PHE C 3 10  ? 25.677  -24.528 -37.261 1.00 56.13 ? 10  PHE L CE2 1 
ATOM   2969 C CZ  . PHE C 3 10  ? 26.279  -25.732 -37.591 1.00 57.80 ? 10  PHE L CZ  1 
ATOM   2970 N N   . LEU C 3 11  ? 22.356  -28.253 -34.174 1.00 29.50 ? 11  LEU L N   1 
ATOM   2971 C CA  . LEU C 3 11  ? 22.650  -29.665 -33.859 1.00 31.24 ? 11  LEU L CA  1 
ATOM   2972 C C   . LEU C 3 11  ? 22.046  -30.512 -34.952 1.00 30.01 ? 11  LEU L C   1 
ATOM   2973 O O   . LEU C 3 11  ? 20.885  -30.299 -35.284 1.00 28.93 ? 11  LEU L O   1 
ATOM   2974 C CB  . LEU C 3 11  ? 22.083  -30.121 -32.498 1.00 32.06 ? 11  LEU L CB  1 
ATOM   2975 C CG  . LEU C 3 11  ? 22.973  -29.815 -31.310 1.00 34.44 ? 11  LEU L CG  1 
ATOM   2976 C CD1 . LEU C 3 11  ? 22.181  -29.903 -30.000 1.00 35.01 ? 11  LEU L CD1 1 
ATOM   2977 C CD2 . LEU C 3 11  ? 24.209  -30.720 -31.284 1.00 37.24 ? 11  LEU L CD2 1 
ATOM   2978 N N   . LEU C 3 12  ? 22.838  -31.447 -35.451 1.00 28.80 ? 12  LEU L N   1 
ATOM   2979 C CA  . LEU C 3 12  ? 22.349  -32.499 -36.351 1.00 29.37 ? 12  LEU L CA  1 
ATOM   2980 C C   . LEU C 3 12  ? 22.450  -33.799 -35.575 1.00 29.33 ? 12  LEU L C   1 
ATOM   2981 O O   . LEU C 3 12  ? 23.524  -34.131 -35.089 1.00 30.26 ? 12  LEU L O   1 
ATOM   2982 C CB  . LEU C 3 12  ? 23.185  -32.514 -37.640 1.00 30.96 ? 12  LEU L CB  1 
ATOM   2983 C CG  . LEU C 3 12  ? 22.766  -33.582 -38.652 1.00 31.64 ? 12  LEU L CG  1 
ATOM   2984 C CD1 . LEU C 3 12  ? 21.444  -33.223 -39.320 1.00 30.44 ? 12  LEU L CD1 1 
ATOM   2985 C CD2 . LEU C 3 12  ? 23.870  -33.791 -39.690 1.00 33.33 ? 12  LEU L CD2 1 
ATOM   2986 N N   . VAL C 3 13  ? 21.328  -34.498 -35.424 1.00 29.44 ? 13  VAL L N   1 
ATOM   2987 C CA  . VAL C 3 13  ? 21.283  -35.689 -34.550 1.00 29.26 ? 13  VAL L CA  1 
ATOM   2988 C C   . VAL C 3 13  ? 20.350  -36.713 -35.196 1.00 28.99 ? 13  VAL L C   1 
ATOM   2989 O O   . VAL C 3 13  ? 19.360  -36.304 -35.884 1.00 26.82 ? 13  VAL L O   1 
ATOM   2990 C CB  . VAL C 3 13  ? 20.857  -35.231 -33.140 1.00 30.97 ? 13  VAL L CB  1 
ATOM   2991 C CG1 . VAL C 3 13  ? 19.505  -34.527 -33.185 1.00 29.22 ? 13  VAL L CG1 1 
ATOM   2992 C CG2 . VAL C 3 13  ? 20.924  -36.379 -32.156 1.00 33.19 ? 13  VAL L CG2 1 
ATOM   2993 N N   . SER C 3 14  ? 20.651  -37.982 -34.982 1.00 29.50 ? 14  SER L N   1 
ATOM   2994 C CA  . SER C 3 14  ? 19.857  -39.120 -35.479 1.00 31.02 ? 14  SER L CA  1 
ATOM   2995 C C   . SER C 3 14  ? 18.753  -39.392 -34.458 1.00 31.13 ? 14  SER L C   1 
ATOM   2996 O O   . SER C 3 14  ? 19.004  -39.201 -33.254 1.00 31.28 ? 14  SER L O   1 
ATOM   2997 C CB  . SER C 3 14  ? 20.748  -40.311 -35.747 1.00 32.82 ? 14  SER L CB  1 
ATOM   2998 O OG  . SER C 3 14  ? 21.531  -40.068 -36.920 1.00 33.84 ? 14  SER L OG  1 
ATOM   2999 N N   . ALA C 3 15  ? 17.571  -39.773 -34.931 1.00 31.12 ? 15  ALA L N   1 
ATOM   3000 C CA  . ALA C 3 15  ? 16.498  -40.311 -34.068 1.00 31.89 ? 15  ALA L CA  1 
ATOM   3001 C C   . ALA C 3 15  ? 17.118  -41.359 -33.137 1.00 33.26 ? 15  ALA L C   1 
ATOM   3002 O O   . ALA C 3 15  ? 17.828  -42.272 -33.618 1.00 34.60 ? 15  ALA L O   1 
ATOM   3003 C CB  . ALA C 3 15  ? 15.358  -40.870 -34.889 1.00 32.54 ? 15  ALA L CB  1 
ATOM   3004 N N   . GLY C 3 16  ? 16.835  -41.227 -31.847 1.00 33.40 ? 16  GLY L N   1 
ATOM   3005 C CA  . GLY C 3 16  ? 17.265  -42.118 -30.757 1.00 35.20 ? 16  GLY L CA  1 
ATOM   3006 C C   . GLY C 3 16  ? 18.449  -41.563 -29.993 1.00 34.78 ? 16  GLY L C   1 
ATOM   3007 O O   . GLY C 3 16  ? 18.778  -42.113 -28.970 1.00 36.57 ? 16  GLY L O   1 
ATOM   3008 N N   . ASP C 3 17  ? 19.096  -40.528 -30.503 1.00 34.02 ? 17  ASP L N   1 
ATOM   3009 C CA  . ASP C 3 17  ? 20.313  -39.956 -29.889 1.00 35.62 ? 17  ASP L CA  1 
ATOM   3010 C C   . ASP C 3 17  ? 19.972  -38.757 -28.992 1.00 35.40 ? 17  ASP L C   1 
ATOM   3011 O O   . ASP C 3 17  ? 18.832  -38.215 -29.034 1.00 34.77 ? 17  ASP L O   1 
ATOM   3012 C CB  . ASP C 3 17  ? 21.304  -39.578 -30.966 1.00 36.72 ? 17  ASP L CB  1 
ATOM   3013 C CG  . ASP C 3 17  ? 21.994  -40.781 -31.621 1.00 39.66 ? 17  ASP L CG  1 
ATOM   3014 O OD1 . ASP C 3 17  ? 21.895  -41.936 -31.124 1.00 40.61 ? 17  ASP L OD1 1 
ATOM   3015 O OD2 . ASP C 3 17  ? 22.635  -40.549 -32.594 1.00 41.15 ? 17  ASP L OD2 1 
ATOM   3016 N N   . LYS C 3 18  ? 20.945  -38.359 -28.184 1.00 35.72 ? 18  LYS L N   1 
ATOM   3017 C CA  . LYS C 3 18  ? 20.755  -37.332 -27.143 1.00 35.61 ? 18  LYS L CA  1 
ATOM   3018 C C   . LYS C 3 18  ? 21.065  -35.951 -27.711 1.00 34.17 ? 18  LYS L C   1 
ATOM   3019 O O   . LYS C 3 18  ? 21.942  -35.849 -28.559 1.00 35.05 ? 18  LYS L O   1 
ATOM   3020 C CB  . LYS C 3 18  ? 21.661  -37.696 -25.974 1.00 38.61 ? 18  LYS L CB  1 
ATOM   3021 C CG  . LYS C 3 18  ? 21.628  -36.744 -24.797 1.00 40.76 ? 18  LYS L CG  1 
ATOM   3022 C CD  . LYS C 3 18  ? 22.761  -37.090 -23.835 1.00 44.25 ? 18  LYS L CD  1 
ATOM   3023 C CE  . LYS C 3 18  ? 22.477  -36.670 -22.427 1.00 46.62 ? 18  LYS L CE  1 
ATOM   3024 N NZ  . LYS C 3 18  ? 23.075  -37.611 -21.447 1.00 50.77 ? 18  LYS L NZ  1 
ATOM   3025 N N   . VAL C 3 19  ? 20.340  -34.944 -27.229 1.00 30.52 ? 19  VAL L N   1 
ATOM   3026 C CA  . VAL C 3 19  ? 20.547  -33.510 -27.520 1.00 30.38 ? 19  VAL L CA  1 
ATOM   3027 C C   . VAL C 3 19  ? 20.792  -32.853 -26.172 1.00 30.92 ? 19  VAL L C   1 
ATOM   3028 O O   . VAL C 3 19  ? 19.959  -33.093 -25.227 1.00 30.28 ? 19  VAL L O   1 
ATOM   3029 C CB  . VAL C 3 19  ? 19.315  -32.895 -28.198 1.00 28.88 ? 19  VAL L CB  1 
ATOM   3030 C CG1 . VAL C 3 19  ? 19.263  -31.361 -28.051 1.00 28.34 ? 19  VAL L CG1 1 
ATOM   3031 C CG2 . VAL C 3 19  ? 19.232  -33.307 -29.656 1.00 30.05 ? 19  VAL L CG2 1 
ATOM   3032 N N   . THR C 3 20  ? 21.838  -32.040 -26.110 1.00 29.71 ? 20  THR L N   1 
ATOM   3033 C CA  . THR C 3 20  ? 22.191  -31.255 -24.922 1.00 28.90 ? 20  THR L CA  1 
ATOM   3034 C C   . THR C 3 20  ? 22.359  -29.817 -25.381 1.00 28.23 ? 20  THR L C   1 
ATOM   3035 O O   . THR C 3 20  ? 23.209  -29.588 -26.314 1.00 30.02 ? 20  THR L O   1 
ATOM   3036 C CB  . THR C 3 20  ? 23.458  -31.778 -24.246 1.00 30.23 ? 20  THR L CB  1 
ATOM   3037 O OG1 . THR C 3 20  ? 23.286  -33.184 -24.015 1.00 30.33 ? 20  THR L OG1 1 
ATOM   3038 C CG2 . THR C 3 20  ? 23.729  -30.992 -22.983 1.00 30.37 ? 20  THR L CG2 1 
ATOM   3039 N N   . ILE C 3 21  ? 21.497  -28.932 -24.888 1.00 25.68 ? 21  ILE L N   1 
ATOM   3040 C CA  . ILE C 3 21  ? 21.545  -27.472 -25.144 1.00 26.42 ? 21  ILE L CA  1 
ATOM   3041 C C   . ILE C 3 21  ? 21.894  -26.756 -23.847 1.00 26.60 ? 21  ILE L C   1 
ATOM   3042 O O   . ILE C 3 21  ? 21.322  -27.112 -22.743 1.00 28.01 ? 21  ILE L O   1 
ATOM   3043 C CB  . ILE C 3 21  ? 20.204  -26.981 -25.714 1.00 26.59 ? 21  ILE L CB  1 
ATOM   3044 C CG1 . ILE C 3 21  ? 19.903  -27.685 -27.036 1.00 28.33 ? 21  ILE L CG1 1 
ATOM   3045 C CG2 . ILE C 3 21  ? 20.188  -25.447 -25.833 1.00 26.66 ? 21  ILE L CG2 1 
ATOM   3046 C CD1 . ILE C 3 21  ? 18.448  -27.639 -27.495 1.00 28.82 ? 21  ILE L CD1 1 
ATOM   3047 N N   . THR C 3 22  ? 22.745  -25.750 -23.953 1.00 25.16 ? 22  THR L N   1 
ATOM   3048 C CA  . THR C 3 22  ? 23.202  -24.950 -22.813 1.00 25.65 ? 22  THR L CA  1 
ATOM   3049 C C   . THR C 3 22  ? 22.693  -23.516 -22.944 1.00 24.64 ? 22  THR L C   1 
ATOM   3050 O O   . THR C 3 22  ? 22.737  -22.928 -24.033 1.00 23.74 ? 22  THR L O   1 
ATOM   3051 C CB  . THR C 3 22  ? 24.733  -25.028 -22.687 1.00 28.08 ? 22  THR L CB  1 
ATOM   3052 O OG1 . THR C 3 22  ? 25.023  -26.393 -22.395 1.00 29.04 ? 22  THR L OG1 1 
ATOM   3053 C CG2 . THR C 3 22  ? 25.254  -24.116 -21.614 1.00 29.28 ? 22  THR L CG2 1 
ATOM   3054 N N   . CYS C 3 23  ? 22.279  -22.954 -21.823 1.00 23.33 ? 23  CYS L N   1 
ATOM   3055 C CA  A CYS C 3 23  ? 21.905  -21.539 -21.708 0.60 24.04 ? 23  CYS L CA  1 
ATOM   3056 C CA  B CYS C 3 23  ? 21.941  -21.511 -21.724 0.40 22.95 ? 23  CYS L CA  1 
ATOM   3057 C C   . CYS C 3 23  ? 22.652  -20.904 -20.532 1.00 24.55 ? 23  CYS L C   1 
ATOM   3058 O O   . CYS C 3 23  ? 22.528  -21.462 -19.394 1.00 24.26 ? 23  CYS L O   1 
ATOM   3059 C CB  A CYS C 3 23  ? 20.388  -21.521 -21.544 0.60 24.59 ? 23  CYS L CB  1 
ATOM   3060 C CB  B CYS C 3 23  ? 20.442  -21.234 -21.602 0.40 22.07 ? 23  CYS L CB  1 
ATOM   3061 S SG  A CYS C 3 23  ? 19.726  -19.862 -21.390 0.60 27.12 ? 23  CYS L SG  1 
ATOM   3062 S SG  B CYS C 3 23  ? 19.762  -20.718 -23.197 0.40 20.30 ? 23  CYS L SG  1 
ATOM   3063 N N   . LYS C 3 24  ? 23.374  -19.805 -20.761 1.00 24.04 ? 24  LYS L N   1 
ATOM   3064 C CA  . LYS C 3 24  ? 24.151  -19.144 -19.692 1.00 25.88 ? 24  LYS L CA  1 
ATOM   3065 C C   . LYS C 3 24  ? 23.641  -17.733 -19.557 1.00 24.51 ? 24  LYS L C   1 
ATOM   3066 O O   . LYS C 3 24  ? 23.688  -16.969 -20.562 1.00 25.42 ? 24  LYS L O   1 
ATOM   3067 C CB  . LYS C 3 24  ? 25.658  -19.139 -19.978 1.00 28.93 ? 24  LYS L CB  1 
ATOM   3068 C CG  . LYS C 3 24  ? 26.224  -20.548 -20.011 1.00 32.62 ? 24  LYS L CG  1 
ATOM   3069 C CD  . LYS C 3 24  ? 27.752  -20.671 -19.998 1.00 36.78 ? 24  LYS L CD  1 
ATOM   3070 C CE  . LYS C 3 24  ? 28.122  -22.127 -19.838 1.00 39.36 ? 24  LYS L CE  1 
ATOM   3071 N NZ  . LYS C 3 24  ? 29.575  -22.310 -19.707 1.00 43.65 ? 24  LYS L NZ  1 
ATOM   3072 N N   . ALA C 3 25  ? 23.195  -17.386 -18.380 1.00 23.61 ? 25  ALA L N   1 
ATOM   3073 C CA  . ALA C 3 25  ? 22.766  -16.016 -18.063 1.00 22.82 ? 25  ALA L CA  1 
ATOM   3074 C C   . ALA C 3 25  ? 23.980  -15.162 -17.705 1.00 24.28 ? 25  ALA L C   1 
ATOM   3075 O O   . ALA C 3 25  ? 24.872  -15.646 -16.964 1.00 23.57 ? 25  ALA L O   1 
ATOM   3076 C CB  . ALA C 3 25  ? 21.767  -16.019 -16.954 1.00 22.19 ? 25  ALA L CB  1 
ATOM   3077 N N   . SER C 3 26  ? 23.890  -13.859 -17.996 1.00 24.93 ? 26  SER L N   1 
ATOM   3078 C CA  . SER C 3 26  ? 24.965  -12.881 -17.690 1.00 26.10 ? 26  SER L CA  1 
ATOM   3079 C C   . SER C 3 26  ? 25.011  -12.600 -16.204 1.00 26.59 ? 26  SER L C   1 
ATOM   3080 O O   . SER C 3 26  ? 26.000  -12.039 -15.758 1.00 27.58 ? 26  SER L O   1 
ATOM   3081 C CB  . SER C 3 26  ? 24.830  -11.603 -18.512 1.00 26.24 ? 26  SER L CB  1 
ATOM   3082 O OG  . SER C 3 26  ? 23.574  -10.980 -18.270 1.00 24.34 ? 26  SER L OG  1 
ATOM   3083 N N   . GLN C 3 27  ? 23.955  -12.912 -15.438 1.00 25.68 ? 27  GLN L N   1 
ATOM   3084 C CA  . GLN C 3 27  ? 23.999  -12.858 -13.979 1.00 27.18 ? 27  GLN L CA  1 
ATOM   3085 C C   . GLN C 3 27  ? 23.079  -13.976 -13.488 1.00 25.72 ? 27  GLN L C   1 
ATOM   3086 O O   . GLN C 3 27  ? 22.315  -14.494 -14.352 1.00 23.89 ? 27  GLN L O   1 
ATOM   3087 C CB  . GLN C 3 27  ? 23.584  -11.482 -13.466 1.00 29.57 ? 27  GLN L CB  1 
ATOM   3088 C CG  . GLN C 3 27  ? 22.123  -11.175 -13.691 1.00 31.10 ? 27  GLN L CG  1 
ATOM   3089 C CD  . GLN C 3 27  ? 21.657  -9.888  -13.040 1.00 34.07 ? 27  GLN L CD  1 
ATOM   3090 O OE1 . GLN C 3 27  ? 21.872  -8.808  -13.598 1.00 39.70 ? 27  GLN L OE1 1 
ATOM   3091 N NE2 . GLN C 3 27  ? 20.932  -9.996  -11.936 1.00 35.98 ? 27  GLN L NE2 1 
ATOM   3092 N N   . SER C 3 28  ? 23.167  -14.338 -12.209 1.00 25.15 ? 28  SER L N   1 
ATOM   3093 C CA  . SER C 3 28  ? 22.339  -15.435 -11.654 1.00 24.37 ? 28  SER L CA  1 
ATOM   3094 C C   . SER C 3 28  ? 20.844  -15.076 -11.825 1.00 23.15 ? 28  SER L C   1 
ATOM   3095 O O   . SER C 3 28  ? 20.421  -13.927 -11.566 1.00 21.96 ? 28  SER L O   1 
ATOM   3096 C CB  . SER C 3 28  ? 22.716  -15.797 -10.220 1.00 25.66 ? 28  SER L CB  1 
ATOM   3097 O OG  . SER C 3 28  ? 23.968  -16.477 -10.218 1.00 25.92 ? 28  SER L OG  1 
ATOM   3098 N N   . VAL C 3 29  ? 20.048  -16.072 -12.215 1.00 22.53 ? 29  VAL L N   1 
ATOM   3099 C CA  . VAL C 3 29  ? 18.580  -15.915 -12.378 1.00 21.31 ? 29  VAL L CA  1 
ATOM   3100 C C   . VAL C 3 29  ? 17.836  -16.962 -11.547 1.00 21.20 ? 29  VAL L C   1 
ATOM   3101 O O   . VAL C 3 29  ? 16.680  -17.319 -11.908 1.00 21.43 ? 29  VAL L O   1 
ATOM   3102 C CB  . VAL C 3 29  ? 18.224  -15.972 -13.867 1.00 20.55 ? 29  VAL L CB  1 
ATOM   3103 C CG1 . VAL C 3 29  ? 18.758  -14.767 -14.608 1.00 21.21 ? 29  VAL L CG1 1 
ATOM   3104 C CG2 . VAL C 3 29  ? 18.683  -17.249 -14.538 1.00 20.91 ? 29  VAL L CG2 1 
ATOM   3105 N N   . SER C 3 30  ? 18.433  -17.394 -10.439 1.00 22.44 ? 30  SER L N   1 
ATOM   3106 C CA  . SER C 3 30  ? 17.790  -18.394 -9.561  1.00 22.50 ? 30  SER L CA  1 
ATOM   3107 C C   . SER C 3 30  ? 17.392  -19.593 -10.447 1.00 21.38 ? 30  SER L C   1 
ATOM   3108 O O   . SER C 3 30  ? 18.274  -20.089 -11.251 1.00 20.93 ? 30  SER L O   1 
ATOM   3109 C CB  . SER C 3 30  ? 16.641  -17.757 -8.837  1.00 24.72 ? 30  SER L CB  1 
ATOM   3110 O OG  . SER C 3 30  ? 15.916  -18.762 -8.182  1.00 27.98 ? 30  SER L OG  1 
ATOM   3111 N N   . ASN C 3 31  ? 16.149  -20.086 -10.369 1.00 19.62 ? 31  ASN L N   1 
ATOM   3112 C CA  . ASN C 3 31  ? 15.711  -21.165 -11.279 1.00 20.18 ? 31  ASN L CA  1 
ATOM   3113 C C   . ASN C 3 31  ? 14.658  -20.633 -12.278 1.00 19.31 ? 31  ASN L C   1 
ATOM   3114 O O   . ASN C 3 31  ? 13.889  -21.466 -12.801 1.00 19.74 ? 31  ASN L O   1 
ATOM   3115 C CB  . ASN C 3 31  ? 15.127  -22.368 -10.546 1.00 20.35 ? 31  ASN L CB  1 
ATOM   3116 C CG  . ASN C 3 31  ? 13.920  -22.002 -9.720  1.00 20.50 ? 31  ASN L CG  1 
ATOM   3117 O OD1 . ASN C 3 31  ? 13.545  -20.832 -9.616  1.00 20.34 ? 31  ASN L OD1 1 
ATOM   3118 N ND2 . ASN C 3 31  ? 13.259  -23.009 -9.172  1.00 21.33 ? 31  ASN L ND2 1 
ATOM   3119 N N   . ASP C 3 32  ? 14.634  -19.321 -12.526 1.00 18.97 ? 32  ASP L N   1 
ATOM   3120 C CA  . ASP C 3 32  ? 13.564  -18.629 -13.302 1.00 19.05 ? 32  ASP L CA  1 
ATOM   3121 C C   . ASP C 3 32  ? 13.901  -18.746 -14.801 1.00 18.68 ? 32  ASP L C   1 
ATOM   3122 O O   . ASP C 3 32  ? 14.176  -17.765 -15.458 1.00 18.29 ? 32  ASP L O   1 
ATOM   3123 C CB  . ASP C 3 32  ? 13.459  -17.188 -12.842 1.00 19.56 ? 32  ASP L CB  1 
ATOM   3124 C CG  . ASP C 3 32  ? 12.832  -17.064 -11.477 1.00 21.09 ? 32  ASP L CG  1 
ATOM   3125 O OD1 . ASP C 3 32  ? 11.839  -17.820 -11.197 1.00 21.06 ? 32  ASP L OD1 1 
ATOM   3126 O OD2 . ASP C 3 32  ? 13.331  -16.166 -10.696 1.00 23.34 ? 32  ASP L OD2 1 
ATOM   3127 N N   . LEU C 3 33  ? 14.055  -19.956 -15.256 1.00 19.39 ? 33  LEU L N   1 
ATOM   3128 C CA  . LEU C 3 33  ? 14.538  -20.283 -16.603 1.00 19.23 ? 33  LEU L CA  1 
ATOM   3129 C C   . LEU C 3 33  ? 13.501  -21.180 -17.253 1.00 18.05 ? 33  LEU L C   1 
ATOM   3130 O O   . LEU C 3 33  ? 13.170  -22.228 -16.692 1.00 17.53 ? 33  LEU L O   1 
ATOM   3131 C CB  . LEU C 3 33  ? 15.892  -20.973 -16.481 1.00 20.82 ? 33  LEU L CB  1 
ATOM   3132 C CG  . LEU C 3 33  ? 16.785  -21.048 -17.722 1.00 22.25 ? 33  LEU L CG  1 
ATOM   3133 C CD1 . LEU C 3 33  ? 16.247  -22.024 -18.735 1.00 23.82 ? 33  LEU L CD1 1 
ATOM   3134 C CD2 . LEU C 3 33  ? 16.976  -19.671 -18.375 1.00 22.22 ? 33  LEU L CD2 1 
ATOM   3135 N N   . THR C 3 34  ? 13.005  -20.752 -18.405 1.00 16.33 ? 34  THR L N   1 
ATOM   3136 C CA  . THR C 3 34  ? 11.937  -21.465 -19.159 1.00 16.77 ? 34  THR L CA  1 
ATOM   3137 C C   . THR C 3 34  ? 12.518  -21.953 -20.502 1.00 16.87 ? 34  THR L C   1 
ATOM   3138 O O   . THR C 3 34  ? 13.334  -21.239 -21.052 1.00 17.32 ? 34  THR L O   1 
ATOM   3139 C CB  . THR C 3 34  ? 10.721  -20.559 -19.355 1.00 16.40 ? 34  THR L CB  1 
ATOM   3140 O OG1 . THR C 3 34  ? 10.274  -20.168 -18.049 1.00 17.40 ? 34  THR L OG1 1 
ATOM   3141 C CG2 . THR C 3 34  ? 9.614   -21.248 -20.124 1.00 16.35 ? 34  THR L CG2 1 
ATOM   3142 N N   . TRP C 3 35  ? 12.140  -23.152 -20.941 1.00 16.91 ? 35  TRP L N   1 
ATOM   3143 C CA  . TRP C 3 35  ? 12.518  -23.692 -22.257 1.00 16.97 ? 35  TRP L CA  1 
ATOM   3144 C C   . TRP C 3 35  ? 11.279  -23.795 -23.142 1.00 16.64 ? 35  TRP L C   1 
ATOM   3145 O O   . TRP C 3 35  ? 10.296  -24.371 -22.732 1.00 17.78 ? 35  TRP L O   1 
ATOM   3146 C CB  . TRP C 3 35  ? 13.218  -25.032 -22.132 1.00 17.23 ? 35  TRP L CB  1 
ATOM   3147 C CG  . TRP C 3 35  ? 14.552  -24.954 -21.461 1.00 18.02 ? 35  TRP L CG  1 
ATOM   3148 C CD1 . TRP C 3 35  ? 14.830  -25.206 -20.140 1.00 18.44 ? 35  TRP L CD1 1 
ATOM   3149 C CD2 . TRP C 3 35  ? 15.795  -24.662 -22.092 1.00 18.12 ? 35  TRP L CD2 1 
ATOM   3150 N NE1 . TRP C 3 35  ? 16.171  -25.018 -19.905 1.00 18.96 ? 35  TRP L NE1 1 
ATOM   3151 C CE2 . TRP C 3 35  ? 16.794  -24.733 -21.094 1.00 19.05 ? 35  TRP L CE2 1 
ATOM   3152 C CE3 . TRP C 3 35  ? 16.161  -24.342 -23.404 1.00 18.33 ? 35  TRP L CE3 1 
ATOM   3153 C CZ2 . TRP C 3 35  ? 18.128  -24.447 -21.382 1.00 19.88 ? 35  TRP L CZ2 1 
ATOM   3154 C CZ3 . TRP C 3 35  ? 17.487  -24.109 -23.680 1.00 18.82 ? 35  TRP L CZ3 1 
ATOM   3155 C CH2 . TRP C 3 35  ? 18.451  -24.178 -22.696 1.00 19.42 ? 35  TRP L CH2 1 
ATOM   3156 N N   . TYR C 3 36  ? 11.409  -23.312 -24.364 1.00 16.70 ? 36  TYR L N   1 
ATOM   3157 C CA  . TYR C 3 36  ? 10.360  -23.382 -25.377 1.00 16.04 ? 36  TYR L CA  1 
ATOM   3158 C C   . TYR C 3 36  ? 10.875  -24.117 -26.599 1.00 17.41 ? 36  TYR L C   1 
ATOM   3159 O O   . TYR C 3 36  ? 12.075  -24.040 -26.870 1.00 18.03 ? 36  TYR L O   1 
ATOM   3160 C CB  . TYR C 3 36  ? 9.919   -21.993 -25.824 1.00 15.45 ? 36  TYR L CB  1 
ATOM   3161 C CG  . TYR C 3 36  ? 9.332   -21.073 -24.800 1.00 14.96 ? 36  TYR L CG  1 
ATOM   3162 C CD1 . TYR C 3 36  ? 10.158  -20.177 -24.097 1.00 15.55 ? 36  TYR L CD1 1 
ATOM   3163 C CD2 . TYR C 3 36  ? 7.999   -21.096 -24.473 1.00 15.54 ? 36  TYR L CD2 1 
ATOM   3164 C CE1 . TYR C 3 36  ? 9.643   -19.267 -23.196 1.00 15.12 ? 36  TYR L CE1 1 
ATOM   3165 C CE2 . TYR C 3 36  ? 7.473   -20.245 -23.510 1.00 15.37 ? 36  TYR L CE2 1 
ATOM   3166 C CZ  . TYR C 3 36  ? 8.306   -19.329 -22.865 1.00 15.80 ? 36  TYR L CZ  1 
ATOM   3167 O OH  . TYR C 3 36  ? 7.775   -18.470 -21.928 1.00 15.87 ? 36  TYR L OH  1 
ATOM   3168 N N   . GLN C 3 37  ? 9.938   -24.736 -27.312 1.00 17.97 ? 37  GLN L N   1 
ATOM   3169 C CA  . GLN C 3 37  ? 10.148  -25.448 -28.596 1.00 18.07 ? 37  GLN L CA  1 
ATOM   3170 C C   . GLN C 3 37  ? 9.329   -24.699 -29.658 1.00 17.57 ? 37  GLN L C   1 
ATOM   3171 O O   . GLN C 3 37  ? 8.096   -24.610 -29.558 1.00 17.61 ? 37  GLN L O   1 
ATOM   3172 C CB  . GLN C 3 37  ? 9.665   -26.893 -28.443 1.00 18.94 ? 37  GLN L CB  1 
ATOM   3173 C CG  . GLN C 3 37  ? 9.735   -27.727 -29.714 1.00 18.84 ? 37  GLN L CG  1 
ATOM   3174 C CD  . GLN C 3 37  ? 8.963   -29.000 -29.522 1.00 20.04 ? 37  GLN L CD  1 
ATOM   3175 O OE1 . GLN C 3 37  ? 7.749   -29.004 -29.255 1.00 21.24 ? 37  GLN L OE1 1 
ATOM   3176 N NE2 . GLN C 3 37  ? 9.693   -30.104 -29.530 1.00 19.49 ? 37  GLN L NE2 1 
ATOM   3177 N N   . GLN C 3 38  ? 9.996   -24.216 -30.686 1.00 18.32 ? 38  GLN L N   1 
ATOM   3178 C CA  . GLN C 3 38  ? 9.301   -23.553 -31.800 1.00 18.43 ? 38  GLN L CA  1 
ATOM   3179 C C   . GLN C 3 38  ? 9.470   -24.399 -33.061 1.00 20.18 ? 38  GLN L C   1 
ATOM   3180 O O   . GLN C 3 38  ? 10.541  -24.363 -33.707 1.00 18.13 ? 38  GLN L O   1 
ATOM   3181 C CB  . GLN C 3 38  ? 9.787   -22.114 -31.970 1.00 18.58 ? 38  GLN L CB  1 
ATOM   3182 C CG  . GLN C 3 38  ? 8.904   -21.396 -32.999 1.00 19.13 ? 38  GLN L CG  1 
ATOM   3183 C CD  . GLN C 3 38  ? 9.201   -19.936 -33.125 1.00 19.22 ? 38  GLN L CD  1 
ATOM   3184 O OE1 . GLN C 3 38  ? 10.349  -19.522 -32.981 1.00 20.79 ? 38  GLN L OE1 1 
ATOM   3185 N NE2 . GLN C 3 38  ? 8.165   -19.174 -33.466 1.00 18.95 ? 38  GLN L NE2 1 
ATOM   3186 N N   . LYS C 3 39  ? 8.401   -25.094 -33.447 1.00 22.28 ? 39  LYS L N   1 
ATOM   3187 C CA  . LYS C 3 39  ? 8.389   -25.913 -34.695 1.00 24.16 ? 39  LYS L CA  1 
ATOM   3188 C C   . LYS C 3 39  ? 8.146   -24.942 -35.850 1.00 24.50 ? 39  LYS L C   1 
ATOM   3189 O O   . LYS C 3 39  ? 7.637   -23.824 -35.721 1.00 25.56 ? 39  LYS L O   1 
ATOM   3190 C CB  . LYS C 3 39  ? 7.357   -27.036 -34.606 1.00 25.32 ? 39  LYS L CB  1 
ATOM   3191 C CG  . LYS C 3 39  ? 7.694   -28.158 -33.646 1.00 27.66 ? 39  LYS L CG  1 
ATOM   3192 C CD  . LYS C 3 39  ? 6.731   -29.325 -33.614 1.00 29.76 ? 39  LYS L CD  1 
ATOM   3193 C CE  . LYS C 3 39  ? 7.099   -30.250 -32.468 1.00 30.81 ? 39  LYS L CE  1 
ATOM   3194 N NZ  . LYS C 3 39  ? 6.286   -31.490 -32.397 1.00 32.13 ? 39  LYS L NZ  1 
ATOM   3195 N N   . PRO C 3 40  ? 8.584   -25.272 -37.073 1.00 27.90 ? 40  PRO L N   1 
ATOM   3196 C CA  . PRO C 3 40  ? 8.482   -24.288 -38.154 1.00 27.34 ? 40  PRO L CA  1 
ATOM   3197 C C   . PRO C 3 40  ? 7.028   -23.890 -38.452 1.00 26.07 ? 40  PRO L C   1 
ATOM   3198 O O   . PRO C 3 40  ? 6.164   -24.721 -38.485 1.00 26.94 ? 40  PRO L O   1 
ATOM   3199 C CB  . PRO C 3 40  ? 9.149   -25.006 -39.349 1.00 28.84 ? 40  PRO L CB  1 
ATOM   3200 C CG  . PRO C 3 40  ? 9.897   -26.178 -38.756 1.00 30.16 ? 40  PRO L CG  1 
ATOM   3201 C CD  . PRO C 3 40  ? 9.200   -26.546 -37.460 1.00 30.06 ? 40  PRO L CD  1 
ATOM   3202 N N   . GLY C 3 41  ? 6.793   -22.607 -38.619 1.00 25.42 ? 41  GLY L N   1 
ATOM   3203 C CA  . GLY C 3 41  ? 5.487   -21.985 -38.896 1.00 27.33 ? 41  GLY L CA  1 
ATOM   3204 C C   . GLY C 3 41  ? 4.613   -21.803 -37.664 1.00 26.95 ? 41  GLY L C   1 
ATOM   3205 O O   . GLY C 3 41  ? 3.505   -21.333 -37.807 1.00 29.31 ? 41  GLY L O   1 
ATOM   3206 N N   . GLN C 3 42  ? 5.059   -22.263 -36.498 1.00 25.35 ? 42  GLN L N   1 
ATOM   3207 C CA  . GLN C 3 42  ? 4.227   -22.286 -35.269 1.00 24.51 ? 42  GLN L CA  1 
ATOM   3208 C C   . GLN C 3 42  ? 4.759   -21.295 -34.237 1.00 21.85 ? 42  GLN L C   1 
ATOM   3209 O O   . GLN C 3 42  ? 5.884   -20.845 -34.314 1.00 21.20 ? 42  GLN L O   1 
ATOM   3210 C CB  . GLN C 3 42  ? 4.199   -23.671 -34.646 1.00 27.11 ? 42  GLN L CB  1 
ATOM   3211 C CG  . GLN C 3 42  ? 3.768   -24.786 -35.592 1.00 30.57 ? 42  GLN L CG  1 
ATOM   3212 C CD  . GLN C 3 42  ? 3.617   -26.086 -34.851 1.00 34.99 ? 42  GLN L CD  1 
ATOM   3213 O OE1 . GLN C 3 42  ? 3.742   -26.174 -33.622 1.00 36.23 ? 42  GLN L OE1 1 
ATOM   3214 N NE2 . GLN C 3 42  ? 3.449   -27.159 -35.611 1.00 41.69 ? 42  GLN L NE2 1 
ATOM   3215 N N   . SER C 3 43  ? 3.919   -20.981 -33.254 1.00 19.97 ? 43  SER L N   1 
ATOM   3216 C CA  . SER C 3 43  ? 4.309   -20.162 -32.087 1.00 19.65 ? 43  SER L CA  1 
ATOM   3217 C C   . SER C 3 43  ? 5.199   -21.020 -31.206 1.00 19.03 ? 43  SER L C   1 
ATOM   3218 O O   . SER C 3 43  ? 5.073   -22.246 -31.250 1.00 19.08 ? 43  SER L O   1 
ATOM   3219 C CB  . SER C 3 43  ? 3.072   -19.692 -31.389 1.00 20.72 ? 43  SER L CB  1 
ATOM   3220 O OG  . SER C 3 43  ? 2.208   -19.103 -32.408 1.00 21.94 ? 43  SER L OG  1 
ATOM   3221 N N   . PRO C 3 44  ? 6.021   -20.426 -30.331 1.00 18.54 ? 44  PRO L N   1 
ATOM   3222 C CA  . PRO C 3 44  ? 6.722   -21.223 -29.335 1.00 18.20 ? 44  PRO L CA  1 
ATOM   3223 C C   . PRO C 3 44  ? 5.781   -21.989 -28.406 1.00 18.53 ? 44  PRO L C   1 
ATOM   3224 O O   . PRO C 3 44  ? 4.662   -21.546 -28.129 1.00 19.08 ? 44  PRO L O   1 
ATOM   3225 C CB  . PRO C 3 44  ? 7.533   -20.194 -28.541 1.00 18.92 ? 44  PRO L CB  1 
ATOM   3226 C CG  . PRO C 3 44  ? 7.603   -18.953 -29.424 1.00 18.62 ? 44  PRO L CG  1 
ATOM   3227 C CD  . PRO C 3 44  ? 6.314   -18.987 -30.217 1.00 18.42 ? 44  PRO L CD  1 
ATOM   3228 N N   . LYS C 3 45  ? 6.219   -23.181 -28.043 1.00 18.32 ? 45  LYS L N   1 
ATOM   3229 C CA  . LYS C 3 45  ? 5.471   -24.098 -27.156 1.00 18.68 ? 45  LYS L CA  1 
ATOM   3230 C C   . LYS C 3 45  ? 6.279   -24.286 -25.870 1.00 17.21 ? 45  LYS L C   1 
ATOM   3231 O O   . LYS C 3 45  ? 7.479   -24.640 -25.957 1.00 16.10 ? 45  LYS L O   1 
ATOM   3232 C CB  . LYS C 3 45  ? 5.338   -25.461 -27.825 1.00 21.20 ? 45  LYS L CB  1 
ATOM   3233 C CG  . LYS C 3 45  ? 4.614   -26.499 -27.000 1.00 23.75 ? 45  LYS L CG  1 
ATOM   3234 C CD  . LYS C 3 45  ? 4.454   -27.849 -27.675 1.00 27.35 ? 45  LYS L CD  1 
ATOM   3235 C CE  . LYS C 3 45  ? 3.922   -28.909 -26.726 1.00 30.95 ? 45  LYS L CE  1 
ATOM   3236 N NZ  . LYS C 3 45  ? 3.824   -30.226 -27.415 1.00 33.75 ? 45  LYS L NZ  1 
ATOM   3237 N N   . LEU C 3 46  ? 5.637   -24.096 -24.724 1.00 16.90 ? 46  LEU L N   1 
ATOM   3238 C CA  A LEU C 3 46  ? 6.296   -24.177 -23.400 0.50 16.91 ? 46  LEU L CA  1 
ATOM   3239 C CA  B LEU C 3 46  ? 6.387   -24.170 -23.449 0.50 17.14 ? 46  LEU L CA  1 
ATOM   3240 C C   . LEU C 3 46  ? 6.613   -25.647 -23.103 1.00 17.66 ? 46  LEU L C   1 
ATOM   3241 O O   . LEU C 3 46  ? 5.664   -26.431 -23.122 1.00 18.16 ? 46  LEU L O   1 
ATOM   3242 C CB  A LEU C 3 46  ? 5.301   -23.598 -22.388 0.50 16.80 ? 46  LEU L CB  1 
ATOM   3243 C CB  B LEU C 3 46  ? 5.649   -23.405 -22.347 0.50 17.32 ? 46  LEU L CB  1 
ATOM   3244 C CG  A LEU C 3 46  ? 5.714   -23.671 -20.923 0.50 16.80 ? 46  LEU L CG  1 
ATOM   3245 C CG  B LEU C 3 46  ? 6.534   -23.044 -21.157 0.50 17.44 ? 46  LEU L CG  1 
ATOM   3246 C CD1 A LEU C 3 46  ? 7.035   -22.955 -20.687 0.50 16.23 ? 46  LEU L CD1 1 
ATOM   3247 C CD1 B LEU C 3 46  ? 5.987   -21.842 -20.421 0.50 17.75 ? 46  LEU L CD1 1 
ATOM   3248 C CD2 A LEU C 3 46  ? 4.628   -23.090 -20.045 0.50 16.94 ? 46  LEU L CD2 1 
ATOM   3249 C CD2 B LEU C 3 46  ? 6.690   -24.224 -20.208 0.50 18.00 ? 46  LEU L CD2 1 
ATOM   3250 N N   . LEU C 3 47  ? 7.862   -25.996 -22.786 1.00 17.85 ? 47  LEU L N   1 
ATOM   3251 C CA  . LEU C 3 47  ? 8.193   -27.394 -22.391 1.00 19.00 ? 47  LEU L CA  1 
ATOM   3252 C C   . LEU C 3 47  ? 8.562   -27.490 -20.903 1.00 19.04 ? 47  LEU L C   1 
ATOM   3253 O O   . LEU C 3 47  ? 8.077   -28.410 -20.259 1.00 20.07 ? 47  LEU L O   1 
ATOM   3254 C CB  . LEU C 3 47  ? 9.356   -27.948 -23.217 1.00 19.91 ? 47  LEU L CB  1 
ATOM   3255 C CG  . LEU C 3 47  ? 9.128   -28.154 -24.718 1.00 20.47 ? 47  LEU L CG  1 
ATOM   3256 C CD1 . LEU C 3 47  ? 10.334  -28.904 -25.298 1.00 21.38 ? 47  LEU L CD1 1 
ATOM   3257 C CD2 . LEU C 3 47  ? 7.827   -28.889 -25.027 1.00 21.18 ? 47  LEU L CD2 1 
ATOM   3258 N N   . ILE C 3 48  ? 9.402   -26.595 -20.419 1.00 18.18 ? 48  ILE L N   1 
ATOM   3259 C CA  . ILE C 3 48  ? 10.016  -26.705 -19.062 1.00 19.03 ? 48  ILE L CA  1 
ATOM   3260 C C   . ILE C 3 48  ? 10.005  -25.316 -18.448 1.00 18.62 ? 48  ILE L C   1 
ATOM   3261 O O   . ILE C 3 48  ? 10.336  -24.341 -19.153 1.00 18.06 ? 48  ILE L O   1 
ATOM   3262 C CB  . ILE C 3 48  ? 11.441  -27.276 -19.118 1.00 20.72 ? 48  ILE L CB  1 
ATOM   3263 C CG1 . ILE C 3 48  ? 11.388  -28.751 -19.532 1.00 22.83 ? 48  ILE L CG1 1 
ATOM   3264 C CG2 . ILE C 3 48  ? 12.126  -27.098 -17.771 1.00 20.58 ? 48  ILE L CG2 1 
ATOM   3265 C CD1 . ILE C 3 48  ? 12.713  -29.397 -19.642 1.00 24.77 ? 48  ILE L CD1 1 
ATOM   3266 N N   . TYR C 3 49  ? 9.647   -25.207 -17.167 1.00 18.32 ? 49  TYR L N   1 
ATOM   3267 C CA  . TYR C 3 49  ? 9.765   -23.945 -16.415 1.00 18.99 ? 49  TYR L CA  1 
ATOM   3268 C C   . TYR C 3 49  ? 10.352  -24.240 -15.038 1.00 18.01 ? 49  TYR L C   1 
ATOM   3269 O O   . TYR C 3 49  ? 10.454  -25.386 -14.629 1.00 18.92 ? 49  TYR L O   1 
ATOM   3270 C CB  . TYR C 3 49  ? 8.414   -23.230 -16.274 1.00 19.27 ? 49  TYR L CB  1 
ATOM   3271 C CG  . TYR C 3 49  ? 7.329   -24.028 -15.648 1.00 20.98 ? 49  TYR L CG  1 
ATOM   3272 C CD1 . TYR C 3 49  ? 6.569   -24.909 -16.387 1.00 22.73 ? 49  TYR L CD1 1 
ATOM   3273 C CD2 . TYR C 3 49  ? 7.037   -23.893 -14.302 1.00 23.27 ? 49  TYR L CD2 1 
ATOM   3274 C CE1 . TYR C 3 49  ? 5.521   -25.624 -15.822 1.00 24.76 ? 49  TYR L CE1 1 
ATOM   3275 C CE2 . TYR C 3 49  ? 6.033   -24.631 -13.707 1.00 25.10 ? 49  TYR L CE2 1 
ATOM   3276 C CZ  . TYR C 3 49  ? 5.257   -25.481 -14.477 1.00 26.21 ? 49  TYR L CZ  1 
ATOM   3277 O OH  . TYR C 3 49  ? 4.274   -26.173 -13.842 1.00 29.90 ? 49  TYR L OH  1 
ATOM   3278 N N   . TYR C 3 50  ? 10.715  -23.189 -14.332 1.00 17.93 ? 50  TYR L N   1 
ATOM   3279 C CA  . TYR C 3 50  ? 11.498  -23.264 -13.092 1.00 18.14 ? 50  TYR L CA  1 
ATOM   3280 C C   . TYR C 3 50  ? 12.699  -24.199 -13.319 1.00 18.62 ? 50  TYR L C   1 
ATOM   3281 O O   . TYR C 3 50  ? 13.054  -25.033 -12.467 1.00 19.38 ? 50  TYR L O   1 
ATOM   3282 C CB  . TYR C 3 50  ? 10.612  -23.757 -11.926 1.00 19.33 ? 50  TYR L CB  1 
ATOM   3283 C CG  . TYR C 3 50  ? 9.395   -22.955 -11.583 1.00 19.07 ? 50  TYR L CG  1 
ATOM   3284 C CD1 . TYR C 3 50  ? 9.319   -21.586 -11.771 1.00 19.05 ? 50  TYR L CD1 1 
ATOM   3285 C CD2 . TYR C 3 50  ? 8.306   -23.589 -11.013 1.00 19.74 ? 50  TYR L CD2 1 
ATOM   3286 C CE1 . TYR C 3 50  ? 8.171   -20.877 -11.454 1.00 19.48 ? 50  TYR L CE1 1 
ATOM   3287 C CE2 . TYR C 3 50  ? 7.180   -22.898 -10.644 1.00 19.69 ? 50  TYR L CE2 1 
ATOM   3288 C CZ  . TYR C 3 50  ? 7.111   -21.538 -10.855 1.00 19.75 ? 50  TYR L CZ  1 
ATOM   3289 O OH  . TYR C 3 50  ? 5.971   -20.883 -10.535 1.00 20.51 ? 50  TYR L OH  1 
ATOM   3290 N N   . ALA C 3 51  ? 13.347  -24.095 -14.483 1.00 18.56 ? 51  ALA L N   1 
ATOM   3291 C CA  . ALA C 3 51  ? 14.575  -24.796 -14.888 1.00 19.35 ? 51  ALA L CA  1 
ATOM   3292 C C   . ALA C 3 51  ? 14.364  -26.296 -15.130 1.00 20.51 ? 51  ALA L C   1 
ATOM   3293 O O   . ALA C 3 51  ? 15.059  -26.825 -16.006 1.00 21.30 ? 51  ALA L O   1 
ATOM   3294 C CB  . ALA C 3 51  ? 15.634  -24.575 -13.829 1.00 19.96 ? 51  ALA L CB  1 
ATOM   3295 N N   . SER C 3 52  ? 13.492  -26.987 -14.395 1.00 20.77 ? 52  SER L N   1 
ATOM   3296 C CA  . SER C 3 52  ? 13.409  -28.461 -14.461 1.00 21.93 ? 52  SER L CA  1 
ATOM   3297 C C   . SER C 3 52  ? 11.975  -29.016 -14.489 1.00 23.02 ? 52  SER L C   1 
ATOM   3298 O O   . SER C 3 52  ? 11.865  -30.251 -14.610 1.00 24.45 ? 52  SER L O   1 
ATOM   3299 C CB  . SER C 3 52  ? 14.164  -29.032 -13.303 1.00 22.57 ? 52  SER L CB  1 
ATOM   3300 O OG  . SER C 3 52  ? 13.491  -28.733 -12.070 1.00 22.96 ? 52  SER L OG  1 
ATOM   3301 N N   . ASN C 3 53  ? 10.943  -28.206 -14.315 1.00 22.82 ? 53  ASN L N   1 
ATOM   3302 C CA  . ASN C 3 53  ? 9.533   -28.688 -14.211 1.00 24.86 ? 53  ASN L CA  1 
ATOM   3303 C C   . ASN C 3 53  ? 8.954   -28.835 -15.619 1.00 22.98 ? 53  ASN L C   1 
ATOM   3304 O O   . ASN C 3 53  ? 8.848   -27.809 -16.313 1.00 22.73 ? 53  ASN L O   1 
ATOM   3305 C CB  . ASN C 3 53  ? 8.660   -27.748 -13.381 1.00 26.80 ? 53  ASN L CB  1 
ATOM   3306 C CG  . ASN C 3 53  ? 9.001   -27.744 -11.908 1.00 33.05 ? 53  ASN L CG  1 
ATOM   3307 O OD1 . ASN C 3 53  ? 10.154  -27.946 -11.503 1.00 38.16 ? 53  ASN L OD1 1 
ATOM   3308 N ND2 . ASN C 3 53  ? 7.999   -27.504 -11.079 1.00 35.07 ? 53  ASN L ND2 1 
ATOM   3309 N N   . ARG C 3 54  ? 8.621   -30.044 -16.037 1.00 23.08 ? 54  ARG L N   1 
ATOM   3310 C CA  . ARG C 3 54  ? 7.885   -30.250 -17.309 1.00 24.31 ? 54  ARG L CA  1 
ATOM   3311 C C   . ARG C 3 54  ? 6.464   -29.686 -17.187 1.00 23.32 ? 54  ARG L C   1 
ATOM   3312 O O   . ARG C 3 54  ? 5.769   -29.939 -16.189 1.00 22.89 ? 54  ARG L O   1 
ATOM   3313 C CB  . ARG C 3 54  ? 7.807   -31.730 -17.696 1.00 26.08 ? 54  ARG L CB  1 
ATOM   3314 C CG  . ARG C 3 54  ? 9.061   -32.213 -18.390 1.00 28.00 ? 54  ARG L CG  1 
ATOM   3315 C CD  . ARG C 3 54  ? 8.871   -33.596 -18.950 1.00 30.24 ? 54  ARG L CD  1 
ATOM   3316 N NE  . ARG C 3 54  ? 8.676   -34.568 -17.918 1.00 33.50 ? 54  ARG L NE  1 
ATOM   3317 C CZ  . ARG C 3 54  ? 9.644   -35.134 -17.222 1.00 36.56 ? 54  ARG L CZ  1 
ATOM   3318 N NH1 . ARG C 3 54  ? 9.333   -36.000 -16.274 1.00 38.01 ? 54  ARG L NH1 1 
ATOM   3319 N NH2 . ARG C 3 54  ? 10.908  -34.820 -17.466 1.00 36.12 ? 54  ARG L NH2 1 
ATOM   3320 N N   . TYR C 3 55  ? 6.053   -28.982 -18.206 1.00 22.45 ? 55  TYR L N   1 
ATOM   3321 C CA  . TYR C 3 55  ? 4.667   -28.513 -18.402 1.00 22.99 ? 55  TYR L CA  1 
ATOM   3322 C C   . TYR C 3 55  ? 3.775   -29.729 -18.631 1.00 23.78 ? 55  TYR L C   1 
ATOM   3323 O O   . TYR C 3 55  ? 4.225   -30.766 -19.077 1.00 23.65 ? 55  TYR L O   1 
ATOM   3324 C CB  . TYR C 3 55  ? 4.625   -27.458 -19.512 1.00 21.82 ? 55  TYR L CB  1 
ATOM   3325 C CG  . TYR C 3 55  ? 3.272   -26.854 -19.732 1.00 22.06 ? 55  TYR L CG  1 
ATOM   3326 C CD1 . TYR C 3 55  ? 2.739   -25.910 -18.886 1.00 22.55 ? 55  TYR L CD1 1 
ATOM   3327 C CD2 . TYR C 3 55  ? 2.529   -27.223 -20.842 1.00 23.85 ? 55  TYR L CD2 1 
ATOM   3328 C CE1 . TYR C 3 55  ? 1.472   -25.370 -19.099 1.00 23.10 ? 55  TYR L CE1 1 
ATOM   3329 C CE2 . TYR C 3 55  ? 1.250   -26.721 -21.059 1.00 24.23 ? 55  TYR L CE2 1 
ATOM   3330 C CZ  . TYR C 3 55  ? 0.722   -25.806 -20.181 1.00 24.09 ? 55  TYR L CZ  1 
ATOM   3331 O OH  . TYR C 3 55  ? -0.531  -25.329 -20.455 1.00 26.01 ? 55  TYR L OH  1 
ATOM   3332 N N   . THR C 3 56  ? 2.514   -29.596 -18.220 1.00 26.35 ? 56  THR L N   1 
ATOM   3333 C CA  . THR C 3 56  ? 1.471   -30.619 -18.396 1.00 29.12 ? 56  THR L CA  1 
ATOM   3334 C C   . THR C 3 56  ? 1.574   -31.259 -19.782 1.00 27.59 ? 56  THR L C   1 
ATOM   3335 O O   . THR C 3 56  ? 1.482   -30.526 -20.784 1.00 26.77 ? 56  THR L O   1 
ATOM   3336 C CB  . THR C 3 56  ? 0.067   -30.020 -18.227 1.00 32.77 ? 56  THR L CB  1 
ATOM   3337 O OG1 . THR C 3 56  ? -0.002  -29.270 -16.993 1.00 38.17 ? 56  THR L OG1 1 
ATOM   3338 C CG2 . THR C 3 56  ? -0.971  -31.130 -18.245 1.00 35.17 ? 56  THR L CG2 1 
ATOM   3339 N N   . GLY C 3 57  ? 1.731   -32.576 -19.837 1.00 28.69 ? 57  GLY L N   1 
ATOM   3340 C CA  . GLY C 3 57  ? 1.642   -33.369 -21.074 1.00 29.21 ? 57  GLY L CA  1 
ATOM   3341 C C   . GLY C 3 57  ? 2.951   -33.396 -21.866 1.00 29.28 ? 57  GLY L C   1 
ATOM   3342 O O   . GLY C 3 57  ? 3.030   -34.072 -22.918 1.00 30.47 ? 57  GLY L O   1 
ATOM   3343 N N   . VAL C 3 58  ? 3.987   -32.748 -21.367 1.00 27.19 ? 58  VAL L N   1 
ATOM   3344 C CA  . VAL C 3 58  ? 5.293   -32.773 -22.068 1.00 26.66 ? 58  VAL L CA  1 
ATOM   3345 C C   . VAL C 3 58  ? 5.909   -34.149 -21.847 1.00 27.98 ? 58  VAL L C   1 
ATOM   3346 O O   . VAL C 3 58  ? 5.958   -34.644 -20.727 1.00 27.43 ? 58  VAL L O   1 
ATOM   3347 C CB  . VAL C 3 58  ? 6.201   -31.615 -21.631 1.00 25.42 ? 58  VAL L CB  1 
ATOM   3348 C CG1 . VAL C 3 58  ? 7.618   -31.760 -22.149 1.00 24.08 ? 58  VAL L CG1 1 
ATOM   3349 C CG2 . VAL C 3 58  ? 5.606   -30.259 -22.028 1.00 23.70 ? 58  VAL L CG2 1 
ATOM   3350 N N   . PRO C 3 59  ? 6.395   -34.840 -22.899 1.00 28.58 ? 59  PRO L N   1 
ATOM   3351 C CA  . PRO C 3 59  ? 7.019   -36.145 -22.682 1.00 30.86 ? 59  PRO L CA  1 
ATOM   3352 C C   . PRO C 3 59  ? 8.283   -36.141 -21.787 1.00 30.39 ? 59  PRO L C   1 
ATOM   3353 O O   . PRO C 3 59  ? 9.042   -35.166 -21.722 1.00 28.30 ? 59  PRO L O   1 
ATOM   3354 C CB  . PRO C 3 59  ? 7.335   -36.651 -24.089 1.00 31.17 ? 59  PRO L CB  1 
ATOM   3355 C CG  . PRO C 3 59  ? 6.548   -35.761 -25.027 1.00 30.09 ? 59  PRO L CG  1 
ATOM   3356 C CD  . PRO C 3 59  ? 6.325   -34.452 -24.313 1.00 29.10 ? 59  PRO L CD  1 
ATOM   3357 N N   . ASP C 3 60  ? 8.473   -37.275 -21.106 1.00 32.50 ? 60  ASP L N   1 
ATOM   3358 C CA  . ASP C 3 60  ? 9.597   -37.622 -20.193 1.00 34.96 ? 60  ASP L CA  1 
ATOM   3359 C C   . ASP C 3 60  ? 10.978  -37.409 -20.792 1.00 31.89 ? 60  ASP L C   1 
ATOM   3360 O O   . ASP C 3 60  ? 11.942  -37.324 -20.018 1.00 30.49 ? 60  ASP L O   1 
ATOM   3361 C CB  . ASP C 3 60  ? 9.717   -39.143 -20.016 1.00 41.25 ? 60  ASP L CB  1 
ATOM   3362 C CG  . ASP C 3 60  ? 8.657   -39.713 -19.149 1.00 48.29 ? 60  ASP L CG  1 
ATOM   3363 O OD1 . ASP C 3 60  ? 7.865   -38.908 -18.598 1.00 54.33 ? 60  ASP L OD1 1 
ATOM   3364 O OD2 . ASP C 3 60  ? 8.663   -40.939 -18.994 1.00 54.01 ? 60  ASP L OD2 1 
ATOM   3365 N N   . ARG C 3 61  ? 11.114  -37.529 -22.116 1.00 30.02 ? 61  ARG L N   1 
ATOM   3366 C CA  . ARG C 3 61  ? 12.456  -37.448 -22.763 1.00 28.97 ? 61  ARG L CA  1 
ATOM   3367 C C   . ARG C 3 61  ? 13.046  -36.024 -22.618 1.00 27.29 ? 61  ARG L C   1 
ATOM   3368 O O   . ARG C 3 61  ? 14.281  -35.853 -22.811 1.00 26.87 ? 61  ARG L O   1 
ATOM   3369 C CB  . ARG C 3 61  ? 12.374  -37.900 -24.228 1.00 28.22 ? 61  ARG L CB  1 
ATOM   3370 C CG  . ARG C 3 61  ? 11.473  -37.063 -25.110 1.00 27.15 ? 61  ARG L CG  1 
ATOM   3371 C CD  . ARG C 3 61  ? 11.565  -37.587 -26.543 1.00 27.04 ? 61  ARG L CD  1 
ATOM   3372 N NE  . ARG C 3 61  ? 10.731  -36.892 -27.477 1.00 25.97 ? 61  ARG L NE  1 
ATOM   3373 C CZ  . ARG C 3 61  ? 9.422   -37.100 -27.646 1.00 27.02 ? 61  ARG L CZ  1 
ATOM   3374 N NH1 . ARG C 3 61  ? 8.774   -37.961 -26.886 1.00 29.28 ? 61  ARG L NH1 1 
ATOM   3375 N NH2 . ARG C 3 61  ? 8.742   -36.438 -28.575 1.00 26.70 ? 61  ARG L NH2 1 
ATOM   3376 N N   . PHE C 3 62  ? 12.225  -35.020 -22.285 1.00 26.23 ? 62  PHE L N   1 
ATOM   3377 C CA  . PHE C 3 62  ? 12.670  -33.616 -22.110 1.00 24.71 ? 62  PHE L CA  1 
ATOM   3378 C C   . PHE C 3 62  ? 12.963  -33.380 -20.631 1.00 25.37 ? 62  PHE L C   1 
ATOM   3379 O O   . PHE C 3 62  ? 12.065  -33.611 -19.811 1.00 24.81 ? 62  PHE L O   1 
ATOM   3380 C CB  . PHE C 3 62  ? 11.621  -32.608 -22.581 1.00 24.04 ? 62  PHE L CB  1 
ATOM   3381 C CG  . PHE C 3 62  ? 11.287  -32.702 -24.059 1.00 23.90 ? 62  PHE L CG  1 
ATOM   3382 C CD1 . PHE C 3 62  ? 12.166  -32.254 -25.028 1.00 24.52 ? 62  PHE L CD1 1 
ATOM   3383 C CD2 . PHE C 3 62  ? 10.132  -33.328 -24.477 1.00 25.66 ? 62  PHE L CD2 1 
ATOM   3384 C CE1 . PHE C 3 62  ? 11.833  -32.329 -26.381 1.00 24.64 ? 62  PHE L CE1 1 
ATOM   3385 C CE2 . PHE C 3 62  ? 9.819   -33.442 -25.826 1.00 26.61 ? 62  PHE L CE2 1 
ATOM   3386 C CZ  . PHE C 3 62  ? 10.668  -32.944 -26.778 1.00 25.05 ? 62  PHE L CZ  1 
ATOM   3387 N N   . THR C 3 63  ? 14.190  -33.005 -20.299 1.00 25.35 ? 63  THR L N   1 
ATOM   3388 C CA  . THR C 3 63  ? 14.572  -32.613 -18.930 1.00 26.42 ? 63  THR L CA  1 
ATOM   3389 C C   . THR C 3 63  ? 15.320  -31.289 -18.997 1.00 25.07 ? 63  THR L C   1 
ATOM   3390 O O   . THR C 3 63  ? 15.842  -30.931 -20.076 1.00 23.99 ? 63  THR L O   1 
ATOM   3391 C CB  . THR C 3 63  ? 15.404  -33.669 -18.211 1.00 28.49 ? 63  THR L CB  1 
ATOM   3392 O OG1 . THR C 3 63  ? 16.632  -33.878 -18.903 1.00 28.07 ? 63  THR L OG1 1 
ATOM   3393 C CG2 . THR C 3 63  ? 14.678  -34.986 -18.034 1.00 30.60 ? 63  THR L CG2 1 
ATOM   3394 N N   . GLY C 3 64  ? 15.391  -30.616 -17.835 1.00 23.49 ? 64  GLY L N   1 
ATOM   3395 C CA  . GLY C 3 64  ? 16.173  -29.392 -17.641 1.00 22.22 ? 64  GLY L CA  1 
ATOM   3396 C C   . GLY C 3 64  ? 16.814  -29.402 -16.268 1.00 22.70 ? 64  GLY L C   1 
ATOM   3397 O O   . GLY C 3 64  ? 16.299  -30.071 -15.371 1.00 22.44 ? 64  GLY L O   1 
ATOM   3398 N N   . SER C 3 65  ? 17.901  -28.683 -16.104 1.00 22.53 ? 65  SER L N   1 
ATOM   3399 C CA  . SER C 3 65  ? 18.606  -28.559 -14.820 1.00 24.55 ? 65  SER L CA  1 
ATOM   3400 C C   . SER C 3 65  ? 19.277  -27.189 -14.771 1.00 23.71 ? 65  SER L C   1 
ATOM   3401 O O   . SER C 3 65  ? 19.469  -26.570 -15.839 1.00 23.11 ? 65  SER L O   1 
ATOM   3402 C CB  . SER C 3 65  ? 19.604  -29.668 -14.578 1.00 26.74 ? 65  SER L CB  1 
ATOM   3403 O OG  . SER C 3 65  ? 20.643  -29.550 -15.520 1.00 28.59 ? 65  SER L OG  1 
ATOM   3404 N N   . GLY C 3 66  ? 19.659  -26.804 -13.540 1.00 23.64 ? 66  GLY L N   1 
ATOM   3405 C CA  . GLY C 3 66  ? 20.517  -25.640 -13.294 1.00 23.49 ? 66  GLY L CA  1 
ATOM   3406 C C   . GLY C 3 66  ? 19.889  -24.678 -12.316 1.00 23.00 ? 66  GLY L C   1 
ATOM   3407 O O   . GLY C 3 66  ? 18.656  -24.719 -12.072 1.00 22.10 ? 66  GLY L O   1 
ATOM   3408 N N   . TYR C 3 67  ? 20.738  -23.857 -11.721 1.00 22.25 ? 67  TYR L N   1 
ATOM   3409 C CA  . TYR C 3 67  ? 20.334  -22.786 -10.777 1.00 22.17 ? 67  TYR L CA  1 
ATOM   3410 C C   . TYR C 3 67  ? 21.451  -21.747 -10.796 1.00 23.09 ? 67  TYR L C   1 
ATOM   3411 O O   . TYR C 3 67  ? 22.569  -22.160 -10.614 1.00 24.13 ? 67  TYR L O   1 
ATOM   3412 C CB  . TYR C 3 67  ? 20.138  -23.394 -9.392  1.00 22.31 ? 67  TYR L CB  1 
ATOM   3413 C CG  . TYR C 3 67  ? 19.419  -22.487 -8.441  1.00 22.05 ? 67  TYR L CG  1 
ATOM   3414 C CD1 . TYR C 3 67  ? 18.086  -22.682 -8.170  1.00 21.63 ? 67  TYR L CD1 1 
ATOM   3415 C CD2 . TYR C 3 67  ? 20.037  -21.382 -7.887  1.00 22.19 ? 67  TYR L CD2 1 
ATOM   3416 C CE1 . TYR C 3 67  ? 17.381  -21.821 -7.334  1.00 21.80 ? 67  TYR L CE1 1 
ATOM   3417 C CE2 . TYR C 3 67  ? 19.354  -20.513 -7.056  1.00 22.91 ? 67  TYR L CE2 1 
ATOM   3418 C CZ  . TYR C 3 67  ? 18.011  -20.721 -6.769  1.00 21.94 ? 67  TYR L CZ  1 
ATOM   3419 O OH  . TYR C 3 67  ? 17.296  -19.904 -5.943  1.00 22.91 ? 67  TYR L OH  1 
ATOM   3420 N N   . GLY C 3 68  ? 21.142  -20.485 -11.027 1.00 23.16 ? 68  GLY L N   1 
ATOM   3421 C CA  . GLY C 3 68  ? 22.173  -19.430 -11.030 1.00 23.26 ? 68  GLY L CA  1 
ATOM   3422 C C   . GLY C 3 68  ? 22.393  -18.996 -12.453 1.00 22.95 ? 68  GLY L C   1 
ATOM   3423 O O   . GLY C 3 68  ? 21.422  -18.471 -13.043 1.00 22.31 ? 68  GLY L O   1 
ATOM   3424 N N   . THR C 3 69  ? 23.540  -19.283 -13.062 1.00 23.43 ? 69  THR L N   1 
ATOM   3425 C CA  . THR C 3 69  ? 23.798  -18.748 -14.413 1.00 23.17 ? 69  THR L CA  1 
ATOM   3426 C C   . THR C 3 69  ? 23.697  -19.856 -15.460 1.00 24.01 ? 69  THR L C   1 
ATOM   3427 O O   . THR C 3 69  ? 23.452  -19.519 -16.632 1.00 23.96 ? 69  THR L O   1 
ATOM   3428 C CB  . THR C 3 69  ? 25.167  -18.068 -14.502 1.00 24.12 ? 69  THR L CB  1 
ATOM   3429 O OG1 . THR C 3 69  ? 26.133  -19.067 -14.182 1.00 24.17 ? 69  THR L OG1 1 
ATOM   3430 C CG2 . THR C 3 69  ? 25.283  -16.842 -13.641 1.00 23.90 ? 69  THR L CG2 1 
ATOM   3431 N N   . ASP C 3 70  ? 23.934  -21.122 -15.094 1.00 25.07 ? 70  ASP L N   1 
ATOM   3432 C CA  . ASP C 3 70  ? 24.258  -22.167 -16.100 1.00 26.51 ? 70  ASP L CA  1 
ATOM   3433 C C   . ASP C 3 70  ? 23.175  -23.252 -16.152 1.00 25.54 ? 70  ASP L C   1 
ATOM   3434 O O   . ASP C 3 70  ? 22.932  -23.949 -15.151 1.00 25.34 ? 70  ASP L O   1 
ATOM   3435 C CB  . ASP C 3 70  ? 25.632  -22.760 -15.767 1.00 30.26 ? 70  ASP L CB  1 
ATOM   3436 C CG  . ASP C 3 70  ? 26.828  -21.802 -15.884 1.00 33.11 ? 70  ASP L CG  1 
ATOM   3437 O OD1 . ASP C 3 70  ? 26.672  -20.671 -16.321 1.00 33.86 ? 70  ASP L OD1 1 
ATOM   3438 O OD2 . ASP C 3 70  ? 27.922  -22.182 -15.439 1.00 38.98 ? 70  ASP L OD2 1 
ATOM   3439 N N   . PHE C 3 71  ? 22.490  -23.356 -17.278 1.00 24.30 ? 71  PHE L N   1 
ATOM   3440 C CA  . PHE C 3 71  ? 21.299  -24.228 -17.437 1.00 23.25 ? 71  PHE L CA  1 
ATOM   3441 C C   . PHE C 3 71  ? 21.503  -25.195 -18.603 1.00 23.75 ? 71  PHE L C   1 
ATOM   3442 O O   . PHE C 3 71  ? 22.089  -24.843 -19.659 1.00 24.73 ? 71  PHE L O   1 
ATOM   3443 C CB  . PHE C 3 71  ? 20.041  -23.388 -17.613 1.00 21.60 ? 71  PHE L CB  1 
ATOM   3444 C CG  . PHE C 3 71  ? 19.823  -22.467 -16.468 1.00 20.96 ? 71  PHE L CG  1 
ATOM   3445 C CD1 . PHE C 3 71  ? 19.028  -22.873 -15.380 1.00 20.96 ? 71  PHE L CD1 1 
ATOM   3446 C CD2 . PHE C 3 71  ? 20.377  -21.183 -16.464 1.00 20.39 ? 71  PHE L CD2 1 
ATOM   3447 C CE1 . PHE C 3 71  ? 18.820  -22.020 -14.318 1.00 20.24 ? 71  PHE L CE1 1 
ATOM   3448 C CE2 . PHE C 3 71  ? 20.161  -20.348 -15.380 1.00 20.86 ? 71  PHE L CE2 1 
ATOM   3449 C CZ  . PHE C 3 71  ? 19.372  -20.764 -14.315 1.00 19.93 ? 71  PHE L CZ  1 
ATOM   3450 N N   . THR C 3 72  ? 20.975  -26.399 -18.445 1.00 23.93 ? 72  THR L N   1 
ATOM   3451 C CA  . THR C 3 72  ? 21.088  -27.478 -19.424 1.00 24.72 ? 72  THR L CA  1 
ATOM   3452 C C   . THR C 3 72  ? 19.694  -27.979 -19.786 1.00 24.55 ? 72  THR L C   1 
ATOM   3453 O O   . THR C 3 72  ? 18.911  -28.339 -18.847 1.00 23.26 ? 72  THR L O   1 
ATOM   3454 C CB  . THR C 3 72  ? 21.931  -28.592 -18.819 1.00 28.04 ? 72  THR L CB  1 
ATOM   3455 O OG1 . THR C 3 72  ? 23.169  -27.999 -18.409 1.00 28.76 ? 72  THR L OG1 1 
ATOM   3456 C CG2 . THR C 3 72  ? 22.185  -29.679 -19.828 1.00 29.71 ? 72  THR L CG2 1 
ATOM   3457 N N   . PHE C 3 73  ? 19.421  -28.116 -21.067 1.00 23.15 ? 73  PHE L N   1 
ATOM   3458 C CA  . PHE C 3 73  ? 18.192  -28.763 -21.598 1.00 23.03 ? 73  PHE L CA  1 
ATOM   3459 C C   . PHE C 3 73  ? 18.627  -30.028 -22.327 1.00 24.05 ? 73  PHE L C   1 
ATOM   3460 O O   . PHE C 3 73  ? 19.611  -29.974 -23.127 1.00 25.05 ? 73  PHE L O   1 
ATOM   3461 C CB  . PHE C 3 73  ? 17.463  -27.798 -22.527 1.00 23.01 ? 73  PHE L CB  1 
ATOM   3462 C CG  . PHE C 3 73  ? 16.264  -28.341 -23.251 1.00 22.92 ? 73  PHE L CG  1 
ATOM   3463 C CD1 . PHE C 3 73  ? 15.001  -28.302 -22.669 1.00 24.07 ? 73  PHE L CD1 1 
ATOM   3464 C CD2 . PHE C 3 73  ? 16.390  -28.857 -24.534 1.00 23.16 ? 73  PHE L CD2 1 
ATOM   3465 C CE1 . PHE C 3 73  ? 13.888  -28.767 -23.361 1.00 24.27 ? 73  PHE L CE1 1 
ATOM   3466 C CE2 . PHE C 3 73  ? 15.274  -29.258 -25.250 1.00 22.60 ? 73  PHE L CE2 1 
ATOM   3467 C CZ  . PHE C 3 73  ? 14.029  -29.238 -24.662 1.00 23.86 ? 73  PHE L CZ  1 
ATOM   3468 N N   . THR C 3 74  ? 17.953  -31.129 -22.052 1.00 24.38 ? 74  THR L N   1 
ATOM   3469 C CA  . THR C 3 74  ? 18.283  -32.444 -22.617 1.00 26.03 ? 74  THR L CA  1 
ATOM   3470 C C   . THR C 3 74  ? 17.052  -33.077 -23.266 1.00 27.18 ? 74  THR L C   1 
ATOM   3471 O O   . THR C 3 74  ? 15.957  -33.089 -22.640 1.00 26.83 ? 74  THR L O   1 
ATOM   3472 C CB  . THR C 3 74  ? 18.888  -33.352 -21.547 1.00 28.39 ? 74  THR L CB  1 
ATOM   3473 O OG1 . THR C 3 74  ? 20.012  -32.658 -20.997 1.00 28.24 ? 74  THR L OG1 1 
ATOM   3474 C CG2 . THR C 3 74  ? 19.278  -34.673 -22.155 1.00 29.38 ? 74  THR L CG2 1 
ATOM   3475 N N   . ILE C 3 75  ? 17.222  -33.595 -24.481 1.00 26.14 ? 75  ILE L N   1 
ATOM   3476 C CA  . ILE C 3 75  ? 16.304  -34.607 -25.055 1.00 27.54 ? 75  ILE L CA  1 
ATOM   3477 C C   . ILE C 3 75  ? 17.057  -35.924 -25.009 1.00 29.75 ? 75  ILE L C   1 
ATOM   3478 O O   . ILE C 3 75  ? 18.106  -36.024 -25.734 1.00 30.12 ? 75  ILE L O   1 
ATOM   3479 C CB  . ILE C 3 75  ? 15.867  -34.236 -26.480 1.00 26.50 ? 75  ILE L CB  1 
ATOM   3480 C CG1 . ILE C 3 75  ? 15.635  -32.738 -26.616 1.00 25.45 ? 75  ILE L CG1 1 
ATOM   3481 C CG2 . ILE C 3 75  ? 14.670  -35.064 -26.938 1.00 26.64 ? 75  ILE L CG2 1 
ATOM   3482 C CD1 . ILE C 3 75  ? 15.194  -32.380 -28.007 1.00 24.92 ? 75  ILE L CD1 1 
ATOM   3483 N N   . SER C 3 76  ? 16.598  -36.820 -24.140 1.00 31.09 ? 76  SER L N   1 
ATOM   3484 C CA  . SER C 3 76  ? 17.252  -38.110 -23.832 1.00 33.96 ? 76  SER L CA  1 
ATOM   3485 C C   . SER C 3 76  ? 17.409  -38.910 -25.133 1.00 34.61 ? 76  SER L C   1 
ATOM   3486 O O   . SER C 3 76  ? 18.568  -39.345 -25.414 1.00 36.54 ? 76  SER L O   1 
ATOM   3487 C CB  . SER C 3 76  ? 16.526  -38.859 -22.747 1.00 35.45 ? 76  SER L CB  1 
ATOM   3488 O OG  . SER C 3 76  ? 15.248  -39.295 -23.199 1.00 36.84 ? 76  SER L OG  1 
ATOM   3489 N N   . THR C 3 77  ? 16.342  -39.014 -25.941 1.00 32.69 ? 77  THR L N   1 
ATOM   3490 C CA  . THR C 3 77  ? 16.243  -39.910 -27.132 1.00 32.89 ? 77  THR L CA  1 
ATOM   3491 C C   . THR C 3 77  ? 15.403  -39.133 -28.130 1.00 31.34 ? 77  THR L C   1 
ATOM   3492 O O   . THR C 3 77  ? 14.160  -39.114 -28.009 1.00 29.89 ? 77  THR L O   1 
ATOM   3493 C CB  . THR C 3 77  ? 15.641  -41.295 -26.835 1.00 35.60 ? 77  THR L CB  1 
ATOM   3494 O OG1 . THR C 3 77  ? 14.330  -41.098 -26.284 1.00 37.69 ? 77  THR L OG1 1 
ATOM   3495 C CG2 . THR C 3 77  ? 16.430  -42.128 -25.838 1.00 37.25 ? 77  THR L CG2 1 
ATOM   3496 N N   . VAL C 3 78  ? 16.067  -38.382 -28.985 1.00 29.78 ? 78  VAL L N   1 
ATOM   3497 C CA  . VAL C 3 78  ? 15.351  -37.427 -29.864 1.00 29.02 ? 78  VAL L CA  1 
ATOM   3498 C C   . VAL C 3 78  ? 14.452  -38.217 -30.824 1.00 30.05 ? 78  VAL L C   1 
ATOM   3499 O O   . VAL C 3 78  ? 14.829  -39.323 -31.265 1.00 30.80 ? 78  VAL L O   1 
ATOM   3500 C CB  . VAL C 3 78  ? 16.324  -36.455 -30.554 1.00 28.71 ? 78  VAL L CB  1 
ATOM   3501 C CG1 . VAL C 3 78  ? 17.108  -37.131 -31.656 1.00 30.68 ? 78  VAL L CG1 1 
ATOM   3502 C CG2 . VAL C 3 78  ? 15.585  -35.228 -31.124 1.00 28.04 ? 78  VAL L CG2 1 
ATOM   3503 N N   . GLN C 3 79  ? 13.281  -37.650 -31.143 1.00 29.89 ? 79  GLN L N   1 
ATOM   3504 C CA  . GLN C 3 79  ? 12.317  -38.235 -32.121 1.00 29.78 ? 79  GLN L CA  1 
ATOM   3505 C C   . GLN C 3 79  ? 12.263  -37.319 -33.341 1.00 26.90 ? 79  GLN L C   1 
ATOM   3506 O O   . GLN C 3 79  ? 12.574  -36.133 -33.219 1.00 25.42 ? 79  GLN L O   1 
ATOM   3507 C CB  . GLN C 3 79  ? 10.887  -38.345 -31.573 1.00 31.81 ? 79  GLN L CB  1 
ATOM   3508 C CG  . GLN C 3 79  ? 10.726  -39.059 -30.235 1.00 34.55 ? 79  GLN L CG  1 
ATOM   3509 C CD  . GLN C 3 79  ? 11.103  -40.500 -30.355 1.00 38.07 ? 79  GLN L CD  1 
ATOM   3510 O OE1 . GLN C 3 79  ? 10.387  -41.326 -30.962 1.00 40.65 ? 79  GLN L OE1 1 
ATOM   3511 N NE2 . GLN C 3 79  ? 12.250  -40.814 -29.758 1.00 41.47 ? 79  GLN L NE2 1 
ATOM   3512 N N   . ALA C 3 80  ? 11.896  -37.894 -34.478 1.00 27.18 ? 80  ALA L N   1 
ATOM   3513 C CA  . ALA C 3 80  ? 11.782  -37.217 -35.779 1.00 26.59 ? 80  ALA L CA  1 
ATOM   3514 C C   . ALA C 3 80  ? 10.986  -35.914 -35.589 1.00 26.52 ? 80  ALA L C   1 
ATOM   3515 O O   . ALA C 3 80  ? 11.420  -34.823 -36.065 1.00 25.93 ? 80  ALA L O   1 
ATOM   3516 C CB  . ALA C 3 80  ? 11.134  -38.173 -36.740 1.00 26.45 ? 80  ALA L CB  1 
ATOM   3517 N N   . GLU C 3 81  ? 9.939   -35.977 -34.760 1.00 26.97 ? 81  GLU L N   1 
ATOM   3518 C CA  . GLU C 3 81  ? 8.998   -34.838 -34.582 1.00 27.33 ? 81  GLU L CA  1 
ATOM   3519 C C   . GLU C 3 81  ? 9.603   -33.752 -33.674 1.00 27.00 ? 81  GLU L C   1 
ATOM   3520 O O   . GLU C 3 81  ? 8.928   -32.721 -33.509 1.00 26.99 ? 81  GLU L O   1 
ATOM   3521 C CB  . GLU C 3 81  ? 7.629   -35.372 -34.133 1.00 29.52 ? 81  GLU L CB  1 
ATOM   3522 C CG  . GLU C 3 81  ? 7.634   -36.120 -32.777 1.00 31.40 ? 81  GLU L CG  1 
ATOM   3523 C CD  . GLU C 3 81  ? 7.697   -37.640 -32.902 1.00 34.46 ? 81  GLU L CD  1 
ATOM   3524 O OE1 . GLU C 3 81  ? 8.300   -38.178 -33.930 1.00 30.81 ? 81  GLU L OE1 1 
ATOM   3525 O OE2 . GLU C 3 81  ? 7.173   -38.329 -31.971 1.00 35.54 ? 81  GLU L OE2 1 
ATOM   3526 N N   . ASP C 3 82  ? 10.818  -33.929 -33.110 1.00 25.70 ? 82  ASP L N   1 
ATOM   3527 C CA  . ASP C 3 82  ? 11.459  -32.946 -32.201 1.00 24.54 ? 82  ASP L CA  1 
ATOM   3528 C C   . ASP C 3 82  ? 12.265  -31.902 -32.961 1.00 24.91 ? 82  ASP L C   1 
ATOM   3529 O O   . ASP C 3 82  ? 12.839  -30.953 -32.332 1.00 24.19 ? 82  ASP L O   1 
ATOM   3530 C CB  . ASP C 3 82  ? 12.267  -33.627 -31.092 1.00 25.59 ? 82  ASP L CB  1 
ATOM   3531 C CG  . ASP C 3 82  ? 11.473  -34.580 -30.208 1.00 25.47 ? 82  ASP L CG  1 
ATOM   3532 O OD1 . ASP C 3 82  ? 10.251  -34.434 -30.122 1.00 25.72 ? 82  ASP L OD1 1 
ATOM   3533 O OD2 . ASP C 3 82  ? 12.090  -35.490 -29.618 1.00 25.62 ? 82  ASP L OD2 1 
ATOM   3534 N N   . LEU C 3 83  ? 12.288  -31.970 -34.295 1.00 23.69 ? 83  LEU L N   1 
ATOM   3535 C CA  . LEU C 3 83  ? 12.974  -30.917 -35.049 1.00 23.59 ? 83  LEU L CA  1 
ATOM   3536 C C   . LEU C 3 83  ? 12.259  -29.577 -34.801 1.00 21.27 ? 83  LEU L C   1 
ATOM   3537 O O   . LEU C 3 83  ? 11.014  -29.517 -34.863 1.00 20.71 ? 83  LEU L O   1 
ATOM   3538 C CB  . LEU C 3 83  ? 13.036  -31.278 -36.543 1.00 25.97 ? 83  LEU L CB  1 
ATOM   3539 C CG  . LEU C 3 83  ? 11.792  -31.145 -37.413 1.00 29.19 ? 83  LEU L CG  1 
ATOM   3540 C CD1 . LEU C 3 83  ? 11.618  -29.746 -37.970 1.00 30.45 ? 83  LEU L CD1 1 
ATOM   3541 C CD2 . LEU C 3 83  ? 11.937  -32.109 -38.596 1.00 30.78 ? 83  LEU L CD2 1 
ATOM   3542 N N   . ALA C 3 84  ? 13.026  -28.565 -34.475 1.00 18.92 ? 84  ALA L N   1 
ATOM   3543 C CA  . ALA C 3 84  ? 12.518  -27.283 -33.957 1.00 19.09 ? 84  ALA L CA  1 
ATOM   3544 C C   . ALA C 3 84  ? 13.683  -26.373 -33.631 1.00 17.98 ? 84  ALA L C   1 
ATOM   3545 O O   . ALA C 3 84  ? 14.800  -26.868 -33.523 1.00 18.98 ? 84  ALA L O   1 
ATOM   3546 C CB  . ALA C 3 84  ? 11.743  -27.536 -32.697 1.00 18.98 ? 84  ALA L CB  1 
ATOM   3547 N N   . VAL C 3 85  ? 13.383  -25.117 -33.336 1.00 17.54 ? 85  VAL L N   1 
ATOM   3548 C CA  . VAL C 3 85  ? 14.322  -24.212 -32.646 1.00 17.80 ? 85  VAL L CA  1 
ATOM   3549 C C   . VAL C 3 85  ? 13.884  -24.205 -31.175 1.00 18.97 ? 85  VAL L C   1 
ATOM   3550 O O   . VAL C 3 85  ? 12.710  -23.968 -30.911 1.00 18.58 ? 85  VAL L O   1 
ATOM   3551 C CB  . VAL C 3 85  ? 14.342  -22.815 -33.249 1.00 18.71 ? 85  VAL L CB  1 
ATOM   3552 C CG1 . VAL C 3 85  ? 15.289  -21.896 -32.477 1.00 20.05 ? 85  VAL L CG1 1 
ATOM   3553 C CG2 . VAL C 3 85  ? 14.721  -22.908 -34.742 1.00 20.81 ? 85  VAL L CG2 1 
ATOM   3554 N N   . TYR C 3 86  ? 14.816  -24.465 -30.294 1.00 19.14 ? 86  TYR L N   1 
ATOM   3555 C CA  . TYR C 3 86  ? 14.577  -24.442 -28.824 1.00 19.69 ? 86  TYR L CA  1 
ATOM   3556 C C   . TYR C 3 86  ? 15.122  -23.124 -28.292 1.00 20.74 ? 86  TYR L C   1 
ATOM   3557 O O   . TYR C 3 86  ? 16.159  -22.686 -28.781 1.00 22.45 ? 86  TYR L O   1 
ATOM   3558 C CB  . TYR C 3 86  ? 15.251  -25.656 -28.188 1.00 19.77 ? 86  TYR L CB  1 
ATOM   3559 C CG  . TYR C 3 86  ? 14.583  -26.936 -28.588 1.00 19.17 ? 86  TYR L CG  1 
ATOM   3560 C CD1 . TYR C 3 86  ? 14.935  -27.585 -29.758 1.00 19.20 ? 86  TYR L CD1 1 
ATOM   3561 C CD2 . TYR C 3 86  ? 13.572  -27.493 -27.832 1.00 19.25 ? 86  TYR L CD2 1 
ATOM   3562 C CE1 . TYR C 3 86  ? 14.282  -28.718 -30.173 1.00 19.22 ? 86  TYR L CE1 1 
ATOM   3563 C CE2 . TYR C 3 86  ? 12.930  -28.647 -28.230 1.00 19.65 ? 86  TYR L CE2 1 
ATOM   3564 C CZ  . TYR C 3 86  ? 13.244  -29.239 -29.444 1.00 19.63 ? 86  TYR L CZ  1 
ATOM   3565 O OH  . TYR C 3 86  ? 12.659  -30.415 -29.820 1.00 19.97 ? 86  TYR L OH  1 
ATOM   3566 N N   . PHE C 3 87  ? 14.436  -22.486 -27.347 1.00 18.67 ? 87  PHE L N   1 
ATOM   3567 C CA  . PHE C 3 87  ? 14.847  -21.190 -26.777 1.00 19.24 ? 87  PHE L CA  1 
ATOM   3568 C C   . PHE C 3 87  ? 14.773  -21.312 -25.259 1.00 19.39 ? 87  PHE L C   1 
ATOM   3569 O O   . PHE C 3 87  ? 13.799  -21.908 -24.746 1.00 18.23 ? 87  PHE L O   1 
ATOM   3570 C CB  . PHE C 3 87  ? 13.917  -20.027 -27.145 1.00 19.37 ? 87  PHE L CB  1 
ATOM   3571 C CG  . PHE C 3 87  ? 13.907  -19.640 -28.584 1.00 19.90 ? 87  PHE L CG  1 
ATOM   3572 C CD1 . PHE C 3 87  ? 14.782  -18.657 -29.045 1.00 21.05 ? 87  PHE L CD1 1 
ATOM   3573 C CD2 . PHE C 3 87  ? 13.014  -20.200 -29.479 1.00 19.71 ? 87  PHE L CD2 1 
ATOM   3574 C CE1 . PHE C 3 87  ? 14.786  -18.276 -30.375 1.00 21.48 ? 87  PHE L CE1 1 
ATOM   3575 C CE2 . PHE C 3 87  ? 13.018  -19.825 -30.817 1.00 20.65 ? 87  PHE L CE2 1 
ATOM   3576 C CZ  . PHE C 3 87  ? 13.914  -18.878 -31.274 1.00 20.51 ? 87  PHE L CZ  1 
ATOM   3577 N N   . CYS C 3 88  ? 15.715  -20.689 -24.581 1.00 18.37 ? 88  CYS L N   1 
ATOM   3578 C CA  . CYS C 3 88  ? 15.593  -20.463 -23.125 1.00 18.73 ? 88  CYS L CA  1 
ATOM   3579 C C   . CYS C 3 88  ? 15.135  -19.007 -22.904 1.00 17.50 ? 88  CYS L C   1 
ATOM   3580 O O   . CYS C 3 88  ? 15.368  -18.096 -23.747 1.00 16.58 ? 88  CYS L O   1 
ATOM   3581 C CB  . CYS C 3 88  ? 16.898  -20.744 -22.392 1.00 19.93 ? 88  CYS L CB  1 
ATOM   3582 S SG  . CYS C 3 88  ? 18.215  -19.585 -22.873 1.00 21.98 ? 88  CYS L SG  1 
ATOM   3583 N N   . GLN C 3 89  ? 14.533  -18.776 -21.767 1.00 17.00 ? 89  GLN L N   1 
ATOM   3584 C CA  . GLN C 3 89  ? 14.038  -17.444 -21.379 1.00 17.46 ? 89  GLN L CA  1 
ATOM   3585 C C   . GLN C 3 89  ? 14.235  -17.289 -19.866 1.00 17.38 ? 89  GLN L C   1 
ATOM   3586 O O   . GLN C 3 89  ? 13.816  -18.157 -19.116 1.00 17.75 ? 89  GLN L O   1 
ATOM   3587 C CB  . GLN C 3 89  ? 12.547  -17.340 -21.716 1.00 17.13 ? 89  GLN L CB  1 
ATOM   3588 C CG  . GLN C 3 89  ? 11.957  -15.986 -21.312 1.00 18.66 ? 89  GLN L CG  1 
ATOM   3589 C CD  . GLN C 3 89  ? 10.561  -16.090 -20.744 1.00 19.63 ? 89  GLN L CD  1 
ATOM   3590 O OE1 . GLN C 3 89  ? 9.680   -16.733 -21.305 1.00 21.99 ? 89  GLN L OE1 1 
ATOM   3591 N NE2 . GLN C 3 89  ? 10.326  -15.396 -19.656 1.00 21.07 ? 89  GLN L NE2 1 
ATOM   3592 N N   . GLN C 3 90  ? 14.810  -16.192 -19.432 1.00 17.15 ? 90  GLN L N   1 
ATOM   3593 C CA  . GLN C 3 90  ? 14.837  -15.904 -17.987 1.00 17.94 ? 90  GLN L CA  1 
ATOM   3594 C C   . GLN C 3 90  ? 13.752  -14.905 -17.636 1.00 17.50 ? 90  GLN L C   1 
ATOM   3595 O O   . GLN C 3 90  ? 13.443  -13.983 -18.468 1.00 17.66 ? 90  GLN L O   1 
ATOM   3596 C CB  . GLN C 3 90  ? 16.202  -15.362 -17.545 1.00 18.67 ? 90  GLN L CB  1 
ATOM   3597 C CG  . GLN C 3 90  ? 16.554  -13.945 -18.009 1.00 19.25 ? 90  GLN L CG  1 
ATOM   3598 C CD  . GLN C 3 90  ? 15.964  -12.817 -17.185 1.00 19.11 ? 90  GLN L CD  1 
ATOM   3599 O OE1 . GLN C 3 90  ? 15.704  -12.957 -15.997 1.00 19.94 ? 90  GLN L OE1 1 
ATOM   3600 N NE2 . GLN C 3 90  ? 15.750  -11.675 -17.824 1.00 18.58 ? 90  GLN L NE2 1 
ATOM   3601 N N   . ASP C 3 91  ? 13.213  -15.027 -16.418 1.00 17.56 ? 91  ASP L N   1 
ATOM   3602 C CA  . ASP C 3 91  ? 12.318  -13.982 -15.894 1.00 18.22 ? 91  ASP L CA  1 
ATOM   3603 C C   . ASP C 3 91  ? 12.665  -13.639 -14.457 1.00 18.63 ? 91  ASP L C   1 
ATOM   3604 O O   . ASP C 3 91  ? 11.768  -13.107 -13.742 1.00 18.69 ? 91  ASP L O   1 
ATOM   3605 C CB  . ASP C 3 91  ? 10.848  -14.336 -16.082 1.00 18.40 ? 91  ASP L CB  1 
ATOM   3606 C CG  . ASP C 3 91  ? 10.356  -15.378 -15.106 1.00 18.88 ? 91  ASP L CG  1 
ATOM   3607 O OD1 . ASP C 3 91  ? 10.948  -16.503 -15.043 1.00 18.73 ? 91  ASP L OD1 1 
ATOM   3608 O OD2 . ASP C 3 91  ? 9.368   -15.009 -14.349 1.00 20.13 ? 91  ASP L OD2 1 
ATOM   3609 N N   . TYR C 3 92  ? 13.916  -13.856 -14.031 1.00 18.57 ? 92  TYR L N   1 
ATOM   3610 C CA  . TYR C 3 92  ? 14.394  -13.308 -12.733 1.00 19.28 ? 92  TYR L CA  1 
ATOM   3611 C C   . TYR C 3 92  ? 14.392  -11.768 -12.767 1.00 19.66 ? 92  TYR L C   1 
ATOM   3612 O O   . TYR C 3 92  ? 13.875  -11.125 -11.843 1.00 20.65 ? 92  TYR L O   1 
ATOM   3613 C CB  . TYR C 3 92  ? 15.748  -13.901 -12.423 1.00 19.48 ? 92  TYR L CB  1 
ATOM   3614 C CG  . TYR C 3 92  ? 16.314  -13.448 -11.094 1.00 21.01 ? 92  TYR L CG  1 
ATOM   3615 C CD1 . TYR C 3 92  ? 15.993  -14.119 -9.927  1.00 21.10 ? 92  TYR L CD1 1 
ATOM   3616 C CD2 . TYR C 3 92  ? 17.194  -12.385 -11.020 1.00 22.10 ? 92  TYR L CD2 1 
ATOM   3617 C CE1 . TYR C 3 92  ? 16.533  -13.732 -8.698  1.00 22.58 ? 92  TYR L CE1 1 
ATOM   3618 C CE2 . TYR C 3 92  ? 17.745  -11.983 -9.812  1.00 24.03 ? 92  TYR L CE2 1 
ATOM   3619 C CZ  . TYR C 3 92  ? 17.382  -12.633 -8.642  1.00 23.67 ? 92  TYR L CZ  1 
ATOM   3620 O OH  . TYR C 3 92  ? 17.970  -12.279 -7.452  1.00 25.14 ? 92  TYR L OH  1 
ATOM   3621 N N   . GLY C 3 93  ? 15.001  -11.217 -13.813 1.00 21.12 ? 93  GLY L N   1 
ATOM   3622 C CA  . GLY C 3 93  ? 15.195  -9.771  -14.035 1.00 22.56 ? 93  GLY L CA  1 
ATOM   3623 C C   . GLY C 3 93  ? 14.124  -9.244  -14.956 1.00 23.39 ? 93  GLY L C   1 
ATOM   3624 O O   . GLY C 3 93  ? 13.578  -10.046 -15.700 1.00 23.91 ? 93  GLY L O   1 
ATOM   3625 N N   . SER C 3 94  ? 13.788  -7.975  -14.835 1.00 23.53 ? 94  SER L N   1 
ATOM   3626 C CA  . SER C 3 94  ? 12.878  -7.309  -15.779 1.00 24.65 ? 94  SER L CA  1 
ATOM   3627 C C   . SER C 3 94  ? 13.776  -6.475  -16.686 1.00 24.73 ? 94  SER L C   1 
ATOM   3628 O O   . SER C 3 94  ? 14.625  -5.747  -16.160 1.00 26.10 ? 94  SER L O   1 
ATOM   3629 C CB  . SER C 3 94  ? 11.882  -6.463  -15.048 1.00 26.66 ? 94  SER L CB  1 
ATOM   3630 O OG  . SER C 3 94  ? 10.940  -6.026  -16.005 1.00 28.45 ? 94  SER L OG  1 
ATOM   3631 N N   . PRO C 3 95  ? 13.639  -6.545  -18.009 1.00 22.11 ? 95  PRO L N   1 
ATOM   3632 C CA  . PRO C 3 95  ? 12.615  -7.369  -18.672 1.00 21.34 ? 95  PRO L CA  1 
ATOM   3633 C C   . PRO C 3 95  ? 12.989  -8.837  -18.791 1.00 20.14 ? 95  PRO L C   1 
ATOM   3634 O O   . PRO C 3 95  ? 14.171  -9.196  -18.802 1.00 20.25 ? 95  PRO L O   1 
ATOM   3635 C CB  . PRO C 3 95  ? 12.577  -6.764  -20.085 1.00 21.90 ? 95  PRO L CB  1 
ATOM   3636 C CG  . PRO C 3 95  ? 14.017  -6.295  -20.335 1.00 22.09 ? 95  PRO L CG  1 
ATOM   3637 C CD  . PRO C 3 95  ? 14.485  -5.812  -18.973 1.00 23.39 ? 95  PRO L CD  1 
ATOM   3638 N N   . PRO C 3 96  ? 11.997  -9.752  -18.962 1.00 19.51 ? 96  PRO L N   1 
ATOM   3639 C CA  . PRO C 3 96  ? 12.297  -11.097 -19.409 1.00 17.95 ? 96  PRO L CA  1 
ATOM   3640 C C   . PRO C 3 96  ? 13.113  -11.008 -20.705 1.00 17.38 ? 96  PRO L C   1 
ATOM   3641 O O   . PRO C 3 96  ? 12.852  -10.155 -21.552 1.00 16.56 ? 96  PRO L O   1 
ATOM   3642 C CB  . PRO C 3 96  ? 10.940  -11.789 -19.620 1.00 18.86 ? 96  PRO L CB  1 
ATOM   3643 C CG  . PRO C 3 96  ? 9.939   -10.913 -18.894 1.00 19.36 ? 96  PRO L CG  1 
ATOM   3644 C CD  . PRO C 3 96  ? 10.545  -9.524  -18.808 1.00 19.82 ? 96  PRO L CD  1 
ATOM   3645 N N   . THR C 3 97  ? 14.085  -11.908 -20.846 1.00 16.83 ? 97  THR L N   1 
ATOM   3646 C CA  . THR C 3 97  ? 14.966  -11.989 -22.031 1.00 17.28 ? 97  THR L CA  1 
ATOM   3647 C C   . THR C 3 97  ? 15.127  -13.438 -22.452 1.00 17.01 ? 97  THR L C   1 
ATOM   3648 O O   . THR C 3 97  ? 15.044  -14.377 -21.617 1.00 18.08 ? 97  THR L O   1 
ATOM   3649 C CB  . THR C 3 97  ? 16.310  -11.278 -21.809 1.00 18.49 ? 97  THR L CB  1 
ATOM   3650 O OG1 . THR C 3 97  ? 16.852  -11.873 -20.643 1.00 18.56 ? 97  THR L OG1 1 
ATOM   3651 C CG2 . THR C 3 97  ? 16.141  -9.791  -21.652 1.00 19.19 ? 97  THR L CG2 1 
ATOM   3652 N N   . PHE C 3 98  ? 15.382  -13.630 -23.747 1.00 17.16 ? 98  PHE L N   1 
ATOM   3653 C CA  . PHE C 3 98  ? 15.429  -14.949 -24.388 1.00 17.03 ? 98  PHE L CA  1 
ATOM   3654 C C   . PHE C 3 98  ? 16.838  -15.219 -24.904 1.00 17.89 ? 98  PHE L C   1 
ATOM   3655 O O   . PHE C 3 98  ? 17.494  -14.249 -25.394 1.00 19.02 ? 98  PHE L O   1 
ATOM   3656 C CB  . PHE C 3 98  ? 14.500  -14.969 -25.600 1.00 16.77 ? 98  PHE L CB  1 
ATOM   3657 C CG  . PHE C 3 98  ? 13.031  -14.926 -25.269 1.00 16.77 ? 98  PHE L CG  1 
ATOM   3658 C CD1 . PHE C 3 98  ? 12.316  -16.080 -25.134 1.00 17.12 ? 98  PHE L CD1 1 
ATOM   3659 C CD2 . PHE C 3 98  ? 12.405  -13.723 -25.015 1.00 17.36 ? 98  PHE L CD2 1 
ATOM   3660 C CE1 . PHE C 3 98  ? 10.962  -16.036 -24.837 1.00 17.17 ? 98  PHE L CE1 1 
ATOM   3661 C CE2 . PHE C 3 98  ? 11.044  -13.678 -24.738 1.00 17.66 ? 98  PHE L CE2 1 
ATOM   3662 C CZ  . PHE C 3 98  ? 10.330  -14.837 -24.636 1.00 17.48 ? 98  PHE L CZ  1 
ATOM   3663 N N   . GLY C 3 99  ? 17.239  -16.476 -24.930 1.00 18.53 ? 99  GLY L N   1 
ATOM   3664 C CA  . GLY C 3 99  ? 18.390  -16.893 -25.726 1.00 19.11 ? 99  GLY L CA  1 
ATOM   3665 C C   . GLY C 3 99  ? 18.160  -16.775 -27.217 1.00 20.42 ? 99  GLY L C   1 
ATOM   3666 O O   . GLY C 3 99  ? 17.008  -16.539 -27.703 1.00 19.73 ? 99  GLY L O   1 
ATOM   3667 N N   . GLY C 3 100 ? 19.246  -16.922 -27.973 1.00 20.39 ? 100 GLY L N   1 
ATOM   3668 C CA  . GLY C 3 100 ? 19.209  -16.832 -29.451 1.00 21.54 ? 100 GLY L CA  1 
ATOM   3669 C C   . GLY C 3 100 ? 18.669  -18.077 -30.138 1.00 22.08 ? 100 GLY L C   1 
ATOM   3670 O O   . GLY C 3 100 ? 18.463  -18.055 -31.380 1.00 24.13 ? 100 GLY L O   1 
ATOM   3671 N N   . GLY C 3 101 ? 18.521  -19.173 -29.425 1.00 21.89 ? 101 GLY L N   1 
ATOM   3672 C CA  . GLY C 3 101 ? 17.924  -20.393 -29.958 1.00 22.40 ? 101 GLY L CA  1 
ATOM   3673 C C   . GLY C 3 101 ? 18.936  -21.424 -30.401 1.00 21.80 ? 101 GLY L C   1 
ATOM   3674 O O   . GLY C 3 101 ? 20.105  -21.098 -30.702 1.00 23.47 ? 101 GLY L O   1 
ATOM   3675 N N   . THR C 3 102 ? 18.491  -22.662 -30.444 1.00 22.09 ? 102 THR L N   1 
ATOM   3676 C CA  . THR C 3 102 ? 19.291  -23.794 -30.982 1.00 22.24 ? 102 THR L CA  1 
ATOM   3677 C C   . THR C 3 102 ? 18.418  -24.525 -31.990 1.00 22.09 ? 102 THR L C   1 
ATOM   3678 O O   . THR C 3 102 ? 17.333  -25.022 -31.613 1.00 21.74 ? 102 THR L O   1 
ATOM   3679 C CB  . THR C 3 102 ? 19.824  -24.716 -29.878 1.00 21.94 ? 102 THR L CB  1 
ATOM   3680 O OG1 . THR C 3 102 ? 20.624  -23.974 -28.947 1.00 21.76 ? 102 THR L OG1 1 
ATOM   3681 C CG2 . THR C 3 102 ? 20.572  -25.877 -30.502 1.00 23.84 ? 102 THR L CG2 1 
ATOM   3682 N N   . LYS C 3 103 ? 18.842  -24.597 -33.255 1.00 21.42 ? 103 LYS L N   1 
ATOM   3683 C CA  . LYS C 3 103 ? 18.103  -25.326 -34.283 1.00 22.68 ? 103 LYS L CA  1 
ATOM   3684 C C   . LYS C 3 103 ? 18.483  -26.796 -34.215 1.00 23.53 ? 103 LYS L C   1 
ATOM   3685 O O   . LYS C 3 103 ? 19.677  -27.117 -34.375 1.00 26.18 ? 103 LYS L O   1 
ATOM   3686 C CB  . LYS C 3 103 ? 18.378  -24.741 -35.677 1.00 25.10 ? 103 LYS L CB  1 
ATOM   3687 C CG  . LYS C 3 103 ? 17.525  -25.376 -36.761 1.00 27.04 ? 103 LYS L CG  1 
ATOM   3688 C CD  . LYS C 3 103 ? 17.668  -24.746 -38.122 1.00 29.93 ? 103 LYS L CD  1 
ATOM   3689 C CE  . LYS C 3 103 ? 16.747  -25.450 -39.100 1.00 32.18 ? 103 LYS L CE  1 
ATOM   3690 N NZ  . LYS C 3 103 ? 17.018  -25.047 -40.505 1.00 35.83 ? 103 LYS L NZ  1 
ATOM   3691 N N   . VAL C 3 104 ? 17.518  -27.668 -34.026 1.00 23.81 ? 104 VAL L N   1 
ATOM   3692 C CA  . VAL C 3 104 ? 17.755  -29.129 -33.961 1.00 23.87 ? 104 VAL L CA  1 
ATOM   3693 C C   . VAL C 3 104 ? 17.230  -29.728 -35.246 1.00 24.54 ? 104 VAL L C   1 
ATOM   3694 O O   . VAL C 3 104 ? 16.007  -29.665 -35.495 1.00 23.58 ? 104 VAL L O   1 
ATOM   3695 C CB  . VAL C 3 104 ? 17.116  -29.778 -32.723 1.00 24.30 ? 104 VAL L CB  1 
ATOM   3696 C CG1 . VAL C 3 104 ? 17.235  -31.280 -32.801 1.00 24.47 ? 104 VAL L CG1 1 
ATOM   3697 C CG2 . VAL C 3 104 ? 17.736  -29.254 -31.435 1.00 24.45 ? 104 VAL L CG2 1 
ATOM   3698 N N   . GLU C 3 105 ? 18.147  -30.346 -35.999 1.00 27.11 ? 105 GLU L N   1 
ATOM   3699 C CA  . GLU C 3 105 ? 17.939  -30.930 -37.346 1.00 29.03 ? 105 GLU L CA  1 
ATOM   3700 C C   . GLU C 3 105 ? 18.194  -32.422 -37.262 1.00 27.05 ? 105 GLU L C   1 
ATOM   3701 O O   . GLU C 3 105 ? 19.039  -32.854 -36.428 1.00 28.47 ? 105 GLU L O   1 
ATOM   3702 C CB  . GLU C 3 105 ? 18.917  -30.335 -38.365 1.00 31.72 ? 105 GLU L CB  1 
ATOM   3703 C CG  . GLU C 3 105 ? 19.034  -28.842 -38.246 1.00 34.06 ? 105 GLU L CG  1 
ATOM   3704 C CD  . GLU C 3 105 ? 19.809  -28.212 -39.384 1.00 39.22 ? 105 GLU L CD  1 
ATOM   3705 O OE1 . GLU C 3 105 ? 21.025  -27.923 -39.181 1.00 44.89 ? 105 GLU L OE1 1 
ATOM   3706 O OE2 . GLU C 3 105 ? 19.204  -28.080 -40.463 1.00 41.32 ? 105 GLU L OE2 1 
ATOM   3707 N N   . ILE C 3 106 ? 17.404  -33.197 -37.994 1.00 27.17 ? 106 ILE L N   1 
ATOM   3708 C CA  . ILE C 3 106 ? 17.426  -34.670 -37.888 1.00 27.81 ? 106 ILE L CA  1 
ATOM   3709 C C   . ILE C 3 106 ? 18.283  -35.198 -39.055 1.00 28.46 ? 106 ILE L C   1 
ATOM   3710 O O   . ILE C 3 106 ? 18.150  -34.733 -40.205 1.00 26.15 ? 106 ILE L O   1 
ATOM   3711 C CB  . ILE C 3 106 ? 16.023  -35.288 -37.888 1.00 28.55 ? 106 ILE L CB  1 
ATOM   3712 C CG1 . ILE C 3 106 ? 15.094  -34.761 -36.775 1.00 29.39 ? 106 ILE L CG1 1 
ATOM   3713 C CG2 . ILE C 3 106 ? 16.144  -36.787 -37.848 1.00 29.39 ? 106 ILE L CG2 1 
ATOM   3714 C CD1 . ILE C 3 106 ? 15.571  -35.073 -35.349 1.00 30.70 ? 106 ILE L CD1 1 
ATOM   3715 N N   . LYS C 3 107 ? 19.144  -36.149 -38.736 1.00 30.92 ? 107 LYS L N   1 
ATOM   3716 C CA  . LYS C 3 107 ? 19.992  -36.884 -39.692 1.00 31.40 ? 107 LYS L CA  1 
ATOM   3717 C C   . LYS C 3 107 ? 19.293  -38.218 -39.866 1.00 31.66 ? 107 LYS L C   1 
ATOM   3718 O O   . LYS C 3 107 ? 18.890  -38.804 -38.833 1.00 33.25 ? 107 LYS L O   1 
ATOM   3719 C CB  . LYS C 3 107 ? 21.401  -37.079 -39.126 1.00 33.62 ? 107 LYS L CB  1 
ATOM   3720 C CG  . LYS C 3 107 ? 22.389  -37.842 -40.001 1.00 38.52 ? 107 LYS L CG  1 
ATOM   3721 C CD  . LYS C 3 107 ? 23.748  -37.916 -39.293 1.00 43.15 ? 107 LYS L CD  1 
ATOM   3722 C CE  . LYS C 3 107 ? 24.952  -37.787 -40.197 1.00 47.17 ? 107 LYS L CE  1 
ATOM   3723 N NZ  . LYS C 3 107 ? 25.377  -39.130 -40.635 1.00 50.43 ? 107 LYS L NZ  1 
ATOM   3724 N N   . ARG C 3 108 ? 19.118  -38.648 -41.110 1.00 28.45 ? 108 ARG L N   1 
ATOM   3725 C CA  . ARG C 3 108 ? 18.457  -39.924 -41.393 1.00 28.46 ? 108 ARG L CA  1 
ATOM   3726 C C   . ARG C 3 108 ? 19.233  -40.567 -42.551 1.00 27.94 ? 108 ARG L C   1 
ATOM   3727 O O   . ARG C 3 108 ? 20.197  -39.946 -43.065 1.00 27.37 ? 108 ARG L O   1 
ATOM   3728 C CB  . ARG C 3 108 ? 16.981  -39.739 -41.736 1.00 27.80 ? 108 ARG L CB  1 
ATOM   3729 C CG  . ARG C 3 108 ? 16.725  -38.761 -42.878 1.00 26.71 ? 108 ARG L CG  1 
ATOM   3730 C CD  . ARG C 3 108 ? 15.470  -39.192 -43.606 1.00 26.81 ? 108 ARG L CD  1 
ATOM   3731 N NE  . ARG C 3 108 ? 15.655  -40.419 -44.333 1.00 28.45 ? 108 ARG L NE  1 
ATOM   3732 C CZ  . ARG C 3 108 ? 14.685  -41.154 -44.872 1.00 29.39 ? 108 ARG L CZ  1 
ATOM   3733 N NH1 . ARG C 3 108 ? 13.420  -40.819 -44.705 1.00 29.61 ? 108 ARG L NH1 1 
ATOM   3734 N NH2 . ARG C 3 108 ? 14.958  -42.241 -45.564 1.00 30.28 ? 108 ARG L NH2 1 
ATOM   3735 N N   . THR C 3 109 ? 18.754  -41.711 -43.000 1.00 27.72 ? 109 THR L N   1 
ATOM   3736 C CA  . THR C 3 109 ? 19.384  -42.436 -44.110 1.00 27.84 ? 109 THR L CA  1 
ATOM   3737 C C   . THR C 3 109 ? 19.178  -41.601 -45.369 1.00 26.13 ? 109 THR L C   1 
ATOM   3738 O O   . THR C 3 109 ? 18.188  -40.854 -45.454 1.00 24.38 ? 109 THR L O   1 
ATOM   3739 C CB  . THR C 3 109 ? 18.825  -43.868 -44.253 1.00 29.44 ? 109 THR L CB  1 
ATOM   3740 O OG1 . THR C 3 109 ? 17.401  -43.702 -44.418 1.00 28.34 ? 109 THR L OG1 1 
ATOM   3741 C CG2 . THR C 3 109 ? 19.197  -44.777 -43.096 1.00 30.85 ? 109 THR L CG2 1 
ATOM   3742 N N   . VAL C 3 110 ? 20.039  -41.842 -46.371 1.00 26.30 ? 110 VAL L N   1 
ATOM   3743 C CA  . VAL C 3 110 ? 19.851  -41.261 -47.722 1.00 25.07 ? 110 VAL L CA  1 
ATOM   3744 C C   . VAL C 3 110 ? 18.479  -41.682 -48.289 1.00 24.92 ? 110 VAL L C   1 
ATOM   3745 O O   . VAL C 3 110 ? 18.109  -42.882 -48.155 1.00 25.24 ? 110 VAL L O   1 
ATOM   3746 C CB  . VAL C 3 110 ? 21.010  -41.639 -48.662 1.00 26.08 ? 110 VAL L CB  1 
ATOM   3747 C CG1 . VAL C 3 110 ? 20.714  -41.252 -50.102 1.00 25.40 ? 110 VAL L CG1 1 
ATOM   3748 C CG2 . VAL C 3 110 ? 22.303  -40.981 -48.172 1.00 26.57 ? 110 VAL L CG2 1 
ATOM   3749 N N   . ALA C 3 111 ? 17.760  -40.715 -48.872 1.00 23.15 ? 111 ALA L N   1 
ATOM   3750 C CA  . ALA C 3 111 ? 16.505  -40.941 -49.621 1.00 23.08 ? 111 ALA L CA  1 
ATOM   3751 C C   . ALA C 3 111 ? 16.571  -40.160 -50.918 1.00 22.55 ? 111 ALA L C   1 
ATOM   3752 O O   . ALA C 3 111 ? 16.754  -38.908 -50.886 1.00 20.83 ? 111 ALA L O   1 
ATOM   3753 C CB  . ALA C 3 111 ? 15.303  -40.548 -48.808 1.00 22.52 ? 111 ALA L CB  1 
ATOM   3754 N N   . ALA C 3 112 ? 16.399  -40.861 -52.030 1.00 22.98 ? 112 ALA L N   1 
ATOM   3755 C CA  . ALA C 3 112 ? 16.420  -40.240 -53.360 1.00 23.06 ? 112 ALA L CA  1 
ATOM   3756 C C   . ALA C 3 112 ? 15.148  -39.405 -53.543 1.00 22.20 ? 112 ALA L C   1 
ATOM   3757 O O   . ALA C 3 112 ? 14.083  -39.809 -53.108 1.00 23.38 ? 112 ALA L O   1 
ATOM   3758 C CB  . ALA C 3 112 ? 16.538  -41.294 -54.416 1.00 23.93 ? 112 ALA L CB  1 
ATOM   3759 N N   . PRO C 3 113 ? 15.190  -38.289 -54.278 1.00 21.58 ? 113 PRO L N   1 
ATOM   3760 C CA  . PRO C 3 113 ? 13.974  -37.554 -54.636 1.00 21.12 ? 113 PRO L CA  1 
ATOM   3761 C C   . PRO C 3 113 ? 13.133  -38.276 -55.699 1.00 21.72 ? 113 PRO L C   1 
ATOM   3762 O O   . PRO C 3 113 ? 13.683  -38.925 -56.552 1.00 23.30 ? 113 PRO L O   1 
ATOM   3763 C CB  . PRO C 3 113 ? 14.506  -36.242 -55.235 1.00 20.27 ? 113 PRO L CB  1 
ATOM   3764 C CG  . PRO C 3 113 ? 15.845  -36.587 -55.748 1.00 20.78 ? 113 PRO L CG  1 
ATOM   3765 C CD  . PRO C 3 113 ? 16.391  -37.702 -54.881 1.00 21.25 ? 113 PRO L CD  1 
ATOM   3766 N N   . SER C 3 114 ? 11.821  -38.160 -55.626 1.00 22.32 ? 114 SER L N   1 
ATOM   3767 C CA  A SER C 3 114 ? 10.892  -38.361 -56.766 0.60 22.74 ? 114 SER L CA  1 
ATOM   3768 C CA  B SER C 3 114 ? 10.892  -38.357 -56.768 0.40 22.65 ? 114 SER L CA  1 
ATOM   3769 C C   . SER C 3 114 ? 10.821  -37.028 -57.528 1.00 22.15 ? 114 SER L C   1 
ATOM   3770 O O   . SER C 3 114 ? 10.669  -35.993 -56.881 1.00 22.12 ? 114 SER L O   1 
ATOM   3771 C CB  A SER C 3 114 ? 9.538   -38.823 -56.289 0.60 23.56 ? 114 SER L CB  1 
ATOM   3772 C CB  B SER C 3 114 ? 9.531   -38.807 -56.306 0.40 23.29 ? 114 SER L CB  1 
ATOM   3773 O OG  A SER C 3 114 ? 9.662   -39.857 -55.315 0.60 24.73 ? 114 SER L OG  1 
ATOM   3774 O OG  B SER C 3 114 ? 9.009   -37.924 -55.323 0.40 22.80 ? 114 SER L OG  1 
ATOM   3775 N N   . VAL C 3 115 ? 10.927  -37.062 -58.834 1.00 21.44 ? 115 VAL L N   1 
ATOM   3776 C CA  . VAL C 3 115 ? 11.045  -35.807 -59.600 1.00 21.69 ? 115 VAL L CA  1 
ATOM   3777 C C   . VAL C 3 115 ? 9.815   -35.629 -60.474 1.00 22.95 ? 115 VAL L C   1 
ATOM   3778 O O   . VAL C 3 115 ? 9.409   -36.607 -61.145 1.00 24.47 ? 115 VAL L O   1 
ATOM   3779 C CB  . VAL C 3 115 ? 12.335  -35.794 -60.421 1.00 21.47 ? 115 VAL L CB  1 
ATOM   3780 C CG1 . VAL C 3 115 ? 12.533  -34.490 -61.169 1.00 21.44 ? 115 VAL L CG1 1 
ATOM   3781 C CG2 . VAL C 3 115 ? 13.522  -36.070 -59.523 1.00 21.92 ? 115 VAL L CG2 1 
ATOM   3782 N N   . PHE C 3 116 ? 9.346   -34.392 -60.576 1.00 21.18 ? 116 PHE L N   1 
ATOM   3783 C CA  . PHE C 3 116 ? 8.181   -34.066 -61.412 1.00 21.79 ? 116 PHE L CA  1 
ATOM   3784 C C   . PHE C 3 116 ? 8.446   -32.749 -62.092 1.00 21.62 ? 116 PHE L C   1 
ATOM   3785 O O   . PHE C 3 116 ? 8.921   -31.821 -61.402 1.00 20.77 ? 116 PHE L O   1 
ATOM   3786 C CB  . PHE C 3 116 ? 6.921   -33.930 -60.565 1.00 21.84 ? 116 PHE L CB  1 
ATOM   3787 C CG  . PHE C 3 116 ? 6.598   -35.108 -59.684 1.00 22.75 ? 116 PHE L CG  1 
ATOM   3788 C CD1 . PHE C 3 116 ? 5.765   -36.132 -60.154 1.00 24.50 ? 116 PHE L CD1 1 
ATOM   3789 C CD2 . PHE C 3 116 ? 7.225   -35.264 -58.472 1.00 22.20 ? 116 PHE L CD2 1 
ATOM   3790 C CE1 . PHE C 3 116 ? 5.473   -37.225 -59.356 1.00 24.36 ? 116 PHE L CE1 1 
ATOM   3791 C CE2 . PHE C 3 116 ? 6.923   -36.345 -57.674 1.00 23.35 ? 116 PHE L CE2 1 
ATOM   3792 C CZ  . PHE C 3 116 ? 6.025   -37.304 -58.100 1.00 24.49 ? 116 PHE L CZ  1 
ATOM   3793 N N   . ILE C 3 117 ? 7.957   -32.626 -63.321 1.00 21.94 ? 117 ILE L N   1 
ATOM   3794 C CA  . ILE C 3 117 ? 8.094   -31.354 -64.068 1.00 21.40 ? 117 ILE L CA  1 
ATOM   3795 C C   . ILE C 3 117 ? 6.698   -30.876 -64.450 1.00 22.42 ? 117 ILE L C   1 
ATOM   3796 O O   . ILE C 3 117 ? 5.828   -31.711 -64.812 1.00 23.00 ? 117 ILE L O   1 
ATOM   3797 C CB  . ILE C 3 117 ? 9.031   -31.492 -65.256 1.00 21.14 ? 117 ILE L CB  1 
ATOM   3798 C CG1 . ILE C 3 117 ? 9.273   -30.120 -65.881 1.00 20.94 ? 117 ILE L CG1 1 
ATOM   3799 C CG2 . ILE C 3 117 ? 8.474   -32.513 -66.268 1.00 22.13 ? 117 ILE L CG2 1 
ATOM   3800 C CD1 . ILE C 3 117 ? 10.367  -30.058 -66.862 1.00 21.24 ? 117 ILE L CD1 1 
ATOM   3801 N N   . PHE C 3 118 ? 6.488   -29.566 -64.356 1.00 21.86 ? 118 PHE L N   1 
ATOM   3802 C CA  . PHE C 3 118 ? 5.194   -28.943 -64.701 1.00 22.65 ? 118 PHE L CA  1 
ATOM   3803 C C   . PHE C 3 118 ? 5.390   -27.857 -65.730 1.00 23.16 ? 118 PHE L C   1 
ATOM   3804 O O   . PHE C 3 118 ? 6.132   -26.908 -65.510 1.00 22.29 ? 118 PHE L O   1 
ATOM   3805 C CB  . PHE C 3 118 ? 4.622   -28.304 -63.465 1.00 22.13 ? 118 PHE L CB  1 
ATOM   3806 C CG  . PHE C 3 118 ? 4.308   -29.256 -62.364 1.00 22.03 ? 118 PHE L CG  1 
ATOM   3807 C CD1 . PHE C 3 118 ? 3.178   -30.044 -62.463 1.00 22.67 ? 118 PHE L CD1 1 
ATOM   3808 C CD2 . PHE C 3 118 ? 5.180   -29.429 -61.304 1.00 21.64 ? 118 PHE L CD2 1 
ATOM   3809 C CE1 . PHE C 3 118 ? 2.859   -30.910 -61.450 1.00 23.44 ? 118 PHE L CE1 1 
ATOM   3810 C CE2 . PHE C 3 118 ? 4.859   -30.289 -60.272 1.00 22.64 ? 118 PHE L CE2 1 
ATOM   3811 C CZ  . PHE C 3 118 ? 3.685   -31.017 -60.349 1.00 23.14 ? 118 PHE L CZ  1 
ATOM   3812 N N   . PRO C 3 119 ? 4.759   -27.951 -66.917 1.00 23.80 ? 119 PRO L N   1 
ATOM   3813 C CA  . PRO C 3 119 ? 4.832   -26.858 -67.869 1.00 24.25 ? 119 PRO L CA  1 
ATOM   3814 C C   . PRO C 3 119 ? 4.019   -25.683 -67.369 1.00 24.01 ? 119 PRO L C   1 
ATOM   3815 O O   . PRO C 3 119 ? 3.212   -25.822 -66.451 1.00 23.46 ? 119 PRO L O   1 
ATOM   3816 C CB  . PRO C 3 119 ? 4.140   -27.364 -69.151 1.00 25.38 ? 119 PRO L CB  1 
ATOM   3817 C CG  . PRO C 3 119 ? 3.953   -28.844 -68.911 1.00 26.44 ? 119 PRO L CG  1 
ATOM   3818 C CD  . PRO C 3 119 ? 3.950   -29.078 -67.405 1.00 25.82 ? 119 PRO L CD  1 
ATOM   3819 N N   . PRO C 3 120 ? 4.223   -24.491 -67.945 1.00 24.91 ? 120 PRO L N   1 
ATOM   3820 C CA  . PRO C 3 120 ? 3.394   -23.342 -67.647 1.00 26.00 ? 120 PRO L CA  1 
ATOM   3821 C C   . PRO C 3 120 ? 1.954   -23.593 -68.089 1.00 27.23 ? 120 PRO L C   1 
ATOM   3822 O O   . PRO C 3 120 ? 1.759   -24.251 -69.087 1.00 26.30 ? 120 PRO L O   1 
ATOM   3823 C CB  . PRO C 3 120 ? 3.962   -22.208 -68.481 1.00 26.89 ? 120 PRO L CB  1 
ATOM   3824 C CG  . PRO C 3 120 ? 4.772   -22.873 -69.535 1.00 26.56 ? 120 PRO L CG  1 
ATOM   3825 C CD  . PRO C 3 120 ? 5.273   -24.160 -68.916 1.00 25.68 ? 120 PRO L CD  1 
ATOM   3826 N N   . SER C 3 121 ? 1.001   -23.126 -67.291 1.00 28.55 ? 121 SER L N   1 
ATOM   3827 C CA  . SER C 3 121 ? -0.437  -23.145 -67.669 1.00 31.16 ? 121 SER L CA  1 
ATOM   3828 C C   . SER C 3 121 ? -0.680  -22.264 -68.901 1.00 32.11 ? 121 SER L C   1 
ATOM   3829 O O   . SER C 3 121 ? 0.009   -21.237 -69.143 1.00 33.22 ? 121 SER L O   1 
ATOM   3830 C CB  . SER C 3 121 ? -1.342  -22.709 -66.513 1.00 30.83 ? 121 SER L CB  1 
ATOM   3831 O OG  . SER C 3 121 ? -1.112  -21.354 -66.157 1.00 30.60 ? 121 SER L OG  1 
ATOM   3832 N N   . ASP C 3 122 ? -1.774  -22.569 -69.608 1.00 35.77 ? 122 ASP L N   1 
ATOM   3833 C CA  . ASP C 3 122 ? -2.243  -21.698 -70.719 1.00 37.94 ? 122 ASP L CA  1 
ATOM   3834 C C   . ASP C 3 122 ? -2.737  -20.377 -70.109 1.00 38.33 ? 122 ASP L C   1 
ATOM   3835 O O   . ASP C 3 122 ? -2.492  -19.295 -70.727 1.00 38.84 ? 122 ASP L O   1 
ATOM   3836 C CB  . ASP C 3 122 ? -3.261  -22.456 -71.571 1.00 40.09 ? 122 ASP L CB  1 
ATOM   3837 C CG  . ASP C 3 122 ? -2.607  -23.560 -72.397 1.00 42.20 ? 122 ASP L CG  1 
ATOM   3838 O OD1 . ASP C 3 122 ? -1.390  -23.443 -72.766 1.00 41.64 ? 122 ASP L OD1 1 
ATOM   3839 O OD2 . ASP C 3 122 ? -3.322  -24.525 -72.716 1.00 46.63 ? 122 ASP L OD2 1 
ATOM   3840 N N   . GLU C 3 123 ? -3.312  -20.464 -68.893 1.00 38.81 ? 123 GLU L N   1 
ATOM   3841 C CA  . GLU C 3 123 ? -3.759  -19.261 -68.153 1.00 40.97 ? 123 GLU L CA  1 
ATOM   3842 C C   . GLU C 3 123 ? -2.559  -18.297 -67.962 1.00 37.97 ? 123 GLU L C   1 
ATOM   3843 O O   . GLU C 3 123 ? -2.690  -17.102 -68.282 1.00 37.62 ? 123 GLU L O   1 
ATOM   3844 C CB  . GLU C 3 123 ? -4.400  -19.612 -66.802 1.00 44.25 ? 123 GLU L CB  1 
ATOM   3845 C CG  . GLU C 3 123 ? -5.167  -18.433 -66.231 1.00 47.51 ? 123 GLU L CG  1 
ATOM   3846 C CD  . GLU C 3 123 ? -5.607  -18.569 -64.787 1.00 51.43 ? 123 GLU L CD  1 
ATOM   3847 O OE1 . GLU C 3 123 ? -5.619  -19.723 -64.267 1.00 53.36 ? 123 GLU L OE1 1 
ATOM   3848 O OE2 . GLU C 3 123 ? -5.888  -17.520 -64.174 1.00 54.94 ? 123 GLU L OE2 1 
ATOM   3849 N N   . GLN C 3 124 ? -1.396  -18.799 -67.523 1.00 33.24 ? 124 GLN L N   1 
ATOM   3850 C CA  . GLN C 3 124 ? -0.233  -17.896 -67.345 1.00 31.93 ? 124 GLN L CA  1 
ATOM   3851 C C   . GLN C 3 124 ? 0.272   -17.385 -68.701 1.00 33.14 ? 124 GLN L C   1 
ATOM   3852 O O   . GLN C 3 124 ? 0.615   -16.179 -68.781 1.00 33.14 ? 124 GLN L O   1 
ATOM   3853 C CB  . GLN C 3 124 ? 0.890   -18.576 -66.544 1.00 29.48 ? 124 GLN L CB  1 
ATOM   3854 C CG  . GLN C 3 124 ? 2.061   -17.646 -66.312 1.00 28.41 ? 124 GLN L CG  1 
ATOM   3855 C CD  . GLN C 3 124 ? 3.199   -18.344 -65.597 1.00 26.44 ? 124 GLN L CD  1 
ATOM   3856 O OE1 . GLN C 3 124 ? 3.392   -19.567 -65.688 1.00 25.95 ? 124 GLN L OE1 1 
ATOM   3857 N NE2 . GLN C 3 124 ? 3.929   -17.550 -64.832 1.00 24.97 ? 124 GLN L NE2 1 
ATOM   3858 N N   . LEU C 3 125 ? 0.351   -18.244 -69.710 1.00 34.40 ? 125 LEU L N   1 
ATOM   3859 C CA  . LEU C 3 125 ? 0.957   -17.856 -71.017 1.00 38.42 ? 125 LEU L CA  1 
ATOM   3860 C C   . LEU C 3 125 ? 0.151   -16.680 -71.624 1.00 42.81 ? 125 LEU L C   1 
ATOM   3861 O O   . LEU C 3 125 ? 0.785   -15.696 -72.121 1.00 42.31 ? 125 LEU L O   1 
ATOM   3862 C CB  . LEU C 3 125 ? 0.980   -19.061 -71.961 1.00 39.05 ? 125 LEU L CB  1 
ATOM   3863 C CG  . LEU C 3 125 ? 2.085   -20.082 -71.695 1.00 38.64 ? 125 LEU L CG  1 
ATOM   3864 C CD1 . LEU C 3 125 ? 2.066   -21.196 -72.737 1.00 39.54 ? 125 LEU L CD1 1 
ATOM   3865 C CD2 . LEU C 3 125 ? 3.462   -19.426 -71.672 1.00 38.65 ? 125 LEU L CD2 1 
ATOM   3866 N N   . LYS C 3 126 ? -1.178  -16.719 -71.457 1.00 47.53 ? 126 LYS L N   1 
ATOM   3867 C CA  . LYS C 3 126 ? -2.100  -15.600 -71.846 1.00 53.30 ? 126 LYS L CA  1 
ATOM   3868 C C   . LYS C 3 126 ? -1.509  -14.254 -71.417 1.00 52.28 ? 126 LYS L C   1 
ATOM   3869 O O   . LYS C 3 126 ? -1.535  -13.318 -72.244 1.00 54.46 ? 126 LYS L O   1 
ATOM   3870 C CB  . LYS C 3 126 ? -3.478  -15.728 -71.184 1.00 57.58 ? 126 LYS L CB  1 
ATOM   3871 C CG  . LYS C 3 126 ? -4.441  -16.670 -71.878 1.00 62.13 ? 126 LYS L CG  1 
ATOM   3872 C CD  . LYS C 3 126 ? -5.797  -16.685 -71.221 1.00 66.83 ? 126 LYS L CD  1 
ATOM   3873 C CE  . LYS C 3 126 ? -6.720  -17.672 -71.895 1.00 71.41 ? 126 LYS L CE  1 
ATOM   3874 N NZ  . LYS C 3 126 ? -8.058  -17.653 -71.260 1.00 77.25 ? 126 LYS L NZ  1 
ATOM   3875 N N   . SER C 3 127 ? -0.951  -14.199 -70.204 1.00 49.64 ? 127 SER L N   1 
ATOM   3876 C CA  . SER C 3 127 ? -0.521  -12.955 -69.518 1.00 48.66 ? 127 SER L CA  1 
ATOM   3877 C C   . SER C 3 127 ? 0.925   -12.586 -69.893 1.00 47.46 ? 127 SER L C   1 
ATOM   3878 O O   . SER C 3 127 ? 1.384   -11.551 -69.400 1.00 50.11 ? 127 SER L O   1 
ATOM   3879 C CB  . SER C 3 127 ? -0.694  -13.077 -68.035 1.00 48.20 ? 127 SER L CB  1 
ATOM   3880 O OG  . SER C 3 127 ? 0.295   -13.924 -67.449 1.00 46.87 ? 127 SER L OG  1 
ATOM   3881 N N   . GLY C 3 128 ? 1.638   -13.378 -70.702 1.00 43.76 ? 128 GLY L N   1 
ATOM   3882 C CA  . GLY C 3 128 ? 2.942   -12.956 -71.252 1.00 41.85 ? 128 GLY L CA  1 
ATOM   3883 C C   . GLY C 3 128 ? 4.140   -13.628 -70.579 1.00 39.20 ? 128 GLY L C   1 
ATOM   3884 O O   . GLY C 3 128 ? 5.292   -13.346 -70.967 1.00 37.70 ? 128 GLY L O   1 
ATOM   3885 N N   . THR C 3 129 ? 3.923   -14.459 -69.565 1.00 37.57 ? 129 THR L N   1 
ATOM   3886 C CA  . THR C 3 129 ? 5.048   -15.101 -68.819 1.00 34.14 ? 129 THR L CA  1 
ATOM   3887 C C   . THR C 3 129 ? 4.862   -16.623 -68.845 1.00 32.45 ? 129 THR L C   1 
ATOM   3888 O O   . THR C 3 129 ? 3.712   -17.080 -68.937 1.00 33.06 ? 129 THR L O   1 
ATOM   3889 C CB  . THR C 3 129 ? 5.196   -14.543 -67.401 1.00 34.09 ? 129 THR L CB  1 
ATOM   3890 O OG1 . THR C 3 129 ? 5.548   -13.165 -67.519 1.00 34.62 ? 129 THR L OG1 1 
ATOM   3891 C CG2 . THR C 3 129 ? 6.293   -15.229 -66.621 1.00 33.13 ? 129 THR L CG2 1 
ATOM   3892 N N   . ALA C 3 130 ? 5.987   -17.363 -68.800 1.00 29.20 ? 130 ALA L N   1 
ATOM   3893 C CA  . ALA C 3 130 ? 6.017   -18.834 -68.673 1.00 26.74 ? 130 ALA L CA  1 
ATOM   3894 C C   . ALA C 3 130 ? 6.853   -19.198 -67.437 1.00 25.22 ? 130 ALA L C   1 
ATOM   3895 O O   . ALA C 3 130 ? 8.061   -18.885 -67.402 1.00 24.50 ? 130 ALA L O   1 
ATOM   3896 C CB  . ALA C 3 130 ? 6.561   -19.430 -69.917 1.00 27.23 ? 130 ALA L CB  1 
ATOM   3897 N N   . SER C 3 131 ? 6.222   -19.809 -66.446 1.00 23.53 ? 131 SER L N   1 
ATOM   3898 C CA  . SER C 3 131 ? 6.918   -20.412 -65.283 1.00 21.89 ? 131 SER L CA  1 
ATOM   3899 C C   . SER C 3 131 ? 6.926   -21.928 -65.455 1.00 21.77 ? 131 SER L C   1 
ATOM   3900 O O   . SER C 3 131 ? 5.861   -22.553 -65.575 1.00 21.96 ? 131 SER L O   1 
ATOM   3901 C CB  . SER C 3 131 ? 6.251   -19.989 -63.996 1.00 21.67 ? 131 SER L CB  1 
ATOM   3902 O OG  . SER C 3 131 ? 6.338   -18.588 -63.809 1.00 22.09 ? 131 SER L OG  1 
ATOM   3903 N N   . VAL C 3 132 ? 8.108   -22.526 -65.432 1.00 21.09 ? 132 VAL L N   1 
ATOM   3904 C CA  . VAL C 3 132 ? 8.272   -23.992 -65.566 1.00 20.22 ? 132 VAL L CA  1 
ATOM   3905 C C   . VAL C 3 132 ? 8.743   -24.462 -64.214 1.00 19.59 ? 132 VAL L C   1 
ATOM   3906 O O   . VAL C 3 132 ? 9.744   -23.902 -63.729 1.00 19.25 ? 132 VAL L O   1 
ATOM   3907 C CB  . VAL C 3 132 ? 9.290   -24.388 -66.653 1.00 20.21 ? 132 VAL L CB  1 
ATOM   3908 C CG1 . VAL C 3 132 ? 9.099   -25.839 -67.021 1.00 19.90 ? 132 VAL L CG1 1 
ATOM   3909 C CG2 . VAL C 3 132 ? 9.226   -23.476 -67.865 1.00 21.02 ? 132 VAL L CG2 1 
ATOM   3910 N N   . VAL C 3 133 ? 8.103   -25.469 -63.637 1.00 19.37 ? 133 VAL L N   1 
ATOM   3911 C CA  . VAL C 3 133 ? 8.412   -25.851 -62.243 1.00 18.57 ? 133 VAL L CA  1 
ATOM   3912 C C   . VAL C 3 133 ? 8.895   -27.290 -62.194 1.00 18.84 ? 133 VAL L C   1 
ATOM   3913 O O   . VAL C 3 133 ? 8.306   -28.169 -62.828 1.00 18.48 ? 133 VAL L O   1 
ATOM   3914 C CB  . VAL C 3 133 ? 7.185   -25.640 -61.342 1.00 18.64 ? 133 VAL L CB  1 
ATOM   3915 C CG1 . VAL C 3 133 ? 7.483   -26.164 -59.957 1.00 18.29 ? 133 VAL L CG1 1 
ATOM   3916 C CG2 . VAL C 3 133 ? 6.765   -24.174 -61.321 1.00 19.32 ? 133 VAL L CG2 1 
ATOM   3917 N N   . CYS C 3 134 ? 9.994   -27.508 -61.503 1.00 18.30 ? 134 CYS L N   1 
ATOM   3918 C CA  . CYS C 3 134 ? 10.566  -28.848 -61.279 1.00 18.48 ? 134 CYS L CA  1 
ATOM   3919 C C   . CYS C 3 134 ? 10.474  -29.123 -59.778 1.00 18.23 ? 134 CYS L C   1 
ATOM   3920 O O   . CYS C 3 134 ? 10.896  -28.268 -58.972 1.00 18.12 ? 134 CYS L O   1 
ATOM   3921 C CB  . CYS C 3 134 ? 11.988  -28.916 -61.783 1.00 19.21 ? 134 CYS L CB  1 
ATOM   3922 S SG  . CYS C 3 134 ? 12.658  -30.585 -61.619 1.00 20.50 ? 134 CYS L SG  1 
ATOM   3923 N N   . LEU C 3 135 ? 9.870   -30.236 -59.382 1.00 17.99 ? 135 LEU L N   1 
ATOM   3924 C CA  . LEU C 3 135 ? 9.678   -30.614 -57.983 1.00 17.76 ? 135 LEU L CA  1 
ATOM   3925 C C   . LEU C 3 135 ? 10.565  -31.820 -57.667 1.00 18.64 ? 135 LEU L C   1 
ATOM   3926 O O   . LEU C 3 135 ? 10.532  -32.831 -58.421 1.00 18.54 ? 135 LEU L O   1 
ATOM   3927 C CB  . LEU C 3 135 ? 8.197   -30.935 -57.752 1.00 18.17 ? 135 LEU L CB  1 
ATOM   3928 C CG  . LEU C 3 135 ? 7.868   -31.622 -56.439 1.00 18.80 ? 135 LEU L CG  1 
ATOM   3929 C CD1 . LEU C 3 135 ? 8.235   -30.779 -55.216 1.00 18.80 ? 135 LEU L CD1 1 
ATOM   3930 C CD2 . LEU C 3 135 ? 6.412   -32.046 -56.411 1.00 20.27 ? 135 LEU L CD2 1 
ATOM   3931 N N   . LEU C 3 136 ? 11.322  -31.732 -56.572 1.00 18.02 ? 136 LEU L N   1 
ATOM   3932 C CA  . LEU C 3 136 ? 12.082  -32.848 -55.955 1.00 18.27 ? 136 LEU L CA  1 
ATOM   3933 C C   . LEU C 3 136 ? 11.374  -33.144 -54.627 1.00 18.76 ? 136 LEU L C   1 
ATOM   3934 O O   . LEU C 3 136 ? 11.351  -32.281 -53.760 1.00 17.73 ? 136 LEU L O   1 
ATOM   3935 C CB  . LEU C 3 136 ? 13.518  -32.430 -55.680 1.00 17.54 ? 136 LEU L CB  1 
ATOM   3936 C CG  . LEU C 3 136 ? 14.449  -32.357 -56.882 1.00 17.65 ? 136 LEU L CG  1 
ATOM   3937 C CD1 . LEU C 3 136 ? 13.994  -31.342 -57.908 1.00 17.55 ? 136 LEU L CD1 1 
ATOM   3938 C CD2 . LEU C 3 136 ? 15.858  -32.064 -56.389 1.00 18.18 ? 136 LEU L CD2 1 
ATOM   3939 N N   . ASN C 3 137 ? 10.732  -34.308 -54.524 1.00 19.60 ? 137 ASN L N   1 
ATOM   3940 C CA  . ASN C 3 137 ? 9.855   -34.657 -53.394 1.00 20.44 ? 137 ASN L CA  1 
ATOM   3941 C C   . ASN C 3 137 ? 10.532  -35.669 -52.449 1.00 20.77 ? 137 ASN L C   1 
ATOM   3942 O O   . ASN C 3 137 ? 11.041  -36.705 -52.939 1.00 20.96 ? 137 ASN L O   1 
ATOM   3943 C CB  . ASN C 3 137 ? 8.510   -35.141 -53.912 1.00 23.04 ? 137 ASN L CB  1 
ATOM   3944 C CG  . ASN C 3 137 ? 7.434   -34.740 -52.948 1.00 26.26 ? 137 ASN L CG  1 
ATOM   3945 O OD1 . ASN C 3 137 ? 7.479   -33.634 -52.412 1.00 28.28 ? 137 ASN L OD1 1 
ATOM   3946 N ND2 . ASN C 3 137 ? 6.558   -35.662 -52.655 1.00 29.70 ? 137 ASN L ND2 1 
ATOM   3947 N N   . ASN C 3 138 ? 10.591  -35.314 -51.164 1.00 20.86 ? 138 ASN L N   1 
ATOM   3948 C CA  . ASN C 3 138 ? 10.898  -36.193 -50.011 1.00 22.33 ? 138 ASN L CA  1 
ATOM   3949 C C   . ASN C 3 138 ? 12.282  -36.835 -50.157 1.00 21.83 ? 138 ASN L C   1 
ATOM   3950 O O   . ASN C 3 138 ? 12.332  -38.065 -50.331 1.00 22.87 ? 138 ASN L O   1 
ATOM   3951 C CB  . ASN C 3 138 ? 9.783   -37.240 -49.852 1.00 25.18 ? 138 ASN L CB  1 
ATOM   3952 C CG  . ASN C 3 138 ? 8.453   -36.588 -49.486 1.00 28.13 ? 138 ASN L CG  1 
ATOM   3953 O OD1 . ASN C 3 138 ? 8.330   -35.388 -49.419 1.00 27.41 ? 138 ASN L OD1 1 
ATOM   3954 N ND2 . ASN C 3 138 ? 7.447   -37.380 -49.155 1.00 33.56 ? 138 ASN L ND2 1 
ATOM   3955 N N   . PHE C 3 139 ? 13.358  -36.057 -50.081 1.00 19.93 ? 139 PHE L N   1 
ATOM   3956 C CA  . PHE C 3 139 ? 14.728  -36.561 -50.238 1.00 20.54 ? 139 PHE L CA  1 
ATOM   3957 C C   . PHE C 3 139 ? 15.578  -36.177 -49.044 1.00 20.58 ? 139 PHE L C   1 
ATOM   3958 O O   . PHE C 3 139 ? 15.176  -35.351 -48.241 1.00 19.96 ? 139 PHE L O   1 
ATOM   3959 C CB  . PHE C 3 139 ? 15.310  -36.116 -51.589 1.00 20.24 ? 139 PHE L CB  1 
ATOM   3960 C CG  . PHE C 3 139 ? 15.478  -34.636 -51.682 1.00 19.30 ? 139 PHE L CG  1 
ATOM   3961 C CD1 . PHE C 3 139 ? 16.684  -34.061 -51.298 1.00 19.13 ? 139 PHE L CD1 1 
ATOM   3962 C CD2 . PHE C 3 139 ? 14.447  -33.821 -52.123 1.00 18.65 ? 139 PHE L CD2 1 
ATOM   3963 C CE1 . PHE C 3 139 ? 16.859  -32.691 -51.387 1.00 19.93 ? 139 PHE L CE1 1 
ATOM   3964 C CE2 . PHE C 3 139 ? 14.630  -32.447 -52.228 1.00 18.71 ? 139 PHE L CE2 1 
ATOM   3965 C CZ  . PHE C 3 139 ? 15.848  -31.872 -51.903 1.00 18.24 ? 139 PHE L CZ  1 
ATOM   3966 N N   . TYR C 3 140 ? 16.722  -36.829 -48.922 1.00 20.80 ? 140 TYR L N   1 
ATOM   3967 C CA  . TYR C 3 140 ? 17.706  -36.614 -47.838 1.00 22.08 ? 140 TYR L CA  1 
ATOM   3968 C C   . TYR C 3 140 ? 19.053  -37.121 -48.306 1.00 22.88 ? 140 TYR L C   1 
ATOM   3969 O O   . TYR C 3 140 ? 19.118  -38.239 -48.827 1.00 22.85 ? 140 TYR L O   1 
ATOM   3970 C CB  . TYR C 3 140 ? 17.280  -37.262 -46.498 1.00 22.77 ? 140 TYR L CB  1 
ATOM   3971 C CG  . TYR C 3 140 ? 18.171  -36.803 -45.374 1.00 23.59 ? 140 TYR L CG  1 
ATOM   3972 C CD1 . TYR C 3 140 ? 19.406  -37.382 -45.187 1.00 25.07 ? 140 TYR L CD1 1 
ATOM   3973 C CD2 . TYR C 3 140 ? 17.851  -35.701 -44.599 1.00 23.86 ? 140 TYR L CD2 1 
ATOM   3974 C CE1 . TYR C 3 140 ? 20.284  -36.923 -44.228 1.00 25.83 ? 140 TYR L CE1 1 
ATOM   3975 C CE2 . TYR C 3 140 ? 18.734  -35.204 -43.650 1.00 24.43 ? 140 TYR L CE2 1 
ATOM   3976 C CZ  . TYR C 3 140 ? 19.955  -35.816 -43.483 1.00 25.62 ? 140 TYR L CZ  1 
ATOM   3977 O OH  . TYR C 3 140 ? 20.834  -35.344 -42.576 1.00 28.13 ? 140 TYR L OH  1 
ATOM   3978 N N   . PRO C 3 141 ? 20.155  -36.358 -48.128 1.00 23.76 ? 141 PRO L N   1 
ATOM   3979 C CA  . PRO C 3 141 ? 20.149  -35.041 -47.463 1.00 23.89 ? 141 PRO L CA  1 
ATOM   3980 C C   . PRO C 3 141 ? 19.703  -33.887 -48.373 1.00 23.86 ? 141 PRO L C   1 
ATOM   3981 O O   . PRO C 3 141 ? 19.357  -34.109 -49.534 1.00 21.94 ? 141 PRO L O   1 
ATOM   3982 C CB  . PRO C 3 141 ? 21.618  -34.881 -47.046 1.00 24.82 ? 141 PRO L CB  1 
ATOM   3983 C CG  . PRO C 3 141 ? 22.361  -35.554 -48.153 1.00 25.51 ? 141 PRO L CG  1 
ATOM   3984 C CD  . PRO C 3 141 ? 21.509  -36.757 -48.522 1.00 24.90 ? 141 PRO L CD  1 
ATOM   3985 N N   . ARG C 3 142 ? 19.715  -32.655 -47.855 1.00 25.10 ? 142 ARG L N   1 
ATOM   3986 C CA  . ARG C 3 142 ? 19.159  -31.500 -48.625 1.00 27.76 ? 142 ARG L CA  1 
ATOM   3987 C C   . ARG C 3 142 ? 19.982  -31.160 -49.874 1.00 26.23 ? 142 ARG L C   1 
ATOM   3988 O O   . ARG C 3 142 ? 19.390  -30.618 -50.819 1.00 28.35 ? 142 ARG L O   1 
ATOM   3989 C CB  . ARG C 3 142 ? 19.012  -30.311 -47.672 1.00 32.49 ? 142 ARG L CB  1 
ATOM   3990 C CG  . ARG C 3 142 ? 19.442  -28.964 -48.228 1.00 37.67 ? 142 ARG L CG  1 
ATOM   3991 C CD  . ARG C 3 142 ? 19.760  -28.143 -46.970 1.00 43.95 ? 142 ARG L CD  1 
ATOM   3992 N NE  . ARG C 3 142 ? 18.598  -27.422 -46.500 1.00 47.35 ? 142 ARG L NE  1 
ATOM   3993 C CZ  . ARG C 3 142 ? 18.119  -26.286 -47.048 1.00 51.32 ? 142 ARG L CZ  1 
ATOM   3994 N NH1 . ARG C 3 142 ? 18.688  -25.705 -48.099 1.00 48.78 ? 142 ARG L NH1 1 
ATOM   3995 N NH2 . ARG C 3 142 ? 17.052  -25.725 -46.511 1.00 57.61 ? 142 ARG L NH2 1 
ATOM   3996 N N   . GLU C 3 143 ? 21.269  -31.467 -49.907 1.00 26.18 ? 143 GLU L N   1 
ATOM   3997 C CA  . GLU C 3 143 ? 22.142  -31.100 -51.052 1.00 27.28 ? 143 GLU L CA  1 
ATOM   3998 C C   . GLU C 3 143 ? 21.652  -31.827 -52.313 1.00 26.12 ? 143 GLU L C   1 
ATOM   3999 O O   . GLU C 3 143 ? 21.449  -33.057 -52.277 1.00 23.91 ? 143 GLU L O   1 
ATOM   4000 C CB  . GLU C 3 143 ? 23.587  -31.466 -50.763 1.00 30.11 ? 143 GLU L CB  1 
ATOM   4001 C CG  . GLU C 3 143 ? 24.118  -30.647 -49.566 1.00 35.52 ? 143 GLU L CG  1 
ATOM   4002 C CD  . GLU C 3 143 ? 23.551  -30.916 -48.161 1.00 36.86 ? 143 GLU L CD  1 
ATOM   4003 O OE1 . GLU C 3 143 ? 23.482  -32.082 -47.757 1.00 35.04 ? 143 GLU L OE1 1 
ATOM   4004 O OE2 . GLU C 3 143 ? 23.166  -29.926 -47.456 1.00 43.42 ? 143 GLU L OE2 1 
ATOM   4005 N N   . ALA C 3 144 ? 21.481  -31.075 -53.380 1.00 24.87 ? 144 ALA L N   1 
ATOM   4006 C CA  . ALA C 3 144 ? 20.984  -31.587 -54.686 1.00 25.44 ? 144 ALA L CA  1 
ATOM   4007 C C   . ALA C 3 144 ? 21.404  -30.625 -55.790 1.00 26.23 ? 144 ALA L C   1 
ATOM   4008 O O   . ALA C 3 144 ? 21.437  -29.437 -55.515 1.00 27.62 ? 144 ALA L O   1 
ATOM   4009 C CB  . ALA C 3 144 ? 19.483  -31.714 -54.638 1.00 23.99 ? 144 ALA L CB  1 
ATOM   4010 N N   . LYS C 3 145 ? 21.689  -31.105 -56.993 1.00 26.93 ? 145 LYS L N   1 
ATOM   4011 C CA  . LYS C 3 145 ? 21.916  -30.194 -58.134 1.00 26.79 ? 145 LYS L CA  1 
ATOM   4012 C C   . LYS C 3 145 ? 20.706  -30.315 -59.067 1.00 25.14 ? 145 LYS L C   1 
ATOM   4013 O O   . LYS C 3 145 ? 20.407  -31.453 -59.499 1.00 23.36 ? 145 LYS L O   1 
ATOM   4014 C CB  . LYS C 3 145 ? 23.239  -30.479 -58.811 1.00 29.54 ? 145 LYS L CB  1 
ATOM   4015 C CG  . LYS C 3 145 ? 23.648  -29.407 -59.816 1.00 32.86 ? 145 LYS L CG  1 
ATOM   4016 C CD  . LYS C 3 145 ? 25.052  -29.565 -60.352 1.00 37.78 ? 145 LYS L CD  1 
ATOM   4017 C CE  . LYS C 3 145 ? 25.209  -30.726 -61.300 1.00 41.31 ? 145 LYS L CE  1 
ATOM   4018 N NZ  . LYS C 3 145 ? 26.546  -30.691 -61.936 1.00 46.30 ? 145 LYS L NZ  1 
ATOM   4019 N N   . VAL C 3 146 ? 20.033  -29.186 -59.315 1.00 22.87 ? 146 VAL L N   1 
ATOM   4020 C CA  . VAL C 3 146 ? 18.887  -29.113 -60.261 1.00 22.72 ? 146 VAL L CA  1 
ATOM   4021 C C   . VAL C 3 146 ? 19.288  -28.215 -61.419 1.00 22.58 ? 146 VAL L C   1 
ATOM   4022 O O   . VAL C 3 146 ? 19.605  -27.070 -61.157 1.00 22.12 ? 146 VAL L O   1 
ATOM   4023 C CB  . VAL C 3 146 ? 17.633  -28.636 -59.518 1.00 22.76 ? 146 VAL L CB  1 
ATOM   4024 C CG1 . VAL C 3 146 ? 16.456  -28.511 -60.454 1.00 24.94 ? 146 VAL L CG1 1 
ATOM   4025 C CG2 . VAL C 3 146 ? 17.345  -29.574 -58.365 1.00 23.45 ? 146 VAL L CG2 1 
ATOM   4026 N N   . GLN C 3 147 ? 19.359  -28.758 -62.629 1.00 21.87 ? 147 GLN L N   1 
ATOM   4027 C CA  . GLN C 3 147 ? 19.840  -28.024 -63.808 1.00 22.91 ? 147 GLN L CA  1 
ATOM   4028 C C   . GLN C 3 147 ? 18.708  -27.994 -64.792 1.00 21.16 ? 147 GLN L C   1 
ATOM   4029 O O   . GLN C 3 147 ? 18.184  -29.060 -65.097 1.00 21.82 ? 147 GLN L O   1 
ATOM   4030 C CB  . GLN C 3 147 ? 21.028  -28.722 -64.479 1.00 25.84 ? 147 GLN L CB  1 
ATOM   4031 C CG  . GLN C 3 147 ? 22.251  -28.773 -63.599 1.00 30.64 ? 147 GLN L CG  1 
ATOM   4032 C CD  . GLN C 3 147 ? 23.555  -28.874 -64.364 1.00 34.20 ? 147 GLN L CD  1 
ATOM   4033 O OE1 . GLN C 3 147 ? 23.746  -29.726 -65.241 1.00 44.43 ? 147 GLN L OE1 1 
ATOM   4034 N NE2 . GLN C 3 147 ? 24.501  -28.014 -64.038 1.00 37.87 ? 147 GLN L NE2 1 
ATOM   4035 N N   . TRP C 3 148 ? 18.386  -26.826 -65.291 1.00 19.57 ? 148 TRP L N   1 
ATOM   4036 C CA  . TRP C 3 148 ? 17.435  -26.688 -66.429 1.00 19.80 ? 148 TRP L CA  1 
ATOM   4037 C C   . TRP C 3 148 ? 18.178  -26.805 -67.760 1.00 20.59 ? 148 TRP L C   1 
ATOM   4038 O O   . TRP C 3 148 ? 19.198  -26.179 -67.909 1.00 21.02 ? 148 TRP L O   1 
ATOM   4039 C CB  . TRP C 3 148 ? 16.728  -25.339 -66.341 1.00 19.27 ? 148 TRP L CB  1 
ATOM   4040 C CG  . TRP C 3 148 ? 15.730  -25.293 -65.229 1.00 19.05 ? 148 TRP L CG  1 
ATOM   4041 C CD1 . TRP C 3 148 ? 15.874  -24.740 -63.990 1.00 18.59 ? 148 TRP L CD1 1 
ATOM   4042 C CD2 . TRP C 3 148 ? 14.425  -25.873 -65.272 1.00 19.03 ? 148 TRP L CD2 1 
ATOM   4043 N NE1 . TRP C 3 148 ? 14.750  -24.987 -63.242 1.00 18.82 ? 148 TRP L NE1 1 
ATOM   4044 C CE2 . TRP C 3 148 ? 13.821  -25.623 -64.025 1.00 18.55 ? 148 TRP L CE2 1 
ATOM   4045 C CE3 . TRP C 3 148 ? 13.699  -26.530 -66.264 1.00 19.11 ? 148 TRP L CE3 1 
ATOM   4046 C CZ2 . TRP C 3 148 ? 12.519  -26.019 -63.751 1.00 18.16 ? 148 TRP L CZ2 1 
ATOM   4047 C CZ3 . TRP C 3 148 ? 12.420  -26.915 -65.985 1.00 19.15 ? 148 TRP L CZ3 1 
ATOM   4048 C CH2 . TRP C 3 148 ? 11.841  -26.689 -64.752 1.00 18.35 ? 148 TRP L CH2 1 
ATOM   4049 N N   . LYS C 3 149 ? 17.609  -27.497 -68.720 1.00 22.13 ? 149 LYS L N   1 
ATOM   4050 C CA  . LYS C 3 149 ? 18.131  -27.542 -70.093 1.00 24.40 ? 149 LYS L CA  1 
ATOM   4051 C C   . LYS C 3 149 ? 16.951  -27.254 -71.020 1.00 24.25 ? 149 LYS L C   1 
ATOM   4052 O O   . LYS C 3 149 ? 15.902  -27.813 -70.810 1.00 24.02 ? 149 LYS L O   1 
ATOM   4053 C CB  . LYS C 3 149 ? 18.704  -28.921 -70.393 1.00 27.18 ? 149 LYS L CB  1 
ATOM   4054 C CG  . LYS C 3 149 ? 19.901  -29.302 -69.530 1.00 30.61 ? 149 LYS L CG  1 
ATOM   4055 C CD  . LYS C 3 149 ? 20.424  -30.732 -69.768 1.00 32.99 ? 149 LYS L CD  1 
ATOM   4056 C CE  . LYS C 3 149 ? 21.599  -31.007 -68.856 1.00 36.39 ? 149 LYS L CE  1 
ATOM   4057 N NZ  . LYS C 3 149 ? 22.480  -32.093 -69.329 1.00 39.49 ? 149 LYS L NZ  1 
ATOM   4058 N N   . VAL C 3 150 ? 17.161  -26.353 -71.962 1.00 24.24 ? 150 VAL L N   1 
ATOM   4059 C CA  . VAL C 3 150 ? 16.137  -25.897 -72.931 1.00 24.18 ? 150 VAL L CA  1 
ATOM   4060 C C   . VAL C 3 150 ? 16.735  -26.225 -74.299 1.00 24.42 ? 150 VAL L C   1 
ATOM   4061 O O   . VAL C 3 150 ? 17.807  -25.690 -74.568 1.00 25.06 ? 150 VAL L O   1 
ATOM   4062 C CB  . VAL C 3 150 ? 15.916  -24.404 -72.718 1.00 24.75 ? 150 VAL L CB  1 
ATOM   4063 C CG1 . VAL C 3 150 ? 14.987  -23.843 -73.794 1.00 26.18 ? 150 VAL L CG1 1 
ATOM   4064 C CG2 . VAL C 3 150 ? 15.376  -24.156 -71.299 1.00 24.36 ? 150 VAL L CG2 1 
ATOM   4065 N N   . ASP C 3 151 ? 16.110  -27.130 -75.051 1.00 24.75 ? 151 ASP L N   1 
ATOM   4066 C CA  . ASP C 3 151 ? 16.711  -27.651 -76.298 1.00 26.76 ? 151 ASP L CA  1 
ATOM   4067 C C   . ASP C 3 151 ? 18.154  -28.076 -75.999 1.00 27.16 ? 151 ASP L C   1 
ATOM   4068 O O   . ASP C 3 151 ? 19.048  -27.785 -76.813 1.00 27.02 ? 151 ASP L O   1 
ATOM   4069 C CB  . ASP C 3 151 ? 16.551  -26.590 -77.402 1.00 28.17 ? 151 ASP L CB  1 
ATOM   4070 C CG  . ASP C 3 151 ? 15.126  -26.532 -77.955 1.00 29.05 ? 151 ASP L CG  1 
ATOM   4071 O OD1 . ASP C 3 151 ? 14.417  -27.556 -77.846 1.00 27.83 ? 151 ASP L OD1 1 
ATOM   4072 O OD2 . ASP C 3 151 ? 14.749  -25.450 -78.492 1.00 31.74 ? 151 ASP L OD2 1 
ATOM   4073 N N   . ASN C 3 152 ? 18.337  -28.775 -74.881 1.00 27.13 ? 152 ASN L N   1 
ATOM   4074 C CA  . ASN C 3 152 ? 19.624  -29.360 -74.412 1.00 27.33 ? 152 ASN L CA  1 
ATOM   4075 C C   . ASN C 3 152 ? 20.660  -28.296 -74.013 1.00 26.83 ? 152 ASN L C   1 
ATOM   4076 O O   . ASN C 3 152 ? 21.826  -28.693 -73.744 1.00 27.52 ? 152 ASN L O   1 
ATOM   4077 C CB  . ASN C 3 152 ? 20.236  -30.275 -75.478 1.00 29.45 ? 152 ASN L CB  1 
ATOM   4078 C CG  . ASN C 3 152 ? 21.274  -31.187 -74.861 1.00 30.00 ? 152 ASN L CG  1 
ATOM   4079 O OD1 . ASN C 3 152 ? 21.063  -31.710 -73.768 1.00 33.62 ? 152 ASN L OD1 1 
ATOM   4080 N ND2 . ASN C 3 152 ? 22.422  -31.260 -75.488 1.00 34.32 ? 152 ASN L ND2 1 
ATOM   4081 N N   . ALA C 3 153 ? 20.329  -27.002 -73.984 1.00 24.77 ? 153 ALA L N   1 
ATOM   4082 C CA  . ALA C 3 153 ? 21.272  -25.962 -73.543 1.00 24.61 ? 153 ALA L CA  1 
ATOM   4083 C C   . ALA C 3 153 ? 21.097  -25.725 -72.038 1.00 23.92 ? 153 ALA L C   1 
ATOM   4084 O O   . ALA C 3 153 ? 19.955  -25.403 -71.582 1.00 23.74 ? 153 ALA L O   1 
ATOM   4085 C CB  . ALA C 3 153 ? 21.073  -24.698 -74.332 1.00 24.99 ? 153 ALA L CB  1 
ATOM   4086 N N   . LEU C 3 154 ? 22.161  -25.907 -71.274 1.00 24.06 ? 154 LEU L N   1 
ATOM   4087 C CA  . LEU C 3 154 ? 22.126  -25.692 -69.831 1.00 24.41 ? 154 LEU L CA  1 
ATOM   4088 C C   . LEU C 3 154 ? 21.882  -24.200 -69.543 1.00 23.90 ? 154 LEU L C   1 
ATOM   4089 O O   . LEU C 3 154 ? 22.608  -23.309 -70.065 1.00 24.26 ? 154 LEU L O   1 
ATOM   4090 C CB  . LEU C 3 154 ? 23.423  -26.177 -69.185 1.00 26.52 ? 154 LEU L CB  1 
ATOM   4091 C CG  . LEU C 3 154 ? 23.607  -25.780 -67.715 1.00 29.02 ? 154 LEU L CG  1 
ATOM   4092 C CD1 . LEU C 3 154 ? 22.543  -26.366 -66.782 1.00 30.35 ? 154 LEU L CD1 1 
ATOM   4093 C CD2 . LEU C 3 154 ? 25.016  -26.197 -67.292 1.00 31.48 ? 154 LEU L CD2 1 
ATOM   4094 N N   . GLN C 3 155 ? 20.888  -23.935 -68.694 1.00 22.75 ? 155 GLN L N   1 
ATOM   4095 C CA  . GLN C 3 155 ? 20.455  -22.552 -68.401 1.00 22.76 ? 155 GLN L CA  1 
ATOM   4096 C C   . GLN C 3 155 ? 21.210  -22.034 -67.183 1.00 22.63 ? 155 GLN L C   1 
ATOM   4097 O O   . GLN C 3 155 ? 21.571  -22.815 -66.281 1.00 21.12 ? 155 GLN L O   1 
ATOM   4098 C CB  . GLN C 3 155 ? 18.946  -22.515 -68.136 1.00 22.69 ? 155 GLN L CB  1 
ATOM   4099 C CG  . GLN C 3 155 ? 18.097  -23.071 -69.262 1.00 23.03 ? 155 GLN L CG  1 
ATOM   4100 C CD  . GLN C 3 155 ? 18.214  -22.153 -70.442 1.00 24.53 ? 155 GLN L CD  1 
ATOM   4101 O OE1 . GLN C 3 155 ? 17.719  -21.032 -70.399 1.00 24.80 ? 155 GLN L OE1 1 
ATOM   4102 N NE2 . GLN C 3 155 ? 18.963  -22.579 -71.465 1.00 25.02 ? 155 GLN L NE2 1 
ATOM   4103 N N   . SER C 3 156 ? 21.351  -20.715 -67.082 1.00 23.86 ? 156 SER L N   1 
ATOM   4104 C CA  . SER C 3 156 ? 21.836  -20.034 -65.867 1.00 24.90 ? 156 SER L CA  1 
ATOM   4105 C C   . SER C 3 156 ? 21.162  -18.665 -65.746 1.00 24.46 ? 156 SER L C   1 
ATOM   4106 O O   . SER C 3 156 ? 20.939  -17.957 -66.766 1.00 24.82 ? 156 SER L O   1 
ATOM   4107 C CB  . SER C 3 156 ? 23.394  -19.860 -65.803 1.00 27.13 ? 156 SER L CB  1 
ATOM   4108 O OG  . SER C 3 156 ? 23.763  -19.170 -66.940 1.00 30.25 ? 156 SER L OG  1 
ATOM   4109 N N   . GLY C 3 157 ? 20.901  -18.321 -64.504 1.00 25.37 ? 157 GLY L N   1 
ATOM   4110 C CA  . GLY C 3 157 ? 20.463  -16.967 -64.134 1.00 26.70 ? 157 GLY L CA  1 
ATOM   4111 C C   . GLY C 3 157 ? 18.956  -16.783 -64.268 1.00 26.43 ? 157 GLY L C   1 
ATOM   4112 O O   . GLY C 3 157 ? 18.510  -15.715 -63.882 1.00 27.43 ? 157 GLY L O   1 
ATOM   4113 N N   . ASN C 3 158 ? 18.190  -17.789 -64.696 1.00 23.46 ? 158 ASN L N   1 
ATOM   4114 C CA  . ASN C 3 158 ? 16.745  -17.563 -64.976 1.00 22.97 ? 158 ASN L CA  1 
ATOM   4115 C C   . ASN C 3 158 ? 15.891  -18.488 -64.082 1.00 20.87 ? 158 ASN L C   1 
ATOM   4116 O O   . ASN C 3 158 ? 14.735  -18.793 -64.504 1.00 19.67 ? 158 ASN L O   1 
ATOM   4117 C CB  . ASN C 3 158 ? 16.439  -17.707 -66.462 1.00 22.82 ? 158 ASN L CB  1 
ATOM   4118 C CG  . ASN C 3 158 ? 17.038  -18.947 -67.106 1.00 22.91 ? 158 ASN L CG  1 
ATOM   4119 O OD1 . ASN C 3 158 ? 17.591  -19.771 -66.408 1.00 23.31 ? 158 ASN L OD1 1 
ATOM   4120 N ND2 . ASN C 3 158 ? 16.862  -19.099 -68.415 1.00 23.67 ? 158 ASN L ND2 1 
ATOM   4121 N N   . SER C 3 159 ? 16.490  -19.091 -63.076 1.00 19.93 ? 159 SER L N   1 
ATOM   4122 C CA  . SER C 3 159 ? 15.739  -19.974 -62.155 1.00 20.14 ? 159 SER L CA  1 
ATOM   4123 C C   . SER C 3 159 ? 15.980  -19.602 -60.713 1.00 20.33 ? 159 SER L C   1 
ATOM   4124 O O   . SER C 3 159 ? 17.007  -18.980 -60.357 1.00 20.04 ? 159 SER L O   1 
ATOM   4125 C CB  . SER C 3 159 ? 16.033  -21.449 -62.433 1.00 20.09 ? 159 SER L CB  1 
ATOM   4126 O OG  . SER C 3 159 ? 17.418  -21.746 -62.238 1.00 19.76 ? 159 SER L OG  1 
ATOM   4127 N N   . GLN C 3 160 ? 15.007  -19.958 -59.864 1.00 19.63 ? 160 GLN L N   1 
ATOM   4128 C CA  . GLN C 3 160 ? 15.127  -19.809 -58.410 1.00 20.49 ? 160 GLN L CA  1 
ATOM   4129 C C   . GLN C 3 160 ? 14.627  -21.102 -57.721 1.00 19.05 ? 160 GLN L C   1 
ATOM   4130 O O   . GLN C 3 160 ? 13.687  -21.741 -58.249 1.00 17.91 ? 160 GLN L O   1 
ATOM   4131 C CB  . GLN C 3 160 ? 14.340  -18.605 -57.876 1.00 22.47 ? 160 GLN L CB  1 
ATOM   4132 C CG  . GLN C 3 160 ? 14.779  -17.258 -58.433 1.00 26.94 ? 160 GLN L CG  1 
ATOM   4133 C CD  . GLN C 3 160 ? 14.137  -16.078 -57.725 1.00 30.47 ? 160 GLN L CD  1 
ATOM   4134 O OE1 . GLN C 3 160 ? 13.053  -15.594 -58.092 1.00 34.23 ? 160 GLN L OE1 1 
ATOM   4135 N NE2 . GLN C 3 160 ? 14.830  -15.600 -56.705 1.00 33.79 ? 160 GLN L NE2 1 
ATOM   4136 N N   . GLU C 3 161 ? 15.289  -21.467 -56.627 1.00 18.30 ? 161 GLU L N   1 
ATOM   4137 C CA  . GLU C 3 161 ? 14.979  -22.700 -55.835 1.00 18.83 ? 161 GLU L CA  1 
ATOM   4138 C C   . GLU C 3 161 ? 14.383  -22.293 -54.485 1.00 18.12 ? 161 GLU L C   1 
ATOM   4139 O O   . GLU C 3 161 ? 14.770  -21.243 -53.921 1.00 16.14 ? 161 GLU L O   1 
ATOM   4140 C CB  . GLU C 3 161 ? 16.267  -23.440 -55.540 1.00 19.38 ? 161 GLU L CB  1 
ATOM   4141 C CG  . GLU C 3 161 ? 16.858  -24.136 -56.719 1.00 22.02 ? 161 GLU L CG  1 
ATOM   4142 C CD  . GLU C 3 161 ? 17.970  -25.090 -56.422 1.00 21.90 ? 161 GLU L CD  1 
ATOM   4143 O OE1 . GLU C 3 161 ? 18.449  -25.122 -55.214 1.00 23.50 ? 161 GLU L OE1 1 
ATOM   4144 O OE2 . GLU C 3 161 ? 18.412  -25.739 -57.414 1.00 24.53 ? 161 GLU L OE2 1 
ATOM   4145 N N   . SER C 3 162 ? 13.493  -23.106 -53.969 1.00 17.42 ? 162 SER L N   1 
ATOM   4146 C CA  . SER C 3 162 ? 13.011  -23.009 -52.581 1.00 17.37 ? 162 SER L CA  1 
ATOM   4147 C C   . SER C 3 162 ? 13.009  -24.405 -51.955 1.00 16.66 ? 162 SER L C   1 
ATOM   4148 O O   . SER C 3 162 ? 12.712  -25.359 -52.664 1.00 16.09 ? 162 SER L O   1 
ATOM   4149 C CB  . SER C 3 162 ? 11.670  -22.395 -52.658 1.00 18.84 ? 162 SER L CB  1 
ATOM   4150 O OG  . SER C 3 162 ? 11.159  -22.282 -51.408 1.00 19.54 ? 162 SER L OG  1 
ATOM   4151 N N   . VAL C 3 163 ? 13.343  -24.517 -50.674 1.00 16.17 ? 163 VAL L N   1 
ATOM   4152 C CA  . VAL C 3 163 ? 13.420  -25.830 -49.980 1.00 17.15 ? 163 VAL L CA  1 
ATOM   4153 C C   . VAL C 3 163 ? 12.508  -25.750 -48.756 1.00 17.99 ? 163 VAL L C   1 
ATOM   4154 O O   . VAL C 3 163 ? 12.511  -24.704 -48.029 1.00 17.38 ? 163 VAL L O   1 
ATOM   4155 C CB  . VAL C 3 163 ? 14.870  -26.206 -49.622 1.00 17.88 ? 163 VAL L CB  1 
ATOM   4156 C CG1 . VAL C 3 163 ? 14.967  -27.585 -48.980 1.00 18.51 ? 163 VAL L CG1 1 
ATOM   4157 C CG2 . VAL C 3 163 ? 15.827  -26.119 -50.804 1.00 19.47 ? 163 VAL L CG2 1 
ATOM   4158 N N   . THR C 3 164 ? 11.670  -26.766 -48.580 1.00 17.58 ? 164 THR L N   1 
ATOM   4159 C CA  . THR C 3 164 ? 10.825  -26.896 -47.370 1.00 18.31 ? 164 THR L CA  1 
ATOM   4160 C C   . THR C 3 164 ? 11.705  -27.082 -46.142 1.00 18.86 ? 164 THR L C   1 
ATOM   4161 O O   . THR C 3 164 ? 12.882  -27.521 -46.195 1.00 18.54 ? 164 THR L O   1 
ATOM   4162 C CB  . THR C 3 164 ? 9.822   -28.041 -47.467 1.00 19.77 ? 164 THR L CB  1 
ATOM   4163 O OG1 . THR C 3 164 ? 10.520  -29.271 -47.763 1.00 19.83 ? 164 THR L OG1 1 
ATOM   4164 C CG2 . THR C 3 164 ? 8.791   -27.743 -48.517 1.00 21.33 ? 164 THR L CG2 1 
ATOM   4165 N N   . GLU C 3 165 ? 11.109  -26.772 -45.003 1.00 21.37 ? 165 GLU L N   1 
ATOM   4166 C CA  . GLU C 3 165 ? 11.694  -27.236 -43.747 1.00 24.31 ? 165 GLU L CA  1 
ATOM   4167 C C   . GLU C 3 165 ? 11.617  -28.760 -43.737 1.00 21.90 ? 165 GLU L C   1 
ATOM   4168 O O   . GLU C 3 165 ? 10.712  -29.338 -44.372 1.00 22.11 ? 165 GLU L O   1 
ATOM   4169 C CB  . GLU C 3 165 ? 10.943  -26.613 -42.564 1.00 28.06 ? 165 GLU L CB  1 
ATOM   4170 C CG  . GLU C 3 165 ? 11.332  -25.138 -42.436 1.00 35.36 ? 165 GLU L CG  1 
ATOM   4171 C CD  . GLU C 3 165 ? 12.687  -24.821 -41.798 1.00 43.05 ? 165 GLU L CD  1 
ATOM   4172 O OE1 . GLU C 3 165 ? 13.253  -25.650 -40.953 1.00 48.57 ? 165 GLU L OE1 1 
ATOM   4173 O OE2 . GLU C 3 165 ? 13.160  -23.704 -42.079 1.00 53.05 ? 165 GLU L OE2 1 
ATOM   4174 N N   . GLN C 3 166 ? 12.501  -29.355 -42.984 1.00 22.21 ? 166 GLN L N   1 
ATOM   4175 C CA  . GLN C 3 166 ? 12.497  -30.834 -42.779 1.00 22.82 ? 166 GLN L CA  1 
ATOM   4176 C C   . GLN C 3 166 ? 11.114  -31.340 -42.330 1.00 22.37 ? 166 GLN L C   1 
ATOM   4177 O O   . GLN C 3 166 ? 10.432  -30.737 -41.439 1.00 21.13 ? 166 GLN L O   1 
ATOM   4178 C CB  . GLN C 3 166 ? 13.586  -31.185 -41.778 1.00 23.57 ? 166 GLN L CB  1 
ATOM   4179 C CG  . GLN C 3 166 ? 13.807  -32.673 -41.711 1.00 25.58 ? 166 GLN L CG  1 
ATOM   4180 C CD  . GLN C 3 166 ? 15.113  -32.964 -41.022 1.00 28.37 ? 166 GLN L CD  1 
ATOM   4181 O OE1 . GLN C 3 166 ? 15.519  -32.225 -40.109 1.00 30.55 ? 166 GLN L OE1 1 
ATOM   4182 N NE2 . GLN C 3 166 ? 15.814  -33.979 -41.509 1.00 26.45 ? 166 GLN L NE2 1 
ATOM   4183 N N   . ASP C 3 167 ? 10.679  -32.463 -42.873 1.00 22.54 ? 167 ASP L N   1 
ATOM   4184 C CA  . ASP C 3 167 ? 9.370   -33.035 -42.509 1.00 24.11 ? 167 ASP L CA  1 
ATOM   4185 C C   . ASP C 3 167 ? 9.443   -33.682 -41.115 1.00 25.53 ? 167 ASP L C   1 
ATOM   4186 O O   . ASP C 3 167 ? 10.449  -34.322 -40.777 1.00 24.29 ? 167 ASP L O   1 
ATOM   4187 C CB  . ASP C 3 167 ? 8.933   -34.033 -43.546 1.00 26.27 ? 167 ASP L CB  1 
ATOM   4188 C CG  . ASP C 3 167 ? 7.557   -34.558 -43.271 1.00 28.93 ? 167 ASP L CG  1 
ATOM   4189 O OD1 . ASP C 3 167 ? 6.633   -33.904 -43.732 1.00 31.73 ? 167 ASP L OD1 1 
ATOM   4190 O OD2 . ASP C 3 167 ? 7.445   -35.648 -42.657 1.00 28.13 ? 167 ASP L OD2 1 
ATOM   4191 N N   . SER C 3 168 ? 8.440   -33.425 -40.304 1.00 24.96 ? 168 SER L N   1 
ATOM   4192 C CA  . SER C 3 168 ? 8.397   -33.910 -38.905 1.00 26.95 ? 168 SER L CA  1 
ATOM   4193 C C   . SER C 3 168 ? 8.175   -35.433 -38.865 1.00 28.47 ? 168 SER L C   1 
ATOM   4194 O O   . SER C 3 168 ? 8.472   -36.017 -37.819 1.00 33.60 ? 168 SER L O   1 
ATOM   4195 C CB  . SER C 3 168 ? 7.311   -33.160 -38.148 1.00 27.53 ? 168 SER L CB  1 
ATOM   4196 O OG  . SER C 3 168 ? 6.025   -33.563 -38.629 1.00 26.83 ? 168 SER L OG  1 
ATOM   4197 N N   A LYS C 3 169 ? 7.723   -36.077 -39.960 0.50 28.26 ? 169 LYS L N   1 
ATOM   4198 N N   B LYS C 3 169 ? 7.554   -36.020 -39.885 0.50 30.05 ? 169 LYS L N   1 
ATOM   4199 C CA  A LYS C 3 169 ? 7.207   -37.484 -40.015 0.50 28.46 ? 169 LYS L CA  1 
ATOM   4200 C CA  B LYS C 3 169 ? 7.287   -37.476 -39.942 0.50 31.51 ? 169 LYS L CA  1 
ATOM   4201 C C   A LYS C 3 169 ? 8.085   -38.436 -40.859 0.50 28.46 ? 169 LYS L C   1 
ATOM   4202 C C   B LYS C 3 169 ? 8.590   -38.179 -40.347 0.50 31.80 ? 169 LYS L C   1 
ATOM   4203 O O   A LYS C 3 169 ? 8.057   -39.666 -40.620 0.50 26.43 ? 169 LYS L O   1 
ATOM   4204 O O   B LYS C 3 169 ? 9.226   -38.801 -39.459 0.50 30.44 ? 169 LYS L O   1 
ATOM   4205 C CB  A LYS C 3 169 ? 5.778   -37.474 -40.550 0.50 29.89 ? 169 LYS L CB  1 
ATOM   4206 C CB  B LYS C 3 169 ? 6.136   -37.772 -40.904 0.50 33.64 ? 169 LYS L CB  1 
ATOM   4207 C CG  A LYS C 3 169 ? 4.729   -37.080 -39.517 0.50 30.32 ? 169 LYS L CG  1 
ATOM   4208 C CG  B LYS C 3 169 ? 4.763   -37.283 -40.458 0.50 35.39 ? 169 LYS L CG  1 
ATOM   4209 C CD  A LYS C 3 169 ? 3.348   -37.497 -39.921 0.50 32.30 ? 169 LYS L CD  1 
ATOM   4210 C CD  B LYS C 3 169 ? 3.650   -37.878 -41.299 0.50 37.71 ? 169 LYS L CD  1 
ATOM   4211 C CE  A LYS C 3 169 ? 2.852   -36.739 -41.138 0.50 33.36 ? 169 LYS L CE  1 
ATOM   4212 C CE  B LYS C 3 169 ? 2.411   -37.007 -41.338 0.50 39.16 ? 169 LYS L CE  1 
ATOM   4213 N NZ  A LYS C 3 169 ? 2.544   -35.321 -40.817 0.50 33.66 ? 169 LYS L NZ  1 
ATOM   4214 N NZ  B LYS C 3 169 ? 2.077   -36.462 -39.998 0.50 40.24 ? 169 LYS L NZ  1 
ATOM   4215 N N   A ASP C 3 170 ? 8.877   -37.935 -41.809 0.50 27.08 ? 170 ASP L N   1 
ATOM   4216 N N   B ASP C 3 170 ? 8.984   -38.020 -41.622 0.50 29.87 ? 170 ASP L N   1 
ATOM   4217 C CA  A ASP C 3 170 ? 9.874   -38.814 -42.481 0.50 27.79 ? 170 ASP L CA  1 
ATOM   4218 C CA  B ASP C 3 170 ? 9.963   -38.892 -42.327 0.50 29.59 ? 170 ASP L CA  1 
ATOM   4219 C C   A ASP C 3 170 ? 11.262  -38.155 -42.598 0.50 27.26 ? 170 ASP L C   1 
ATOM   4220 C C   B ASP C 3 170 ? 11.339  -38.223 -42.465 0.50 28.34 ? 170 ASP L C   1 
ATOM   4221 O O   A ASP C 3 170 ? 12.056  -38.733 -43.349 0.50 28.05 ? 170 ASP L O   1 
ATOM   4222 O O   B ASP C 3 170 ? 12.194  -38.835 -43.114 0.50 29.38 ? 170 ASP L O   1 
ATOM   4223 C CB  A ASP C 3 170 ? 9.355   -39.280 -43.839 0.50 28.87 ? 170 ASP L CB  1 
ATOM   4224 C CB  B ASP C 3 170 ? 9.450   -39.230 -43.717 0.50 30.21 ? 170 ASP L CB  1 
ATOM   4225 C CG  A ASP C 3 170 ? 9.340   -38.171 -44.879 0.50 27.87 ? 170 ASP L CG  1 
ATOM   4226 C CG  B ASP C 3 170 ? 9.266   -37.966 -44.547 0.50 28.98 ? 170 ASP L CG  1 
ATOM   4227 O OD1 A ASP C 3 170 ? 9.785   -37.047 -44.532 0.50 26.81 ? 170 ASP L OD1 1 
ATOM   4228 O OD1 B ASP C 3 170 ? 8.331   -37.934 -45.360 0.50 28.87 ? 170 ASP L OD1 1 
ATOM   4229 O OD2 A ASP C 3 170 ? 8.895   -38.440 -46.018 0.50 28.64 ? 170 ASP L OD2 1 
ATOM   4230 O OD2 B ASP C 3 170 ? 10.039  -37.008 -44.318 0.50 27.65 ? 170 ASP L OD2 1 
ATOM   4231 N N   . SER C 3 171 ? 11.517  -37.010 -41.928 1.00 26.43 ? 171 SER L N   1 
ATOM   4232 C CA  . SER C 3 171 ? 12.801  -36.257 -41.834 1.00 25.56 ? 171 SER L CA  1 
ATOM   4233 C C   . SER C 3 171 ? 13.404  -35.911 -43.230 1.00 24.74 ? 171 SER L C   1 
ATOM   4234 O O   . SER C 3 171 ? 14.618  -35.629 -43.319 1.00 24.44 ? 171 SER L O   1 
ATOM   4235 C CB  . SER C 3 171 ? 13.794  -37.015 -40.937 1.00 28.22 ? 171 SER L CB  1 
ATOM   4236 O OG  . SER C 3 171 ? 13.136  -37.613 -39.795 1.00 28.35 ? 171 SER L OG  1 
ATOM   4237 N N   . THR C 3 172 ? 12.563  -35.818 -44.246 1.00 22.60 ? 172 THR L N   1 
ATOM   4238 C CA  . THR C 3 172 ? 13.014  -35.475 -45.627 1.00 21.83 ? 172 THR L CA  1 
ATOM   4239 C C   . THR C 3 172 ? 12.798  -33.977 -45.907 1.00 21.13 ? 172 THR L C   1 
ATOM   4240 O O   . THR C 3 172 ? 12.119  -33.302 -45.133 1.00 19.29 ? 172 THR L O   1 
ATOM   4241 C CB  . THR C 3 172 ? 12.334  -36.303 -46.708 1.00 22.29 ? 172 THR L CB  1 
ATOM   4242 O OG1 . THR C 3 172 ? 10.969  -35.955 -46.815 1.00 21.86 ? 172 THR L OG1 1 
ATOM   4243 C CG2 . THR C 3 172 ? 12.469  -37.801 -46.492 1.00 23.60 ? 172 THR L CG2 1 
ATOM   4244 N N   . TYR C 3 173 ? 13.429  -33.515 -46.988 1.00 20.32 ? 173 TYR L N   1 
ATOM   4245 C CA  . TYR C 3 173 ? 13.238  -32.183 -47.598 1.00 19.92 ? 173 TYR L CA  1 
ATOM   4246 C C   . TYR C 3 173 ? 12.482  -32.352 -48.916 1.00 18.83 ? 173 TYR L C   1 
ATOM   4247 O O   . TYR C 3 173 ? 12.556  -33.461 -49.539 1.00 17.85 ? 173 TYR L O   1 
ATOM   4248 C CB  . TYR C 3 173 ? 14.592  -31.533 -47.851 1.00 21.13 ? 173 TYR L CB  1 
ATOM   4249 C CG  . TYR C 3 173 ? 15.367  -31.295 -46.583 1.00 23.66 ? 173 TYR L CG  1 
ATOM   4250 C CD1 . TYR C 3 173 ? 16.183  -32.293 -46.065 1.00 26.05 ? 173 TYR L CD1 1 
ATOM   4251 C CD2 . TYR C 3 173 ? 15.174  -30.140 -45.823 1.00 23.95 ? 173 TYR L CD2 1 
ATOM   4252 C CE1 . TYR C 3 173 ? 16.847  -32.131 -44.858 1.00 27.77 ? 173 TYR L CE1 1 
ATOM   4253 C CE2 . TYR C 3 173 ? 15.823  -29.971 -44.613 1.00 26.00 ? 173 TYR L CE2 1 
ATOM   4254 C CZ  . TYR C 3 173 ? 16.665  -30.969 -44.127 1.00 28.38 ? 173 TYR L CZ  1 
ATOM   4255 O OH  . TYR C 3 173 ? 17.347  -30.875 -42.941 1.00 30.54 ? 173 TYR L OH  1 
ATOM   4256 N N   . SER C 3 174 ? 11.819  -31.285 -49.361 1.00 17.32 ? 174 SER L N   1 
ATOM   4257 C CA  . SER C 3 174 ? 11.353  -31.169 -50.755 1.00 17.07 ? 174 SER L CA  1 
ATOM   4258 C C   . SER C 3 174 ? 11.896  -29.853 -51.337 1.00 16.93 ? 174 SER L C   1 
ATOM   4259 O O   . SER C 3 174 ? 12.194  -28.903 -50.570 1.00 15.88 ? 174 SER L O   1 
ATOM   4260 C CB  . SER C 3 174 ? 9.879   -31.321 -50.879 1.00 17.60 ? 174 SER L CB  1 
ATOM   4261 O OG  . SER C 3 174 ? 9.479   -32.616 -50.445 1.00 18.25 ? 174 SER L OG  1 
ATOM   4262 N N   . LEU C 3 175 ? 12.010  -29.762 -52.649 1.00 16.91 ? 175 LEU L N   1 
ATOM   4263 C CA  . LEU C 3 175 ? 12.629  -28.567 -53.282 1.00 16.78 ? 175 LEU L CA  1 
ATOM   4264 C C   . LEU C 3 175 ? 11.854  -28.266 -54.565 1.00 17.02 ? 175 LEU L C   1 
ATOM   4265 O O   . LEU C 3 175 ? 11.507  -29.198 -55.308 1.00 16.75 ? 175 LEU L O   1 
ATOM   4266 C CB  . LEU C 3 175 ? 14.104  -28.867 -53.529 1.00 17.57 ? 175 LEU L CB  1 
ATOM   4267 C CG  . LEU C 3 175 ? 14.959  -27.825 -54.279 1.00 18.59 ? 175 LEU L CG  1 
ATOM   4268 C CD1 . LEU C 3 175 ? 16.423  -28.079 -54.028 1.00 19.67 ? 175 LEU L CD1 1 
ATOM   4269 C CD2 . LEU C 3 175 ? 14.768  -27.863 -55.773 1.00 18.85 ? 175 LEU L CD2 1 
ATOM   4270 N N   . SER C 3 176 ? 11.614  -26.998 -54.822 1.00 16.87 ? 176 SER L N   1 
ATOM   4271 C CA  . SER C 3 176 ? 11.062  -26.542 -56.106 1.00 18.00 ? 176 SER L CA  1 
ATOM   4272 C C   . SER C 3 176 ? 12.195  -25.779 -56.815 1.00 18.89 ? 176 SER L C   1 
ATOM   4273 O O   . SER C 3 176 ? 12.886  -25.001 -56.162 1.00 18.38 ? 176 SER L O   1 
ATOM   4274 C CB  . SER C 3 176 ? 9.831   -25.684 -55.975 1.00 19.49 ? 176 SER L CB  1 
ATOM   4275 O OG  . SER C 3 176 ? 10.158  -24.486 -55.259 1.00 20.92 ? 176 SER L OG  1 
ATOM   4276 N N   . SER C 3 177 ? 12.297  -25.905 -58.111 1.00 17.88 ? 177 SER L N   1 
ATOM   4277 C CA  . SER C 3 177 ? 13.099  -24.990 -58.965 1.00 18.34 ? 177 SER L CA  1 
ATOM   4278 C C   . SER C 3 177 ? 12.147  -24.452 -60.016 1.00 18.50 ? 177 SER L C   1 
ATOM   4279 O O   . SER C 3 177 ? 11.422  -25.275 -60.662 1.00 19.68 ? 177 SER L O   1 
ATOM   4280 C CB  . SER C 3 177 ? 14.287  -25.630 -59.542 1.00 18.64 ? 177 SER L CB  1 
ATOM   4281 O OG  . SER C 3 177 ? 14.954  -24.765 -60.458 1.00 19.20 ? 177 SER L OG  1 
ATOM   4282 N N   . THR C 3 178 ? 12.069  -23.142 -60.148 1.00 17.81 ? 178 THR L N   1 
ATOM   4283 C CA  . THR C 3 178 ? 11.169  -22.484 -61.094 1.00 18.24 ? 178 THR L CA  1 
ATOM   4284 C C   . THR C 3 178 ? 12.017  -21.748 -62.140 1.00 18.38 ? 178 THR L C   1 
ATOM   4285 O O   . THR C 3 178 ? 12.803  -20.847 -61.725 1.00 18.23 ? 178 THR L O   1 
ATOM   4286 C CB  . THR C 3 178 ? 10.264  -21.506 -60.364 1.00 19.23 ? 178 THR L CB  1 
ATOM   4287 O OG1 . THR C 3 178 ? 9.652   -22.285 -59.330 1.00 19.04 ? 178 THR L OG1 1 
ATOM   4288 C CG2 . THR C 3 178 ? 9.284   -20.868 -61.299 1.00 19.97 ? 178 THR L CG2 1 
ATOM   4289 N N   . LEU C 3 179 ? 11.841  -22.103 -63.400 1.00 18.65 ? 179 LEU L N   1 
ATOM   4290 C CA  . LEU C 3 179 ? 12.484  -21.446 -64.590 1.00 19.30 ? 179 LEU L CA  1 
ATOM   4291 C C   . LEU C 3 179 ? 11.513  -20.369 -65.092 1.00 20.59 ? 179 LEU L C   1 
ATOM   4292 O O   . LEU C 3 179 ? 10.370  -20.742 -65.355 1.00 20.98 ? 179 LEU L O   1 
ATOM   4293 C CB  . LEU C 3 179 ? 12.731  -22.501 -65.673 1.00 19.57 ? 179 LEU L CB  1 
ATOM   4294 C CG  . LEU C 3 179 ? 13.329  -21.967 -66.962 1.00 20.94 ? 179 LEU L CG  1 
ATOM   4295 C CD1 . LEU C 3 179 ? 14.745  -21.460 -66.740 1.00 21.56 ? 179 LEU L CD1 1 
ATOM   4296 C CD2 . LEU C 3 179 ? 13.336  -23.080 -68.002 1.00 21.44 ? 179 LEU L CD2 1 
ATOM   4297 N N   . THR C 3 180 ? 11.908  -19.099 -65.185 1.00 21.27 ? 180 THR L N   1 
ATOM   4298 C CA  . THR C 3 180 ? 10.993  -18.020 -65.611 1.00 23.97 ? 180 THR L CA  1 
ATOM   4299 C C   . THR C 3 180 ? 11.469  -17.462 -66.947 1.00 25.39 ? 180 THR L C   1 
ATOM   4300 O O   . THR C 3 180 ? 12.606  -16.986 -66.958 1.00 25.05 ? 180 THR L O   1 
ATOM   4301 C CB  . THR C 3 180 ? 10.822  -16.965 -64.517 1.00 25.44 ? 180 THR L CB  1 
ATOM   4302 O OG1 . THR C 3 180 ? 10.370  -17.630 -63.324 1.00 24.66 ? 180 THR L OG1 1 
ATOM   4303 C CG2 . THR C 3 180 ? 9.861   -15.886 -64.968 1.00 27.98 ? 180 THR L CG2 1 
ATOM   4304 N N   . LEU C 3 181 ? 10.629  -17.588 -67.989 1.00 26.23 ? 181 LEU L N   1 
ATOM   4305 C CA  . LEU C 3 181 ? 10.886  -17.033 -69.337 1.00 29.80 ? 181 LEU L CA  1 
ATOM   4306 C C   . LEU C 3 181 ? 9.736   -16.110 -69.751 1.00 30.95 ? 181 LEU L C   1 
ATOM   4307 O O   . LEU C 3 181 ? 8.620   -16.332 -69.318 1.00 32.23 ? 181 LEU L O   1 
ATOM   4308 C CB  . LEU C 3 181 ? 11.023  -18.196 -70.314 1.00 30.86 ? 181 LEU L CB  1 
ATOM   4309 C CG  . LEU C 3 181 ? 12.045  -19.273 -69.945 1.00 31.92 ? 181 LEU L CG  1 
ATOM   4310 C CD1 . LEU C 3 181 ? 12.103  -20.350 -71.004 1.00 33.63 ? 181 LEU L CD1 1 
ATOM   4311 C CD2 . LEU C 3 181 ? 13.418  -18.665 -69.819 1.00 33.35 ? 181 LEU L CD2 1 
ATOM   4312 N N   . SER C 3 182 ? 9.992   -15.158 -70.644 1.00 32.43 ? 182 SER L N   1 
ATOM   4313 C CA  . SER C 3 182 ? 8.903   -14.457 -71.365 1.00 33.24 ? 182 SER L CA  1 
ATOM   4314 C C   . SER C 3 182 ? 8.144   -15.494 -72.217 1.00 33.72 ? 182 SER L C   1 
ATOM   4315 O O   . SER C 3 182 ? 8.745   -16.524 -72.617 1.00 32.95 ? 182 SER L O   1 
ATOM   4316 C CB  . SER C 3 182 ? 9.466   -13.311 -72.200 1.00 34.80 ? 182 SER L CB  1 
ATOM   4317 O OG  . SER C 3 182 ? 10.259  -13.842 -73.263 1.00 34.49 ? 182 SER L OG  1 
ATOM   4318 N N   . LYS C 3 183 ? 6.855   -15.263 -72.505 1.00 34.80 ? 183 LYS L N   1 
ATOM   4319 C CA  . LYS C 3 183 ? 6.110   -16.115 -73.463 1.00 36.67 ? 183 LYS L CA  1 
ATOM   4320 C C   . LYS C 3 183 ? 6.922   -16.240 -74.763 1.00 36.37 ? 183 LYS L C   1 
ATOM   4321 O O   . LYS C 3 183 ? 7.043   -17.370 -75.281 1.00 35.73 ? 183 LYS L O   1 
ATOM   4322 C CB  . LYS C 3 183 ? 4.732   -15.548 -73.794 1.00 40.55 ? 183 LYS L CB  1 
ATOM   4323 C CG  . LYS C 3 183 ? 4.057   -16.340 -74.901 1.00 42.15 ? 183 LYS L CG  1 
ATOM   4324 C CD  . LYS C 3 183 ? 2.603   -16.356 -74.776 1.00 45.22 ? 183 LYS L CD  1 
ATOM   4325 C CE  . LYS C 3 183 ? 2.016   -15.070 -75.289 1.00 48.70 ? 183 LYS L CE  1 
ATOM   4326 N NZ  . LYS C 3 183 ? 1.307   -15.366 -76.547 1.00 53.76 ? 183 LYS L NZ  1 
ATOM   4327 N N   . ALA C 3 184 ? 7.510   -15.137 -75.235 1.00 37.44 ? 184 ALA L N   1 
ATOM   4328 C CA  . ALA C 3 184 ? 8.256   -15.077 -76.520 1.00 39.26 ? 184 ALA L CA  1 
ATOM   4329 C C   . ALA C 3 184 ? 9.390   -16.115 -76.502 1.00 38.49 ? 184 ALA L C   1 
ATOM   4330 O O   . ALA C 3 184 ? 9.423   -17.023 -77.398 1.00 37.94 ? 184 ALA L O   1 
ATOM   4331 C CB  . ALA C 3 184 ? 8.777   -13.670 -76.711 1.00 40.98 ? 184 ALA L CB  1 
ATOM   4332 N N   . ASP C 3 185 ? 10.245  -16.029 -75.473 1.00 36.75 ? 185 ASP L N   1 
ATOM   4333 C CA  . ASP C 3 185 ? 11.396  -16.943 -75.252 1.00 35.97 ? 185 ASP L CA  1 
ATOM   4334 C C   . ASP C 3 185 ? 10.897  -18.363 -75.079 1.00 34.79 ? 185 ASP L C   1 
ATOM   4335 O O   . ASP C 3 185 ? 11.467  -19.266 -75.704 1.00 34.26 ? 185 ASP L O   1 
ATOM   4336 C CB  . ASP C 3 185 ? 12.237  -16.536 -74.048 1.00 36.98 ? 185 ASP L CB  1 
ATOM   4337 C CG  . ASP C 3 185 ? 13.034  -15.297 -74.374 1.00 38.05 ? 185 ASP L CG  1 
ATOM   4338 O OD1 . ASP C 3 185 ? 12.893  -14.827 -75.505 1.00 43.09 ? 185 ASP L OD1 1 
ATOM   4339 O OD2 . ASP C 3 185 ? 13.800  -14.854 -73.539 1.00 38.83 ? 185 ASP L OD2 1 
ATOM   4340 N N   . TYR C 3 186 ? 9.819   -18.551 -74.329 1.00 32.80 ? 186 TYR L N   1 
ATOM   4341 C CA  . TYR C 3 186 ? 9.290   -19.912 -74.106 1.00 32.13 ? 186 TYR L CA  1 
ATOM   4342 C C   . TYR C 3 186 ? 8.934   -20.519 -75.463 1.00 33.86 ? 186 TYR L C   1 
ATOM   4343 O O   . TYR C 3 186 ? 9.182   -21.738 -75.719 1.00 32.42 ? 186 TYR L O   1 
ATOM   4344 C CB  . TYR C 3 186 ? 8.130   -19.861 -73.120 1.00 29.89 ? 186 TYR L CB  1 
ATOM   4345 C CG  . TYR C 3 186 ? 7.491   -21.196 -72.890 1.00 29.08 ? 186 TYR L CG  1 
ATOM   4346 C CD1 . TYR C 3 186 ? 8.127   -22.186 -72.151 1.00 27.69 ? 186 TYR L CD1 1 
ATOM   4347 C CD2 . TYR C 3 186 ? 6.227   -21.465 -73.394 1.00 29.60 ? 186 TYR L CD2 1 
ATOM   4348 C CE1 . TYR C 3 186 ? 7.554   -23.430 -71.972 1.00 27.59 ? 186 TYR L CE1 1 
ATOM   4349 C CE2 . TYR C 3 186 ? 5.646   -22.711 -73.229 1.00 28.84 ? 186 TYR L CE2 1 
ATOM   4350 C CZ  . TYR C 3 186 ? 6.288   -23.677 -72.471 1.00 27.77 ? 186 TYR L CZ  1 
ATOM   4351 O OH  . TYR C 3 186 ? 5.647   -24.862 -72.263 1.00 26.59 ? 186 TYR L OH  1 
ATOM   4352 N N   . GLU C 3 187 ? 8.372   -19.690 -76.345 1.00 36.28 ? 187 GLU L N   1 
ATOM   4353 C CA  . GLU C 3 187 ? 7.787   -20.194 -77.607 1.00 38.39 ? 187 GLU L CA  1 
ATOM   4354 C C   . GLU C 3 187 ? 8.866   -20.436 -78.651 1.00 39.13 ? 187 GLU L C   1 
ATOM   4355 O O   . GLU C 3 187 ? 8.501   -21.091 -79.642 1.00 38.16 ? 187 GLU L O   1 
ATOM   4356 C CB  . GLU C 3 187 ? 6.665   -19.285 -78.100 1.00 40.96 ? 187 GLU L CB  1 
ATOM   4357 C CG  . GLU C 3 187 ? 5.404   -19.578 -77.329 1.00 42.66 ? 187 GLU L CG  1 
ATOM   4358 C CD  . GLU C 3 187 ? 4.238   -18.666 -77.614 1.00 45.23 ? 187 GLU L CD  1 
ATOM   4359 O OE1 . GLU C 3 187 ? 4.417   -17.664 -78.357 1.00 46.45 ? 187 GLU L OE1 1 
ATOM   4360 O OE2 . GLU C 3 187 ? 3.181   -18.987 -77.092 1.00 46.96 ? 187 GLU L OE2 1 
ATOM   4361 N N   . LYS C 3 188 ? 10.114  -20.005 -78.415 1.00 38.42 ? 188 LYS L N   1 
ATOM   4362 C CA  . LYS C 3 188 ? 11.244  -20.232 -79.363 1.00 40.18 ? 188 LYS L CA  1 
ATOM   4363 C C   . LYS C 3 188 ? 11.809  -21.658 -79.216 1.00 37.98 ? 188 LYS L C   1 
ATOM   4364 O O   . LYS C 3 188 ? 12.727  -22.009 -79.966 1.00 35.31 ? 188 LYS L O   1 
ATOM   4365 C CB  . LYS C 3 188 ? 12.369  -19.225 -79.100 1.00 43.22 ? 188 LYS L CB  1 
ATOM   4366 C CG  . LYS C 3 188 ? 12.072  -17.761 -79.439 1.00 47.14 ? 188 LYS L CG  1 
ATOM   4367 C CD  . LYS C 3 188 ? 13.329  -16.937 -79.705 1.00 51.19 ? 188 LYS L CD  1 
ATOM   4368 C CE  . LYS C 3 188 ? 13.744  -16.029 -78.569 1.00 54.39 ? 188 LYS L CE  1 
ATOM   4369 N NZ  . LYS C 3 188 ? 13.701  -14.602 -78.974 1.00 56.86 ? 188 LYS L NZ  1 
ATOM   4370 N N   . HIS C 3 189 ? 11.368  -22.450 -78.231 1.00 34.16 ? 189 HIS L N   1 
ATOM   4371 C CA  . HIS C 3 189 ? 12.108  -23.674 -77.856 1.00 33.39 ? 189 HIS L CA  1 
ATOM   4372 C C   . HIS C 3 189 ? 11.127  -24.806 -77.698 1.00 32.28 ? 189 HIS L C   1 
ATOM   4373 O O   . HIS C 3 189 ? 9.979   -24.542 -77.366 1.00 34.34 ? 189 HIS L O   1 
ATOM   4374 C CB  . HIS C 3 189 ? 12.961  -23.429 -76.603 1.00 33.37 ? 189 HIS L CB  1 
ATOM   4375 C CG  . HIS C 3 189 ? 14.000  -22.387 -76.815 1.00 35.68 ? 189 HIS L CG  1 
ATOM   4376 N ND1 . HIS C 3 189 ? 15.150  -22.632 -77.541 1.00 38.22 ? 189 HIS L ND1 1 
ATOM   4377 C CD2 . HIS C 3 189 ? 14.081  -21.114 -76.382 1.00 38.64 ? 189 HIS L CD2 1 
ATOM   4378 C CE1 . HIS C 3 189 ? 15.892  -21.545 -77.565 1.00 40.07 ? 189 HIS L CE1 1 
ATOM   4379 N NE2 . HIS C 3 189 ? 15.249  -20.591 -76.875 1.00 40.61 ? 189 HIS L NE2 1 
ATOM   4380 N N   . LYS C 3 190 ? 11.605  -26.021 -77.847 1.00 32.85 ? 190 LYS L N   1 
ATOM   4381 C CA  . LYS C 3 190 ? 10.745  -27.224 -77.862 1.00 35.43 ? 190 LYS L CA  1 
ATOM   4382 C C   . LYS C 3 190 ? 10.884  -28.021 -76.562 1.00 32.45 ? 190 LYS L C   1 
ATOM   4383 O O   . LYS C 3 190 ? 9.848   -28.309 -75.916 1.00 31.07 ? 190 LYS L O   1 
ATOM   4384 C CB  . LYS C 3 190 ? 11.121  -28.057 -79.092 1.00 41.03 ? 190 LYS L CB  1 
ATOM   4385 C CG  . LYS C 3 190 ? 10.300  -29.312 -79.302 1.00 47.79 ? 190 LYS L CG  1 
ATOM   4386 C CD  . LYS C 3 190 ? 10.276  -29.732 -80.773 1.00 54.49 ? 190 LYS L CD  1 
ATOM   4387 C CE  . LYS C 3 190 ? 9.099   -30.630 -81.099 1.00 60.98 ? 190 LYS L CE  1 
ATOM   4388 N NZ  . LYS C 3 190 ? 9.404   -32.037 -80.731 1.00 64.69 ? 190 LYS L NZ  1 
ATOM   4389 N N   . VAL C 3 191 ? 12.112  -28.380 -76.185 1.00 29.28 ? 191 VAL L N   1 
ATOM   4390 C CA  . VAL C 3 191 ? 12.326  -29.366 -75.089 1.00 28.12 ? 191 VAL L CA  1 
ATOM   4391 C C   . VAL C 3 191 ? 12.735  -28.617 -73.814 1.00 25.84 ? 191 VAL L C   1 
ATOM   4392 O O   . VAL C 3 191 ? 13.712  -27.825 -73.852 1.00 23.99 ? 191 VAL L O   1 
ATOM   4393 C CB  . VAL C 3 191 ? 13.371  -30.428 -75.440 1.00 28.72 ? 191 VAL L CB  1 
ATOM   4394 C CG1 . VAL C 3 191 ? 13.448  -31.459 -74.328 1.00 28.48 ? 191 VAL L CG1 1 
ATOM   4395 C CG2 . VAL C 3 191 ? 13.082  -31.090 -76.793 1.00 29.86 ? 191 VAL L CG2 1 
ATOM   4396 N N   . TYR C 3 192 ? 11.978  -28.864 -72.767 1.00 24.68 ? 192 TYR L N   1 
ATOM   4397 C CA  . TYR C 3 192 ? 12.180  -28.297 -71.421 1.00 23.64 ? 192 TYR L CA  1 
ATOM   4398 C C   . TYR C 3 192 ? 12.482  -29.499 -70.527 1.00 23.64 ? 192 TYR L C   1 
ATOM   4399 O O   . TYR C 3 192 ? 11.660  -30.442 -70.337 1.00 25.09 ? 192 TYR L O   1 
ATOM   4400 C CB  . TYR C 3 192 ? 10.962  -27.447 -70.996 1.00 23.61 ? 192 TYR L CB  1 
ATOM   4401 C CG  . TYR C 3 192 ? 10.890  -26.152 -71.737 1.00 23.26 ? 192 TYR L CG  1 
ATOM   4402 C CD1 . TYR C 3 192 ? 11.497  -25.004 -71.240 1.00 22.95 ? 192 TYR L CD1 1 
ATOM   4403 C CD2 . TYR C 3 192 ? 10.298  -26.099 -72.985 1.00 23.63 ? 192 TYR L CD2 1 
ATOM   4404 C CE1 . TYR C 3 192 ? 11.505  -23.839 -71.980 1.00 23.71 ? 192 TYR L CE1 1 
ATOM   4405 C CE2 . TYR C 3 192 ? 10.302  -24.940 -73.733 1.00 24.53 ? 192 TYR L CE2 1 
ATOM   4406 C CZ  . TYR C 3 192 ? 10.890  -23.805 -73.218 1.00 24.39 ? 192 TYR L CZ  1 
ATOM   4407 O OH  . TYR C 3 192 ? 10.909  -22.655 -73.945 1.00 26.21 ? 192 TYR L OH  1 
ATOM   4408 N N   . ALA C 3 193 ? 13.665  -29.474 -69.929 1.00 22.70 ? 193 ALA L N   1 
ATOM   4409 C CA  . ALA C 3 193 ? 14.123  -30.580 -69.086 1.00 22.93 ? 193 ALA L CA  1 
ATOM   4410 C C   . ALA C 3 193 ? 14.627  -30.071 -67.729 1.00 21.58 ? 193 ALA L C   1 
ATOM   4411 O O   . ALA C 3 193 ? 15.351  -29.096 -67.703 1.00 21.46 ? 193 ALA L O   1 
ATOM   4412 C CB  . ALA C 3 193 ? 15.186  -31.332 -69.842 1.00 23.80 ? 193 ALA L CB  1 
ATOM   4413 N N   . CYS C 3 194 ? 14.322  -30.847 -66.707 1.00 21.29 ? 194 CYS L N   1 
ATOM   4414 C CA  . CYS C 3 194 ? 14.864  -30.688 -65.341 1.00 21.43 ? 194 CYS L CA  1 
ATOM   4415 C C   . CYS C 3 194 ? 15.791  -31.875 -65.080 1.00 21.48 ? 194 CYS L C   1 
ATOM   4416 O O   . CYS C 3 194 ? 15.287  -32.990 -65.144 1.00 22.07 ? 194 CYS L O   1 
ATOM   4417 C CB  . CYS C 3 194 ? 13.693  -30.658 -64.353 1.00 21.91 ? 194 CYS L CB  1 
ATOM   4418 S SG  . CYS C 3 194 ? 14.293  -30.409 -62.695 1.00 25.43 ? 194 CYS L SG  1 
ATOM   4419 N N   . GLU C 3 195 ? 17.083  -31.660 -64.865 1.00 21.05 ? 195 GLU L N   1 
ATOM   4420 C CA  . GLU C 3 195 ? 18.021  -32.751 -64.540 1.00 22.38 ? 195 GLU L CA  1 
ATOM   4421 C C   . GLU C 3 195 ? 18.466  -32.672 -63.085 1.00 21.52 ? 195 GLU L C   1 
ATOM   4422 O O   . GLU C 3 195 ? 19.010  -31.632 -62.682 1.00 20.97 ? 195 GLU L O   1 
ATOM   4423 C CB  . GLU C 3 195 ? 19.213  -32.710 -65.501 1.00 24.66 ? 195 GLU L CB  1 
ATOM   4424 C CG  . GLU C 3 195 ? 20.253  -33.763 -65.153 1.00 28.01 ? 195 GLU L CG  1 
ATOM   4425 C CD  . GLU C 3 195 ? 21.658  -33.367 -65.591 1.00 31.95 ? 195 GLU L CD  1 
ATOM   4426 O OE1 . GLU C 3 195 ? 22.325  -32.474 -64.903 1.00 33.99 ? 195 GLU L OE1 1 
ATOM   4427 O OE2 . GLU C 3 195 ? 22.070  -33.903 -66.609 1.00 34.27 ? 195 GLU L OE2 1 
ATOM   4428 N N   . VAL C 3 196 ? 18.300  -33.767 -62.334 1.00 20.94 ? 196 VAL L N   1 
ATOM   4429 C CA  . VAL C 3 196 ? 18.478  -33.796 -60.879 1.00 21.01 ? 196 VAL L CA  1 
ATOM   4430 C C   . VAL C 3 196 ? 19.618  -34.750 -60.545 1.00 21.17 ? 196 VAL L C   1 
ATOM   4431 O O   . VAL C 3 196 ? 19.591  -35.955 -60.973 1.00 21.53 ? 196 VAL L O   1 
ATOM   4432 C CB  . VAL C 3 196 ? 17.172  -34.212 -60.186 1.00 21.07 ? 196 VAL L CB  1 
ATOM   4433 C CG1 . VAL C 3 196 ? 17.354  -34.502 -58.704 1.00 20.72 ? 196 VAL L CG1 1 
ATOM   4434 C CG2 . VAL C 3 196 ? 16.141  -33.122 -60.405 1.00 21.64 ? 196 VAL L CG2 1 
ATOM   4435 N N   . THR C 3 197 ? 20.598  -34.232 -59.830 1.00 21.05 ? 197 THR L N   1 
ATOM   4436 C CA  . THR C 3 197 ? 21.754  -35.018 -59.346 1.00 22.15 ? 197 THR L CA  1 
ATOM   4437 C C   . THR C 3 197 ? 21.606  -35.065 -57.819 1.00 21.75 ? 197 THR L C   1 
ATOM   4438 O O   . THR C 3 197 ? 21.394  -34.028 -57.197 1.00 21.85 ? 197 THR L O   1 
ATOM   4439 C CB  . THR C 3 197 ? 23.074  -34.379 -59.793 1.00 22.80 ? 197 THR L CB  1 
ATOM   4440 O OG1 . THR C 3 197 ? 23.173  -34.353 -61.214 1.00 23.06 ? 197 THR L OG1 1 
ATOM   4441 C CG2 . THR C 3 197 ? 24.280  -35.136 -59.277 1.00 24.50 ? 197 THR L CG2 1 
ATOM   4442 N N   . HIS C 3 198 ? 21.664  -36.245 -57.227 1.00 21.90 ? 198 HIS L N   1 
ATOM   4443 C CA  . HIS C 3 198 ? 21.487  -36.406 -55.771 1.00 21.80 ? 198 HIS L CA  1 
ATOM   4444 C C   . HIS C 3 198 ? 22.185  -37.700 -55.357 1.00 23.16 ? 198 HIS L C   1 
ATOM   4445 O O   . HIS C 3 198 ? 22.137  -38.692 -56.126 1.00 23.09 ? 198 HIS L O   1 
ATOM   4446 C CB  . HIS C 3 198 ? 20.006  -36.398 -55.361 1.00 20.99 ? 198 HIS L CB  1 
ATOM   4447 C CG  . HIS C 3 198 ? 19.795  -36.419 -53.880 1.00 20.69 ? 198 HIS L CG  1 
ATOM   4448 N ND1 . HIS C 3 198 ? 19.752  -37.609 -53.159 1.00 21.14 ? 198 HIS L ND1 1 
ATOM   4449 C CD2 . HIS C 3 198 ? 19.667  -35.420 -52.983 1.00 19.76 ? 198 HIS L CD2 1 
ATOM   4450 C CE1 . HIS C 3 198 ? 19.620  -37.341 -51.871 1.00 21.44 ? 198 HIS L CE1 1 
ATOM   4451 N NE2 . HIS C 3 198 ? 19.590  -35.974 -51.715 1.00 20.55 ? 198 HIS L NE2 1 
ATOM   4452 N N   . GLN C 3 199 ? 22.801  -37.667 -54.189 1.00 24.21 ? 199 GLN L N   1 
ATOM   4453 C CA  . GLN C 3 199 ? 23.517  -38.804 -53.552 1.00 26.69 ? 199 GLN L CA  1 
ATOM   4454 C C   . GLN C 3 199 ? 22.731  -40.124 -53.615 1.00 26.57 ? 199 GLN L C   1 
ATOM   4455 O O   . GLN C 3 199 ? 23.379  -41.214 -53.639 1.00 27.41 ? 199 GLN L O   1 
ATOM   4456 C CB  . GLN C 3 199 ? 23.584  -38.494 -52.067 1.00 29.51 ? 199 GLN L CB  1 
ATOM   4457 C CG  . GLN C 3 199 ? 24.968  -38.450 -51.562 1.00 34.22 ? 199 GLN L CG  1 
ATOM   4458 C CD  . GLN C 3 199 ? 24.889  -37.617 -50.318 1.00 33.66 ? 199 GLN L CD  1 
ATOM   4459 O OE1 . GLN C 3 199 ? 24.937  -38.188 -49.250 1.00 35.72 ? 199 GLN L OE1 1 
ATOM   4460 N NE2 . GLN C 3 199 ? 24.697  -36.297 -50.483 1.00 33.13 ? 199 GLN L NE2 1 
ATOM   4461 N N   . GLY C 3 200 ? 21.401  -40.044 -53.482 1.00 24.65 ? 200 GLY L N   1 
ATOM   4462 C CA  . GLY C 3 200 ? 20.526  -41.230 -53.375 1.00 25.87 ? 200 GLY L CA  1 
ATOM   4463 C C   . GLY C 3 200 ? 20.192  -41.836 -54.746 1.00 26.01 ? 200 GLY L C   1 
ATOM   4464 O O   . GLY C 3 200 ? 19.578  -42.876 -54.763 1.00 26.69 ? 200 GLY L O   1 
ATOM   4465 N N   . LEU C 3 201 ? 20.580  -41.170 -55.828 1.00 25.43 ? 201 LEU L N   1 
ATOM   4466 C CA  . LEU C 3 201 ? 20.346  -41.642 -57.207 1.00 26.78 ? 201 LEU L CA  1 
ATOM   4467 C C   . LEU C 3 201 ? 21.596  -42.293 -57.777 1.00 28.44 ? 201 LEU L C   1 
ATOM   4468 O O   . LEU C 3 201 ? 22.685  -41.696 -57.709 1.00 28.99 ? 201 LEU L O   1 
ATOM   4469 C CB  . LEU C 3 201 ? 19.961  -40.453 -58.072 1.00 26.01 ? 201 LEU L CB  1 
ATOM   4470 C CG  . LEU C 3 201 ? 18.647  -39.762 -57.716 1.00 25.36 ? 201 LEU L CG  1 
ATOM   4471 C CD1 . LEU C 3 201 ? 18.494  -38.489 -58.527 1.00 24.16 ? 201 LEU L CD1 1 
ATOM   4472 C CD2 . LEU C 3 201 ? 17.452  -40.677 -57.929 1.00 26.59 ? 201 LEU L CD2 1 
ATOM   4473 N N   . SER C 3 202 ? 21.426  -43.417 -58.473 1.00 29.41 ? 202 SER L N   1 
ATOM   4474 C CA  . SER C 3 202 ? 22.581  -44.116 -59.089 1.00 31.13 ? 202 SER L CA  1 
ATOM   4475 C C   . SER C 3 202 ? 23.166  -43.234 -60.202 1.00 31.93 ? 202 SER L C   1 
ATOM   4476 O O   . SER C 3 202 ? 24.342  -43.355 -60.509 1.00 32.85 ? 202 SER L O   1 
ATOM   4477 C CB  . SER C 3 202 ? 22.127  -45.476 -59.597 1.00 31.43 ? 202 SER L CB  1 
ATOM   4478 O OG  . SER C 3 202 ? 21.735  -46.294 -58.487 1.00 32.17 ? 202 SER L OG  1 
ATOM   4479 N N   . SER C 3 203 ? 22.328  -42.453 -60.876 1.00 31.59 ? 203 SER L N   1 
ATOM   4480 C CA  . SER C 3 203 ? 22.763  -41.508 -61.936 1.00 32.05 ? 203 SER L CA  1 
ATOM   4481 C C   . SER C 3 203 ? 21.683  -40.429 -62.027 1.00 30.06 ? 203 SER L C   1 
ATOM   4482 O O   . SER C 3 203 ? 20.590  -40.594 -61.510 1.00 28.05 ? 203 SER L O   1 
ATOM   4483 C CB  . SER C 3 203 ? 23.027  -42.182 -63.254 1.00 35.22 ? 203 SER L CB  1 
ATOM   4484 O OG  . SER C 3 203 ? 21.803  -42.614 -63.825 1.00 38.56 ? 203 SER L OG  1 
ATOM   4485 N N   . PRO C 3 204 ? 21.972  -39.278 -62.632 1.00 29.95 ? 204 PRO L N   1 
ATOM   4486 C CA  . PRO C 3 204 ? 21.011  -38.166 -62.660 1.00 28.66 ? 204 PRO L CA  1 
ATOM   4487 C C   . PRO C 3 204 ? 19.708  -38.568 -63.351 1.00 28.43 ? 204 PRO L C   1 
ATOM   4488 O O   . PRO C 3 204 ? 19.766  -39.322 -64.316 1.00 28.50 ? 204 PRO L O   1 
ATOM   4489 C CB  . PRO C 3 204 ? 21.713  -37.099 -63.509 1.00 28.69 ? 204 PRO L CB  1 
ATOM   4490 C CG  . PRO C 3 204 ? 23.199  -37.447 -63.406 1.00 30.18 ? 204 PRO L CG  1 
ATOM   4491 C CD  . PRO C 3 204 ? 23.234  -38.956 -63.310 1.00 31.59 ? 204 PRO L CD  1 
ATOM   4492 N N   . VAL C 3 205 ? 18.600  -38.060 -62.843 1.00 27.09 ? 205 VAL L N   1 
ATOM   4493 C CA  . VAL C 3 205 ? 17.216  -38.257 -63.335 1.00 27.50 ? 205 VAL L CA  1 
ATOM   4494 C C   . VAL C 3 205 ? 16.816  -36.995 -64.083 1.00 25.94 ? 205 VAL L C   1 
ATOM   4495 O O   . VAL C 3 205 ? 17.009  -35.851 -63.544 1.00 24.91 ? 205 VAL L O   1 
ATOM   4496 C CB  . VAL C 3 205 ? 16.271  -38.592 -62.166 1.00 28.68 ? 205 VAL L CB  1 
ATOM   4497 C CG1 . VAL C 3 205 ? 14.810  -38.524 -62.573 1.00 29.34 ? 205 VAL L CG1 1 
ATOM   4498 C CG2 . VAL C 3 205 ? 16.616  -39.961 -61.592 1.00 30.38 ? 205 VAL L CG2 1 
ATOM   4499 N N   . THR C 3 206 ? 16.337  -37.163 -65.305 1.00 25.00 ? 206 THR L N   1 
ATOM   4500 C CA  . THR C 3 206 ? 15.790  -36.052 -66.094 1.00 25.15 ? 206 THR L CA  1 
ATOM   4501 C C   . THR C 3 206 ? 14.292  -36.228 -66.270 1.00 26.33 ? 206 THR L C   1 
ATOM   4502 O O   . THR C 3 206 ? 13.869  -37.366 -66.589 1.00 26.66 ? 206 THR L O   1 
ATOM   4503 C CB  . THR C 3 206 ? 16.467  -35.951 -67.451 1.00 25.74 ? 206 THR L CB  1 
ATOM   4504 O OG1 . THR C 3 206 ? 17.831  -35.784 -67.072 1.00 25.22 ? 206 THR L OG1 1 
ATOM   4505 C CG2 . THR C 3 206 ? 15.868  -34.841 -68.299 1.00 25.33 ? 206 THR L CG2 1 
ATOM   4506 N N   . LYS C 3 207 ? 13.521  -35.160 -66.041 1.00 24.78 ? 207 LYS L N   1 
ATOM   4507 C CA  . LYS C 3 207 ? 12.084  -35.126 -66.429 1.00 25.56 ? 207 LYS L CA  1 
ATOM   4508 C C   . LYS C 3 207 ? 11.944  -34.019 -67.456 1.00 25.34 ? 207 LYS L C   1 
ATOM   4509 O O   . LYS C 3 207 ? 12.536  -32.940 -67.291 1.00 23.18 ? 207 LYS L O   1 
ATOM   4510 C CB  . LYS C 3 207 ? 11.146  -34.923 -65.241 1.00 26.25 ? 207 LYS L CB  1 
ATOM   4511 C CG  . LYS C 3 207 ? 11.192  -36.015 -64.199 1.00 27.61 ? 207 LYS L CG  1 
ATOM   4512 C CD  . LYS C 3 207 ? 10.663  -37.340 -64.668 1.00 30.09 ? 207 LYS L CD  1 
ATOM   4513 C CE  . LYS C 3 207 ? 10.895  -38.382 -63.590 1.00 32.51 ? 207 LYS L CE  1 
ATOM   4514 N NZ  . LYS C 3 207 ? 10.502  -39.735 -64.024 1.00 34.68 ? 207 LYS L NZ  1 
ATOM   4515 N N   . SER C 3 208 ? 11.273  -34.291 -68.571 1.00 25.75 ? 208 SER L N   1 
ATOM   4516 C CA  . SER C 3 208 ? 11.184  -33.273 -69.615 1.00 27.22 ? 208 SER L CA  1 
ATOM   4517 C C   . SER C 3 208 ? 9.803   -33.337 -70.261 1.00 27.56 ? 208 SER L C   1 
ATOM   4518 O O   . SER C 3 208 ? 9.043   -34.313 -70.020 1.00 27.32 ? 208 SER L O   1 
ATOM   4519 C CB  . SER C 3 208 ? 12.240  -33.459 -70.632 1.00 29.30 ? 208 SER L CB  1 
ATOM   4520 O OG  . SER C 3 208 ? 11.928  -34.625 -71.337 1.00 31.23 ? 208 SER L OG  1 
ATOM   4521 N N   . PHE C 3 209 ? 9.481   -32.278 -70.968 1.00 28.28 ? 209 PHE L N   1 
ATOM   4522 C CA  . PHE C 3 209 ? 8.312   -32.235 -71.888 1.00 28.35 ? 209 PHE L CA  1 
ATOM   4523 C C   . PHE C 3 209 ? 8.728   -31.469 -73.137 1.00 29.82 ? 209 PHE L C   1 
ATOM   4524 O O   . PHE C 3 209 ? 9.706   -30.755 -73.122 1.00 27.77 ? 209 PHE L O   1 
ATOM   4525 C CB  . PHE C 3 209 ? 7.099   -31.611 -71.209 1.00 27.80 ? 209 PHE L CB  1 
ATOM   4526 C CG  . PHE C 3 209 ? 7.258   -30.153 -70.856 1.00 26.44 ? 209 PHE L CG  1 
ATOM   4527 C CD1 . PHE C 3 209 ? 7.710   -29.787 -69.597 1.00 25.59 ? 209 PHE L CD1 1 
ATOM   4528 C CD2 . PHE C 3 209 ? 6.958   -29.148 -71.760 1.00 25.97 ? 209 PHE L CD2 1 
ATOM   4529 C CE1 . PHE C 3 209 ? 7.874   -28.452 -69.255 1.00 24.39 ? 209 PHE L CE1 1 
ATOM   4530 C CE2 . PHE C 3 209 ? 7.106   -27.812 -71.409 1.00 25.37 ? 209 PHE L CE2 1 
ATOM   4531 C CZ  . PHE C 3 209 ? 7.606   -27.467 -70.169 1.00 24.57 ? 209 PHE L CZ  1 
ATOM   4532 N N   . ASN C 3 210 ? 7.967   -31.652 -74.219 1.00 32.08 ? 210 ASN L N   1 
ATOM   4533 C CA  . ASN C 3 210 ? 8.087   -30.927 -75.511 1.00 34.98 ? 210 ASN L CA  1 
ATOM   4534 C C   . ASN C 3 210 ? 6.944   -29.906 -75.639 1.00 35.84 ? 210 ASN L C   1 
ATOM   4535 O O   . ASN C 3 210 ? 5.843   -30.331 -75.433 1.00 39.54 ? 210 ASN L O   1 
ATOM   4536 C CB  . ASN C 3 210 ? 7.977   -31.937 -76.653 1.00 38.90 ? 210 ASN L CB  1 
ATOM   4537 C CG  . ASN C 3 210 ? 9.302   -32.598 -76.944 1.00 41.79 ? 210 ASN L CG  1 
ATOM   4538 O OD1 . ASN C 3 210 ? 9.767   -32.551 -78.083 1.00 48.07 ? 210 ASN L OD1 1 
ATOM   4539 N ND2 . ASN C 3 210 ? 9.952   -33.126 -75.914 1.00 43.83 ? 210 ASN L ND2 1 
ATOM   4540 N N   . ARG C 3 211 ? 7.181   -28.619 -75.910 1.00 35.77 ? 211 ARG L N   1 
ATOM   4541 C CA  . ARG C 3 211 ? 6.145   -27.542 -75.821 1.00 36.76 ? 211 ARG L CA  1 
ATOM   4542 C C   . ARG C 3 211 ? 5.156   -27.669 -76.993 1.00 37.59 ? 211 ARG L C   1 
ATOM   4543 O O   . ARG C 3 211 ? 5.563   -28.326 -77.919 1.00 38.24 ? 211 ARG L O   1 
ATOM   4544 C CB  . ARG C 3 211 ? 6.800   -26.161 -75.844 1.00 36.81 ? 211 ARG L CB  1 
ATOM   4545 C CG  . ARG C 3 211 ? 5.798   -25.027 -75.963 1.00 39.61 ? 211 ARG L CG  1 
ATOM   4546 C CD  . ARG C 3 211 ? 6.484   -23.707 -76.134 1.00 41.17 ? 211 ARG L CD  1 
ATOM   4547 N NE  . ARG C 3 211 ? 7.289   -23.721 -77.335 1.00 45.29 ? 211 ARG L NE  1 
ATOM   4548 C CZ  . ARG C 3 211 ? 6.822   -23.568 -78.538 1.00 46.19 ? 211 ARG L CZ  1 
ATOM   4549 N NH1 . ARG C 3 211 ? 5.526   -23.371 -78.717 1.00 48.12 ? 211 ARG L NH1 1 
ATOM   4550 N NH2 . ARG C 3 211 ? 7.660   -23.589 -79.562 1.00 51.04 ? 211 ARG L NH2 1 
HETATM 4551 C C1  . GOL D 4 .   ? 7.998   -8.770  -16.056 1.00 42.47 ? 301 GOL H C1  1 
HETATM 4552 O O1  . GOL D 4 .   ? 9.306   -8.307  -15.761 1.00 38.07 ? 301 GOL H O1  1 
HETATM 4553 C C2  . GOL D 4 .   ? 7.023   -8.341  -14.987 1.00 46.22 ? 301 GOL H C2  1 
HETATM 4554 O O2  . GOL D 4 .   ? 5.816   -9.093  -15.108 1.00 48.31 ? 301 GOL H O2  1 
HETATM 4555 C C3  . GOL D 4 .   ? 6.720   -6.865  -15.070 1.00 45.10 ? 301 GOL H C3  1 
HETATM 4556 O O3  . GOL D 4 .   ? 5.578   -6.541  -14.283 1.00 47.17 ? 301 GOL H O3  1 
HETATM 4557 N N   . NO3 E 5 .   ? 20.407  -17.111 -7.547  1.00 29.36 ? 301 NO3 L N   1 
HETATM 4558 O O1  . NO3 E 5 .   ? 19.554  -16.230 -7.435  1.00 32.94 ? 301 NO3 L O1  1 
HETATM 4559 O O2  . NO3 E 5 .   ? 21.129  -17.560 -6.449  1.00 26.93 ? 301 NO3 L O2  1 
HETATM 4560 O O3  . NO3 E 5 .   ? 20.708  -17.732 -8.728  1.00 30.79 ? 301 NO3 L O3  1 
HETATM 4561 O O   . HOH F 6 .   ? -2.172  -20.281 -11.210 1.00 31.78 ? 201 HOH A O   1 
HETATM 4562 O O   . HOH F 6 .   ? -8.042  -41.765 -5.060  0.60 28.30 ? 202 HOH A O   1 
HETATM 4563 O O   . HOH F 6 .   ? -7.885  -30.989 12.708  1.00 38.00 ? 203 HOH A O   1 
HETATM 4564 O O   . HOH F 6 .   ? 14.103  -23.081 -5.660  1.00 29.75 ? 204 HOH A O   1 
HETATM 4565 O O   . HOH F 6 .   ? 10.993  -11.050 0.807   1.00 27.36 ? 205 HOH A O   1 
HETATM 4566 O O   . HOH F 6 .   ? 18.489  -28.030 6.605   0.60 23.57 ? 206 HOH A O   1 
HETATM 4567 O O   . HOH F 6 .   ? 6.539   -11.577 -5.295  1.00 25.16 ? 207 HOH A O   1 
HETATM 4568 O O   . HOH F 6 .   ? -14.770 -35.030 -0.415  1.00 35.79 ? 208 HOH A O   1 
HETATM 4569 O O   . HOH F 6 .   ? -3.505  -12.116 13.257  1.00 37.79 ? 209 HOH A O   1 
HETATM 4570 O O   . HOH F 6 .   ? 18.805  -25.635 2.170   0.60 30.40 ? 210 HOH A O   1 
HETATM 4571 O O   . HOH F 6 .   ? 9.461   -24.941 -8.151  1.00 28.76 ? 211 HOH A O   1 
HETATM 4572 O O   . HOH F 6 .   ? -14.881 -11.406 8.168   1.00 38.50 ? 212 HOH A O   1 
HETATM 4573 O O   . HOH F 6 .   ? -16.922 -23.856 -8.801  1.00 39.30 ? 213 HOH A O   1 
HETATM 4574 O O   . HOH F 6 .   ? -5.514  -35.902 -8.422  1.00 37.10 ? 214 HOH A O   1 
HETATM 4575 O O   . HOH F 6 .   ? 3.016   -38.590 4.556   0.60 30.98 ? 215 HOH A O   1 
HETATM 4576 O O   . HOH F 6 .   ? -7.550  -27.670 -2.420  1.00 22.89 ? 216 HOH A O   1 
HETATM 4577 O O   . HOH F 6 .   ? 3.054   -36.446 5.961   1.00 26.75 ? 217 HOH A O   1 
HETATM 4578 O O   . HOH F 6 .   ? -7.901  -10.754 -9.776  1.00 38.42 ? 218 HOH A O   1 
HETATM 4579 O O   . HOH F 6 .   ? 0.034   -13.407 -8.256  1.00 17.74 ? 219 HOH A O   1 
HETATM 4580 O O   . HOH F 6 .   ? 0.413   -25.115 -12.083 0.60 29.37 ? 220 HOH A O   1 
HETATM 4581 O O   . HOH F 6 .   ? -14.403 -15.746 7.663   1.00 19.94 ? 221 HOH A O   1 
HETATM 4582 O O   . HOH F 6 .   ? -4.574  -16.808 12.629  1.00 20.89 ? 222 HOH A O   1 
HETATM 4583 O O   . HOH F 6 .   ? -8.373  -13.668 4.376   1.00 16.30 ? 223 HOH A O   1 
HETATM 4584 O O   . HOH F 6 .   ? -14.860 -18.473 -0.244  1.00 26.28 ? 224 HOH A O   1 
HETATM 4585 O O   . HOH F 6 .   ? -14.939 -30.098 -7.002  1.00 35.22 ? 225 HOH A O   1 
HETATM 4586 O O   . HOH F 6 .   ? 2.804   -5.749  6.352   0.60 30.97 ? 226 HOH A O   1 
HETATM 4587 O O   . HOH F 6 .   ? -9.160  -47.381 -0.804  0.60 32.34 ? 227 HOH A O   1 
HETATM 4588 O O   . HOH F 6 .   ? -19.533 -19.537 3.302   1.00 19.50 ? 228 HOH A O   1 
HETATM 4589 O O   . HOH F 6 .   ? 5.414   -28.584 11.167  1.00 30.99 ? 229 HOH A O   1 
HETATM 4590 O O   . HOH F 6 .   ? -8.447  -7.238  -2.474  1.00 31.06 ? 230 HOH A O   1 
HETATM 4591 O O   . HOH F 6 .   ? -8.596  -35.111 5.615   1.00 27.54 ? 231 HOH A O   1 
HETATM 4592 O O   . HOH F 6 .   ? -5.777  -32.737 11.130  1.00 34.29 ? 232 HOH A O   1 
HETATM 4593 O O   . HOH F 6 .   ? -7.884  -22.598 -8.918  1.00 24.02 ? 233 HOH A O   1 
HETATM 4594 O O   . HOH F 6 .   ? 9.291   -16.015 -10.253 1.00 27.69 ? 234 HOH A O   1 
HETATM 4595 O O   . HOH F 6 .   ? 7.487   -28.531 9.314   1.00 17.12 ? 235 HOH A O   1 
HETATM 4596 O O   . HOH F 6 .   ? -0.311  -16.333 10.584  1.00 20.64 ? 236 HOH A O   1 
HETATM 4597 O O   . HOH F 6 .   ? -10.769 -29.811 -11.268 1.00 33.45 ? 237 HOH A O   1 
HETATM 4598 O O   . HOH F 6 .   ? 14.181  -14.789 5.591   1.00 35.79 ? 238 HOH A O   1 
HETATM 4599 O O   . HOH F 6 .   ? 8.584   -29.886 -3.323  1.00 27.83 ? 239 HOH A O   1 
HETATM 4600 O O   . HOH F 6 .   ? -4.062  -36.604 1.472   1.00 29.69 ? 240 HOH A O   1 
HETATM 4601 O O   . HOH F 6 .   ? 2.091   -26.603 12.465  1.00 35.96 ? 241 HOH A O   1 
HETATM 4602 O O   . HOH F 6 .   ? -15.922 -20.208 -8.329  1.00 28.73 ? 242 HOH A O   1 
HETATM 4603 O O   . HOH F 6 .   ? -3.354  -33.556 5.705   1.00 20.35 ? 243 HOH A O   1 
HETATM 4604 O O   . HOH F 6 .   ? 4.598   -23.888 10.621  1.00 21.90 ? 244 HOH A O   1 
HETATM 4605 O O   . HOH F 6 .   ? -10.631 -7.782  -0.472  0.60 34.36 ? 245 HOH A O   1 
HETATM 4606 O O   . HOH F 6 .   ? -6.849  -26.619 -7.687  1.00 21.98 ? 246 HOH A O   1 
HETATM 4607 O O   . HOH F 6 .   ? -14.253 -10.422 -0.964  1.00 30.68 ? 247 HOH A O   1 
HETATM 4608 O O   . HOH F 6 .   ? -13.683 -22.607 -6.100  1.00 23.02 ? 248 HOH A O   1 
HETATM 4609 O O   . HOH F 6 .   ? -10.905 -16.201 -10.402 0.60 29.91 ? 249 HOH A O   1 
HETATM 4610 O O   . HOH F 6 .   ? -4.869  -29.162 -1.876  1.00 26.07 ? 250 HOH A O   1 
HETATM 4611 O O   . HOH F 6 .   ? -2.122  -5.504  -7.876  1.00 44.20 ? 251 HOH A O   1 
HETATM 4612 O O   . HOH F 6 .   ? 16.803  -15.799 -4.030  1.00 25.23 ? 252 HOH A O   1 
HETATM 4613 O O   . HOH F 6 .   ? -9.005  -11.381 -5.653  1.00 26.43 ? 253 HOH A O   1 
HETATM 4614 O O   . HOH F 6 .   ? -15.798 -27.367 -3.931  1.00 33.34 ? 254 HOH A O   1 
HETATM 4615 O O   . HOH F 6 .   ? -1.225  -10.482 10.705  1.00 31.63 ? 255 HOH A O   1 
HETATM 4616 O O   . HOH F 6 .   ? 7.350   -10.085 -1.561  1.00 24.93 ? 256 HOH A O   1 
HETATM 4617 O O   . HOH F 6 .   ? 15.516  -22.200 2.811   1.00 29.08 ? 257 HOH A O   1 
HETATM 4618 O O   . HOH F 6 .   ? -10.984 -25.323 -8.853  1.00 28.38 ? 258 HOH A O   1 
HETATM 4619 O O   . HOH F 6 .   ? 3.985   -30.257 -3.567  1.00 31.98 ? 259 HOH A O   1 
HETATM 4620 O O   . HOH F 6 .   ? 7.368   -8.744  -10.349 0.60 28.57 ? 260 HOH A O   1 
HETATM 4621 O O   . HOH F 6 .   ? 21.010  -25.153 4.224   1.00 18.66 ? 261 HOH A O   1 
HETATM 4622 O O   . HOH F 6 .   ? -16.525 -14.226 -0.453  1.00 33.21 ? 262 HOH A O   1 
HETATM 4623 O O   . HOH F 6 .   ? 12.030  -14.831 7.255   1.00 28.32 ? 263 HOH A O   1 
HETATM 4624 O O   . HOH F 6 .   ? -9.312  -14.702 -8.172  1.00 32.67 ? 264 HOH A O   1 
HETATM 4625 O O   . HOH F 6 .   ? 9.608   -38.478 0.823   1.00 36.02 ? 265 HOH A O   1 
HETATM 4626 O O   . HOH F 6 .   ? 14.308  -11.864 -1.559  1.00 25.51 ? 266 HOH A O   1 
HETATM 4627 O O   . HOH F 6 .   ? -4.686  -25.965 13.315  1.00 31.99 ? 267 HOH A O   1 
HETATM 4628 O O   . HOH F 6 .   ? 6.755   -23.947 7.676   1.00 16.14 ? 268 HOH A O   1 
HETATM 4629 O O   . HOH F 6 .   ? -12.257 -16.029 -7.987  0.60 37.04 ? 269 HOH A O   1 
HETATM 4630 O O   . HOH F 6 .   ? 14.562  -24.372 8.857   1.00 25.32 ? 270 HOH A O   1 
HETATM 4631 O O   . HOH F 6 .   ? -6.700  -37.221 4.271   1.00 34.38 ? 271 HOH A O   1 
HETATM 4632 O O   . HOH F 6 .   ? 10.443  -22.241 -8.384  1.00 28.34 ? 272 HOH A O   1 
HETATM 4633 O O   . HOH F 6 .   ? 3.216   -25.459 -6.489  1.00 19.86 ? 273 HOH A O   1 
HETATM 4634 O O   . HOH F 6 .   ? 6.456   -8.954  1.760   1.00 22.67 ? 274 HOH A O   1 
HETATM 4635 O O   . HOH F 6 .   ? 13.503  -33.339 7.203   1.00 27.12 ? 275 HOH A O   1 
HETATM 4636 O O   . HOH F 6 .   ? 2.408   -37.917 -9.501  0.60 34.70 ? 276 HOH A O   1 
HETATM 4637 O O   . HOH F 6 .   ? 4.702   -28.527 -9.361  1.00 39.05 ? 277 HOH A O   1 
HETATM 4638 O O   . HOH F 6 .   ? -14.174 -19.853 -6.237  1.00 23.97 ? 278 HOH A O   1 
HETATM 4639 O O   . HOH F 6 .   ? 18.796  -25.177 8.309   1.00 42.27 ? 279 HOH A O   1 
HETATM 4640 O O   . HOH F 6 .   ? -10.118 -8.094  4.727   0.60 24.15 ? 280 HOH A O   1 
HETATM 4641 O O   . HOH F 6 .   ? -6.813  -8.830  -7.826  1.00 43.11 ? 281 HOH A O   1 
HETATM 4642 O O   . HOH F 6 .   ? -16.930 -12.041 5.039   1.00 37.33 ? 282 HOH A O   1 
HETATM 4643 O O   . HOH F 6 .   ? 6.932   -38.984 5.812   1.00 35.49 ? 283 HOH A O   1 
HETATM 4644 O O   . HOH F 6 .   ? -3.787  -31.488 12.164  1.00 27.64 ? 284 HOH A O   1 
HETATM 4645 O O   . HOH F 6 .   ? -3.915  -36.914 4.719   1.00 32.74 ? 285 HOH A O   1 
HETATM 4646 O O   . HOH F 6 .   ? 12.446  -18.563 10.003  0.60 24.75 ? 286 HOH A O   1 
HETATM 4647 O O   . HOH F 6 .   ? 16.298  -31.789 2.512   1.00 21.33 ? 287 HOH A O   1 
HETATM 4648 O O   . HOH F 6 .   ? -12.130 -18.980 -12.907 1.00 34.12 ? 288 HOH A O   1 
HETATM 4649 O O   . HOH F 6 .   ? 2.376   -6.678  -7.983  1.00 29.33 ? 289 HOH A O   1 
HETATM 4650 O O   . HOH F 6 .   ? 11.177  -29.868 -2.021  1.00 25.00 ? 290 HOH A O   1 
HETATM 4651 O O   . HOH F 6 .   ? 7.483   -38.655 -1.105  1.00 33.44 ? 291 HOH A O   1 
HETATM 4652 O O   . HOH F 6 .   ? 9.624   -13.853 11.666  1.00 40.69 ? 292 HOH A O   1 
HETATM 4653 O O   . HOH F 6 .   ? 16.041  -20.711 5.211   1.00 33.30 ? 293 HOH A O   1 
HETATM 4654 O O   . HOH F 6 .   ? -7.911  -29.636 -10.219 1.00 36.31 ? 294 HOH A O   1 
HETATM 4655 O O   . HOH F 6 .   ? 10.529  -19.867 10.931  1.00 33.44 ? 295 HOH A O   1 
HETATM 4656 O O   . HOH F 6 .   ? -9.021  -11.071 11.007  1.00 39.95 ? 296 HOH A O   1 
HETATM 4657 O O   . HOH F 6 .   ? -9.504  -44.904 -3.121  0.60 31.15 ? 297 HOH A O   1 
HETATM 4658 O O   . HOH F 6 .   ? 0.976   -11.841 -10.234 1.00 33.05 ? 298 HOH A O   1 
HETATM 4659 O O   . HOH F 6 .   ? 10.535  -32.995 -1.561  1.00 27.75 ? 299 HOH A O   1 
HETATM 4660 O O   . HOH F 6 .   ? -3.698  -27.540 -8.696  1.00 27.18 ? 300 HOH A O   1 
HETATM 4661 O O   . HOH F 6 .   ? -4.707  -29.056 12.237  1.00 33.63 ? 301 HOH A O   1 
HETATM 4662 O O   . HOH F 6 .   ? 6.735   -26.874 -5.168  1.00 38.00 ? 302 HOH A O   1 
HETATM 4663 O O   . HOH F 6 .   ? 15.007  -16.179 7.301   1.00 43.95 ? 303 HOH A O   1 
HETATM 4664 O O   . HOH F 6 .   ? 8.733   -7.578  -1.161  0.60 31.70 ? 304 HOH A O   1 
HETATM 4665 O O   . HOH F 6 .   ? -5.609  -6.523  -8.591  1.00 35.06 ? 305 HOH A O   1 
HETATM 4666 O O   . HOH F 6 .   ? -16.544 -23.374 -5.814  1.00 25.41 ? 306 HOH A O   1 
HETATM 4667 O O   . HOH F 6 .   ? 0.593   -38.166 10.653  1.00 45.58 ? 307 HOH A O   1 
HETATM 4668 O O   . HOH F 6 .   ? -2.371  -2.505  1.309   1.00 35.88 ? 308 HOH A O   1 
HETATM 4669 O O   . HOH F 6 .   ? -8.731  -25.151 -10.174 1.00 29.03 ? 309 HOH A O   1 
HETATM 4670 O O   . HOH F 6 .   ? 10.877  -10.653 -4.159  0.60 35.94 ? 310 HOH A O   1 
HETATM 4671 O O   . HOH F 6 .   ? -8.238  -11.969 15.108  1.00 43.72 ? 311 HOH A O   1 
HETATM 4672 O O   . HOH F 6 .   ? 0.175   -24.806 14.174  0.60 30.56 ? 312 HOH A O   1 
HETATM 4673 O O   . HOH F 6 .   ? 4.113   -28.081 -5.837  1.00 36.68 ? 313 HOH A O   1 
HETATM 4674 O O   . HOH F 6 .   ? 4.401   -22.705 13.763  1.00 50.24 ? 314 HOH A O   1 
HETATM 4675 O O   . HOH F 6 .   ? 20.933  -27.292 6.193   1.00 26.15 ? 315 HOH A O   1 
HETATM 4676 O O   . HOH F 6 .   ? -1.817  -17.796 12.445  1.00 27.40 ? 316 HOH A O   1 
HETATM 4677 O O   . HOH F 6 .   ? -9.459  -12.208 -8.095  1.00 38.68 ? 317 HOH A O   1 
HETATM 4678 O O   . HOH F 6 .   ? 15.944  -28.861 -0.609  1.00 39.52 ? 318 HOH A O   1 
HETATM 4679 O O   . HOH F 6 .   ? 4.326   -6.670  3.649   0.60 40.87 ? 319 HOH A O   1 
HETATM 4680 O O   . HOH F 6 .   ? -4.052  -14.254 13.687  1.00 32.87 ? 320 HOH A O   1 
HETATM 4681 O O   . HOH F 6 .   ? 11.961  -10.587 -1.840  1.00 28.09 ? 321 HOH A O   1 
HETATM 4682 O O   . HOH F 6 .   ? 2.538   -42.579 -7.357  0.60 29.53 ? 322 HOH A O   1 
HETATM 4683 O O   . HOH F 6 .   ? -11.521 -9.720  -1.616  1.00 36.71 ? 323 HOH A O   1 
HETATM 4684 O O   . HOH F 6 .   ? -17.964 -13.210 7.221   0.60 30.69 ? 324 HOH A O   1 
HETATM 4685 O O   . HOH F 6 .   ? -6.578  -26.931 -10.573 0.60 34.66 ? 325 HOH A O   1 
HETATM 4686 O O   . HOH F 6 .   ? -15.461 -7.984  -0.372  0.60 29.95 ? 326 HOH A O   1 
HETATM 4687 O O   . HOH F 6 .   ? 2.153   -23.445 14.730  0.60 35.42 ? 327 HOH A O   1 
HETATM 4688 O O   . HOH F 6 .   ? -17.156 -15.735 8.120   1.00 22.32 ? 328 HOH A O   1 
HETATM 4689 O O   . HOH F 6 .   ? 9.106   -9.095  1.168   1.00 32.49 ? 329 HOH A O   1 
HETATM 4690 O O   . HOH F 6 .   ? -10.993 -10.204 -4.535  1.00 34.29 ? 330 HOH A O   1 
HETATM 4691 O O   . HOH F 6 .   ? -16.197 -12.088 -2.072  1.00 36.63 ? 331 HOH A O   1 
HETATM 4692 O O   A HOH F 6 .   ? 16.443  -33.345 4.732   0.60 34.43 ? 332 HOH A O   1 
HETATM 4693 O O   B HOH F 6 .   ? 15.730  -34.602 6.255   0.40 27.75 ? 332 HOH A O   1 
HETATM 4694 O O   . HOH F 6 .   ? 7.749   -24.090 10.086  1.00 23.34 ? 333 HOH A O   1 
HETATM 4695 O O   . HOH F 6 .   ? 13.579  -29.284 9.631   0.60 31.53 ? 334 HOH A O   1 
HETATM 4696 O O   . HOH F 6 .   ? -17.103 -36.856 -0.033  0.60 35.60 ? 335 HOH A O   1 
HETATM 4697 O O   . HOH F 6 .   ? 14.497  -31.822 9.149   1.00 32.47 ? 336 HOH A O   1 
HETATM 4698 O O   . HOH F 6 .   ? 6.749   -7.307  3.758   0.60 33.60 ? 337 HOH A O   1 
HETATM 4699 O O   . HOH F 6 .   ? 0.847   -14.550 12.221  1.00 28.66 ? 338 HOH A O   1 
HETATM 4700 O O   . HOH F 6 .   ? 8.777   -26.570 10.816  1.00 29.72 ? 339 HOH A O   1 
HETATM 4701 O O   . HOH F 6 .   ? 12.813  -26.883 -3.559  1.00 53.26 ? 340 HOH A O   1 
HETATM 4702 O O   . HOH F 6 .   ? -17.756 -33.267 0.423   0.60 34.11 ? 341 HOH A O   1 
HETATM 4703 O O   . HOH F 6 .   ? -0.250  -12.196 12.406  1.00 35.73 ? 342 HOH A O   1 
HETATM 4704 O O   . HOH F 6 .   ? 16.012  -21.632 7.782   1.00 36.06 ? 343 HOH A O   1 
HETATM 4705 O O   . HOH F 6 .   ? 16.508  -33.884 0.693   1.00 40.50 ? 344 HOH A O   1 
HETATM 4706 O O   . HOH F 6 .   ? 12.636  -23.990 10.678  0.60 26.46 ? 345 HOH A O   1 
HETATM 4707 O O   . HOH F 6 .   ? 15.662  -10.942 0.677   1.00 35.46 ? 346 HOH A O   1 
HETATM 4708 O O   . HOH F 6 .   ? 9.471   -22.387 11.452  1.00 35.37 ? 347 HOH A O   1 
HETATM 4709 O O   . HOH F 6 .   ? -11.997 -13.390 -7.677  0.60 32.98 ? 348 HOH A O   1 
HETATM 4710 O O   . HOH G 6 .   ? -2.685  2.771   -35.517 0.60 29.11 ? 401 HOH H O   1 
HETATM 4711 O O   . HOH G 6 .   ? -0.804  1.583   -55.293 0.60 33.20 ? 402 HOH H O   1 
HETATM 4712 O O   . HOH G 6 .   ? 2.150   -11.621 -14.623 1.00 29.44 ? 403 HOH H O   1 
HETATM 4713 O O   . HOH G 6 .   ? 2.815   -23.777 -24.890 1.00 20.55 ? 404 HOH H O   1 
HETATM 4714 O O   . HOH G 6 .   ? -8.494  -12.312 -48.139 1.00 37.74 ? 405 HOH H O   1 
HETATM 4715 O O   . HOH G 6 .   ? 9.255   -12.066 -13.631 1.00 25.52 ? 406 HOH H O   1 
HETATM 4716 O O   . HOH G 6 .   ? -11.817 -26.569 -50.967 1.00 39.20 ? 407 HOH H O   1 
HETATM 4717 O O   . HOH G 6 .   ? 16.150  -6.870  -26.735 1.00 25.29 ? 408 HOH H O   1 
HETATM 4718 O O   . HOH G 6 .   ? 0.044   -36.555 -66.439 1.00 49.51 ? 409 HOH H O   1 
HETATM 4719 O O   . HOH G 6 .   ? 11.776  0.060   -33.738 1.00 35.82 ? 410 HOH H O   1 
HETATM 4720 O O   . HOH G 6 .   ? 12.714  -9.425  -32.162 1.00 27.42 ? 411 HOH H O   1 
HETATM 4721 O O   . HOH G 6 .   ? -9.858  -10.760 -12.144 0.60 38.44 ? 412 HOH H O   1 
HETATM 4722 O O   . HOH G 6 .   ? 9.334   -3.083  -49.393 0.60 23.34 ? 413 HOH H O   1 
HETATM 4723 O O   . HOH G 6 .   ? 0.017   2.100   -21.184 1.00 31.50 ? 414 HOH H O   1 
HETATM 4724 O O   . HOH G 6 .   ? -3.353  -7.002  -37.376 1.00 19.11 ? 415 HOH H O   1 
HETATM 4725 O O   . HOH G 6 .   ? -7.488  0.224   -27.376 1.00 31.84 ? 416 HOH H O   1 
HETATM 4726 O O   . HOH G 6 .   ? 17.851  -10.228 -29.028 1.00 34.46 ? 417 HOH H O   1 
HETATM 4727 O O   . HOH G 6 .   ? -11.553 -21.123 -26.761 1.00 31.96 ? 418 HOH H O   1 
HETATM 4728 O O   . HOH G 6 .   ? -3.055  1.113   -21.267 1.00 28.31 ? 419 HOH H O   1 
HETATM 4729 O O   . HOH G 6 .   ? 10.668  -3.696  -43.582 1.00 33.20 ? 420 HOH H O   1 
HETATM 4730 O O   . HOH G 6 .   ? 9.595   1.130   -19.631 0.60 26.85 ? 421 HOH H O   1 
HETATM 4731 O O   . HOH G 6 .   ? -6.526  -18.516 -61.072 1.00 40.22 ? 422 HOH H O   1 
HETATM 4732 O O   . HOH G 6 .   ? -2.827  -2.303  -54.197 0.60 24.20 ? 423 HOH H O   1 
HETATM 4733 O O   . HOH G 6 .   ? -5.346  -18.596 -35.057 1.00 39.63 ? 424 HOH H O   1 
HETATM 4734 O O   . HOH G 6 .   ? -15.218 -20.957 -52.868 1.00 31.96 ? 425 HOH H O   1 
HETATM 4735 O O   . HOH G 6 .   ? -11.487 -5.583  -31.945 1.00 41.22 ? 426 HOH H O   1 
HETATM 4736 O O   . HOH G 6 .   ? 13.821  -14.733 -35.822 1.00 38.27 ? 427 HOH H O   1 
HETATM 4737 O O   . HOH G 6 .   ? -1.396  1.206   -40.189 0.60 31.60 ? 428 HOH H O   1 
HETATM 4738 O O   . HOH G 6 .   ? -2.012  -23.964 -18.155 1.00 38.63 ? 429 HOH H O   1 
HETATM 4739 O O   . HOH G 6 .   ? 2.112   -19.227 -35.267 1.00 28.93 ? 430 HOH H O   1 
HETATM 4740 O O   . HOH G 6 .   ? -5.829  -17.503 -44.330 1.00 37.41 ? 431 HOH H O   1 
HETATM 4741 O O   . HOH G 6 .   ? 10.633  -10.555 -15.389 1.00 29.15 ? 432 HOH H O   1 
HETATM 4742 O O   . HOH G 6 .   ? -0.560  -30.261 -44.736 0.60 32.17 ? 433 HOH H O   1 
HETATM 4743 O O   . HOH G 6 .   ? 1.830   -39.151 -51.367 0.60 33.28 ? 434 HOH H O   1 
HETATM 4744 O O   . HOH G 6 .   ? 6.353   -29.209 -46.352 1.00 27.38 ? 435 HOH H O   1 
HETATM 4745 O O   . HOH G 6 .   ? -3.367  2.436   -28.379 1.00 29.41 ? 436 HOH H O   1 
HETATM 4746 O O   . HOH G 6 .   ? 3.695   -33.246 -46.509 0.60 27.30 ? 437 HOH H O   1 
HETATM 4747 O O   . HOH G 6 .   ? 4.142   -3.901  -54.602 1.00 24.76 ? 438 HOH H O   1 
HETATM 4748 O O   . HOH G 6 .   ? 4.839   2.950   -23.804 1.00 34.00 ? 439 HOH H O   1 
HETATM 4749 O O   . HOH G 6 .   ? 2.509   -34.651 -62.147 1.00 37.42 ? 440 HOH H O   1 
HETATM 4750 O O   . HOH G 6 .   ? -6.839  -13.078 -37.862 1.00 41.87 ? 441 HOH H O   1 
HETATM 4751 O O   . HOH G 6 .   ? -2.419  -5.030  -24.838 1.00 17.33 ? 442 HOH H O   1 
HETATM 4752 O O   . HOH G 6 .   ? 13.503  -4.645  -31.623 1.00 26.20 ? 443 HOH H O   1 
HETATM 4753 O O   . HOH G 6 .   ? 7.313   -10.575 -61.004 1.00 25.88 ? 444 HOH H O   1 
HETATM 4754 O O   . HOH G 6 .   ? 11.000  4.349   -34.186 1.00 38.18 ? 445 HOH H O   1 
HETATM 4755 O O   . HOH G 6 .   ? 12.475  2.137   -35.307 0.60 28.94 ? 446 HOH H O   1 
HETATM 4756 O O   . HOH G 6 .   ? 9.056   -20.324 -53.666 1.00 26.91 ? 447 HOH H O   1 
HETATM 4757 O O   . HOH G 6 .   ? -1.696  -13.945 -15.031 1.00 19.46 ? 448 HOH H O   1 
HETATM 4758 O O   . HOH G 6 .   ? -0.152  -25.413 -46.984 1.00 30.05 ? 449 HOH H O   1 
HETATM 4759 O O   . HOH G 6 .   ? -4.473  -18.930 -32.050 1.00 28.36 ? 450 HOH H O   1 
HETATM 4760 O O   . HOH G 6 .   ? -8.080  -10.581 -32.568 1.00 27.79 ? 451 HOH H O   1 
HETATM 4761 O O   . HOH G 6 .   ? 2.930   1.880   -17.630 1.00 32.24 ? 452 HOH H O   1 
HETATM 4762 O O   . HOH G 6 .   ? -10.172 -14.352 -45.440 0.60 35.77 ? 453 HOH H O   1 
HETATM 4763 O O   . HOH G 6 .   ? -1.388  1.188   -17.036 1.00 38.09 ? 454 HOH H O   1 
HETATM 4764 O O   A HOH G 6 .   ? -13.162 -10.223 -20.843 0.50 26.40 ? 455 HOH H O   1 
HETATM 4765 O O   B HOH G 6 .   ? -13.081 -11.339 -18.401 0.50 23.62 ? 455 HOH H O   1 
HETATM 4766 O O   . HOH G 6 .   ? -15.758 -11.171 -24.515 0.60 32.37 ? 456 HOH H O   1 
HETATM 4767 O O   . HOH G 6 .   ? 9.625   5.984   -39.909 1.00 44.09 ? 457 HOH H O   1 
HETATM 4768 O O   . HOH G 6 .   ? -2.043  -13.009 -38.107 1.00 17.26 ? 458 HOH H O   1 
HETATM 4769 O O   . HOH G 6 .   ? 7.976   -13.067 -63.598 1.00 35.08 ? 459 HOH H O   1 
HETATM 4770 O O   . HOH G 6 .   ? -11.811 -8.469  -30.963 1.00 30.52 ? 460 HOH H O   1 
HETATM 4771 O O   . HOH G 6 .   ? 0.638   -26.342 -65.265 1.00 44.22 ? 461 HOH H O   1 
HETATM 4772 O O   . HOH G 6 .   ? 2.957   -8.466  -43.643 1.00 15.53 ? 462 HOH H O   1 
HETATM 4773 O O   . HOH G 6 .   ? 9.154   -3.052  -33.010 1.00 19.74 ? 463 HOH H O   1 
HETATM 4774 O O   . HOH G 6 .   ? 6.938   -17.898 -47.401 1.00 29.92 ? 464 HOH H O   1 
HETATM 4775 O O   A HOH G 6 .   ? -0.269  -20.465 -30.892 0.50 14.60 ? 465 HOH H O   1 
HETATM 4776 O O   B HOH G 6 .   ? -1.742  -20.107 -31.694 0.50 19.37 ? 465 HOH H O   1 
HETATM 4777 O O   . HOH G 6 .   ? -5.092  -2.856  -37.646 1.00 30.21 ? 466 HOH H O   1 
HETATM 4778 O O   . HOH G 6 .   ? 3.556   -16.978 -46.920 1.00 24.51 ? 467 HOH H O   1 
HETATM 4779 O O   . HOH G 6 .   ? -1.334  -1.381  -10.594 0.60 30.77 ? 468 HOH H O   1 
HETATM 4780 O O   . HOH G 6 .   ? -14.522 -18.392 -23.768 1.00 41.74 ? 469 HOH H O   1 
HETATM 4781 O O   . HOH G 6 .   ? -15.992 -28.480 -60.603 1.00 40.89 ? 470 HOH H O   1 
HETATM 4782 O O   . HOH G 6 .   ? 2.241   3.363   -29.374 1.00 24.17 ? 471 HOH H O   1 
HETATM 4783 O O   . HOH G 6 .   ? 15.198  -3.826  -29.402 1.00 39.36 ? 472 HOH H O   1 
HETATM 4784 O O   . HOH G 6 .   ? -6.849  -20.949 -17.879 1.00 38.34 ? 473 HOH H O   1 
HETATM 4785 O O   . HOH G 6 .   ? -3.221  -0.213  -27.729 1.00 20.69 ? 474 HOH H O   1 
HETATM 4786 O O   . HOH G 6 .   ? -2.681  -3.949  -47.365 1.00 32.64 ? 475 HOH H O   1 
HETATM 4787 O O   . HOH G 6 .   ? -0.523  -19.620 -9.119  1.00 22.82 ? 476 HOH H O   1 
HETATM 4788 O O   . HOH G 6 .   ? 2.138   -42.226 -62.498 1.00 45.66 ? 477 HOH H O   1 
HETATM 4789 O O   . HOH G 6 .   ? -9.875  -16.452 -28.981 1.00 21.32 ? 478 HOH H O   1 
HETATM 4790 O O   . HOH G 6 .   ? -4.002  -6.454  -44.120 1.00 38.49 ? 479 HOH H O   1 
HETATM 4791 O O   . HOH G 6 .   ? -2.428  -13.432 -45.902 1.00 16.65 ? 480 HOH H O   1 
HETATM 4792 O O   . HOH G 6 .   ? 2.630   0.523   -48.200 1.00 25.83 ? 481 HOH H O   1 
HETATM 4793 O O   . HOH G 6 .   ? -5.825  -12.345 -20.405 1.00 29.38 ? 482 HOH H O   1 
HETATM 4794 O O   . HOH G 6 .   ? 9.626   0.727   -48.343 0.60 27.44 ? 483 HOH H O   1 
HETATM 4795 O O   . HOH G 6 .   ? 15.083  -11.191 -25.403 1.00 17.67 ? 484 HOH H O   1 
HETATM 4796 O O   . HOH G 6 .   ? 14.351  -6.270  -34.914 0.60 29.15 ? 485 HOH H O   1 
HETATM 4797 O O   . HOH G 6 .   ? 6.607   0.340   -17.820 1.00 25.59 ? 486 HOH H O   1 
HETATM 4798 O O   . HOH G 6 .   ? 2.846   -18.290 -15.483 1.00 20.90 ? 487 HOH H O   1 
HETATM 4799 O O   . HOH G 6 .   ? 4.239   -0.724  -55.031 1.00 29.25 ? 488 HOH H O   1 
HETATM 4800 O O   . HOH G 6 .   ? -1.963  -9.057  -33.059 1.00 22.33 ? 489 HOH H O   1 
HETATM 4801 O O   . HOH G 6 .   ? -4.763  -28.238 -46.434 1.00 32.09 ? 490 HOH H O   1 
HETATM 4802 O O   . HOH G 6 .   ? -11.710 -21.596 -49.177 1.00 44.99 ? 491 HOH H O   1 
HETATM 4803 O O   . HOH G 6 .   ? 12.951  -2.472  -19.324 1.00 27.80 ? 492 HOH H O   1 
HETATM 4804 O O   . HOH G 6 .   ? -3.701  -19.844 -28.247 1.00 26.96 ? 493 HOH H O   1 
HETATM 4805 O O   . HOH G 6 .   ? -6.353  -27.024 -63.828 0.60 35.71 ? 494 HOH H O   1 
HETATM 4806 O O   . HOH G 6 .   ? -0.408  6.799   -38.150 1.00 38.77 ? 495 HOH H O   1 
HETATM 4807 O O   . HOH G 6 .   ? -4.294  -23.260 -17.524 0.60 35.58 ? 496 HOH H O   1 
HETATM 4808 O O   . HOH G 6 .   ? 4.496   -18.190 -36.109 1.00 27.74 ? 497 HOH H O   1 
HETATM 4809 O O   . HOH G 6 .   ? -6.697  -25.219 -23.052 1.00 37.66 ? 498 HOH H O   1 
HETATM 4810 O O   . HOH G 6 .   ? -5.760  -20.462 -47.475 1.00 25.05 ? 499 HOH H O   1 
HETATM 4811 O O   . HOH G 6 .   ? -0.276  -10.857 -59.279 1.00 36.98 ? 500 HOH H O   1 
HETATM 4812 O O   . HOH G 6 .   ? -7.636  -9.078  -38.945 1.00 26.85 ? 501 HOH H O   1 
HETATM 4813 O O   . HOH G 6 .   ? -9.226  -19.482 -50.407 0.60 26.43 ? 502 HOH H O   1 
HETATM 4814 O O   . HOH G 6 .   ? -9.046  -19.253 -60.722 1.00 36.16 ? 503 HOH H O   1 
HETATM 4815 O O   . HOH G 6 .   ? 10.860  2.790   -27.785 1.00 38.15 ? 504 HOH H O   1 
HETATM 4816 O O   . HOH G 6 .   ? -3.948  -0.495  -37.423 1.00 27.82 ? 505 HOH H O   1 
HETATM 4817 O O   . HOH G 6 .   ? 0.159   2.361   -44.160 1.00 35.01 ? 506 HOH H O   1 
HETATM 4818 O O   . HOH G 6 .   ? 0.761   0.563   -14.897 1.00 32.87 ? 507 HOH H O   1 
HETATM 4819 O O   . HOH G 6 .   ? -1.359  -12.518 -12.731 1.00 32.50 ? 508 HOH H O   1 
HETATM 4820 O O   . HOH G 6 .   ? 13.889  -14.782 -51.462 1.00 42.75 ? 509 HOH H O   1 
HETATM 4821 O O   . HOH G 6 .   ? 0.073   -12.441 -39.967 1.00 15.21 ? 510 HOH H O   1 
HETATM 4822 O O   . HOH G 6 .   ? 7.823   -19.451 -57.619 1.00 41.83 ? 511 HOH H O   1 
HETATM 4823 O O   . HOH G 6 .   ? -4.569  -22.342 -28.178 1.00 35.30 ? 512 HOH H O   1 
HETATM 4824 O O   . HOH G 6 .   ? 12.088  2.462   -42.555 1.00 35.66 ? 513 HOH H O   1 
HETATM 4825 O O   . HOH G 6 .   ? 14.830  -6.880  -24.260 1.00 18.07 ? 514 HOH H O   1 
HETATM 4826 O O   . HOH G 6 .   ? 5.327   -20.661 -47.439 1.00 29.00 ? 515 HOH H O   1 
HETATM 4827 O O   . HOH G 6 .   ? -12.247 -2.384  -20.892 1.00 30.56 ? 516 HOH H O   1 
HETATM 4828 O O   . HOH G 6 .   ? 10.041  -6.185  -52.202 1.00 30.68 ? 517 HOH H O   1 
HETATM 4829 O O   . HOH G 6 .   ? -4.031  -6.701  -55.941 1.00 32.74 ? 518 HOH H O   1 
HETATM 4830 O O   . HOH G 6 .   ? -2.429  -4.348  -44.660 1.00 27.82 ? 519 HOH H O   1 
HETATM 4831 O O   . HOH G 6 .   ? 0.471   -16.156 -38.146 1.00 27.15 ? 520 HOH H O   1 
HETATM 4832 O O   . HOH G 6 .   ? -9.079  -22.399 -18.921 1.00 43.99 ? 521 HOH H O   1 
HETATM 4833 O O   . HOH G 6 .   ? 11.728  -4.288  -58.496 0.60 26.03 ? 522 HOH H O   1 
HETATM 4834 O O   . HOH G 6 .   ? 0.031   -9.328  -10.135 1.00 32.78 ? 523 HOH H O   1 
HETATM 4835 O O   . HOH G 6 .   ? -12.948 -14.466 -22.894 1.00 44.13 ? 524 HOH H O   1 
HETATM 4836 O O   . HOH G 6 .   ? 2.582   -14.589 -13.305 1.00 20.58 ? 525 HOH H O   1 
HETATM 4837 O O   . HOH G 6 .   ? 6.598   -9.208  -46.298 1.00 24.16 ? 526 HOH H O   1 
HETATM 4838 O O   . HOH G 6 .   ? -0.208  -21.866 -45.904 1.00 33.20 ? 527 HOH H O   1 
HETATM 4839 O O   A HOH G 6 .   ? -7.788  -5.560  -34.839 0.60 29.42 ? 528 HOH H O   1 
HETATM 4840 O O   B HOH G 6 .   ? -6.847  -3.814  -34.085 0.40 14.24 ? 528 HOH H O   1 
HETATM 4841 O O   . HOH G 6 .   ? -5.715  -6.330  -40.298 1.00 51.02 ? 529 HOH H O   1 
HETATM 4842 O O   B HOH G 6 .   ? 2.667   6.991   -35.956 0.50 25.57 ? 530 HOH H O   1 
HETATM 4843 O O   . HOH G 6 .   ? 3.961   -27.447 -46.225 1.00 26.97 ? 531 HOH H O   1 
HETATM 4844 O O   . HOH G 6 .   ? 8.572   -7.928  -47.134 0.60 27.64 ? 532 HOH H O   1 
HETATM 4845 O O   . HOH G 6 .   ? 15.041  0.962   -28.433 0.60 40.65 ? 533 HOH H O   1 
HETATM 4846 O O   . HOH G 6 .   ? 0.071   -3.223  -56.562 1.00 41.82 ? 534 HOH H O   1 
HETATM 4847 O O   . HOH G 6 .   ? -5.790  -37.793 -52.100 1.00 43.71 ? 535 HOH H O   1 
HETATM 4848 O O   . HOH G 6 .   ? -1.199  -0.826  -50.533 1.00 24.02 ? 536 HOH H O   1 
HETATM 4849 O O   . HOH G 6 .   ? -13.929 -22.502 -56.941 1.00 31.86 ? 537 HOH H O   1 
HETATM 4850 O O   . HOH G 6 .   ? -2.646  -8.634  -58.877 1.00 41.91 ? 538 HOH H O   1 
HETATM 4851 O O   . HOH G 6 .   ? -0.179  -21.710 -27.697 1.00 22.21 ? 539 HOH H O   1 
HETATM 4852 O O   . HOH G 6 .   ? 8.374   -17.393 -59.514 1.00 36.78 ? 540 HOH H O   1 
HETATM 4853 O O   . HOH G 6 .   ? -9.808  -20.351 -58.481 1.00 27.25 ? 541 HOH H O   1 
HETATM 4854 O O   . HOH G 6 .   ? 13.135  -6.221  -37.388 1.00 42.94 ? 542 HOH H O   1 
HETATM 4855 O O   . HOH G 6 .   ? -5.657  -15.952 -59.832 1.00 31.78 ? 543 HOH H O   1 
HETATM 4856 O O   . HOH G 6 .   ? 7.037   -4.664  -53.902 1.00 30.14 ? 544 HOH H O   1 
HETATM 4857 O O   . HOH G 6 .   ? 1.961   -23.090 -63.168 1.00 26.80 ? 545 HOH H O   1 
HETATM 4858 O O   . HOH G 6 .   ? -5.256  -8.241  -41.623 1.00 40.93 ? 546 HOH H O   1 
HETATM 4859 O O   . HOH G 6 .   ? -8.597  -14.570 -10.385 1.00 33.34 ? 547 HOH H O   1 
HETATM 4860 O O   . HOH G 6 .   ? 11.061  -10.605 -61.369 1.00 39.79 ? 548 HOH H O   1 
HETATM 4861 O O   . HOH G 6 .   ? 10.466  -7.435  -49.538 0.60 27.50 ? 549 HOH H O   1 
HETATM 4862 O O   . HOH G 6 .   ? 1.756   -13.598 -62.544 1.00 32.45 ? 550 HOH H O   1 
HETATM 4863 O O   . HOH G 6 .   ? 7.796   -8.590  -42.117 1.00 30.23 ? 551 HOH H O   1 
HETATM 4864 O O   . HOH G 6 .   ? -4.925  -35.734 -45.785 1.00 39.25 ? 552 HOH H O   1 
HETATM 4865 O O   . HOH G 6 .   ? -14.881 -2.958  -21.413 1.00 34.38 ? 553 HOH H O   1 
HETATM 4866 O O   . HOH G 6 .   ? -6.248  -13.913 -58.294 1.00 31.83 ? 554 HOH H O   1 
HETATM 4867 O O   . HOH G 6 .   ? 1.023   -17.939 -43.836 1.00 29.69 ? 555 HOH H O   1 
HETATM 4868 O O   . HOH G 6 .   ? -3.366  -15.217 -38.958 1.00 25.93 ? 556 HOH H O   1 
HETATM 4869 O O   . HOH G 6 .   ? 2.154   -37.015 -61.681 0.60 28.81 ? 557 HOH H O   1 
HETATM 4870 O O   . HOH G 6 .   ? 13.338  -2.122  -33.154 1.00 35.34 ? 558 HOH H O   1 
HETATM 4871 O O   . HOH G 6 .   ? 14.920  -7.939  -38.567 0.60 29.79 ? 559 HOH H O   1 
HETATM 4872 O O   . HOH G 6 .   ? 10.277  -13.460 -38.090 0.60 27.21 ? 560 HOH H O   1 
HETATM 4873 O O   . HOH G 6 .   ? 6.067   -41.612 -59.536 1.00 59.25 ? 561 HOH H O   1 
HETATM 4874 O O   . HOH G 6 .   ? 11.514  0.148   -30.473 0.60 29.21 ? 562 HOH H O   1 
HETATM 4875 O O   . HOH G 6 .   ? -0.378  -25.175 -23.748 0.60 26.42 ? 563 HOH H O   1 
HETATM 4876 O O   . HOH G 6 .   ? 0.195   0.458   -46.684 0.60 35.05 ? 564 HOH H O   1 
HETATM 4877 O O   . HOH G 6 .   ? -2.429  -27.403 -47.032 1.00 42.76 ? 565 HOH H O   1 
HETATM 4878 O O   . HOH G 6 .   ? 8.917   7.915   -41.818 0.60 32.32 ? 566 HOH H O   1 
HETATM 4879 O O   . HOH G 6 .   ? 5.407   -15.487 -44.169 1.00 36.54 ? 567 HOH H O   1 
HETATM 4880 O O   . HOH G 6 .   ? -12.345 0.341   -26.287 0.60 21.07 ? 568 HOH H O   1 
HETATM 4881 O O   . HOH G 6 .   ? 9.488   -10.159 -40.471 0.60 27.59 ? 569 HOH H O   1 
HETATM 4882 O O   . HOH G 6 .   ? 7.362   2.640   -19.542 1.00 39.28 ? 570 HOH H O   1 
HETATM 4883 O O   . HOH G 6 .   ? -4.288  -37.975 -49.589 1.00 41.12 ? 571 HOH H O   1 
HETATM 4884 O O   . HOH G 6 .   ? -13.999 -21.243 -25.877 0.60 36.49 ? 572 HOH H O   1 
HETATM 4885 O O   . HOH G 6 .   ? -9.023  -11.154 -35.172 1.00 39.00 ? 573 HOH H O   1 
HETATM 4886 O O   . HOH G 6 .   ? -13.621 -0.686  -22.249 1.00 49.72 ? 574 HOH H O   1 
HETATM 4887 O O   . HOH G 6 .   ? 9.697   -8.646  -12.011 1.00 44.46 ? 575 HOH H O   1 
HETATM 4888 O O   . HOH G 6 .   ? -0.386  -18.555 -38.521 1.00 37.55 ? 576 HOH H O   1 
HETATM 4889 O O   . HOH G 6 .   ? -5.610  -22.181 -44.986 1.00 37.08 ? 577 HOH H O   1 
HETATM 4890 O O   . HOH G 6 .   ? 9.038   -3.926  -52.337 1.00 35.65 ? 578 HOH H O   1 
HETATM 4891 O O   . HOH G 6 .   ? 14.609  -18.125 -34.573 1.00 34.29 ? 579 HOH H O   1 
HETATM 4892 O O   . HOH G 6 .   ? 1.688   -26.080 -24.949 1.00 40.53 ? 580 HOH H O   1 
HETATM 4893 O O   . HOH G 6 .   ? 5.291   3.573   -21.259 1.00 41.56 ? 581 HOH H O   1 
HETATM 4894 O O   . HOH G 6 .   ? 4.125   -38.484 -62.648 1.00 42.42 ? 582 HOH H O   1 
HETATM 4895 O O   . HOH G 6 .   ? -4.733  4.324   -27.191 1.00 34.59 ? 583 HOH H O   1 
HETATM 4896 O O   . HOH G 6 .   ? 8.185   -11.005 -44.343 0.60 28.56 ? 584 HOH H O   1 
HETATM 4897 O O   . HOH G 6 .   ? 9.360   -5.430  -47.695 0.60 29.48 ? 585 HOH H O   1 
HETATM 4898 O O   . HOH G 6 .   ? 17.124  -9.555  -26.475 1.00 28.46 ? 586 HOH H O   1 
HETATM 4899 O O   . HOH G 6 .   ? 8.613   -18.708 -45.400 1.00 40.16 ? 587 HOH H O   1 
HETATM 4900 O O   . HOH G 6 .   ? -10.883 -10.422 -32.575 0.60 28.53 ? 588 HOH H O   1 
HETATM 4901 O O   . HOH G 6 .   ? -2.500  -1.622  -48.466 0.60 27.30 ? 589 HOH H O   1 
HETATM 4902 O O   . HOH G 6 .   ? -3.074  -26.771 -66.715 1.00 44.57 ? 590 HOH H O   1 
HETATM 4903 O O   . HOH G 6 .   ? 1.296   -14.944 -40.533 1.00 20.70 ? 591 HOH H O   1 
HETATM 4904 O O   . HOH G 6 .   ? 11.975  5.067   -41.729 0.60 37.58 ? 592 HOH H O   1 
HETATM 4905 O O   . HOH G 6 .   ? -11.316 -8.695  -11.594 0.60 33.13 ? 593 HOH H O   1 
HETATM 4906 O O   . HOH G 6 .   ? -2.572  -14.735 -43.460 1.00 28.06 ? 594 HOH H O   1 
HETATM 4907 O O   . HOH G 6 .   ? -7.460  -1.953  -38.180 0.60 31.93 ? 595 HOH H O   1 
HETATM 4908 O O   . HOH G 6 .   ? 13.122  -7.177  -48.915 0.60 32.32 ? 596 HOH H O   1 
HETATM 4909 O O   . HOH G 6 .   ? -0.539  -16.338 -42.253 1.00 29.30 ? 597 HOH H O   1 
HETATM 4910 O O   . HOH G 6 .   ? 3.824   -15.223 -41.187 0.60 29.93 ? 598 HOH H O   1 
HETATM 4911 O O   . HOH G 6 .   ? 3.960   -37.552 -66.398 1.00 49.15 ? 599 HOH H O   1 
HETATM 4912 O O   . HOH G 6 .   ? 3.208   -41.615 -65.857 1.00 52.69 ? 600 HOH H O   1 
HETATM 4913 O O   . HOH H 6 .   ? 22.934  -38.583 -33.430 1.00 38.42 ? 401 HOH L O   1 
HETATM 4914 O O   . HOH H 6 .   ? 14.209  -27.706 -41.380 1.00 30.93 ? 402 HOH L O   1 
HETATM 4915 O O   . HOH H 6 .   ? 16.978  -28.539 -40.978 0.60 31.32 ? 403 HOH L O   1 
HETATM 4916 O O   . HOH H 6 .   ? 19.309  -44.909 -47.944 1.00 35.13 ? 404 HOH L O   1 
HETATM 4917 O O   . HOH H 6 .   ? 22.227  -36.047 -19.855 0.60 31.22 ? 405 HOH L O   1 
HETATM 4918 O O   . HOH H 6 .   ? 23.723  -9.079  -16.778 1.00 41.75 ? 406 HOH L O   1 
HETATM 4919 O O   . HOH H 6 .   ? 15.372  -2.999  -21.640 1.00 32.89 ? 407 HOH L O   1 
HETATM 4920 O O   . HOH H 6 .   ? 21.716  -3.550  -17.099 0.60 36.63 ? 408 HOH L O   1 
HETATM 4921 O O   . HOH H 6 .   ? 22.206  -33.630 -21.546 1.00 43.05 ? 409 HOH L O   1 
HETATM 4922 O O   . HOH H 6 .   ? 17.090  -4.378  -16.778 1.00 37.99 ? 410 HOH L O   1 
HETATM 4923 O O   . HOH H 6 .   ? 25.305  -27.349 -20.105 1.00 32.81 ? 411 HOH L O   1 
HETATM 4924 O O   . HOH H 6 .   ? 28.540  -19.093 -16.835 1.00 32.89 ? 412 HOH L O   1 
HETATM 4925 O O   . HOH H 6 .   ? 25.403  -34.407 -62.396 0.60 23.18 ? 413 HOH L O   1 
HETATM 4926 O O   . HOH H 6 .   ? 17.589  -25.138 -59.729 1.00 25.26 ? 414 HOH L O   1 
HETATM 4927 O O   . HOH H 6 .   ? 20.662  -26.823 -57.819 1.00 25.81 ? 415 HOH L O   1 
HETATM 4928 O O   . HOH H 6 .   ? 23.643  -26.319 -15.688 1.00 27.69 ? 416 HOH L O   1 
HETATM 4929 O O   . HOH H 6 .   ? 22.481  -39.928 -44.179 1.00 40.85 ? 417 HOH L O   1 
HETATM 4930 O O   . HOH H 6 .   ? 15.025  -26.411 -45.122 1.00 27.85 ? 418 HOH L O   1 
HETATM 4931 O O   . HOH H 6 .   ? 8.790   -16.621 -12.439 1.00 29.47 ? 419 HOH L O   1 
HETATM 4932 O O   A HOH H 6 .   ? 24.360  -34.314 -32.669 0.50 24.29 ? 420 HOH L O   1 
HETATM 4933 O O   . HOH H 6 .   ? 8.049   -17.502 -62.220 1.00 24.17 ? 421 HOH L O   1 
HETATM 4934 O O   . HOH H 6 .   ? 18.042  -22.255 -59.789 1.00 34.85 ? 422 HOH L O   1 
HETATM 4935 O O   . HOH H 6 .   ? 14.169  -39.731 -38.717 1.00 32.24 ? 423 HOH L O   1 
HETATM 4936 O O   . HOH H 6 .   ? 24.283  -34.486 -26.022 0.60 30.84 ? 424 HOH L O   1 
HETATM 4937 O O   . HOH H 6 .   ? 23.265  -36.143 -43.070 1.00 39.12 ? 425 HOH L O   1 
HETATM 4938 O O   . HOH H 6 .   ? 25.142  -14.440 -21.417 1.00 25.97 ? 426 HOH L O   1 
HETATM 4939 O O   . HOH H 6 .   ? 1.135   -24.530 -71.603 1.00 43.11 ? 427 HOH L O   1 
HETATM 4940 O O   . HOH H 6 .   ? 12.412  -18.091 -61.765 1.00 20.48 ? 428 HOH L O   1 
HETATM 4941 O O   . HOH H 6 .   ? 7.959   -39.432 -64.564 0.60 30.41 ? 429 HOH L O   1 
HETATM 4942 O O   . HOH H 6 .   ? 25.429  -29.985 -27.645 0.60 27.98 ? 430 HOH L O   1 
HETATM 4943 O O   . HOH H 6 .   ? 24.114  -29.865 -73.230 1.00 28.23 ? 431 HOH L O   1 
HETATM 4944 O O   . HOH H 6 .   ? 27.478  -15.918 -16.866 1.00 33.84 ? 432 HOH L O   1 
HETATM 4945 O O   . HOH H 6 .   ? 6.222   -30.903 -28.277 1.00 31.32 ? 433 HOH L O   1 
HETATM 4946 O O   . HOH H 6 .   ? 17.124  -6.537  -23.139 1.00 25.41 ? 434 HOH L O   1 
HETATM 4947 O O   . HOH H 6 .   ? 21.764  -19.222 -29.909 1.00 25.94 ? 435 HOH L O   1 
HETATM 4948 O O   . HOH H 6 .   ? 20.822  -31.931 -16.617 0.60 28.78 ? 436 HOH L O   1 
HETATM 4949 O O   . HOH H 6 .   ? 19.316  -37.912 -66.658 1.00 29.77 ? 437 HOH L O   1 
HETATM 4950 O O   . HOH H 6 .   ? 26.356  -19.215 -11.563 1.00 29.32 ? 438 HOH L O   1 
HETATM 4951 O O   . HOH H 6 .   ? 28.426  -24.555 -14.411 1.00 40.28 ? 439 HOH L O   1 
HETATM 4952 O O   . HOH H 6 .   ? 10.514  -34.345 -73.544 0.60 30.31 ? 440 HOH L O   1 
HETATM 4953 O O   . HOH H 6 .   ? 23.100  -32.128 -72.143 0.60 29.94 ? 441 HOH L O   1 
HETATM 4954 O O   . HOH H 6 .   ? 16.188  -35.832 -20.985 1.00 35.12 ? 442 HOH L O   1 
HETATM 4955 O O   . HOH H 6 .   ? 23.767  -38.924 -36.105 1.00 44.24 ? 443 HOH L O   1 
HETATM 4956 O O   . HOH H 6 .   ? 22.650  -6.028  -21.060 0.60 24.46 ? 444 HOH L O   1 
HETATM 4957 O O   . HOH H 6 .   ? 1.452   -21.286 -65.136 1.00 23.49 ? 445 HOH L O   1 
HETATM 4958 O O   . HOH H 6 .   ? 12.933  -23.625 -45.638 0.60 24.23 ? 446 HOH L O   1 
HETATM 4959 O O   . HOH H 6 .   ? 24.094  -37.134 -29.441 0.60 31.40 ? 447 HOH L O   1 
HETATM 4960 O O   . HOH H 6 .   ? 19.897  -27.184 -54.365 1.00 28.97 ? 448 HOH L O   1 
HETATM 4961 O O   . HOH H 6 .   ? 18.618  -21.589 -64.607 1.00 22.21 ? 449 HOH L O   1 
HETATM 4962 O O   . HOH H 6 .   ? 11.440  -24.090 -36.199 1.00 34.25 ? 450 HOH L O   1 
HETATM 4963 O O   . HOH H 6 .   ? 10.150  -18.348 -13.189 1.00 22.77 ? 451 HOH L O   1 
HETATM 4964 O O   . HOH H 6 .   ? 25.442  -40.766 -49.711 1.00 44.78 ? 452 HOH L O   1 
HETATM 4965 O O   . HOH H 6 .   ? 2.225   -22.590 -27.819 1.00 28.81 ? 453 HOH L O   1 
HETATM 4966 O O   . HOH H 6 .   ? 8.677   -25.686 -44.742 1.00 36.43 ? 454 HOH L O   1 
HETATM 4967 O O   . HOH H 6 .   ? 4.626   -33.969 -41.819 0.60 32.31 ? 455 HOH L O   1 
HETATM 4968 O O   . HOH H 6 .   ? 6.123   -27.417 -30.671 0.60 23.58 ? 456 HOH L O   1 
HETATM 4969 O O   . HOH H 6 .   ? 3.119   -25.126 -73.112 1.00 34.87 ? 457 HOH L O   1 
HETATM 4970 O O   . HOH H 6 .   ? 12.953  -14.617 -71.005 1.00 35.12 ? 458 HOH L O   1 
HETATM 4971 O O   . HOH H 6 .   ? 16.868  -26.161 -10.668 1.00 21.23 ? 459 HOH L O   1 
HETATM 4972 O O   . HOH H 6 .   ? 18.143  -43.497 -35.996 0.60 25.00 ? 460 HOH L O   1 
HETATM 4973 O O   . HOH H 6 .   ? 18.444  -17.696 -4.910  1.00 20.98 ? 461 HOH L O   1 
HETATM 4974 O O   . HOH H 6 .   ? 15.846  -44.346 -47.995 0.60 28.89 ? 462 HOH L O   1 
HETATM 4975 O O   . HOH H 6 .   ? 11.956  -35.393 -38.806 1.00 28.30 ? 463 HOH L O   1 
HETATM 4976 O O   . HOH H 6 .   ? 16.129  -46.080 -44.256 1.00 32.26 ? 464 HOH L O   1 
HETATM 4977 O O   . HOH H 6 .   ? 3.508   -27.710 -24.130 1.00 31.87 ? 465 HOH L O   1 
HETATM 4978 O O   . HOH H 6 .   ? 19.133  -32.470 -41.682 1.00 31.33 ? 466 HOH L O   1 
HETATM 4979 O O   . HOH H 6 .   ? 5.731   -27.351 -38.014 1.00 37.00 ? 467 HOH L O   1 
HETATM 4980 O O   . HOH H 6 .   ? 9.591   -31.227 -45.954 1.00 21.67 ? 468 HOH L O   1 
HETATM 4981 O O   . HOH H 6 .   ? 8.798   -30.838 -35.683 1.00 25.18 ? 469 HOH L O   1 
HETATM 4982 O O   . HOH H 6 .   ? 8.164   -22.696 -54.872 1.00 20.43 ? 470 HOH L O   1 
HETATM 4983 O O   . HOH H 6 .   ? 23.963  -42.744 -51.481 1.00 41.00 ? 471 HOH L O   1 
HETATM 4984 O O   . HOH H 6 .   ? 11.525  -17.793 -17.355 1.00 20.74 ? 472 HOH L O   1 
HETATM 4985 O O   . HOH H 6 .   ? 4.340   -24.282 -64.144 1.00 22.23 ? 473 HOH L O   1 
HETATM 4986 O O   . HOH H 6 .   ? 4.661   -35.001 -36.767 0.60 27.89 ? 474 HOH L O   1 
HETATM 4987 O O   . HOH H 6 .   ? 19.591  -28.166 -51.981 1.00 33.64 ? 475 HOH L O   1 
HETATM 4988 O O   . HOH H 6 .   ? 17.161  -25.613 -17.250 1.00 18.63 ? 476 HOH L O   1 
HETATM 4989 O O   . HOH H 6 .   ? 17.234  -13.358 -5.053  1.00 28.06 ? 477 HOH L O   1 
HETATM 4990 O O   . HOH H 6 .   ? 12.503  -20.146 -34.545 1.00 26.72 ? 478 HOH L O   1 
HETATM 4991 O O   . HOH H 6 .   ? 3.375   -25.036 -11.522 1.00 32.61 ? 479 HOH L O   1 
HETATM 4992 O O   . HOH H 6 .   ? 9.921   -33.524 -47.506 1.00 22.28 ? 480 HOH L O   1 
HETATM 4993 O O   . HOH H 6 .   ? 21.836  -32.187 -62.219 1.00 27.25 ? 481 HOH L O   1 
HETATM 4994 O O   . HOH H 6 .   ? 13.987  -15.403 -68.716 1.00 40.74 ? 482 HOH L O   1 
HETATM 4995 O O   . HOH H 6 .   ? 8.213   -29.781 -40.143 1.00 34.12 ? 483 HOH L O   1 
HETATM 4996 O O   . HOH H 6 .   ? 13.362  -9.379  -24.134 1.00 16.27 ? 484 HOH L O   1 
HETATM 4997 O O   . HOH H 6 .   ? 13.752  -25.603 -81.045 0.60 27.23 ? 485 HOH L O   1 
HETATM 4998 O O   . HOH H 6 .   ? 19.366  -18.595 -61.710 1.00 27.78 ? 486 HOH L O   1 
HETATM 4999 O O   . HOH H 6 .   ? 14.165  -26.148 -10.211 1.00 36.02 ? 487 HOH L O   1 
HETATM 5000 O O   . HOH H 6 .   ? 4.432   -35.068 -51.013 1.00 34.38 ? 488 HOH L O   1 
HETATM 5001 O O   . HOH H 6 .   ? 8.074   -32.752 -29.966 1.00 24.32 ? 489 HOH L O   1 
HETATM 5002 O O   . HOH H 6 .   ? 7.375   -38.558 -36.504 1.00 27.68 ? 490 HOH L O   1 
HETATM 5003 O O   . HOH H 6 .   ? 15.013  -6.596  -12.775 1.00 33.33 ? 491 HOH L O   1 
HETATM 5004 O O   . HOH H 6 .   ? 25.558  -31.355 -34.962 0.60 23.41 ? 492 HOH L O   1 
HETATM 5005 O O   . HOH H 6 .   ? 4.564   -33.807 -63.524 1.00 42.39 ? 493 HOH L O   1 
HETATM 5006 O O   . HOH H 6 .   ? 21.924  -16.812 -27.290 1.00 22.57 ? 494 HOH L O   1 
HETATM 5007 O O   . HOH H 6 .   ? 6.009   -24.773 -31.874 1.00 21.75 ? 495 HOH L O   1 
HETATM 5008 O O   . HOH H 6 .   ? 14.590  -38.118 -19.902 0.60 26.81 ? 496 HOH L O   1 
HETATM 5009 O O   . HOH H 6 .   ? 18.736  -23.834 -52.782 0.60 32.80 ? 497 HOH L O   1 
HETATM 5010 O O   . HOH H 6 .   ? 16.450  -29.742 -73.100 1.00 23.54 ? 498 HOH L O   1 
HETATM 5011 O O   . HOH H 6 .   ? 7.356   -37.433 -62.813 1.00 28.16 ? 499 HOH L O   1 
HETATM 5012 O O   . HOH H 6 .   ? 23.876  -24.066 -9.075  1.00 18.43 ? 500 HOH L O   1 
HETATM 5013 O O   . HOH H 6 .   ? 23.283  -35.103 -52.705 1.00 22.66 ? 501 HOH L O   1 
HETATM 5014 O O   . HOH H 6 .   ? 16.790  -17.433 -55.962 0.60 44.60 ? 502 HOH L O   1 
HETATM 5015 O O   . HOH H 6 .   ? 10.654  -20.549 -15.216 1.00 18.69 ? 503 HOH L O   1 
HETATM 5016 O O   . HOH H 6 .   ? 18.750  -28.480 -11.509 1.00 28.05 ? 504 HOH L O   1 
HETATM 5017 O O   . HOH H 6 .   ? 14.062  -15.503 -65.103 1.00 29.54 ? 505 HOH L O   1 
HETATM 5018 O O   . HOH H 6 .   ? 25.357  -45.558 -59.135 0.60 27.53 ? 506 HOH L O   1 
HETATM 5019 O O   . HOH H 6 .   ? 26.782  -25.902 -25.678 0.60 29.25 ? 507 HOH L O   1 
HETATM 5020 O O   . HOH H 6 .   ? 16.655  -8.320  -17.859 1.00 19.75 ? 508 HOH L O   1 
HETATM 5021 O O   . HOH H 6 .   ? 2.268   -30.371 -23.465 1.00 33.93 ? 509 HOH L O   1 
HETATM 5022 O O   . HOH H 6 .   ? 13.525  -32.056 -15.960 1.00 22.49 ? 510 HOH L O   1 
HETATM 5023 O O   . HOH H 6 .   ? 11.167  -22.377 -56.977 1.00 20.23 ? 511 HOH L O   1 
HETATM 5024 O O   . HOH H 6 .   ? 7.546   -22.142 -57.490 1.00 23.43 ? 512 HOH L O   1 
HETATM 5025 O O   . HOH H 6 .   ? 11.507  -39.504 -60.081 1.00 31.40 ? 513 HOH L O   1 
HETATM 5026 O O   . HOH H 6 .   ? 4.782   -36.493 -49.093 0.60 27.63 ? 514 HOH L O   1 
HETATM 5027 O O   . HOH H 6 .   ? 26.032  -41.284 -54.561 1.00 36.44 ? 515 HOH L O   1 
HETATM 5028 O O   . HOH H 6 .   ? 6.136   -33.771 -73.950 1.00 40.90 ? 516 HOH L O   1 
HETATM 5029 O O   A HOH H 6 .   ? 10.965  -3.943  -17.897 0.60 28.14 ? 517 HOH L O   1 
HETATM 5030 O O   B HOH H 6 .   ? 9.778   -2.509  -17.065 0.40 23.11 ? 517 HOH L O   1 
HETATM 5031 O O   . HOH H 6 .   ? 25.233  -27.761 -24.848 1.00 33.19 ? 518 HOH L O   1 
HETATM 5032 O O   . HOH H 6 .   ? 19.667  -24.416 -64.590 1.00 26.98 ? 519 HOH L O   1 
HETATM 5033 O O   . HOH H 6 .   ? 15.284  -29.869 -79.204 0.60 29.64 ? 520 HOH L O   1 
HETATM 5034 O O   . HOH H 6 .   ? 25.974  -21.069 -23.573 1.00 25.30 ? 521 HOH L O   1 
HETATM 5035 O O   . HOH H 6 .   ? 23.825  -32.764 -27.983 1.00 32.60 ? 522 HOH L O   1 
HETATM 5036 O O   . HOH H 6 .   ? 11.735  -30.794 -11.252 1.00 43.01 ? 523 HOH L O   1 
HETATM 5037 O O   . HOH H 6 .   ? 6.498   -34.757 -68.863 1.00 37.58 ? 524 HOH L O   1 
HETATM 5038 O O   . HOH H 6 .   ? 15.182  -29.438 -39.729 1.00 32.75 ? 525 HOH L O   1 
HETATM 5039 O O   . HOH H 6 .   ? 22.068  -43.772 -45.877 1.00 29.09 ? 526 HOH L O   1 
HETATM 5040 O O   . HOH H 6 .   ? 19.053  -31.385 -18.626 1.00 27.53 ? 527 HOH L O   1 
HETATM 5041 O O   . HOH H 6 .   ? 11.092  -39.533 -52.503 1.00 26.27 ? 528 HOH L O   1 
HETATM 5042 O O   . HOH H 6 .   ? 8.903   -32.342 -14.353 1.00 30.79 ? 529 HOH L O   1 
HETATM 5043 O O   . HOH H 6 .   ? 19.445  -12.440 -24.171 1.00 24.87 ? 530 HOH L O   1 
HETATM 5044 O O   . HOH H 6 .   ? 3.332   -31.928 -25.164 0.60 25.96 ? 531 HOH L O   1 
HETATM 5045 O O   . HOH H 6 .   ? 7.063   -42.184 -41.575 1.00 24.26 ? 532 HOH L O   1 
HETATM 5046 O O   . HOH H 6 .   ? 7.895   -28.762 -44.327 0.60 31.84 ? 533 HOH L O   1 
HETATM 5047 O O   . HOH H 6 .   ? 14.942  -9.293  -9.897  0.60 35.96 ? 534 HOH L O   1 
HETATM 5048 O O   . HOH H 6 .   ? 17.969  -23.227 -76.049 0.60 29.79 ? 535 HOH L O   1 
HETATM 5049 O O   . HOH H 6 .   ? 16.304  -13.910 -28.641 1.00 32.68 ? 536 HOH L O   1 
HETATM 5050 O O   . HOH H 6 .   ? 20.632  -32.097 -45.181 1.00 25.10 ? 537 HOH L O   1 
HETATM 5051 O O   . HOH H 6 .   ? 11.262  -17.337 -59.527 1.00 29.51 ? 538 HOH L O   1 
HETATM 5052 O O   . HOH H 6 .   ? 16.653  -40.299 -37.797 1.00 31.90 ? 539 HOH L O   1 
HETATM 5053 O O   . HOH H 6 .   ? 21.160  -20.233 -62.359 1.00 31.93 ? 540 HOH L O   1 
HETATM 5054 O O   . HOH H 6 .   ? -3.141  -25.026 -68.960 1.00 41.96 ? 541 HOH L O   1 
HETATM 5055 O O   . HOH H 6 .   ? 3.100   -29.849 -77.979 0.60 39.37 ? 542 HOH L O   1 
HETATM 5056 O O   . HOH H 6 .   ? 17.319  -44.574 -28.507 0.60 30.43 ? 543 HOH L O   1 
HETATM 5057 O O   . HOH H 6 .   ? 1.275   -22.181 -33.264 1.00 37.32 ? 544 HOH L O   1 
HETATM 5058 O O   . HOH H 6 .   ? 17.985  -44.540 -56.533 0.60 27.22 ? 545 HOH L O   1 
HETATM 5059 O O   . HOH H 6 .   ? 20.883  -41.667 -39.260 1.00 41.14 ? 546 HOH L O   1 
HETATM 5060 O O   . HOH H 6 .   ? 15.817  -26.417 -42.773 0.60 30.77 ? 547 HOH L O   1 
HETATM 5061 O O   . HOH H 6 .   ? 7.178   -35.542 -46.550 1.00 48.62 ? 548 HOH L O   1 
HETATM 5062 O O   . HOH H 6 .   ? 6.571   -31.322 -41.060 1.00 30.00 ? 549 HOH L O   1 
HETATM 5063 O O   . HOH H 6 .   ? 14.402  -22.033 -49.576 1.00 28.79 ? 550 HOH L O   1 
HETATM 5064 O O   . HOH H 6 .   ? 5.900   -38.426 -27.082 0.60 34.95 ? 551 HOH L O   1 
HETATM 5065 O O   . HOH H 6 .   ? 10.019  -36.921 -68.380 1.00 37.52 ? 552 HOH L O   1 
HETATM 5066 O O   . HOH H 6 .   ? 16.105  -16.665 -69.842 1.00 30.63 ? 553 HOH L O   1 
HETATM 5067 O O   . HOH H 6 .   ? 7.166   -31.236 -44.809 1.00 37.75 ? 554 HOH L O   1 
HETATM 5068 O O   . HOH H 6 .   ? 17.141  -7.118  -15.512 1.00 31.39 ? 555 HOH L O   1 
HETATM 5069 O O   . HOH H 6 .   ? 9.283   -39.431 -24.393 0.60 27.71 ? 556 HOH L O   1 
HETATM 5070 O O   . HOH H 6 .   ? 15.010  -27.833 -37.569 1.00 29.56 ? 557 HOH L O   1 
HETATM 5071 O O   . HOH H 6 .   ? 16.326  -43.803 -51.937 1.00 33.98 ? 558 HOH L O   1 
HETATM 5072 O O   . HOH H 6 .   ? 17.678  -19.898 -55.856 1.00 26.93 ? 559 HOH L O   1 
HETATM 5073 O O   . HOH H 6 .   ? 4.368   -32.548 -15.984 0.60 27.88 ? 560 HOH L O   1 
HETATM 5074 O O   . HOH H 6 .   ? 16.212  -39.946 -66.351 1.00 34.16 ? 561 HOH L O   1 
HETATM 5075 O O   . HOH H 6 .   ? 19.313  -8.216  -22.570 1.00 31.40 ? 562 HOH L O   1 
HETATM 5076 O O   . HOH H 6 .   ? 18.583  -44.274 -58.737 1.00 37.39 ? 563 HOH L O   1 
HETATM 5077 O O   . HOH H 6 .   ? 11.461  -40.851 -34.398 1.00 22.15 ? 564 HOH L O   1 
HETATM 5078 O O   . HOH H 6 .   ? 22.561  -38.338 -59.170 1.00 29.23 ? 565 HOH L O   1 
HETATM 5079 O O   . HOH H 6 .   ? 11.276  -40.644 -49.235 1.00 34.46 ? 566 HOH L O   1 
HETATM 5080 O O   . HOH H 6 .   ? 27.487  -23.006 -31.603 0.60 34.23 ? 567 HOH L O   1 
HETATM 5081 O O   . HOH H 6 .   ? 25.002  -21.964 -12.371 1.00 25.12 ? 568 HOH L O   1 
HETATM 5082 O O   . HOH H 6 .   ? 22.876  -28.307 -13.909 1.00 30.13 ? 569 HOH L O   1 
HETATM 5083 O O   . HOH H 6 .   ? 5.536   -32.552 -35.135 0.60 29.79 ? 570 HOH L O   1 
HETATM 5084 O O   . HOH H 6 .   ? 6.740   -35.245 -64.301 1.00 26.84 ? 571 HOH L O   1 
HETATM 5085 O O   . HOH H 6 .   ? 16.728  -15.606 -61.403 1.00 32.30 ? 572 HOH L O   1 
HETATM 5086 O O   . HOH H 6 .   ? 2.219   -27.512 -15.837 1.00 31.33 ? 573 HOH L O   1 
HETATM 5087 O O   . HOH H 6 .   ? 12.349  -42.877 -32.742 1.00 40.01 ? 574 HOH L O   1 
HETATM 5088 O O   . HOH H 6 .   ? 15.152  -24.724 -7.467  1.00 27.16 ? 575 HOH L O   1 
HETATM 5089 O O   . HOH H 6 .   ? 15.827  -17.077 -72.917 0.60 38.30 ? 576 HOH L O   1 
HETATM 5090 O O   . HOH H 6 .   ? 2.483   -23.736 -30.532 1.00 38.52 ? 577 HOH L O   1 
HETATM 5091 O O   . HOH H 6 .   ? 6.937   -19.502 -36.874 0.60 27.29 ? 578 HOH L O   1 
HETATM 5092 O O   . HOH H 6 .   ? 21.763  -13.086 -26.631 1.00 32.26 ? 579 HOH L O   1 
HETATM 5093 O O   . HOH H 6 .   ? 2.955   -14.588 -64.731 1.00 31.55 ? 580 HOH L O   1 
HETATM 5094 O O   A HOH H 6 .   ? 12.513  -14.403 -60.933 0.60 31.65 ? 581 HOH L O   1 
HETATM 5095 O O   B HOH H 6 .   ? 13.629  -12.743 -60.322 0.40 20.79 ? 581 HOH L O   1 
HETATM 5096 O O   . HOH H 6 .   ? 16.643  -43.100 -41.119 1.00 29.59 ? 582 HOH L O   1 
HETATM 5097 O O   . HOH H 6 .   ? 21.002  -30.489 -41.455 0.60 34.75 ? 583 HOH L O   1 
HETATM 5098 O O   . HOH H 6 .   ? 8.369   -39.426 -60.054 0.60 38.30 ? 584 HOH L O   1 
HETATM 5099 O O   . HOH H 6 .   ? 14.954  -34.693 -72.384 0.60 28.05 ? 585 HOH L O   1 
HETATM 5100 O O   . HOH H 6 .   ? -0.396  -26.123 -16.256 1.00 50.38 ? 586 HOH L O   1 
HETATM 5101 O O   . HOH H 6 .   ? 21.950  -28.013 -11.473 1.00 35.92 ? 587 HOH L O   1 
HETATM 5102 O O   . HOH H 6 .   ? 14.346  -16.304 -62.337 1.00 27.70 ? 588 HOH L O   1 
HETATM 5103 O O   . HOH H 6 .   ? 30.373  -20.094 -14.484 0.60 30.18 ? 589 HOH L O   1 
HETATM 5104 O O   . HOH H 6 .   ? 8.444   -43.778 -29.567 1.00 35.48 ? 590 HOH L O   1 
HETATM 5105 O O   . HOH H 6 .   ? 29.801  -21.958 -23.121 0.60 34.68 ? 591 HOH L O   1 
HETATM 5106 O O   . HOH H 6 .   ? 22.396  -26.254 -9.600  1.00 31.45 ? 592 HOH L O   1 
HETATM 5107 O O   . HOH H 6 .   ? 13.399  -25.837 -37.342 1.00 26.04 ? 593 HOH L O   1 
HETATM 5108 O O   . HOH H 6 .   ? 5.005   -30.719 -36.634 1.00 42.60 ? 594 HOH L O   1 
HETATM 5109 O O   . HOH H 6 .   ? 24.607  -34.594 -55.057 1.00 40.69 ? 595 HOH L O   1 
HETATM 5110 O O   A HOH H 6 .   ? 15.051  -33.318 -14.190 0.50 29.61 ? 596 HOH L O   1 
HETATM 5111 O O   B HOH H 6 .   ? 16.581  -32.093 -13.907 0.50 23.75 ? 596 HOH L O   1 
HETATM 5112 O O   . HOH H 6 .   ? 27.158  -15.764 -20.126 1.00 34.74 ? 597 HOH L O   1 
HETATM 5113 O O   . HOH H 6 .   ? 10.329  -13.051 -67.596 1.00 45.43 ? 598 HOH L O   1 
HETATM 5114 O O   . HOH H 6 .   ? 16.852  -30.770 -77.686 1.00 37.30 ? 599 HOH L O   1 
HETATM 5115 O O   . HOH H 6 .   ? 3.102   -23.125 -75.859 1.00 43.32 ? 600 HOH L O   1 
HETATM 5116 O O   . HOH H 6 .   ? 18.677  -12.938 -28.710 1.00 47.34 ? 601 HOH L O   1 
HETATM 5117 O O   . HOH H 6 .   ? 10.356  -20.058 -56.384 1.00 39.15 ? 602 HOH L O   1 
HETATM 5118 O O   . HOH H 6 .   ? 17.272  -22.531 -51.406 1.00 46.95 ? 603 HOH L O   1 
HETATM 5119 O O   . HOH H 6 .   ? 28.371  -26.307 -27.792 0.60 30.06 ? 604 HOH L O   1 
HETATM 5120 O O   . HOH H 6 .   ? 21.439  -6.558  -23.125 1.00 35.00 ? 605 HOH L O   1 
HETATM 5121 O O   . HOH H 6 .   ? 3.261   -27.872 -73.260 1.00 41.00 ? 606 HOH L O   1 
HETATM 5122 O O   . HOH H 6 .   ? 23.648  -38.086 -45.438 1.00 49.31 ? 607 HOH L O   1 
HETATM 5123 O O   . HOH H 6 .   ? 16.584  -0.710  -21.882 0.60 26.98 ? 608 HOH L O   1 
HETATM 5124 O O   . HOH H 6 .   ? 14.595  -46.102 -46.719 0.60 26.86 ? 609 HOH L O   1 
HETATM 5125 O O   . HOH H 6 .   ? 7.147   -29.771 -37.764 1.00 34.84 ? 610 HOH L O   1 
HETATM 5126 O O   . HOH H 6 .   ? 26.635  -11.992 -21.620 1.00 32.31 ? 611 HOH L O   1 
HETATM 5127 O O   . HOH H 6 .   ? 20.273  -36.073 -18.527 0.60 38.19 ? 612 HOH L O   1 
HETATM 5128 O O   . HOH H 6 .   ? 28.213  -19.876 -23.484 0.60 21.78 ? 613 HOH L O   1 
HETATM 5129 O O   . HOH H 6 .   ? 24.653  -36.825 -31.986 0.60 31.69 ? 614 HOH L O   1 
HETATM 5130 O O   . HOH H 6 .   ? 26.383  -26.392 -15.825 1.00 31.97 ? 615 HOH L O   1 
HETATM 5131 O O   . HOH H 6 .   ? 19.319  -9.896  -24.903 1.00 35.40 ? 616 HOH L O   1 
HETATM 5132 O O   . HOH H 6 .   ? 15.828  -11.390 -3.830  1.00 27.02 ? 617 HOH L O   1 
HETATM 5133 O O   . HOH H 6 .   ? 20.936  -16.628 -60.442 1.00 43.38 ? 618 HOH L O   1 
HETATM 5134 O O   . HOH H 6 .   ? 13.894  -11.039 -6.813  1.00 47.37 ? 619 HOH L O   1 
HETATM 5135 O O   . HOH H 6 .   ? 7.376   -42.113 -27.461 1.00 46.34 ? 620 HOH L O   1 
HETATM 5136 O O   . HOH H 6 .   ? 23.321  -15.357 -29.032 0.60 27.28 ? 621 HOH L O   1 
HETATM 5137 O O   . HOH H 6 .   ? 13.343  -42.862 -62.388 1.00 46.43 ? 622 HOH L O   1 
HETATM 5138 O O   . HOH H 6 .   ? 28.021  -17.929 -28.346 0.60 27.98 ? 623 HOH L O   1 
HETATM 5139 O O   . HOH H 6 .   ? 29.168  -18.909 -25.978 0.60 33.35 ? 624 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  ? 0.6218 0.5906 0.5492 -0.0535 -0.0941 -0.1209 39  LEU A N   
2    C CA  . LEU A 11  ? 0.5731 0.5596 0.5123 -0.0506 -0.0808 -0.0919 39  LEU A CA  
3    C C   . LEU A 11  ? 0.5067 0.4878 0.4771 -0.0645 -0.0849 -0.0755 39  LEU A C   
4    O O   . LEU A 11  ? 0.5134 0.4660 0.4993 -0.0698 -0.0887 -0.0801 39  LEU A O   
5    C CB  . LEU A 11  ? 0.6035 0.5785 0.5382 -0.0360 -0.0650 -0.0886 39  LEU A CB  
6    C CG  . LEU A 11  ? 0.6698 0.6522 0.5780 -0.0205 -0.0569 -0.1004 39  LEU A CG  
7    C CD1 . LEU A 11  ? 0.6879 0.6490 0.5995 -0.0093 -0.0463 -0.1037 39  LEU A CD1 
8    C CD2 . LEU A 11  ? 0.6497 0.6639 0.5492 -0.0150 -0.0486 -0.0833 39  LEU A CD2 
9    N N   . THR A 12  ? 0.4460 0.4540 0.4274 -0.0694 -0.0840 -0.0563 40  THR A N   
10   C CA  . THR A 12  ? 0.4092 0.4192 0.4202 -0.0811 -0.0857 -0.0384 40  THR A CA  
11   C C   . THR A 12  ? 0.3442 0.3608 0.3597 -0.0716 -0.0698 -0.0199 40  THR A C   
12   O O   . THR A 12  ? 0.2939 0.3282 0.2992 -0.0614 -0.0610 -0.0134 40  THR A O   
13   C CB  . THR A 12  ? 0.4336 0.4691 0.4590 -0.0946 -0.0976 -0.0317 40  THR A CB  
14   O OG1 . THR A 12  ? 0.4621 0.5288 0.4822 -0.0867 -0.0906 -0.0187 40  THR A OG1 
15   C CG2 . THR A 12  ? 0.4581 0.4920 0.4733 -0.1025 -0.1147 -0.0529 40  THR A CG2 
16   N N   . PRO A 13  ? 0.3268 0.3294 0.3594 -0.0752 -0.0668 -0.0104 41  PRO A N   
17   C CA  . PRO A 13  ? 0.2929 0.3031 0.3280 -0.0665 -0.0534 0.0050  41  PRO A CA  
18   C C   . PRO A 13  ? 0.2505 0.2935 0.2920 -0.0661 -0.0495 0.0195  41  PRO A C   
19   O O   . PRO A 13  ? 0.2370 0.2956 0.2914 -0.0765 -0.0577 0.0238  41  PRO A O   
20   C CB  . PRO A 13  ? 0.3059 0.3019 0.3610 -0.0736 -0.0539 0.0160  41  PRO A CB  
21   C CG  . PRO A 13  ? 0.3608 0.3336 0.4261 -0.0857 -0.0676 0.0044  41  PRO A CG  
22   C CD  . PRO A 13  ? 0.3626 0.3438 0.4152 -0.0887 -0.0770 -0.0121 41  PRO A CD  
23   N N   . LEU A 14  ? 0.2179 0.2707 0.2527 -0.0543 -0.0382 0.0260  42  LEU A N   
24   C CA  . LEU A 14  ? 0.1993 0.2806 0.2436 -0.0517 -0.0331 0.0395  42  LEU A CA  
25   C C   . LEU A 14  ? 0.1948 0.2852 0.2582 -0.0590 -0.0313 0.0548  42  LEU A C   
26   O O   . LEU A 14  ? 0.2050 0.2776 0.2705 -0.0612 -0.0305 0.0569  42  LEU A O   
27   C CB  . LEU A 14  ? 0.1884 0.2738 0.2218 -0.0373 -0.0229 0.0394  42  LEU A CB  
28   C CG  . LEU A 14  ? 0.1920 0.2821 0.2153 -0.0303 -0.0231 0.0338  42  LEU A CG  
29   C CD1 . LEU A 14  ? 0.2115 0.2840 0.2199 -0.0310 -0.0274 0.0215  42  LEU A CD1 
30   C CD2 . LEU A 14  ? 0.1801 0.2732 0.2002 -0.0179 -0.0143 0.0355  42  LEU A CD2 
31   N N   . ALA A 15  ? 0.1772 0.2967 0.2555 -0.0620 -0.0307 0.0668  43  ALA A N   
32   C CA  . ALA A 15  ? 0.1740 0.3139 0.2720 -0.0674 -0.0266 0.0856  43  ALA A CA  
33   C C   . ALA A 15  ? 0.1603 0.3100 0.2474 -0.0525 -0.0132 0.0897  43  ALA A C   
34   O O   . ALA A 15  ? 0.1386 0.2833 0.2090 -0.0397 -0.0087 0.0787  43  ALA A O   
35   C CB  . ALA A 15  ? 0.1773 0.3502 0.2944 -0.0729 -0.0291 0.0962  43  ALA A CB  
36   N N   . TYR A 16  ? 0.1680 0.3338 0.2661 -0.0549 -0.0078 0.1062  44  TYR A N   
37   C CA  . TYR A 16  ? 0.1608 0.3418 0.2471 -0.0409 0.0040  0.1100  44  TYR A CA  
38   C C   . TYR A 16  ? 0.1495 0.3568 0.2330 -0.0279 0.0110  0.1065  44  TYR A C   
39   O O   . TYR A 16  ? 0.1446 0.3771 0.2459 -0.0320 0.0107  0.1160  44  TYR A O   
40   C CB  . TYR A 16  ? 0.1716 0.3730 0.2734 -0.0479 0.0077  0.1329  44  TYR A CB  
41   C CG  . TYR A 16  ? 0.1697 0.3900 0.2575 -0.0348 0.0188  0.1386  44  TYR A CG  
42   C CD1 . TYR A 16  ? 0.1825 0.3818 0.2508 -0.0277 0.0190  0.1292  44  TYR A CD1 
43   C CD2 . TYR A 16  ? 0.1738 0.4370 0.2681 -0.0293 0.0287  0.1534  44  TYR A CD2 
44   C CE1 . TYR A 16  ? 0.1890 0.4086 0.2430 -0.0162 0.0271  0.1334  44  TYR A CE1 
45   C CE2 . TYR A 16  ? 0.1836 0.4678 0.2621 -0.0170 0.0384  0.1580  44  TYR A CE2 
46   C CZ  . TYR A 16  ? 0.1893 0.4513 0.2465 -0.0106 0.0368  0.1469  44  TYR A CZ  
47   O OH  . TYR A 16  ? 0.2237 0.5115 0.2639 0.0014  0.0449  0.1509  44  TYR A OH  
48   N N   . LYS A 17  ? 0.1408 0.3407 0.2056 -0.0132 0.0161  0.0929  45  LYS A N   
49   C CA  . LYS A 17  ? 0.1389 0.3543 0.2000 0.0022  0.0224  0.0850  45  LYS A CA  
50   C C   . LYS A 17  ? 0.1331 0.3397 0.1990 0.0019  0.0163  0.0781  45  LYS A C   
51   O O   . LYS A 17  ? 0.1308 0.3467 0.1975 0.0148  0.0205  0.0731  45  LYS A O   
52   C CB  . LYS A 17  ? 0.1405 0.3970 0.2113 0.0093  0.0321  0.0972  45  LYS A CB  
53   C CG  . LYS A 17  ? 0.1640 0.4354 0.2264 0.0118  0.0391  0.1058  45  LYS A CG  
54   C CD  . LYS A 17  ? 0.1709 0.4309 0.2090 0.0253  0.0424  0.0897  45  LYS A CD  
55   C CE  . LYS A 17  ? 0.1819 0.4626 0.2121 0.0261  0.0479  0.1021  45  LYS A CE  
56   N NZ  . LYS A 17  ? 0.1925 0.4722 0.1983 0.0403  0.0507  0.0864  45  LYS A NZ  
57   N N   . GLN A 18  ? 0.1345 0.3230 0.2024 -0.0106 0.0067  0.0770  46  GLN A N   
58   C CA  . GLN A 18  ? 0.1425 0.3254 0.2113 -0.0109 0.0001  0.0714  46  GLN A CA  
59   C C   . GLN A 18  ? 0.1319 0.2925 0.1852 -0.0005 0.0018  0.0588  46  GLN A C   
60   O O   . GLN A 18  ? 0.1279 0.2681 0.1690 -0.0004 0.0030  0.0521  46  GLN A O   
61   C CB  . GLN A 18  ? 0.1525 0.3224 0.2230 -0.0266 -0.0113 0.0702  46  GLN A CB  
62   C CG  . GLN A 18  ? 0.1545 0.3251 0.2222 -0.0255 -0.0179 0.0655  46  GLN A CG  
63   C CD  . GLN A 18  ? 0.1743 0.3417 0.2453 -0.0410 -0.0306 0.0635  46  GLN A CD  
64   O OE1 . GLN A 18  ? 0.1839 0.3358 0.2558 -0.0513 -0.0344 0.0612  46  GLN A OE1 
65   N NE2 . GLN A 18  ? 0.1796 0.3601 0.2518 -0.0421 -0.0382 0.0635  46  GLN A NE2 
66   N N   . PHE A 19  ? 0.1325 0.2987 0.1896 0.0077  0.0018  0.0580  47  PHE A N   
67   C CA  . PHE A 19  ? 0.1430 0.2891 0.1914 0.0152  0.0018  0.0501  47  PHE A CA  
68   C C   . PHE A 19  ? 0.1416 0.2901 0.1920 0.0122  -0.0050 0.0541  47  PHE A C   
69   O O   . PHE A 19  ? 0.1423 0.3124 0.2043 0.0111  -0.0083 0.0623  47  PHE A O   
70   C CB  . PHE A 19  ? 0.1543 0.3018 0.2066 0.0304  0.0087  0.0460  47  PHE A CB  
71   C CG  . PHE A 19  ? 0.1721 0.3457 0.2397 0.0393  0.0124  0.0524  47  PHE A CG  
72   C CD1 . PHE A 19  ? 0.1833 0.3797 0.2550 0.0418  0.0186  0.0556  47  PHE A CD1 
73   C CD2 . PHE A 19  ? 0.1814 0.3601 0.2608 0.0467  0.0105  0.0572  47  PHE A CD2 
74   C CE1 . PHE A 19  ? 0.2045 0.4298 0.2922 0.0512  0.0234  0.0626  47  PHE A CE1 
75   C CE2 . PHE A 19  ? 0.1982 0.4017 0.2942 0.0577  0.0147  0.0630  47  PHE A CE2 
76   C CZ  . PHE A 19  ? 0.2197 0.4483 0.3202 0.0598  0.0213  0.0655  47  PHE A CZ  
77   N N   . ILE A 20  ? 0.1479 0.2774 0.1867 0.0111  -0.0069 0.0493  48  ILE A N   
78   C CA  A ILE A 20  ? 0.1534 0.2861 0.1882 0.0087  -0.0130 0.0530  48  ILE A CA  
79   C CA  B ILE A 20  ? 0.1492 0.2820 0.1841 0.0088  -0.0129 0.0531  48  ILE A CA  
80   C C   . ILE A 20  ? 0.1501 0.2698 0.1834 0.0169  -0.0094 0.0540  48  ILE A C   
81   O O   . ILE A 20  ? 0.1411 0.2427 0.1677 0.0172  -0.0060 0.0474  48  ILE A O   
82   C CB  A ILE A 20  ? 0.1673 0.2932 0.1884 -0.0024 -0.0189 0.0465  48  ILE A CB  
83   C CB  B ILE A 20  ? 0.1573 0.2839 0.1787 -0.0024 -0.0191 0.0467  48  ILE A CB  
84   C CG1 A ILE A 20  ? 0.1753 0.3142 0.2039 -0.0127 -0.0253 0.0477  48  ILE A CG1 
85   C CG1 B ILE A 20  ? 0.1585 0.2975 0.1878 -0.0126 -0.0249 0.0479  48  ILE A CG1 
86   C CG2 A ILE A 20  ? 0.1780 0.3071 0.1881 -0.0020 -0.0232 0.0478  48  ILE A CG2 
87   C CG2 B ILE A 20  ? 0.1685 0.2999 0.1795 -0.0024 -0.0239 0.0484  48  ILE A CG2 
88   C CD1 A ILE A 20  ? 0.1944 0.3218 0.2119 -0.0236 -0.0328 0.0380  48  ILE A CD1 
89   C CD1 B ILE A 20  ? 0.1611 0.3255 0.1999 -0.0150 -0.0323 0.0560  48  ILE A CD1 
90   N N   . PRO A 21  ? 0.1541 0.2836 0.1962 0.0231  -0.0109 0.0643  49  PRO A N   
91   C CA  . PRO A 21  ? 0.1594 0.3137 0.2125 0.0244  -0.0155 0.0742  49  PRO A CA  
92   C C   . PRO A 21  ? 0.1512 0.3159 0.2203 0.0310  -0.0112 0.0745  49  PRO A C   
93   O O   . PRO A 21  ? 0.1490 0.3002 0.2191 0.0369  -0.0045 0.0665  49  PRO A O   
94   C CB  . PRO A 21  ? 0.1669 0.3243 0.2275 0.0325  -0.0163 0.0869  49  PRO A CB  
95   C CG  . PRO A 21  ? 0.1684 0.3002 0.2307 0.0375  -0.0102 0.0831  49  PRO A CG  
96   C CD  . PRO A 21  ? 0.1619 0.2802 0.2068 0.0289  -0.0087 0.0699  49  PRO A CD  
97   N N   . ASN A 22  ? 0.1410 0.3325 0.2220 0.0303  -0.0154 0.0834  50  ASN A N   
98   C CA  . ASN A 22  ? 0.1436 0.3552 0.2405 0.0346  -0.0114 0.0859  50  ASN A CA  
99   C C   . ASN A 22  ? 0.1415 0.3555 0.2551 0.0533  -0.0050 0.0896  50  ASN A C   
100  O O   . ASN A 22  ? 0.1397 0.3796 0.2721 0.0606  -0.0054 0.1000  50  ASN A O   
101  C CB  . ASN A 22  ? 0.1647 0.4057 0.2702 0.0237  -0.0200 0.0944  50  ASN A CB  
102  C CG  . ASN A 22  ? 0.1775 0.4463 0.3036 0.0281  -0.0152 0.1012  50  ASN A CG  
103  O OD1 . ASN A 22  ? 0.2033 0.5029 0.3475 0.0283  -0.0203 0.1133  50  ASN A OD1 
104  N ND2 . ASN A 22  ? 0.1841 0.4457 0.3079 0.0334  -0.0051 0.0946  50  ASN A ND2 
105  N N   . VAL A 23  ? 0.1374 0.3242 0.2462 0.0611  -0.0001 0.0809  51  VAL A N   
106  C CA  . VAL A 23  ? 0.1538 0.3333 0.2788 0.0792  0.0050  0.0800  51  VAL A CA  
107  C C   . VAL A 23  ? 0.1485 0.3032 0.2634 0.0826  0.0105  0.0625  51  VAL A C   
108  O O   . VAL A 23  ? 0.1520 0.2946 0.2493 0.0706  0.0091  0.0563  51  VAL A O   
109  C CB  . VAL A 23  ? 0.1620 0.3316 0.2975 0.0842  0.0005  0.0918  51  VAL A CB  
110  C CG1 . VAL A 23  ? 0.1680 0.3681 0.3146 0.0836  -0.0056 0.1101  51  VAL A CG1 
111  C CG2 . VAL A 23  ? 0.1648 0.3112 0.2851 0.0739  -0.0023 0.0903  51  VAL A CG2 
112  N N   . ALA A 24  ? 0.1602 0.3066 0.2864 0.0989  0.0155  0.0541  52  ALA A N   
113  C CA  . ALA A 24  ? 0.1693 0.2926 0.2854 0.1028  0.0187  0.0346  52  ALA A CA  
114  C C   . ALA A 24  ? 0.1767 0.2698 0.2877 0.0937  0.0132  0.0331  52  ALA A C   
115  O O   . ALA A 24  ? 0.1760 0.2614 0.2984 0.0924  0.0090  0.0461  52  ALA A O   
116  C CB  . ALA A 24  ? 0.1943 0.3136 0.3239 0.1232  0.0236  0.0232  52  ALA A CB  
117  N N   . GLU A 25  ? 0.1747 0.2531 0.2714 0.0892  0.0134  0.0185  53  GLU A N   
118  C CA  . GLU A 25  ? 0.1809 0.2363 0.2727 0.0787  0.0088  0.0174  53  GLU A CA  
119  C C   . GLU A 25  ? 0.2065 0.2395 0.3187 0.0835  0.0053  0.0214  53  GLU A C   
120  O O   . GLU A 25  ? 0.2083 0.2341 0.3230 0.0742  0.0022  0.0334  53  GLU A O   
121  C CB  . GLU A 25  ? 0.1855 0.2315 0.2637 0.0770  0.0090  0.0000  53  GLU A CB  
122  C CG  . GLU A 25  ? 0.1791 0.2071 0.2544 0.0658  0.0044  0.0002  53  GLU A CG  
123  C CD  . GLU A 25  ? 0.1873 0.2119 0.2483 0.0627  0.0033  -0.0144 53  GLU A CD  
124  O OE1 . GLU A 25  ? 0.2054 0.2343 0.2619 0.0724  0.0050  -0.0287 53  GLU A OE1 
125  O OE2 . GLU A 25  ? 0.1811 0.2019 0.2356 0.0523  0.0012  -0.0110 53  GLU A OE2 
126  N N   . LYS A 26  ? 0.2368 0.2586 0.3640 0.0976  0.0059  0.0114  54  LYS A N   
127  C CA  . LYS A 26  ? 0.2663 0.2583 0.4165 0.1008  0.0010  0.0121  54  LYS A CA  
128  C C   . LYS A 26  ? 0.2673 0.2632 0.4400 0.1089  0.0008  0.0319  54  LYS A C   
129  O O   . LYS A 26  ? 0.2876 0.2586 0.4854 0.1156  -0.0026 0.0335  54  LYS A O   
130  C CB  . LYS A 26  ? 0.3128 0.2845 0.4662 0.1110  -0.0003 -0.0144 54  LYS A CB  
131  C CG  . LYS A 26  ? 0.3459 0.3066 0.4850 0.0997  -0.0045 -0.0285 54  LYS A CG  
132  C CD  . LYS A 26  ? 0.3930 0.3409 0.5278 0.1091  -0.0071 -0.0579 54  LYS A CD  
133  C CE  . LYS A 26  ? 0.4165 0.3932 0.5247 0.1157  -0.0001 -0.0688 54  LYS A CE  
134  N NZ  . LYS A 26  ? 0.4707 0.4389 0.5732 0.1288  -0.0019 -0.0985 54  LYS A NZ  
135  N N   . THR A 27  ? 0.2347 0.2602 0.4015 0.1082  0.0033  0.0470  55  THR A N   
136  C CA  . THR A 27  ? 0.2423 0.2776 0.4295 0.1151  0.0018  0.0691  55  THR A CA  
137  C C   . THR A 27  ? 0.2358 0.2685 0.4241 0.1028  -0.0024 0.0904  55  THR A C   
138  O O   . THR A 27  ? 0.2268 0.2585 0.3965 0.0888  -0.0029 0.0881  55  THR A O   
139  C CB  . THR A 27  ? 0.2285 0.3007 0.4116 0.1195  0.0045  0.0765  55  THR A CB  
140  O OG1 . THR A 27  ? 0.2025 0.2927 0.3615 0.1029  0.0032  0.0800  55  THR A OG1 
141  C CG2 . THR A 27  ? 0.2383 0.3183 0.4234 0.1338  0.0108  0.0588  55  THR A CG2 
142  N N   . LEU A 28  ? 0.2623 0.2987 0.4719 0.1091  -0.0048 0.1124  56  LEU A N   
143  C CA  . LEU A 28  ? 0.2781 0.3148 0.4932 0.1006  -0.0081 0.1373  56  LEU A CA  
144  C C   . LEU A 28  ? 0.2537 0.3168 0.4387 0.0868  -0.0082 0.1425  56  LEU A C   
145  O O   . LEU A 28  ? 0.2770 0.3365 0.4569 0.0773  -0.0085 0.1518  56  LEU A O   
146  C CB  . LEU A 28  ? 0.3056 0.3520 0.5462 0.1118  -0.0107 0.1630  56  LEU A CB  
147  C CG  . LEU A 28  ? 0.3484 0.3630 0.6252 0.1264  -0.0116 0.1620  56  LEU A CG  
148  C CD1 . LEU A 28  ? 0.3656 0.3903 0.6695 0.1362  -0.0147 0.1933  56  LEU A CD1 
149  C CD2 . LEU A 28  ? 0.3718 0.3496 0.6588 0.1181  -0.0135 0.1551  56  LEU A CD2 
150  N N   . GLY A 29  ? 0.2379 0.3270 0.4063 0.0860  -0.0082 0.1376  57  GLY A N   
151  C CA  . GLY A 29  ? 0.2297 0.3420 0.3712 0.0736  -0.0102 0.1408  57  GLY A CA  
152  C C   . GLY A 29  ? 0.2178 0.3212 0.3368 0.0636  -0.0077 0.1199  57  GLY A C   
153  O O   . GLY A 29  ? 0.2353 0.3513 0.3326 0.0538  -0.0091 0.1193  57  GLY A O   
154  N N   . ALA A 30  ? 0.2073 0.2883 0.3311 0.0664  -0.0044 0.1031  58  ALA A N   
155  C CA  . ALA A 30  ? 0.1914 0.2636 0.2964 0.0580  -0.0024 0.0854  58  ALA A CA  
156  C C   . ALA A 30  ? 0.1904 0.2389 0.3018 0.0549  -0.0019 0.0836  58  ALA A C   
157  O O   . ALA A 30  ? 0.1872 0.2379 0.3009 0.0504  -0.0025 0.0985  58  ALA A O   
158  C CB  . ALA A 30  ? 0.1908 0.2643 0.2942 0.0633  0.0001  0.0693  58  ALA A CB  
159  N N   . SER A 31  ? 0.1872 0.2166 0.3024 0.0568  -0.0013 0.0667  59  SER A N   
160  C CA  . SER A 31  ? 0.1845 0.1934 0.3080 0.0513  -0.0028 0.0645  59  SER A CA  
161  C C   . SER A 31  ? 0.2144 0.2014 0.3673 0.0581  -0.0059 0.0674  59  SER A C   
162  O O   . SER A 31  ? 0.2161 0.1860 0.3835 0.0521  -0.0087 0.0700  59  SER A O   
163  C CB  . SER A 31  ? 0.1765 0.1796 0.2857 0.0477  -0.0025 0.0442  59  SER A CB  
164  O OG  . SER A 31  ? 0.1546 0.1723 0.2423 0.0402  -0.0004 0.0446  59  SER A OG  
165  N N   . GLY A 32  ? 0.2266 0.2141 0.3918 0.0702  -0.0058 0.0691  60  GLY A N   
166  C CA  . GLY A 32  ? 0.2685 0.2322 0.4649 0.0791  -0.0091 0.0720  60  GLY A CA  
167  C C   . GLY A 32  ? 0.2937 0.2302 0.4972 0.0827  -0.0123 0.0457  60  GLY A C   
168  O O   . GLY A 32  ? 0.2767 0.2174 0.4576 0.0792  -0.0114 0.0253  60  GLY A O   
169  N N   . ARG A 33  ? 0.3444 0.2537 0.5792 0.0891  -0.0169 0.0472  61  ARG A N   
170  C CA  . ARG A 33  ? 0.4074 0.2881 0.6542 0.0988  -0.0213 0.0195  61  ARG A CA  
171  C C   . ARG A 33  ? 0.4102 0.2775 0.6488 0.0863  -0.0269 0.0008  61  ARG A C   
172  O O   . ARG A 33  ? 0.3808 0.2464 0.6268 0.0712  -0.0296 0.0165  61  ARG A O   
173  C CB  . ARG A 33  ? 0.4711 0.3202 0.7591 0.1059  -0.0269 0.0284  61  ARG A CB  
174  C CG  . ARG A 33  ? 0.5501 0.3780 0.8469 0.1250  -0.0285 -0.0013 61  ARG A CG  
175  C CD  . ARG A 33  ? 0.6200 0.4126 0.9614 0.1338  -0.0345 0.0075  61  ARG A CD  
176  N NE  . ARG A 33  ? 0.6549 0.4275 1.0170 0.1144  -0.0424 0.0226  61  ARG A NE  
177  C CZ  . ARG A 33  ? 0.7228 0.4608 1.1022 0.1072  -0.0526 0.0030  61  ARG A CZ  
178  N NH1 . ARG A 33  ? 0.7763 0.4915 1.1543 0.1197  -0.0572 -0.0352 61  ARG A NH1 
179  N NH2 . ARG A 33  ? 0.7426 0.4709 1.1420 0.0876  -0.0587 0.0219  61  ARG A NH2 
180  N N   . TYR A 34  ? 0.4461 0.3089 0.6701 0.0940  -0.0281 -0.0301 62  TYR A N   
181  C CA  . TYR A 34  ? 0.4891 0.3346 0.7102 0.0867  -0.0366 -0.0544 62  TYR A CA  
182  C C   . TYR A 34  ? 0.5646 0.3705 0.8253 0.0853  -0.0471 -0.0564 62  TYR A C   
183  O O   . TYR A 34  ? 0.5964 0.3822 0.8759 0.1011  -0.0481 -0.0650 62  TYR A O   
184  C CB  . TYR A 34  ? 0.5109 0.3641 0.7069 0.1000  -0.0350 -0.0866 62  TYR A CB  
185  C CG  . TYR A 34  ? 0.5310 0.3701 0.7208 0.0942  -0.0454 -0.1140 62  TYR A CG  
186  C CD1 . TYR A 34  ? 0.5063 0.3633 0.6753 0.0805  -0.0468 -0.1131 62  TYR A CD1 
187  C CD2 . TYR A 34  ? 0.5831 0.3912 0.7889 0.1029  -0.0548 -0.1416 62  TYR A CD2 
188  C CE1 . TYR A 34  ? 0.5308 0.3799 0.6937 0.0754  -0.0575 -0.1374 62  TYR A CE1 
189  C CE2 . TYR A 34  ? 0.6052 0.4022 0.8049 0.0966  -0.0667 -0.1686 62  TYR A CE2 
190  C CZ  . TYR A 34  ? 0.5750 0.3951 0.7523 0.0827  -0.0681 -0.1657 62  TYR A CZ  
191  O OH  . TYR A 34  ? 0.5918 0.4059 0.7629 0.0759  -0.0809 -0.1902 62  TYR A OH  
192  N N   . GLU A 35  ? 0.5959 0.3916 0.8724 0.0671  -0.0544 -0.0467 63  GLU A N   
193  C CA  . GLU A 35  ? 0.6529 0.4116 0.9739 0.0604  -0.0655 -0.0418 63  GLU A CA  
194  C C   . GLU A 35  ? 0.6662 0.3987 0.9905 0.0599  -0.0786 -0.0803 63  GLU A C   
195  O O   . GLU A 35  ? 0.7414 0.4366 1.0946 0.0680  -0.0873 -0.0959 63  GLU A O   
196  C CB  . GLU A 35  ? 0.6636 0.4332 1.0008 0.0415  -0.0646 -0.0062 63  GLU A CB  
197  C CG  . GLU A 35  ? 0.6915 0.4781 1.0335 0.0463  -0.0547 0.0289  63  GLU A CG  
198  C CD  . GLU A 35  ? 0.7168 0.5229 1.0684 0.0311  -0.0510 0.0657  63  GLU A CD  
199  O OE1 . GLU A 35  ? 0.7655 0.5655 1.1337 0.0156  -0.0569 0.0687  63  GLU A OE1 
200  O OE2 . GLU A 35  ? 0.7251 0.5550 1.0680 0.0351  -0.0423 0.0914  63  GLU A OE2 
201  N N   . GLY A 36  ? 0.6154 0.3668 0.9111 0.0522  -0.0807 -0.0963 64  GLY A N   
202  C CA  . GLY A 36  ? 0.6239 0.3606 0.9129 0.0521  -0.0936 -0.1351 64  GLY A CA  
203  C C   . GLY A 36  ? 0.5807 0.3437 0.8468 0.0377  -0.0964 -0.1374 64  GLY A C   
204  O O   . GLY A 36  ? 0.5339 0.3162 0.8026 0.0249  -0.0908 -0.1077 64  GLY A O   
205  N N   . LYS A 37  ? 0.5897 0.3534 0.8358 0.0407  -0.1054 -0.1717 65  LYS A N   
206  C CA  . LYS A 37  ? 0.5894 0.3793 0.8122 0.0300  -0.1099 -0.1778 65  LYS A CA  
207  C C   . LYS A 37  ? 0.5625 0.3440 0.8194 0.0074  -0.1217 -0.1636 65  LYS A C   
208  O O   . LYS A 37  ? 0.5877 0.3365 0.8804 0.0010  -0.1346 -0.1715 65  LYS A O   
209  C CB  . LYS A 37  ? 0.6594 0.4504 0.8551 0.0416  -0.1181 -0.2193 65  LYS A CB  
210  C CG  . LYS A 37  ? 0.7041 0.5152 0.8821 0.0310  -0.1294 -0.2330 65  LYS A CG  
211  C CD  . LYS A 37  ? 0.7765 0.5972 0.9188 0.0463  -0.1347 -0.2724 65  LYS A CD  
212  C CE  . LYS A 37  ? 0.7997 0.6489 0.9049 0.0656  -0.1156 -0.2688 65  LYS A CE  
213  N NZ  . LYS A 37  ? 0.8293 0.7100 0.8922 0.0746  -0.1173 -0.2913 65  LYS A NZ  
214  N N   . ILE A 38  ? 0.5033 0.3142 0.7521 -0.0041 -0.1174 -0.1427 66  ILE A N   
215  C CA  . ILE A 38  ? 0.4971 0.3084 0.7779 -0.0250 -0.1277 -0.1290 66  ILE A CA  
216  C C   . ILE A 38  ? 0.5152 0.3405 0.7797 -0.0300 -0.1415 -0.1544 66  ILE A C   
217  O O   . ILE A 38  ? 0.4578 0.3140 0.6844 -0.0235 -0.1339 -0.1556 66  ILE A O   
218  C CB  . ILE A 38  ? 0.4556 0.2926 0.7399 -0.0323 -0.1136 -0.0898 66  ILE A CB  
219  C CG1 . ILE A 38  ? 0.4483 0.2754 0.7472 -0.0274 -0.1017 -0.0642 66  ILE A CG1 
220  C CG2 . ILE A 38  ? 0.4445 0.2907 0.7600 -0.0521 -0.1227 -0.0757 66  ILE A CG2 
221  C CD1 . ILE A 38  ? 0.4120 0.2652 0.7133 -0.0338 -0.0889 -0.0283 66  ILE A CD1 
222  N N   . SER A 39  ? 0.5627 0.3673 0.8564 -0.0420 -0.1616 -0.1721 67  SER A N   
223  C CA  . SER A 39  ? 0.6056 0.4235 0.8892 -0.0492 -0.1791 -0.1973 67  SER A CA  
224  C C   . SER A 39  ? 0.6132 0.4476 0.9300 -0.0711 -0.1864 -0.1737 67  SER A C   
225  O O   . SER A 39  ? 0.6176 0.4401 0.9769 -0.0833 -0.1842 -0.1462 67  SER A O   
226  C CB  . SER A 39  ? 0.6641 0.4500 0.9556 -0.0473 -0.1991 -0.2384 67  SER A CB  
227  O OG  . SER A 39  ? 0.6863 0.4707 0.9370 -0.0242 -0.1921 -0.2649 67  SER A OG  
228  N N   . ARG A 40  ? 0.6212 0.4855 0.9204 -0.0753 -0.1946 -0.1825 68  ARG A N   
229  C CA  . ARG A 40  ? 0.6347 0.5236 0.9629 -0.0939 -0.2005 -0.1598 68  ARG A CA  
230  C C   . ARG A 40  ? 0.7050 0.5685 1.0897 -0.1144 -0.2196 -0.1607 68  ARG A C   
231  O O   . ARG A 40  ? 0.7242 0.5974 1.1476 -0.1287 -0.2160 -0.1279 68  ARG A O   
232  C CB  . ARG A 40  ? 0.6131 0.5370 0.9124 -0.0927 -0.2089 -0.1731 68  ARG A CB  
233  C CG  . ARG A 40  ? 0.5825 0.5393 0.9067 -0.1070 -0.2109 -0.1466 68  ARG A CG  
234  C CD  . ARG A 40  ? 0.5755 0.5680 0.8672 -0.1018 -0.2172 -0.1571 68  ARG A CD  
235  N NE  . ARG A 40  ? 0.5127 0.5245 0.7620 -0.0842 -0.1964 -0.1453 68  ARG A NE  
236  C CZ  . ARG A 40  ? 0.4774 0.5118 0.7291 -0.0826 -0.1806 -0.1146 68  ARG A CZ  
237  N NH1 . ARG A 40  ? 0.4435 0.4914 0.6585 -0.0675 -0.1646 -0.1072 68  ARG A NH1 
238  N NH2 . ARG A 40  ? 0.4779 0.5219 0.7707 -0.0959 -0.1805 -0.0910 68  ARG A NH2 
239  N N   . ASN A 41  ? 0.7998 0.6317 1.1914 -0.1157 -0.2393 -0.1966 69  ASN A N   
240  C CA  . ASN A 41  ? 0.8998 0.7068 1.3489 -0.1382 -0.2623 -0.2008 69  ASN A CA  
241  C C   . ASN A 41  ? 0.9005 0.6783 1.3929 -0.1436 -0.2525 -0.1707 69  ASN A C   
242  O O   . ASN A 41  ? 0.9204 0.6811 1.4686 -0.1644 -0.2671 -0.1607 69  ASN A O   
243  C CB  . ASN A 41  ? 0.9864 0.7639 1.4299 -0.1371 -0.2875 -0.2520 69  ASN A CB  
244  C CG  . ASN A 41  ? 1.0417 0.7835 1.4607 -0.1150 -0.2799 -0.2764 69  ASN A CG  
245  O OD1 . ASN A 41  ? 1.0796 0.7839 1.5317 -0.1154 -0.2764 -0.2663 69  ASN A OD1 
246  N ND2 . ASN A 41  ? 1.0642 0.8206 1.4267 -0.0946 -0.2760 -0.3055 69  ASN A ND2 
247  N N   . SER A 42  ? 0.8763 0.6500 1.3457 -0.1261 -0.2295 -0.1555 70  SER A N   
248  C CA  . SER A 42  ? 0.8879 0.6244 1.3898 -0.1247 -0.2238 -0.1397 70  SER A CA  
249  C C   . SER A 42  ? 0.8446 0.5974 1.3862 -0.1389 -0.2123 -0.0883 70  SER A C   
250  O O   . SER A 42  ? 0.7671 0.5623 1.3060 -0.1470 -0.2060 -0.0666 70  SER A O   
251  C CB  . SER A 42  ? 0.8654 0.5918 1.3273 -0.0993 -0.2072 -0.1486 70  SER A CB  
252  O OG  . SER A 42  ? 0.8646 0.6207 1.3075 -0.0923 -0.1831 -0.1133 70  SER A OG  
253  N N   . GLU A 43  ? 0.8535 0.5732 1.4336 -0.1415 -0.2111 -0.0706 71  GLU A N   
254  C CA  . GLU A 43  ? 0.8043 0.5357 1.4236 -0.1522 -0.1989 -0.0191 71  GLU A CA  
255  C C   . GLU A 43  ? 0.7225 0.4858 1.2988 -0.1349 -0.1717 0.0040  71  GLU A C   
256  O O   . GLU A 43  ? 0.7173 0.5131 1.3055 -0.1419 -0.1589 0.0423  71  GLU A O   
257  C CB  . GLU A 43  ? 0.8185 0.5029 1.4880 -0.1572 -0.2065 -0.0087 71  GLU A CB  
258  C CG  . GLU A 43  ? 0.8502 0.5036 1.5763 -0.1800 -0.2338 -0.0218 71  GLU A CG  
259  C CD  . GLU A 43  ? 0.8771 0.4793 1.6583 -0.1852 -0.2423 -0.0101 71  GLU A CD  
260  O OE1 . GLU A 43  ? 0.8697 0.4475 1.6348 -0.1648 -0.2326 -0.0136 71  GLU A OE1 
261  O OE2 . GLU A 43  ? 0.9008 0.4884 1.7438 -0.2097 -0.2587 0.0043  71  GLU A OE2 
262  N N   . ARG A 44  ? 0.6901 0.4459 1.2195 -0.1132 -0.1638 -0.0188 72  ARG A N   
263  C CA  . ARG A 44  ? 0.6350 0.4188 1.1221 -0.0969 -0.1405 -0.0016 72  ARG A CA  
264  C C   . ARG A 44  ? 0.5758 0.4029 1.0261 -0.0959 -0.1326 -0.0024 72  ARG A C   
265  O O   . ARG A 44  ? 0.4956 0.3468 0.9164 -0.0857 -0.1147 0.0138  72  ARG A O   
266  C CB  . ARG A 44  ? 0.6601 0.4239 1.1127 -0.0751 -0.1362 -0.0270 72  ARG A CB  
267  C CG  . ARG A 44  ? 0.7093 0.4306 1.1936 -0.0701 -0.1410 -0.0266 72  ARG A CG  
268  C CD  . ARG A 44  ? 0.7164 0.4291 1.1654 -0.0459 -0.1320 -0.0449 72  ARG A CD  
269  N NE  . ARG A 44  ? 0.7140 0.4603 1.1297 -0.0357 -0.1117 -0.0216 72  ARG A NE  
270  C CZ  . ARG A 44  ? 0.7006 0.4571 1.0757 -0.0172 -0.1017 -0.0355 72  ARG A CZ  
271  N NH1 . ARG A 44  ? 0.7001 0.4861 1.0509 -0.0116 -0.0858 -0.0130 72  ARG A NH1 
272  N NH2 . ARG A 44  ? 0.7419 0.4816 1.1004 -0.0041 -0.1074 -0.0718 72  ARG A NH2 
273  N N   . PHE A 45  ? 0.5624 0.3987 1.0134 -0.1051 -0.1464 -0.0217 73  PHE A N   
274  C CA  . PHE A 45  ? 0.5106 0.3870 0.9295 -0.1027 -0.1400 -0.0219 73  PHE A CA  
275  C C   . PHE A 45  ? 0.4735 0.3821 0.9078 -0.1089 -0.1250 0.0185  73  PHE A C   
276  O O   . PHE A 45  ? 0.4214 0.3573 0.8221 -0.0989 -0.1105 0.0254  73  PHE A O   
277  C CB  . PHE A 45  ? 0.5232 0.4038 0.9493 -0.1133 -0.1607 -0.0469 73  PHE A CB  
278  C CG  . PHE A 45  ? 0.4917 0.4127 0.8923 -0.1116 -0.1571 -0.0456 73  PHE A CG  
279  C CD1 . PHE A 45  ? 0.4747 0.4081 0.8237 -0.0945 -0.1481 -0.0595 73  PHE A CD1 
280  C CD2 . PHE A 45  ? 0.4845 0.4316 0.9164 -0.1271 -0.1635 -0.0294 73  PHE A CD2 
281  C CE1 . PHE A 45  ? 0.4545 0.4225 0.7840 -0.0926 -0.1457 -0.0564 73  PHE A CE1 
282  C CE2 . PHE A 45  ? 0.4683 0.4519 0.8798 -0.1240 -0.1611 -0.0281 73  PHE A CE2 
283  C CZ  . PHE A 45  ? 0.4483 0.4406 0.8087 -0.1065 -0.1525 -0.0415 73  PHE A CZ  
284  N N   . LYS A 46  ? 0.4830 0.3878 0.9679 -0.1245 -0.1287 0.0440  74  LYS A N   
285  C CA  . LYS A 46  ? 0.4717 0.4114 0.9791 -0.1321 -0.1153 0.0847  74  LYS A CA  
286  C C   . LYS A 46  ? 0.4273 0.3805 0.9031 -0.1163 -0.0925 0.1041  74  LYS A C   
287  O O   . LYS A 46  ? 0.4112 0.4010 0.8853 -0.1156 -0.0776 0.1306  74  LYS A O   
288  C CB  . LYS A 46  ? 0.5438 0.4727 1.1149 -0.1520 -0.1246 0.1091  74  LYS A CB  
289  C CG  . LYS A 46  ? 0.5770 0.4837 1.1649 -0.1491 -0.1173 0.1316  74  LYS A CG  
290  C CD  . LYS A 46  ? 0.6320 0.5383 1.2846 -0.1690 -0.1221 0.1674  74  LYS A CD  
291  C CE  . LYS A 46  ? 0.6719 0.5578 1.3384 -0.1639 -0.1144 0.1921  74  LYS A CE  
292  N NZ  . LYS A 46  ? 0.7220 0.5809 1.4565 -0.1835 -0.1288 0.2115  74  LYS A NZ  
293  N N   . GLU A 47  ? 0.3979 0.3257 0.8475 -0.1029 -0.0899 0.0899  75  GLU A N   
294  C CA  . GLU A 47  ? 0.3824 0.3230 0.7996 -0.0881 -0.0711 0.1043  75  GLU A CA  
295  C C   . GLU A 47  ? 0.3349 0.3018 0.7062 -0.0774 -0.0614 0.0930  75  GLU A C   
296  O O   . GLU A 47  ? 0.3156 0.3004 0.6616 -0.0677 -0.0463 0.1058  75  GLU A O   
297  C CB  . GLU A 47  ? 0.4147 0.3228 0.8199 -0.0768 -0.0728 0.0906  75  GLU A CB  
298  C CG  . GLU A 47  ? 0.4687 0.3433 0.9211 -0.0852 -0.0838 0.0989  75  GLU A CG  
299  C CD  . GLU A 47  ? 0.5109 0.3518 0.9553 -0.0717 -0.0862 0.0832  75  GLU A CD  
300  O OE1 . GLU A 47  ? 0.5334 0.3822 0.9354 -0.0562 -0.0774 0.0705  75  GLU A OE1 
301  O OE2 . GLU A 47  ? 0.5425 0.3497 1.0258 -0.0766 -0.0972 0.0839  75  GLU A OE2 
302  N N   . LEU A 48  ? 0.3139 0.2797 0.6722 -0.0778 -0.0711 0.0668  76  LEU A N   
303  C CA  . LEU A 48  ? 0.2840 0.2707 0.6011 -0.0672 -0.0630 0.0568  76  LEU A CA  
304  C C   . LEU A 48  ? 0.2624 0.2829 0.5924 -0.0731 -0.0581 0.0741  76  LEU A C   
305  O O   . LEU A 48  ? 0.2544 0.2802 0.6221 -0.0868 -0.0675 0.0818  76  LEU A O   
306  C CB  . LEU A 48  ? 0.2932 0.2666 0.5892 -0.0631 -0.0750 0.0236  76  LEU A CB  
307  C CG  . LEU A 48  ? 0.3076 0.2506 0.5924 -0.0553 -0.0791 0.0045  76  LEU A CG  
308  C CD1 . LEU A 48  ? 0.3287 0.2679 0.5875 -0.0495 -0.0886 -0.0268 76  LEU A CD1 
309  C CD2 . LEU A 48  ? 0.3063 0.2507 0.5677 -0.0433 -0.0640 0.0148  76  LEU A CD2 
310  N N   . THR A 49  ? 0.2418 0.2836 0.5427 -0.0624 -0.0440 0.0795  77  THR A N   
311  C CA  . THR A 49  ? 0.2440 0.3205 0.5516 -0.0623 -0.0348 0.0963  77  THR A CA  
312  C C   . THR A 49  ? 0.2167 0.3011 0.4902 -0.0513 -0.0325 0.0797  77  THR A C   
313  O O   . THR A 49  ? 0.1897 0.2600 0.4301 -0.0418 -0.0296 0.0664  77  THR A O   
314  C CB  . THR A 49  ? 0.2591 0.3521 0.5675 -0.0583 -0.0181 0.1222  77  THR A CB  
315  O OG1 . THR A 49  ? 0.2675 0.3953 0.5763 -0.0539 -0.0064 0.1356  77  THR A OG1 
316  C CG2 . THR A 49  ? 0.2701 0.3514 0.5416 -0.0462 -0.0096 0.1166  77  THR A CG2 
317  N N   . PRO A 50  ? 0.2057 0.3128 0.4896 -0.0528 -0.0349 0.0816  78  PRO A N   
318  C CA  . PRO A 50  ? 0.1974 0.3099 0.4530 -0.0425 -0.0342 0.0681  78  PRO A CA  
319  C C   . PRO A 50  ? 0.1854 0.3124 0.4207 -0.0293 -0.0167 0.0769  78  PRO A C   
320  O O   . PRO A 50  ? 0.2075 0.3575 0.4592 -0.0284 -0.0072 0.0940  78  PRO A O   
321  C CB  . PRO A 50  ? 0.2065 0.3388 0.4879 -0.0499 -0.0457 0.0687  78  PRO A CB  
322  C CG  . PRO A 50  ? 0.2119 0.3612 0.5353 -0.0612 -0.0440 0.0906  78  PRO A CG  
323  C CD  . PRO A 50  ? 0.2133 0.3408 0.5403 -0.0654 -0.0408 0.0963  78  PRO A CD  
324  N N   . ASN A 51  ? 0.1696 0.2855 0.3717 -0.0191 -0.0140 0.0642  79  ASN A N   
325  C CA  . ASN A 51  ? 0.1636 0.2875 0.3451 -0.0064 0.0000  0.0673  79  ASN A CA  
326  C C   . ASN A 51  ? 0.1510 0.2887 0.3336 0.0000  -0.0013 0.0652  79  ASN A C   
327  O O   . ASN A 51  ? 0.1486 0.2757 0.3167 0.0018  -0.0091 0.0539  79  ASN A O   
328  C CB  . ASN A 51  ? 0.1641 0.2667 0.3144 -0.0011 0.0029  0.0571  79  ASN A CB  
329  C CG  . ASN A 51  ? 0.1721 0.2794 0.3028 0.0099  0.0152  0.0581  79  ASN A CG  
330  O OD1 . ASN A 51  ? 0.1940 0.3144 0.3275 0.0172  0.0198  0.0598  79  ASN A OD1 
331  N ND2 . ASN A 51  ? 0.1675 0.2658 0.2810 0.0117  0.0203  0.0572  79  ASN A ND2 
332  N N   . TYR A 52  ? 0.1461 0.3090 0.3455 0.0050  0.0069  0.0774  80  TYR A N   
333  C CA  . TYR A 52  ? 0.1511 0.3286 0.3544 0.0143  0.0072  0.0776  80  TYR A CA  
334  C C   . TYR A 52  ? 0.1398 0.3193 0.3265 0.0304  0.0224  0.0773  80  TYR A C   
335  O O   . TYR A 52  ? 0.1460 0.3423 0.3428 0.0411  0.0270  0.0813  80  TYR A O   
336  C CB  . TYR A 52  ? 0.1630 0.3695 0.4035 0.0079  0.0013  0.0894  80  TYR A CB  
337  C CG  . TYR A 52  ? 0.1906 0.3921 0.4410 -0.0047 -0.0183 0.0821  80  TYR A CG  
338  C CD1 . TYR A 52  ? 0.2122 0.4151 0.4541 -0.0005 -0.0280 0.0748  80  TYR A CD1 
339  C CD2 . TYR A 52  ? 0.2154 0.4099 0.4825 -0.0202 -0.0280 0.0814  80  TYR A CD2 
340  C CE1 . TYR A 52  ? 0.2219 0.4239 0.4682 -0.0109 -0.0466 0.0658  80  TYR A CE1 
341  C CE2 . TYR A 52  ? 0.2337 0.4209 0.5058 -0.0306 -0.0471 0.0693  80  TYR A CE2 
342  C CZ  . TYR A 52  ? 0.2397 0.4325 0.4991 -0.0257 -0.0563 0.0606  80  TYR A CZ  
343  O OH  . TYR A 52  ? 0.2746 0.4635 0.5343 -0.0347 -0.0751 0.0468  80  TYR A OH  
344  N N   . ASN A 53  ? 0.1343 0.2953 0.2954 0.0333  0.0284  0.0702  81  ASN A N   
345  C CA  . ASN A 53  ? 0.1422 0.2973 0.2823 0.0478  0.0393  0.0635  81  ASN A CA  
346  C C   . ASN A 53  ? 0.1543 0.3017 0.2927 0.0562  0.0353  0.0578  81  ASN A C   
347  O O   . ASN A 53  ? 0.1484 0.2776 0.2768 0.0512  0.0254  0.0519  81  ASN A O   
348  C CB  . ASN A 53  ? 0.1450 0.2774 0.2575 0.0460  0.0402  0.0541  81  ASN A CB  
349  C CG  . ASN A 53  ? 0.1524 0.2795 0.2440 0.0587  0.0499  0.0453  81  ASN A CG  
350  O OD1 . ASN A 53  ? 0.1653 0.2943 0.2583 0.0708  0.0544  0.0412  81  ASN A OD1 
351  N ND2 . ASN A 53  ? 0.1608 0.2815 0.2336 0.0565  0.0525  0.0418  81  ASN A ND2 
352  N N   . PRO A 54  ? 0.1616 0.3232 0.3096 0.0701  0.0433  0.0604  82  PRO A N   
353  C CA  . PRO A 54  ? 0.1666 0.3209 0.3178 0.0791  0.0391  0.0583  82  PRO A CA  
354  C C   . PRO A 54  ? 0.1758 0.2969 0.3017 0.0830  0.0381  0.0460  82  PRO A C   
355  O O   . PRO A 54  ? 0.1687 0.2794 0.2968 0.0868  0.0321  0.0469  82  PRO A O   
356  C CB  . PRO A 54  ? 0.1825 0.3611 0.3521 0.0952  0.0504  0.0639  82  PRO A CB  
357  C CG  . PRO A 54  ? 0.1862 0.3754 0.3471 0.0982  0.0635  0.0623  82  PRO A CG  
358  C CD  . PRO A 54  ? 0.1699 0.3581 0.3282 0.0796  0.0575  0.0669  82  PRO A CD  
359  N N   . ASP A 55  ? 0.1760 0.2827 0.2807 0.0813  0.0428  0.0367  83  ASP A N   
360  C CA  . ASP A 55  ? 0.2061 0.2825 0.2903 0.0825  0.0404  0.0253  83  ASP A CA  
361  C C   . ASP A 55  ? 0.1906 0.2536 0.2632 0.0680  0.0310  0.0248  83  ASP A C   
362  O O   . ASP A 55  ? 0.2052 0.2485 0.2611 0.0657  0.0300  0.0166  83  ASP A O   
363  C CB  . ASP A 55  ? 0.2367 0.3076 0.3050 0.0913  0.0499  0.0133  83  ASP A CB  
364  C CG  . ASP A 55  ? 0.2623 0.3429 0.3413 0.1094  0.0591  0.0109  83  ASP A CG  
365  O OD1 . ASP A 55  ? 0.2816 0.3541 0.3740 0.1164  0.0558  0.0133  83  ASP A OD1 
366  O OD2 . ASP A 55  ? 0.2645 0.3637 0.3397 0.1177  0.0700  0.0081  83  ASP A OD2 
367  N N   . ILE A 56  ? 0.1704 0.2456 0.2520 0.0584  0.0247  0.0320  84  ILE A N   
368  C CA  . ILE A 56  ? 0.1627 0.2277 0.2344 0.0474  0.0159  0.0303  84  ILE A CA  
369  C C   . ILE A 56  ? 0.1612 0.2341 0.2423 0.0457  0.0067  0.0359  84  ILE A C   
370  O O   . ILE A 56  ? 0.1589 0.2505 0.2572 0.0450  0.0042  0.0413  84  ILE A O   
371  C CB  . ILE A 56  ? 0.1573 0.2259 0.2271 0.0381  0.0154  0.0297  84  ILE A CB  
372  C CG1 . ILE A 56  ? 0.1536 0.2212 0.2141 0.0404  0.0242  0.0275  84  ILE A CG1 
373  C CG2 . ILE A 56  ? 0.1543 0.2119 0.2133 0.0308  0.0076  0.0257  84  ILE A CG2 
374  C CD1 . ILE A 56  ? 0.1486 0.2227 0.2132 0.0324  0.0241  0.0322  84  ILE A CD1 
375  N N   . ILE A 57  ? 0.1602 0.2220 0.2308 0.0449  0.0019  0.0358  85  ILE A N   
376  C CA  . ILE A 57  ? 0.1710 0.2436 0.2452 0.0439  -0.0072 0.0420  85  ILE A CA  
377  C C   . ILE A 57  ? 0.1558 0.2329 0.2217 0.0345  -0.0138 0.0363  85  ILE A C   
378  O O   . ILE A 57  ? 0.1720 0.2370 0.2246 0.0308  -0.0114 0.0306  85  ILE A O   
379  C CB  . ILE A 57  ? 0.1940 0.2549 0.2612 0.0477  -0.0082 0.0477  85  ILE A CB  
380  C CG1 . ILE A 57  ? 0.2233 0.2735 0.3009 0.0583  -0.0021 0.0503  85  ILE A CG1 
381  C CG2 . ILE A 57  ? 0.2003 0.2777 0.2675 0.0469  -0.0176 0.0565  85  ILE A CG2 
382  C CD1 . ILE A 57  ? 0.2434 0.3121 0.3409 0.0665  -0.0015 0.0561  85  ILE A CD1 
383  N N   . PHE A 58  ? 0.1521 0.2460 0.2271 0.0312  -0.0221 0.0365  86  PHE A N   
384  C CA  . PHE A 58  ? 0.1466 0.2431 0.2139 0.0236  -0.0301 0.0272  86  PHE A CA  
385  C C   . PHE A 58  ? 0.1492 0.2600 0.2081 0.0255  -0.0392 0.0295  86  PHE A C   
386  O O   . PHE A 58  ? 0.1424 0.2704 0.2129 0.0278  -0.0454 0.0366  86  PHE A O   
387  C CB  . PHE A 58  ? 0.1443 0.2469 0.2291 0.0165  -0.0347 0.0227  86  PHE A CB  
388  C CG  . PHE A 58  ? 0.1431 0.2338 0.2326 0.0141  -0.0257 0.0224  86  PHE A CG  
389  C CD1 . PHE A 58  ? 0.1454 0.2233 0.2280 0.0095  -0.0263 0.0146  86  PHE A CD1 
390  C CD2 . PHE A 58  ? 0.1395 0.2339 0.2391 0.0186  -0.0162 0.0307  86  PHE A CD2 
391  C CE1 . PHE A 58  ? 0.1453 0.2155 0.2330 0.0076  -0.0191 0.0174  86  PHE A CE1 
392  C CE2 . PHE A 58  ? 0.1419 0.2309 0.2437 0.0168  -0.0083 0.0322  86  PHE A CE2 
393  C CZ  . PHE A 58  ? 0.1428 0.2199 0.2386 0.0110  -0.0100 0.0269  86  PHE A CZ  
394  N N   . LYS A 59  ? 0.1599 0.2677 0.1991 0.0254  -0.0398 0.0254  87  LYS A N   
395  C CA  . LYS A 59  ? 0.1705 0.2964 0.1974 0.0282  -0.0470 0.0295  87  LYS A CA  
396  C C   . LYS A 59  ? 0.1794 0.3238 0.2091 0.0249  -0.0603 0.0201  87  LYS A C   
397  O O   . LYS A 59  ? 0.1801 0.3466 0.2061 0.0280  -0.0684 0.0272  87  LYS A O   
398  C CB  . LYS A 59  ? 0.1792 0.3014 0.1852 0.0288  -0.0430 0.0257  87  LYS A CB  
399  C CG  . LYS A 59  ? 0.2032 0.3481 0.1930 0.0328  -0.0477 0.0328  87  LYS A CG  
400  C CD  . LYS A 59  ? 0.2055 0.3506 0.1776 0.0340  -0.0411 0.0318  87  LYS A CD  
401  C CE  . LYS A 59  ? 0.2277 0.4017 0.1826 0.0388  -0.0444 0.0415  87  LYS A CE  
402  N NZ  . LYS A 59  ? 0.2395 0.4190 0.1799 0.0405  -0.0363 0.0430  87  LYS A NZ  
403  N N   . ASP A 60  ? 0.1889 0.3253 0.2249 0.0186  -0.0638 0.0052  88  ASP A N   
404  C CA  . ASP A 60  ? 0.2253 0.3751 0.2690 0.0129  -0.0787 -0.0067 88  ASP A CA  
405  C C   . ASP A 60  ? 0.2586 0.4276 0.2776 0.0167  -0.0881 -0.0145 88  ASP A C   
406  O O   . ASP A 60  ? 0.2528 0.4446 0.2743 0.0159  -0.1005 -0.0139 88  ASP A O   
407  C CB  . ASP A 60  ? 0.2324 0.3975 0.3019 0.0104  -0.0846 0.0035  88  ASP A CB  
408  C CG  . ASP A 60  ? 0.2579 0.4317 0.3455 0.0004  -0.0997 -0.0083 88  ASP A CG  
409  O OD1 . ASP A 60  ? 0.2726 0.4336 0.3546 -0.0047 -0.1053 -0.0268 88  ASP A OD1 
410  O OD2 . ASP A 60  ? 0.2678 0.4618 0.3777 -0.0021 -0.1069 0.0007  88  ASP A OD2 
411  N N   . GLU A 61  ? 0.2980 0.4602 0.2950 0.0206  -0.0824 -0.0227 89  GLU A N   
412  C CA  . GLU A 61  ? 0.3525 0.5358 0.3211 0.0267  -0.0872 -0.0300 89  GLU A CA  
413  C C   . GLU A 61  ? 0.3906 0.5880 0.3573 0.0233  -0.1051 -0.0499 89  GLU A C   
414  O O   . GLU A 61  ? 0.4178 0.6439 0.3678 0.0275  -0.1134 -0.0482 89  GLU A O   
415  C CB  . GLU A 61  ? 0.3846 0.5578 0.3355 0.0314  -0.0773 -0.0387 89  GLU A CB  
416  C CG  . GLU A 61  ? 0.3961 0.5631 0.3448 0.0343  -0.0622 -0.0184 89  GLU A CG  
417  C CD  . GLU A 61  ? 0.4322 0.5932 0.3682 0.0383  -0.0521 -0.0242 89  GLU A CD  
418  O OE1 . GLU A 61  ? 0.4569 0.6169 0.3917 0.0394  -0.0415 -0.0073 89  GLU A OE1 
419  O OE2 . GLU A 61  ? 0.4592 0.6146 0.3901 0.0400  -0.0551 -0.0453 89  GLU A OE2 
420  N N   . GLU A 62  ? 0.4085 0.5873 0.3936 0.0154  -0.1118 -0.0665 90  GLU A N   
421  C CA  . GLU A 62  ? 0.4519 0.6384 0.4380 0.0104  -0.1312 -0.0905 90  GLU A CA  
422  C C   . GLU A 62  ? 0.4328 0.6341 0.4450 0.0014  -0.1443 -0.0823 90  GLU A C   
423  O O   . GLU A 62  ? 0.4415 0.6542 0.4550 -0.0040 -0.1633 -0.1012 90  GLU A O   
424  C CB  . GLU A 62  ? 0.4970 0.6530 0.4928 0.0062  -0.1328 -0.1130 90  GLU A CB  
425  C CG  . GLU A 62  ? 0.5497 0.6957 0.5208 0.0168  -0.1218 -0.1238 90  GLU A CG  
426  C CD  . GLU A 62  ? 0.6421 0.8138 0.5765 0.0277  -0.1264 -0.1393 90  GLU A CD  
427  O OE1 . GLU A 62  ? 0.6917 0.8843 0.6186 0.0258  -0.1432 -0.1514 90  GLU A OE1 
428  O OE2 . GLU A 62  ? 0.7387 0.9134 0.6517 0.0384  -0.1129 -0.1384 90  GLU A OE2 
429  N N   . ASN A 63  ? 0.3963 0.6006 0.4278 0.0008  -0.1356 -0.0568 91  ASN A N   
430  C CA  . ASN A 63  ? 0.3999 0.6220 0.4608 -0.0057 -0.1452 -0.0450 91  ASN A CA  
431  C C   . ASN A 63  ? 0.3945 0.6041 0.4857 -0.0195 -0.1559 -0.0583 91  ASN A C   
432  O O   . ASN A 63  ? 0.4255 0.6553 0.5349 -0.0275 -0.1729 -0.0611 91  ASN A O   
433  C CB  . ASN A 63  ? 0.4557 0.7151 0.5050 -0.0028 -0.1605 -0.0426 91  ASN A CB  
434  C CG  . ASN A 63  ? 0.4892 0.7633 0.5174 0.0097  -0.1503 -0.0215 91  ASN A CG  
435  O OD1 . ASN A 63  ? 0.5029 0.7636 0.5390 0.0145  -0.1340 -0.0024 91  ASN A OD1 
436  N ND2 . ASN A 63  ? 0.5623 0.8639 0.5631 0.0151  -0.1598 -0.0249 91  ASN A ND2 
437  N N   . THR A 64  ? 0.3552 0.5338 0.4535 -0.0228 -0.1474 -0.0654 92  THR A N   
438  C CA  . THR A 64  ? 0.3505 0.5127 0.4815 -0.0364 -0.1558 -0.0743 92  THR A CA  
439  C C   . THR A 64  ? 0.3092 0.4601 0.4663 -0.0390 -0.1398 -0.0527 92  THR A C   
440  O O   . THR A 64  ? 0.3125 0.4571 0.5024 -0.0507 -0.1449 -0.0509 92  THR A O   
441  C CB  . THR A 64  ? 0.3684 0.5032 0.4870 -0.0369 -0.1603 -0.1008 92  THR A CB  
442  O OG1 . THR A 64  ? 0.3581 0.4767 0.4563 -0.0262 -0.1409 -0.0950 92  THR A OG1 
443  C CG2 . THR A 64  ? 0.4046 0.5523 0.4970 -0.0337 -0.1773 -0.1268 92  THR A CG2 
444  N N   . GLY A 65  ? 0.2785 0.4272 0.4212 -0.0286 -0.1214 -0.0373 93  GLY A N   
445  C CA  . GLY A 65  ? 0.2490 0.3861 0.4083 -0.0288 -0.1051 -0.0208 93  GLY A CA  
446  C C   . GLY A 65  ? 0.2461 0.3542 0.4032 -0.0310 -0.0999 -0.0294 93  GLY A C   
447  O O   . GLY A 65  ? 0.2240 0.3239 0.3950 -0.0322 -0.0879 -0.0160 93  GLY A O   
448  N N   . ALA A 66  ? 0.2580 0.3527 0.3965 -0.0295 -0.1072 -0.0502 94  ALA A N   
449  C CA  . ALA A 66  ? 0.2735 0.3399 0.4137 -0.0303 -0.1037 -0.0591 94  ALA A CA  
450  C C   . ALA A 66  ? 0.2447 0.3033 0.3695 -0.0216 -0.0848 -0.0463 94  ALA A C   
451  O O   . ALA A 66  ? 0.2639 0.3058 0.4010 -0.0238 -0.0789 -0.0416 94  ALA A O   
452  C CB  . ALA A 66  ? 0.3012 0.3570 0.4232 -0.0270 -0.1144 -0.0861 94  ALA A CB  
453  N N   . ASP A 67  ? 0.2260 0.2964 0.3272 -0.0128 -0.0767 -0.0400 95  ASP A N   
454  C CA  . ASP A 67  ? 0.2196 0.2827 0.3068 -0.0058 -0.0609 -0.0297 95  ASP A CA  
455  C C   . ASP A 67  ? 0.2043 0.2663 0.3105 -0.0088 -0.0516 -0.0129 95  ASP A C   
456  O O   . ASP A 67  ? 0.2048 0.2577 0.3027 -0.0051 -0.0408 -0.0074 95  ASP A O   
457  C CB  . ASP A 67  ? 0.2205 0.2950 0.2838 0.0022  -0.0559 -0.0251 95  ASP A CB  
458  C CG  . ASP A 67  ? 0.2283 0.3213 0.2971 0.0033  -0.0579 -0.0140 95  ASP A CG  
459  O OD1 . ASP A 67  ? 0.2324 0.3335 0.3244 -0.0021 -0.0629 -0.0096 95  ASP A OD1 
460  O OD2 . ASP A 67  ? 0.2423 0.3423 0.2944 0.0098  -0.0545 -0.0083 95  ASP A OD2 
461  N N   . ARG A 68  ? 0.2079 0.2809 0.3394 -0.0154 -0.0559 -0.0053 96  ARG A N   
462  C CA  . ARG A 68  ? 0.2039 0.2821 0.3528 -0.0167 -0.0451 0.0119  96  ARG A CA  
463  C C   . ARG A 68  ? 0.2027 0.2686 0.3709 -0.0240 -0.0447 0.0159  96  ARG A C   
464  O O   . ARG A 68  ? 0.1919 0.2633 0.3682 -0.0234 -0.0336 0.0314  96  ARG A O   
465  C CB  . ARG A 68  ? 0.2186 0.3201 0.3883 -0.0191 -0.0483 0.0213  96  ARG A CB  
466  C CG  . ARG A 68  ? 0.2227 0.3345 0.3751 -0.0084 -0.0431 0.0244  96  ARG A CG  
467  C CD  . ARG A 68  ? 0.2378 0.3735 0.4106 -0.0085 -0.0468 0.0332  96  ARG A CD  
468  N NE  . ARG A 68  ? 0.2435 0.3869 0.4029 0.0021  -0.0441 0.0364  96  ARG A NE  
469  C CZ  . ARG A 68  ? 0.2276 0.3718 0.3832 0.0125  -0.0314 0.0446  96  ARG A CZ  
470  N NH1 . ARG A 68  ? 0.1977 0.3381 0.3561 0.0149  -0.0187 0.0494  96  ARG A NH1 
471  N NH2 . ARG A 68  ? 0.2230 0.3733 0.3728 0.0212  -0.0323 0.0483  96  ARG A NH2 
472  N N   . LEU A 69  ? 0.2046 0.2558 0.3810 -0.0301 -0.0565 0.0032  97  LEU A N   
473  C CA  . LEU A 69  ? 0.2127 0.2496 0.4153 -0.0384 -0.0591 0.0080  97  LEU A CA  
474  C C   . LEU A 69  ? 0.2126 0.2313 0.3993 -0.0315 -0.0512 0.0068  97  LEU A C   
475  O O   . LEU A 69  ? 0.2115 0.2192 0.3760 -0.0248 -0.0538 -0.0100 97  LEU A O   
476  C CB  . LEU A 69  ? 0.2453 0.2718 0.4663 -0.0475 -0.0775 -0.0081 97  LEU A CB  
477  C CG  . LEU A 69  ? 0.2566 0.3036 0.5043 -0.0580 -0.0872 -0.0026 97  LEU A CG  
478  C CD1 . LEU A 69  ? 0.2887 0.3255 0.5456 -0.0658 -0.1081 -0.0254 97  LEU A CD1 
479  C CD2 . LEU A 69  ? 0.2662 0.3224 0.5519 -0.0678 -0.0822 0.0222  97  LEU A CD2 
480  N N   . MET A 70  ? 0.2031 0.2228 0.4009 -0.0325 -0.0417 0.0254  98  MET A N   
481  C CA  . MET A 70  ? 0.1909 0.2000 0.3720 -0.0250 -0.0333 0.0278  98  MET A CA  
482  C C   . MET A 70  ? 0.1894 0.1978 0.3953 -0.0299 -0.0289 0.0493  98  MET A C   
483  O O   . MET A 70  ? 0.1751 0.1956 0.4072 -0.0382 -0.0290 0.0644  98  MET A O   
484  C CB  . MET A 70  ? 0.1786 0.1996 0.3288 -0.0158 -0.0226 0.0290  98  MET A CB  
485  C CG  . MET A 70  ? 0.1796 0.2217 0.3322 -0.0154 -0.0128 0.0451  98  MET A CG  
486  S SD  . MET A 70  ? 0.1732 0.2225 0.2921 -0.0050 -0.0042 0.0399  98  MET A SD  
487  C CE  . MET A 70  ? 0.1683 0.2172 0.2814 -0.0046 -0.0137 0.0252  98  MET A CE  
488  N N   . THR A 71  ? 0.1902 0.1873 0.3896 -0.0248 -0.0250 0.0526  99  THR A N   
489  C CA  . THR A 71  ? 0.1946 0.1929 0.4161 -0.0282 -0.0206 0.0763  99  THR A CA  
490  C C   . THR A 71  ? 0.1857 0.2123 0.3956 -0.0256 -0.0076 0.0948  99  THR A C   
491  O O   . THR A 71  ? 0.1549 0.1931 0.3374 -0.0193 -0.0022 0.0860  99  THR A O   
492  C CB  . THR A 71  ? 0.1983 0.1795 0.4159 -0.0216 -0.0206 0.0759  99  THR A CB  
493  O OG1 . THR A 71  ? 0.1812 0.1736 0.3642 -0.0122 -0.0125 0.0719  99  THR A OG1 
494  C CG2 . THR A 71  ? 0.2172 0.1701 0.4458 -0.0212 -0.0326 0.0546  99  THR A CG2 
495  N N   . GLN A 72  ? 0.2009 0.2387 0.4323 -0.0298 -0.0027 0.1204  100 GLN A N   
496  C CA  . GLN A 72  ? 0.2063 0.2756 0.4265 -0.0260 0.0106  0.1391  100 GLN A CA  
497  C C   . GLN A 72  ? 0.1874 0.2609 0.3681 -0.0148 0.0171  0.1305  100 GLN A C   
498  O O   . GLN A 72  ? 0.1679 0.2579 0.3263 -0.0091 0.0242  0.1251  100 GLN A O   
499  C CB  . GLN A 72  ? 0.2416 0.3239 0.4904 -0.0316 0.0149  0.1708  100 GLN A CB  
500  C CG  . GLN A 72  ? 0.2713 0.3925 0.5080 -0.0267 0.0295  0.1894  100 GLN A CG  
501  C CD  . GLN A 72  ? 0.2861 0.4249 0.5278 -0.0280 0.0326  0.1842  100 GLN A CD  
502  O OE1 . GLN A 72  ? 0.3196 0.4585 0.5967 -0.0388 0.0267  0.1916  100 GLN A OE1 
503  N NE2 . GLN A 72  ? 0.2919 0.4427 0.5008 -0.0174 0.0398  0.1699  100 GLN A NE2 
504  N N   . ARG A 73  ? 0.1936 0.2512 0.3670 -0.0114 0.0136  0.1270  101 ARG A N   
505  C CA  . ARG A 73  ? 0.1874 0.2517 0.3273 -0.0027 0.0180  0.1210  101 ARG A CA  
506  C C   . ARG A 73  ? 0.1785 0.2359 0.2951 0.0005  0.0163  0.0964  101 ARG A C   
507  O O   . ARG A 73  ? 0.1739 0.2424 0.2650 0.0056  0.0213  0.0909  101 ARG A O   
508  C CB  . ARG A 73  ? 0.1948 0.2461 0.3381 0.0000  0.0138  0.1246  101 ARG A CB  
509  C CG  . ARG A 73  ? 0.1944 0.2573 0.3079 0.0071  0.0169  0.1217  101 ARG A CG  
510  C CD  . ARG A 73  ? 0.2012 0.2573 0.3239 0.0104  0.0132  0.1310  101 ARG A CD  
511  N NE  . ARG A 73  ? 0.2104 0.2793 0.3079 0.0159  0.0139  0.1281  101 ARG A NE  
512  C CZ  . ARG A 73  ? 0.2219 0.3155 0.3058 0.0181  0.0176  0.1428  101 ARG A CZ  
513  N NH1 . ARG A 73  ? 0.2220 0.3330 0.3124 0.0162  0.0234  0.1620  101 ARG A NH1 
514  N NH2 . ARG A 73  ? 0.2160 0.3204 0.2781 0.0217  0.0155  0.1371  101 ARG A NH2 
515  N N   . CYS A 74  ? 0.1803 0.2198 0.3058 -0.0022 0.0086  0.0817  102 CYS A N   
516  C CA  . CYS A 74  ? 0.1681 0.2029 0.2739 0.0006  0.0065  0.0619  102 CYS A CA  
517  C C   . CYS A 74  ? 0.1648 0.2156 0.2646 0.0013  0.0121  0.0634  102 CYS A C   
518  O O   . CYS A 74  ? 0.1624 0.2162 0.2402 0.0063  0.0154  0.0556  102 CYS A O   
519  C CB  . CYS A 74  ? 0.1778 0.1962 0.2937 -0.0018 -0.0028 0.0475  102 CYS A CB  
520  S SG  . CYS A 74  ? 0.1910 0.2079 0.2802 0.0030  -0.0044 0.0284  102 CYS A SG  
521  N N   . LYS A 75  ? 0.1722 0.2337 0.2936 -0.0031 0.0133  0.0744  103 LYS A N   
522  C CA  . LYS A 75  ? 0.1779 0.2584 0.2986 -0.0005 0.0197  0.0776  103 LYS A CA  
523  C C   . LYS A 75  ? 0.1692 0.2643 0.2677 0.0074  0.0303  0.0817  103 LYS A C   
524  O O   . LYS A 75  ? 0.1546 0.2532 0.2367 0.0140  0.0340  0.0723  103 LYS A O   
525  C CB  . LYS A 75  ? 0.1982 0.2919 0.3521 -0.0080 0.0193  0.0930  103 LYS A CB  
526  C CG  . LYS A 75  ? 0.2184 0.3382 0.3756 -0.0037 0.0283  0.1006  103 LYS A CG  
527  C CD  . LYS A 75  ? 0.2217 0.3586 0.4170 -0.0127 0.0273  0.1182  103 LYS A CD  
528  C CE  . LYS A 75  ? 0.2274 0.3574 0.4400 -0.0193 0.0152  0.1078  103 LYS A CE  
529  N NZ  . LYS A 75  ? 0.2458 0.3996 0.4966 -0.0277 0.0152  0.1261  103 LYS A NZ  
530  N N   . ASP A 76  ? 0.1803 0.2828 0.2779 0.0074  0.0339  0.0948  104 ASP A N   
531  C CA  . ASP A 76  ? 0.1801 0.3013 0.2551 0.0149  0.0430  0.0988  104 ASP A CA  
532  C C   . ASP A 76  ? 0.1807 0.2889 0.2270 0.0197  0.0401  0.0796  104 ASP A C   
533  O O   . ASP A 76  ? 0.1708 0.2859 0.1992 0.0265  0.0450  0.0702  104 ASP A O   
534  C CB  . ASP A 76  ? 0.1996 0.3334 0.2821 0.0130  0.0455  0.1202  104 ASP A CB  
535  C CG  . ASP A 76  ? 0.2079 0.3587 0.3220 0.0074  0.0496  0.1441  104 ASP A CG  
536  O OD1 . ASP A 76  ? 0.2037 0.3621 0.3336 0.0055  0.0516  0.1445  104 ASP A OD1 
537  O OD2 . ASP A 76  ? 0.2327 0.3907 0.3586 0.0045  0.0503  0.1653  104 ASP A OD2 
538  N N   . LYS A 77  ? 0.1703 0.2595 0.2150 0.0163  0.0321  0.0729  105 LYS A N   
539  C CA  . LYS A 77  ? 0.1731 0.2532 0.1945 0.0189  0.0291  0.0579  105 LYS A CA  
540  C C   . LYS A 77  ? 0.1725 0.2418 0.1896 0.0204  0.0277  0.0434  105 LYS A C   
541  O O   . LYS A 77  ? 0.1636 0.2306 0.1637 0.0241  0.0286  0.0330  105 LYS A O   
542  C CB  . LYS A 77  ? 0.1709 0.2394 0.1953 0.0159  0.0224  0.0575  105 LYS A CB  
543  C CG  . LYS A 77  ? 0.1948 0.2722 0.2259 0.0157  0.0225  0.0735  105 LYS A CG  
544  C CD  . LYS A 77  ? 0.2171 0.3173 0.2378 0.0188  0.0285  0.0849  105 LYS A CD  
545  C CE  . LYS A 77  ? 0.2305 0.3402 0.2553 0.0191  0.0268  0.1015  105 LYS A CE  
546  N NZ  . LYS A 77  ? 0.2453 0.3821 0.2633 0.0221  0.0337  0.1176  105 LYS A NZ  
547  N N   . LEU A 78  ? 0.1651 0.2287 0.1989 0.0176  0.0250  0.0434  106 LEU A N   
548  C CA  . LEU A 78  ? 0.1613 0.2181 0.1936 0.0194  0.0232  0.0339  106 LEU A CA  
549  C C   . LEU A 78  ? 0.1681 0.2355 0.1967 0.0262  0.0303  0.0333  106 LEU A C   
550  O O   . LEU A 78  ? 0.1648 0.2241 0.1831 0.0307  0.0302  0.0237  106 LEU A O   
551  C CB  . LEU A 78  ? 0.1543 0.2082 0.2048 0.0150  0.0174  0.0346  106 LEU A CB  
552  C CG  . LEU A 78  ? 0.1561 0.2035 0.2021 0.0166  0.0131  0.0260  106 LEU A CG  
553  C CD1 . LEU A 78  ? 0.1575 0.1939 0.1900 0.0157  0.0093  0.0191  106 LEU A CD1 
554  C CD2 . LEU A 78  ? 0.1598 0.2114 0.2229 0.0131  0.0071  0.0268  106 LEU A CD2 
555  N N   . ASN A 79  ? 0.1653 0.2511 0.2037 0.0279  0.0369  0.0441  107 ASN A N   
556  C CA  . ASN A 79  ? 0.1787 0.2790 0.2125 0.0374  0.0459  0.0428  107 ASN A CA  
557  C C   . ASN A 79  ? 0.1872 0.2853 0.1947 0.0441  0.0489  0.0318  107 ASN A C   
558  O O   . ASN A 79  ? 0.1945 0.2908 0.1950 0.0530  0.0526  0.0215  107 ASN A O   
559  C CB  . ASN A 79  ? 0.1842 0.3110 0.2359 0.0378  0.0536  0.0596  107 ASN A CB  
560  C CG  . ASN A 79  ? 0.1788 0.3098 0.2592 0.0322  0.0497  0.0671  107 ASN A CG  
561  O OD1 . ASN A 79  ? 0.1823 0.3023 0.2656 0.0328  0.0440  0.0583  107 ASN A OD1 
562  N ND2 . ASN A 79  ? 0.1798 0.3261 0.2833 0.0254  0.0510  0.0842  107 ASN A ND2 
563  N N   . ALA A 80  ? 0.2032 0.3034 0.1978 0.0411  0.0475  0.0337  108 ALA A N   
564  C CA  . ALA A 80  ? 0.2181 0.3157 0.1868 0.0457  0.0470  0.0204  108 ALA A CA  
565  C C   . ALA A 80  ? 0.2222 0.2933 0.1861 0.0437  0.0392  0.0048  108 ALA A C   
566  O O   . ALA A 80  ? 0.2408 0.3044 0.1912 0.0496  0.0393  -0.0100 108 ALA A O   
567  C CB  . ALA A 80  ? 0.2311 0.3375 0.1903 0.0413  0.0442  0.0275  108 ALA A CB  
568  N N   . LEU A 81  ? 0.2059 0.2637 0.1803 0.0357  0.0324  0.0080  109 LEU A N   
569  C CA  . LEU A 81  ? 0.2089 0.2459 0.1813 0.0328  0.0256  -0.0016 109 LEU A CA  
570  C C   . LEU A 81  ? 0.2005 0.2294 0.1791 0.0394  0.0279  -0.0067 109 LEU A C   
571  O O   . LEU A 81  ? 0.2090 0.2213 0.1828 0.0409  0.0246  -0.0168 109 LEU A O   
572  C CB  . LEU A 81  ? 0.1875 0.2196 0.1703 0.0253  0.0202  0.0051  109 LEU A CB  
573  C CG  . LEU A 81  ? 0.1967 0.2143 0.1790 0.0214  0.0143  0.0005  109 LEU A CG  
574  C CD1 . LEU A 81  ? 0.2174 0.2284 0.1882 0.0189  0.0106  -0.0074 109 LEU A CD1 
575  C CD2 . LEU A 81  ? 0.1812 0.2004 0.1703 0.0166  0.0110  0.0062  109 LEU A CD2 
576  N N   . ALA A 82  ? 0.1904 0.2307 0.1822 0.0434  0.0328  0.0007  110 ALA A N   
577  C CA  . ALA A 82  ? 0.1982 0.2349 0.1993 0.0513  0.0351  -0.0017 110 ALA A CA  
578  C C   . ALA A 82  ? 0.2259 0.2577 0.2151 0.0620  0.0399  -0.0150 110 ALA A C   
579  O O   . ALA A 82  ? 0.2283 0.2428 0.2203 0.0674  0.0379  -0.0226 110 ALA A O   
580  C CB  . ALA A 82  ? 0.1900 0.2460 0.2094 0.0534  0.0393  0.0095  110 ALA A CB  
581  N N   . ILE A 83  ? 0.2397 0.2868 0.2154 0.0657  0.0456  -0.0179 111 ILE A N   
582  C CA  . ILE A 83  ? 0.2687 0.3139 0.2281 0.0772  0.0500  -0.0345 111 ILE A CA  
583  C C   . ILE A 83  ? 0.2778 0.2961 0.2251 0.0721  0.0400  -0.0499 111 ILE A C   
584  O O   . ILE A 83  ? 0.2867 0.2862 0.2335 0.0798  0.0390  -0.0643 111 ILE A O   
585  C CB  . ILE A 83  ? 0.2901 0.3652 0.2356 0.0828  0.0590  -0.0319 111 ILE A CB  
586  C CG1 . ILE A 83  ? 0.2969 0.3986 0.2606 0.0882  0.0694  -0.0156 111 ILE A CG1 
587  C CG2 . ILE A 83  ? 0.3321 0.4044 0.2548 0.0947  0.0614  -0.0539 111 ILE A CG2 
588  C CD1 . ILE A 83  ? 0.3021 0.4376 0.2600 0.0893  0.0780  -0.0025 111 ILE A CD1 
589  N N   . SER A 84  ? 0.2745 0.2910 0.2158 0.0598  0.0326  -0.0465 112 SER A N   
590  C CA  . SER A 84  ? 0.2991 0.2954 0.2313 0.0530  0.0223  -0.0597 112 SER A CA  
591  C C   . SER A 84  ? 0.2895 0.2597 0.2381 0.0486  0.0161  -0.0589 112 SER A C   
592  O O   . SER A 84  ? 0.3108 0.2588 0.2579 0.0481  0.0097  -0.0729 112 SER A O   
593  C CB  . SER A 84  ? 0.3021 0.3087 0.2261 0.0423  0.0165  -0.0543 112 SER A CB  
594  O OG  . SER A 84  ? 0.2866 0.2953 0.2250 0.0345  0.0153  -0.0382 112 SER A OG  
595  N N   . VAL A 85  ? 0.2645 0.2376 0.2292 0.0467  0.0179  -0.0435 113 VAL A N   
596  C CA  . VAL A 85  ? 0.2726 0.2259 0.2525 0.0439  0.0128  -0.0392 113 VAL A CA  
597  C C   . VAL A 85  ? 0.3020 0.2388 0.2877 0.0559  0.0150  -0.0491 113 VAL A C   
598  O O   . VAL A 85  ? 0.3314 0.2429 0.3232 0.0531  0.0081  -0.0548 113 VAL A O   
599  C CB  . VAL A 85  ? 0.2490 0.2128 0.2410 0.0401  0.0131  -0.0221 113 VAL A CB  
600  C CG1 . VAL A 85  ? 0.2623 0.2114 0.2684 0.0400  0.0092  -0.0151 113 VAL A CG1 
601  C CG2 . VAL A 85  ? 0.2272 0.2019 0.2150 0.0297  0.0102  -0.0153 113 VAL A CG2 
602  N N   . MET A 86  ? 0.3032 0.2533 0.2894 0.0691  0.0241  -0.0509 114 MET A N   
603  C CA  . MET A 86  ? 0.3509 0.2879 0.3445 0.0843  0.0279  -0.0608 114 MET A CA  
604  C C   . MET A 86  ? 0.3832 0.2995 0.3628 0.0882  0.0245  -0.0848 114 MET A C   
605  O O   . MET A 86  ? 0.3847 0.2738 0.3745 0.0945  0.0212  -0.0940 114 MET A O   
606  C CB  . MET A 86  ? 0.3546 0.3185 0.3517 0.0976  0.0397  -0.0567 114 MET A CB  
607  C CG  . MET A 86  ? 0.3253 0.3047 0.3409 0.0933  0.0397  -0.0354 114 MET A CG  
608  S SD  . MET A 86  ? 0.3608 0.3706 0.3909 0.1080  0.0513  -0.0280 114 MET A SD  
609  C CE  . MET A 86  ? 0.3599 0.3992 0.3736 0.1064  0.0599  -0.0285 114 MET A CE  
610  N N   . ASN A 87  ? 0.3921 0.3207 0.3499 0.0842  0.0241  -0.0945 115 ASN A N   
611  C CA  . ASN A 87  ? 0.4520 0.3642 0.3927 0.0867  0.0185  -0.1205 115 ASN A CA  
612  C C   . ASN A 87  ? 0.4411 0.3223 0.3913 0.0715  0.0038  -0.1234 115 ASN A C   
613  O O   . ASN A 87  ? 0.4527 0.3039 0.4045 0.0743  -0.0034 -0.1438 115 ASN A O   
614  C CB  . ASN A 87  ? 0.4742 0.4140 0.3886 0.0854  0.0206  -0.1262 115 ASN A CB  
615  C CG  . ASN A 87  ? 0.5168 0.4872 0.4206 0.1019  0.0354  -0.1263 115 ASN A CG  
616  O OD1 . ASN A 87  ? 0.5580 0.5253 0.4703 0.1174  0.0434  -0.1315 115 ASN A OD1 
617  N ND2 . ASN A 87  ? 0.5349 0.5371 0.4223 0.0992  0.0394  -0.1186 115 ASN A ND2 
618  N N   . GLN A 88  ? 0.3990 0.2870 0.3575 0.0560  -0.0006 -0.1039 116 GLN A N   
619  C CA  . GLN A 88  ? 0.4054 0.2720 0.3754 0.0400  -0.0134 -0.1017 116 GLN A CA  
620  C C   . GLN A 88  ? 0.4173 0.2533 0.4114 0.0421  -0.0167 -0.0980 116 GLN A C   
621  O O   . GLN A 88  ? 0.4422 0.2493 0.4449 0.0359  -0.0272 -0.1094 116 GLN A O   
622  C CB  . GLN A 88  ? 0.3799 0.2656 0.3545 0.0264  -0.0147 -0.0799 116 GLN A CB  
623  C CG  . GLN A 88  ? 0.3956 0.2699 0.3801 0.0096  -0.0266 -0.0770 116 GLN A CG  
624  C CD  . GLN A 88  ? 0.4320 0.3071 0.4025 0.0029  -0.0356 -0.0948 116 GLN A CD  
625  O OE1 . GLN A 88  ? 0.4560 0.3496 0.4045 0.0093  -0.0321 -0.1048 116 GLN A OE1 
626  N NE2 . GLN A 88  ? 0.4347 0.2918 0.4191 -0.0106 -0.0479 -0.0973 116 GLN A NE2 
627  N N   . TRP A 89  ? 0.3937 0.2355 0.4000 0.0507  -0.0090 -0.0826 117 TRP A N   
628  C CA  . TRP A 89  ? 0.4073 0.2262 0.4393 0.0521  -0.0120 -0.0704 117 TRP A CA  
629  C C   . TRP A 89  ? 0.4141 0.2374 0.4521 0.0714  -0.0025 -0.0698 117 TRP A C   
630  O O   . TRP A 89  ? 0.3890 0.2370 0.4299 0.0745  0.0037  -0.0530 117 TRP A O   
631  C CB  . TRP A 89  ? 0.3856 0.2173 0.4287 0.0390  -0.0144 -0.0433 117 TRP A CB  
632  C CG  . TRP A 89  ? 0.3770 0.2118 0.4184 0.0210  -0.0219 -0.0389 117 TRP A CG  
633  C CD1 . TRP A 89  ? 0.4047 0.2176 0.4603 0.0085  -0.0322 -0.0386 117 TRP A CD1 
634  C CD2 . TRP A 89  ? 0.3461 0.2102 0.3754 0.0132  -0.0196 -0.0305 117 TRP A CD2 
635  N NE1 . TRP A 89  ? 0.3839 0.2152 0.4363 -0.0060 -0.0356 -0.0299 117 TRP A NE1 
636  C CE2 . TRP A 89  ? 0.3453 0.2071 0.3811 -0.0022 -0.0277 -0.0254 117 TRP A CE2 
637  C CE3 . TRP A 89  ? 0.3175 0.2088 0.3346 0.0182  -0.0118 -0.0259 117 TRP A CE3 
638  C CZ2 . TRP A 89  ? 0.3236 0.2110 0.3523 -0.0106 -0.0271 -0.0170 117 TRP A CZ2 
639  C CZ3 . TRP A 89  ? 0.2953 0.2070 0.3054 0.0094  -0.0121 -0.0191 117 TRP A CZ3 
640  C CH2 . TRP A 89  ? 0.3089 0.2194 0.3240 -0.0035 -0.0191 -0.0150 117 TRP A CH2 
641  N N   . PRO A 90  ? 0.4633 0.2667 0.5014 0.0863  -0.0007 -0.0908 118 PRO A N   
642  C CA  . PRO A 90  ? 0.4749 0.2868 0.5202 0.1067  0.0095  -0.0905 118 PRO A CA  
643  C C   . PRO A 90  ? 0.4669 0.2791 0.5379 0.1070  0.0085  -0.0635 118 PRO A C   
644  O O   . PRO A 90  ? 0.4990 0.2879 0.5861 0.0979  -0.0002 -0.0530 118 PRO A O   
645  C CB  . PRO A 90  ? 0.5303 0.3122 0.5745 0.1216  0.0088  -0.1193 118 PRO A CB  
646  C CG  . PRO A 90  ? 0.5455 0.3209 0.5671 0.1093  0.0010  -0.1398 118 PRO A CG  
647  C CD  . PRO A 90  ? 0.5056 0.2838 0.5333 0.0854  -0.0079 -0.1188 118 PRO A CD  
648  N N   . GLY A 91  ? 0.4356 0.2774 0.5104 0.1160  0.0169  -0.0509 119 GLY A N   
649  C CA  . GLY A 91  ? 0.4283 0.2787 0.5246 0.1171  0.0154  -0.0251 119 GLY A CA  
650  C C   . GLY A 91  ? 0.3897 0.2642 0.4792 0.1000  0.0119  -0.0067 119 GLY A C   
651  O O   . GLY A 91  ? 0.3978 0.2879 0.4994 0.1004  0.0105  0.0131  119 GLY A O   
652  N N   . VAL A 92  ? 0.3661 0.2445 0.4372 0.0863  0.0099  -0.0134 120 VAL A N   
653  C CA  . VAL A 92  ? 0.3318 0.2306 0.3971 0.0718  0.0068  0.0018  120 VAL A CA  
654  C C   . VAL A 92  ? 0.3115 0.2382 0.3629 0.0713  0.0127  -0.0023 120 VAL A C   
655  O O   . VAL A 92  ? 0.3408 0.2696 0.3818 0.0771  0.0182  -0.0173 120 VAL A O   
656  C CB  . VAL A 92  ? 0.3450 0.2283 0.4060 0.0569  -0.0003 0.0016  120 VAL A CB  
657  C CG1 . VAL A 92  ? 0.3188 0.2248 0.3708 0.0443  -0.0017 0.0129  120 VAL A CG1 
658  C CG2 . VAL A 92  ? 0.3776 0.2337 0.4587 0.0560  -0.0065 0.0105  120 VAL A CG2 
659  N N   . LYS A 93  ? 0.2805 0.2293 0.3324 0.0654  0.0115  0.0106  121 LYS A N   
660  C CA  A LYS A 93  ? 0.2605 0.2333 0.3047 0.0631  0.0156  0.0090  121 LYS A CA  
661  C CA  B LYS A 93  ? 0.2548 0.2275 0.2989 0.0631  0.0156  0.0090  121 LYS A CA  
662  C C   . LYS A 93  ? 0.2351 0.2148 0.2698 0.0500  0.0113  0.0130  121 LYS A C   
663  O O   . LYS A 93  ? 0.2304 0.2055 0.2664 0.0439  0.0058  0.0213  121 LYS A O   
664  C CB  A LYS A 93  ? 0.2690 0.2628 0.3272 0.0698  0.0174  0.0183  121 LYS A CB  
665  C CB  B LYS A 93  ? 0.2543 0.2482 0.3124 0.0697  0.0175  0.0182  121 LYS A CB  
666  C CG  A LYS A 93  ? 0.2963 0.2858 0.3683 0.0851  0.0218  0.0173  121 LYS A CG  
667  C CG  B LYS A 93  ? 0.2694 0.2652 0.3382 0.0850  0.0244  0.0143  121 LYS A CG  
668  C CD  A LYS A 93  ? 0.2999 0.3163 0.3868 0.0926  0.0257  0.0245  121 LYS A CD  
669  C CD  B LYS A 93  ? 0.2600 0.2833 0.3455 0.0897  0.0259  0.0251  121 LYS A CD  
670  C CE  A LYS A 93  ? 0.3204 0.3339 0.4215 0.1107  0.0320  0.0220  121 LYS A CE  
671  C CE  B LYS A 93  ? 0.2714 0.3010 0.3711 0.1072  0.0340  0.0232  121 LYS A CE  
672  N NZ  A LYS A 93  ? 0.3421 0.3411 0.4307 0.1188  0.0397  0.0037  121 LYS A NZ  
673  N NZ  B LYS A 93  ? 0.2533 0.3120 0.3745 0.1105  0.0330  0.0371  121 LYS A NZ  
674  N N   . LEU A 94  ? 0.2100 0.2021 0.2370 0.0467  0.0142  0.0090  122 LEU A N   
675  C CA  . LEU A 94  ? 0.1859 0.1868 0.2077 0.0373  0.0108  0.0125  122 LEU A CA  
676  C C   . LEU A 94  ? 0.1759 0.1898 0.2063 0.0367  0.0068  0.0211  122 LEU A C   
677  O O   . LEU A 94  ? 0.1686 0.1920 0.2102 0.0424  0.0079  0.0243  122 LEU A O   
678  C CB  . LEU A 94  ? 0.1842 0.1952 0.2012 0.0359  0.0149  0.0089  122 LEU A CB  
679  C CG  . LEU A 94  ? 0.1708 0.1890 0.1863 0.0284  0.0118  0.0116  122 LEU A CG  
680  C CD1 . LEU A 94  ? 0.1766 0.1868 0.1829 0.0229  0.0085  0.0099  122 LEU A CD1 
681  C CD2 . LEU A 94  ? 0.1796 0.2068 0.1951 0.0279  0.0160  0.0119  122 LEU A CD2 
682  N N   . ARG A 95  ? 0.1618 0.1789 0.1870 0.0307  0.0021  0.0242  123 ARG A N   
683  C CA  . ARG A 95  ? 0.1676 0.1995 0.1958 0.0301  -0.0032 0.0293  123 ARG A CA  
684  C C   . ARG A 95  ? 0.1543 0.1922 0.1748 0.0246  -0.0054 0.0239  123 ARG A C   
685  O O   . ARG A 95  ? 0.1524 0.1848 0.1646 0.0216  -0.0037 0.0219  123 ARG A O   
686  C CB  . ARG A 95  ? 0.1761 0.2084 0.2045 0.0318  -0.0064 0.0394  123 ARG A CB  
687  C CG  . ARG A 95  ? 0.1731 0.2248 0.1989 0.0316  -0.0127 0.0446  123 ARG A CG  
688  C CD  . ARG A 95  ? 0.1898 0.2448 0.2195 0.0353  -0.0151 0.0595  123 ARG A CD  
689  N NE  . ARG A 95  ? 0.1918 0.2701 0.2138 0.0355  -0.0213 0.0653  123 ARG A NE  
690  C CZ  . ARG A 95  ? 0.1885 0.2767 0.1969 0.0328  -0.0213 0.0679  123 ARG A CZ  
691  N NH1 . ARG A 95  ? 0.1908 0.2679 0.1951 0.0287  -0.0160 0.0662  123 ARG A NH1 
692  N NH2 . ARG A 95  ? 0.1958 0.3085 0.1945 0.0349  -0.0267 0.0723  123 ARG A NH2 
693  N N   . VAL A 96  ? 0.1461 0.1946 0.1718 0.0236  -0.0095 0.0210  124 VAL A N   
694  C CA  . VAL A 96  ? 0.1438 0.1954 0.1648 0.0200  -0.0130 0.0132  124 VAL A CA  
695  C C   . VAL A 96  ? 0.1534 0.2183 0.1674 0.0212  -0.0199 0.0122  124 VAL A C   
696  O O   . VAL A 96  ? 0.1522 0.2282 0.1727 0.0221  -0.0257 0.0144  124 VAL A O   
697  C CB  . VAL A 96  ? 0.1406 0.1926 0.1747 0.0169  -0.0146 0.0092  124 VAL A CB  
698  C CG1 . VAL A 96  ? 0.1530 0.2042 0.1858 0.0142  -0.0202 -0.0005 124 VAL A CG1 
699  C CG2 . VAL A 96  ? 0.1460 0.1906 0.1841 0.0166  -0.0071 0.0122  124 VAL A CG2 
700  N N   . THR A 97  ? 0.1596 0.2276 0.1606 0.0220  -0.0192 0.0096  125 THR A N   
701  C CA  . THR A 97  ? 0.1687 0.2541 0.1585 0.0246  -0.0249 0.0072  125 THR A CA  
702  C C   . THR A 97  ? 0.1830 0.2703 0.1716 0.0242  -0.0311 -0.0093 125 THR A C   
703  O O   . THR A 97  ? 0.1999 0.3021 0.1834 0.0255  -0.0397 -0.0145 125 THR A O   
704  C CB  . THR A 97  ? 0.1749 0.2691 0.1515 0.0271  -0.0202 0.0144  125 THR A CB  
705  O OG1 . THR A 97  ? 0.1654 0.2513 0.1404 0.0264  -0.0151 0.0082  125 THR A OG1 
706  C CG2 . THR A 97  ? 0.1703 0.2606 0.1523 0.0263  -0.0168 0.0314  125 THR A CG2 
707  N N   . GLU A 98  ? 0.1803 0.2538 0.1735 0.0229  -0.0284 -0.0173 126 GLU A N   
708  C CA  . GLU A 98  ? 0.2163 0.2861 0.2117 0.0230  -0.0350 -0.0344 126 GLU A CA  
709  C C   . GLU A 98  ? 0.1976 0.2488 0.2110 0.0186  -0.0328 -0.0338 126 GLU A C   
710  O O   . GLU A 98  ? 0.2075 0.2524 0.2207 0.0190  -0.0243 -0.0253 126 GLU A O   
711  C CB  . GLU A 98  ? 0.2501 0.3277 0.2279 0.0304  -0.0327 -0.0439 126 GLU A CB  
712  C CG  . GLU A 98  ? 0.3076 0.4098 0.2664 0.0352  -0.0352 -0.0431 126 GLU A CG  
713  C CD  . GLU A 98  ? 0.3656 0.4836 0.3048 0.0444  -0.0340 -0.0555 126 GLU A CD  
714  O OE1 . GLU A 98  ? 0.3763 0.4853 0.3172 0.0485  -0.0289 -0.0634 126 GLU A OE1 
715  O OE2 . GLU A 98  ? 0.4185 0.5606 0.3402 0.0489  -0.0379 -0.0569 126 GLU A OE2 
716  N N   . GLY A 99  ? 0.2016 0.2464 0.2314 0.0137  -0.0406 -0.0405 127 GLY A N   
717  C CA  . GLY A 99  ? 0.1990 0.2281 0.2486 0.0093  -0.0391 -0.0379 127 GLY A CA  
718  C C   . GLY A 99  ? 0.2150 0.2317 0.2734 0.0088  -0.0476 -0.0541 127 GLY A C   
719  O O   . GLY A 99  ? 0.2406 0.2565 0.2842 0.0164  -0.0479 -0.0673 127 GLY A O   
720  N N   . TRP A 100 ? 0.2163 0.2254 0.2992 0.0006  -0.0553 -0.0543 128 TRP A N   
721  C CA  . TRP A 100 ? 0.2382 0.2305 0.3356 -0.0016 -0.0662 -0.0711 128 TRP A CA  
722  C C   . TRP A 100 ? 0.2688 0.2686 0.3483 0.0027  -0.0765 -0.0940 128 TRP A C   
723  O O   . TRP A 100 ? 0.2467 0.2662 0.3172 0.0007  -0.0811 -0.0930 128 TRP A O   
724  C CB  . TRP A 100 ? 0.2406 0.2254 0.3726 -0.0139 -0.0731 -0.0630 128 TRP A CB  
725  C CG  . TRP A 100 ? 0.2662 0.2302 0.4178 -0.0182 -0.0870 -0.0812 128 TRP A CG  
726  C CD1 . TRP A 100 ? 0.2835 0.2234 0.4409 -0.0129 -0.0881 -0.0923 128 TRP A CD1 
727  C CD2 . TRP A 100 ? 0.2853 0.2493 0.4587 -0.0297 -0.1030 -0.0896 128 TRP A CD2 
728  N NE1 . TRP A 100 ? 0.3087 0.2301 0.4880 -0.0195 -0.1041 -0.1100 128 TRP A NE1 
729  C CE2 . TRP A 100 ? 0.3169 0.2531 0.5071 -0.0313 -0.1142 -0.1086 128 TRP A CE2 
730  C CE3 . TRP A 100 ? 0.2811 0.2665 0.4635 -0.0385 -0.1096 -0.0830 128 TRP A CE3 
731  C CZ2 . TRP A 100 ? 0.3435 0.2713 0.5588 -0.0432 -0.1331 -0.1224 128 TRP A CZ2 
732  C CZ3 . TRP A 100 ? 0.3057 0.2874 0.5128 -0.0503 -0.1280 -0.0950 128 TRP A CZ3 
733  C CH2 . TRP A 100 ? 0.3400 0.2923 0.5632 -0.0535 -0.1402 -0.1152 128 TRP A CH2 
734  N N   . ASP A 101 ? 0.2954 0.2821 0.3684 0.0103  -0.0790 -0.1134 129 ASP A N   
735  C CA  . ASP A 101 ? 0.3469 0.3442 0.3952 0.0186  -0.0862 -0.1377 129 ASP A CA  
736  C C   . ASP A 101 ? 0.3845 0.3618 0.4502 0.0145  -0.1029 -0.1624 129 ASP A C   
737  O O   . ASP A 101 ? 0.3779 0.3297 0.4583 0.0179  -0.1027 -0.1707 129 ASP A O   
738  C CB  . ASP A 101 ? 0.3660 0.3689 0.3903 0.0336  -0.0747 -0.1429 129 ASP A CB  
739  C CG  . ASP A 101 ? 0.4066 0.4293 0.4006 0.0446  -0.0784 -0.1643 129 ASP A CG  
740  O OD1 . ASP A 101 ? 0.4361 0.4648 0.4261 0.0413  -0.0925 -0.1807 129 ASP A OD1 
741  O OD2 . ASP A 101 ? 0.4627 0.4977 0.4378 0.0566  -0.0671 -0.1638 129 ASP A OD2 
742  N N   . GLU A 102 ? 0.4155 0.4035 0.4827 0.0069  -0.1177 -0.1726 130 GLU A N   
743  C CA  . GLU A 102 ? 0.4930 0.4634 0.5742 0.0022  -0.1372 -0.2015 130 GLU A CA  
744  C C   . GLU A 102 ? 0.5670 0.5447 0.6140 0.0173  -0.1416 -0.2338 130 GLU A C   
745  O O   . GLU A 102 ? 0.6339 0.5900 0.6906 0.0170  -0.1564 -0.2631 130 GLU A O   
746  C CB  . GLU A 102 ? 0.4995 0.4820 0.5978 -0.0131 -0.1539 -0.2008 130 GLU A CB  
747  C CG  . GLU A 102 ? 0.4601 0.4473 0.5877 -0.0259 -0.1481 -0.1679 130 GLU A CG  
748  C CD  . GLU A 102 ? 0.4636 0.4647 0.6141 -0.0411 -0.1658 -0.1681 130 GLU A CD  
749  O OE1 . GLU A 102 ? 0.4725 0.4539 0.6521 -0.0521 -0.1814 -0.1816 130 GLU A OE1 
750  O OE2 . GLU A 102 ? 0.4424 0.4738 0.5836 -0.0417 -0.1641 -0.1539 130 GLU A OE2 
751  N N   . ASP A 103 ? 0.6144 0.6202 0.6251 0.0303  -0.1289 -0.2284 131 ASP A N   
752  C CA  . ASP A 103 ? 0.6773 0.7102 0.6487 0.0431  -0.1329 -0.2513 131 ASP A CA  
753  C C   . ASP A 103 ? 0.6817 0.7194 0.6276 0.0632  -0.1190 -0.2627 131 ASP A C   
754  O O   . ASP A 103 ? 0.7061 0.7739 0.6169 0.0750  -0.1189 -0.2765 131 ASP A O   
755  C CB  . ASP A 103 ? 0.6918 0.7632 0.6433 0.0411  -0.1293 -0.2288 131 ASP A CB  
756  C CG  . ASP A 103 ? 0.7054 0.7812 0.6795 0.0243  -0.1427 -0.2175 131 ASP A CG  
757  O OD1 . ASP A 103 ? 0.7344 0.8138 0.7101 0.0188  -0.1629 -0.2402 131 ASP A OD1 
758  O OD2 . ASP A 103 ? 0.7017 0.7773 0.6929 0.0171  -0.1334 -0.1877 131 ASP A OD2 
759  N N   . GLY A 104 ? 0.6491 0.6643 0.6108 0.0681  -0.1068 -0.2553 132 GLY A N   
760  C CA  . GLY A 104 ? 0.6733 0.6983 0.6150 0.0875  -0.0920 -0.2616 132 GLY A CA  
761  C C   . GLY A 104 ? 0.6390 0.7048 0.5526 0.0936  -0.0768 -0.2391 132 GLY A C   
762  O O   . GLY A 104 ? 0.6776 0.7672 0.5642 0.1104  -0.0695 -0.2518 132 GLY A O   
763  N N   . HIS A 105 ? 0.5929 0.6667 0.5140 0.0818  -0.0711 -0.2067 133 HIS A N   
764  C CA  . HIS A 105 ? 0.5689 0.6761 0.4708 0.0841  -0.0583 -0.1811 133 HIS A CA  
765  C C   . HIS A 105 ? 0.5495 0.6540 0.4600 0.0875  -0.0418 -0.1614 133 HIS A C   
766  O O   . HIS A 105 ? 0.5293 0.6515 0.4355 0.0836  -0.0329 -0.1355 133 HIS A O   
767  C CB  . HIS A 105 ? 0.5567 0.6685 0.4670 0.0696  -0.0621 -0.1577 133 HIS A CB  
768  C CG  . HIS A 105 ? 0.6158 0.7452 0.5139 0.0664  -0.0765 -0.1674 133 HIS A CG  
769  N ND1 . HIS A 105 ? 0.6785 0.8184 0.5566 0.0750  -0.0869 -0.1977 133 HIS A ND1 
770  C CD2 . HIS A 105 ? 0.6299 0.7698 0.5330 0.0565  -0.0830 -0.1514 133 HIS A CD2 
771  C CE1 . HIS A 105 ? 0.6801 0.8387 0.5503 0.0693  -0.1002 -0.1993 133 HIS A CE1 
772  N NE2 . HIS A 105 ? 0.6791 0.8379 0.5664 0.0581  -0.0978 -0.1698 133 HIS A NE2 
773  N N   . HIS A 106 ? 0.5149 0.5942 0.4430 0.0917  -0.0397 -0.1705 134 HIS A N   
774  C CA  . HIS A 106 ? 0.4938 0.5699 0.4340 0.0938  -0.0265 -0.1519 134 HIS A CA  
775  C C   . HIS A 106 ? 0.5421 0.6134 0.4819 0.1108  -0.0234 -0.1739 134 HIS A C   
776  O O   . HIS A 106 ? 0.5545 0.6142 0.4907 0.1164  -0.0334 -0.2020 134 HIS A O   
777  C CB  . HIS A 106 ? 0.4445 0.4933 0.4124 0.0803  -0.0284 -0.1354 134 HIS A CB  
778  C CG  . HIS A 106 ? 0.4108 0.4676 0.3785 0.0674  -0.0275 -0.1125 134 HIS A CG  
779  N ND1 . HIS A 106 ? 0.4320 0.4841 0.4040 0.0572  -0.0376 -0.1130 134 HIS A ND1 
780  C CD2 . HIS A 106 ? 0.3924 0.4616 0.3574 0.0637  -0.0185 -0.0900 134 HIS A CD2 
781  C CE1 . HIS A 106 ? 0.3941 0.4544 0.3661 0.0496  -0.0336 -0.0915 134 HIS A CE1 
782  N NE2 . HIS A 106 ? 0.4009 0.4697 0.3684 0.0529  -0.0224 -0.0780 134 HIS A NE2 
783  N N   . SER A 107 ? 0.5580 0.6356 0.5047 0.1185  -0.0113 -0.1627 135 SER A N   
784  C CA  . SER A 107 ? 0.6401 0.7155 0.5883 0.1379  -0.0068 -0.1832 135 SER A CA  
785  C C   . SER A 107 ? 0.6284 0.6593 0.6042 0.1362  -0.0169 -0.1968 135 SER A C   
786  O O   . SER A 107 ? 0.5354 0.5446 0.5301 0.1193  -0.0237 -0.1822 135 SER A O   
787  C CB  . SER A 107 ? 0.6579 0.7582 0.6087 0.1456  0.0086  -0.1636 135 SER A CB  
788  O OG  . SER A 107 ? 0.7183 0.8617 0.6433 0.1515  0.0173  -0.1583 135 SER A OG  
789  N N   . GLU A 108 ? 0.6401 0.6583 0.6209 0.1536  -0.0173 -0.2217 136 GLU A N   
790  C CA  . GLU A 108 ? 0.6689 0.6419 0.6809 0.1537  -0.0270 -0.2339 136 GLU A CA  
791  C C   . GLU A 108 ? 0.5928 0.5522 0.6333 0.1434  -0.0231 -0.2018 136 GLU A C   
792  O O   . GLU A 108 ? 0.5617 0.5468 0.5979 0.1447  -0.0109 -0.1786 136 GLU A O   
793  C CB  . GLU A 108 ? 0.7535 0.7181 0.7673 0.1784  -0.0246 -0.2633 136 GLU A CB  
794  C CG  . GLU A 108 ? 0.8437 0.8087 0.8340 0.1866  -0.0344 -0.3023 136 GLU A CG  
795  C CD  . GLU A 108 ? 0.9362 0.9290 0.9016 0.2140  -0.0237 -0.3264 136 GLU A CD  
796  O OE1 . GLU A 108 ? 1.0007 0.9783 0.9836 0.2328  -0.0182 -0.3373 136 GLU A OE1 
797  O OE2 . GLU A 108 ? 0.9988 1.0304 0.9279 0.2178  -0.0206 -0.3335 136 GLU A OE2 
798  N N   . GLU A 109 ? 0.5659 0.4885 0.6345 0.1326  -0.0341 -0.2003 137 GLU A N   
799  C CA  . GLU A 109 ? 0.5365 0.4429 0.6341 0.1217  -0.0333 -0.1711 137 GLU A CA  
800  C C   . GLU A 109 ? 0.4670 0.3983 0.5532 0.1069  -0.0271 -0.1418 137 GLU A C   
801  O O   . GLU A 109 ? 0.4269 0.3580 0.5277 0.1022  -0.0223 -0.1162 137 GLU A O   
802  C CB  . GLU A 109 ? 0.5786 0.4782 0.6944 0.1387  -0.0262 -0.1678 137 GLU A CB  
803  C CG  . GLU A 109 ? 0.6435 0.5117 0.7741 0.1537  -0.0337 -0.1990 137 GLU A CG  
804  C CD  . GLU A 109 ? 0.7040 0.5455 0.8713 0.1633  -0.0332 -0.1894 137 GLU A CD  
805  O OE1 . GLU A 109 ? 0.7759 0.5762 0.9710 0.1628  -0.0449 -0.2026 137 GLU A OE1 
806  O OE2 . GLU A 109 ? 0.7075 0.5696 0.8775 0.1711  -0.0220 -0.1684 137 GLU A OE2 
807  N N   . SER A 110 ? 0.4155 0.3651 0.4782 0.0990  -0.0288 -0.1451 138 SER A N   
808  C CA  . SER A 110 ? 0.3526 0.3188 0.4076 0.0844  -0.0253 -0.1206 138 SER A CA  
809  C C   . SER A 110 ? 0.3183 0.2638 0.3977 0.0699  -0.0310 -0.1050 138 SER A C   
810  O O   . SER A 110 ? 0.3200 0.2450 0.4148 0.0636  -0.0417 -0.1150 138 SER A O   
811  C CB  . SER A 110 ? 0.3594 0.3445 0.3903 0.0798  -0.0280 -0.1274 138 SER A CB  
812  O OG  . SER A 110 ? 0.3265 0.3254 0.3520 0.0688  -0.0237 -0.1047 138 SER A OG  
813  N N   . LEU A 111 ? 0.2800 0.2352 0.3610 0.0633  -0.0245 -0.0804 139 LEU A N   
814  C CA  . LEU A 111 ? 0.2718 0.2164 0.3713 0.0500  -0.0275 -0.0628 139 LEU A CA  
815  C C   . LEU A 111 ? 0.2557 0.2057 0.3484 0.0391  -0.0329 -0.0656 139 LEU A C   
816  O O   . LEU A 111 ? 0.2538 0.1956 0.3651 0.0287  -0.0370 -0.0554 139 LEU A O   
817  C CB  . LEU A 111 ? 0.2509 0.2079 0.3492 0.0479  -0.0192 -0.0389 139 LEU A CB  
818  C CG  . LEU A 111 ? 0.2733 0.2274 0.3835 0.0576  -0.0154 -0.0316 139 LEU A CG  
819  C CD1 . LEU A 111 ? 0.2524 0.2191 0.3630 0.0522  -0.0106 -0.0071 139 LEU A CD1 
820  C CD2 . LEU A 111 ? 0.3002 0.2269 0.4381 0.0617  -0.0219 -0.0374 139 LEU A CD2 
821  N N   . HIS A 112 ? 0.2550 0.2207 0.3245 0.0419  -0.0332 -0.0775 140 HIS A N   
822  C CA  . HIS A 112 ? 0.2598 0.2314 0.3254 0.0331  -0.0406 -0.0817 140 HIS A CA  
823  C C   . HIS A 112 ? 0.2823 0.2340 0.3690 0.0281  -0.0536 -0.0961 140 HIS A C   
824  O O   . HIS A 112 ? 0.2712 0.2245 0.3686 0.0172  -0.0604 -0.0922 140 HIS A O   
825  C CB  . HIS A 112 ? 0.2615 0.2554 0.2987 0.0384  -0.0395 -0.0905 140 HIS A CB  
826  C CG  . HIS A 112 ? 0.2457 0.2569 0.2691 0.0384  -0.0292 -0.0727 140 HIS A CG  
827  N ND1 . HIS A 112 ? 0.2383 0.2576 0.2597 0.0305  -0.0285 -0.0592 140 HIS A ND1 
828  C CD2 . HIS A 112 ? 0.2494 0.2710 0.2628 0.0448  -0.0201 -0.0663 140 HIS A CD2 
829  C CE1 . HIS A 112 ? 0.2242 0.2541 0.2352 0.0317  -0.0202 -0.0468 140 HIS A CE1 
830  N NE2 . HIS A 112 ? 0.2313 0.2636 0.2381 0.0393  -0.0152 -0.0500 140 HIS A NE2 
831  N N   . TYR A 113 ? 0.3098 0.2432 0.4044 0.0359  -0.0580 -0.1138 141 TYR A N   
832  C CA  . TYR A 113 ? 0.3573 0.2678 0.4737 0.0306  -0.0730 -0.1318 141 TYR A CA  
833  C C   . TYR A 113 ? 0.3519 0.2439 0.5058 0.0179  -0.0760 -0.1120 141 TYR A C   
834  O O   . TYR A 113 ? 0.3643 0.2390 0.5429 0.0084  -0.0896 -0.1212 141 TYR A O   
835  C CB  . TYR A 113 ? 0.4070 0.3008 0.5209 0.0450  -0.0766 -0.1592 141 TYR A CB  
836  C CG  . TYR A 113 ? 0.4438 0.3604 0.5211 0.0585  -0.0735 -0.1793 141 TYR A CG  
837  C CD1 . TYR A 113 ? 0.4575 0.3983 0.5120 0.0542  -0.0776 -0.1840 141 TYR A CD1 
838  C CD2 . TYR A 113 ? 0.4861 0.4035 0.5525 0.0766  -0.0660 -0.1921 141 TYR A CD2 
839  C CE1 . TYR A 113 ? 0.4934 0.4594 0.5141 0.0667  -0.0742 -0.1989 141 TYR A CE1 
840  C CE2 . TYR A 113 ? 0.5123 0.4561 0.5452 0.0898  -0.0614 -0.2082 141 TYR A CE2 
841  C CZ  . TYR A 113 ? 0.5201 0.4891 0.5292 0.0844  -0.0654 -0.2105 141 TYR A CZ  
842  O OH  . TYR A 113 ? 0.5535 0.5525 0.5293 0.0971  -0.0608 -0.2231 141 TYR A OH  
843  N N   . GLU A 114 ? 0.3367 0.2346 0.4949 0.0176  -0.0642 -0.0853 142 GLU A N   
844  C CA  . GLU A 114 ? 0.3393 0.2261 0.5297 0.0083  -0.0636 -0.0612 142 GLU A CA  
845  C C   . GLU A 114 ? 0.2935 0.2035 0.4813 -0.0018 -0.0578 -0.0387 142 GLU A C   
846  O O   . GLU A 114 ? 0.2777 0.1869 0.4890 -0.0092 -0.0551 -0.0155 142 GLU A O   
847  C CB  . GLU A 114 ? 0.3557 0.2370 0.5500 0.0181  -0.0545 -0.0478 142 GLU A CB  
848  C CG  . GLU A 114 ? 0.4263 0.2855 0.6264 0.0312  -0.0583 -0.0683 142 GLU A CG  
849  C CD  . GLU A 114 ? 0.4504 0.2955 0.6735 0.0377  -0.0544 -0.0513 142 GLU A CD  
850  O OE1 . GLU A 114 ? 0.4562 0.3163 0.6795 0.0347  -0.0464 -0.0245 142 GLU A OE1 
851  O OE2 . GLU A 114 ? 0.5467 0.3652 0.7887 0.0462  -0.0603 -0.0655 142 GLU A OE2 
852  N N   . GLY A 115 ? 0.2701 0.2013 0.4321 -0.0014 -0.0553 -0.0435 143 GLY A N   
853  C CA  . GLY A 115 ? 0.2426 0.1948 0.4011 -0.0077 -0.0487 -0.0245 143 GLY A CA  
854  C C   . GLY A 115 ? 0.2343 0.1958 0.3835 -0.0037 -0.0358 -0.0053 143 GLY A C   
855  O O   . GLY A 115 ? 0.2183 0.1925 0.3731 -0.0086 -0.0304 0.0120  143 GLY A O   
856  N N   . ARG A 116 ? 0.2317 0.1895 0.3667 0.0057  -0.0313 -0.0093 144 ARG A N   
857  C CA  . ARG A 116 ? 0.2320 0.1981 0.3602 0.0092  -0.0218 0.0075  144 ARG A CA  
858  C C   . ARG A 116 ? 0.2068 0.1864 0.3058 0.0150  -0.0163 0.0016  144 ARG A C   
859  O O   . ARG A 116 ? 0.1898 0.1762 0.2806 0.0186  -0.0106 0.0105  144 ARG A O   
860  C CB  . ARG A 116 ? 0.2751 0.2280 0.4164 0.0153  -0.0220 0.0110  144 ARG A CB  
861  C CG  . ARG A 116 ? 0.3373 0.2735 0.5127 0.0100  -0.0272 0.0214  144 ARG A CG  
862  C CD  . ARG A 116 ? 0.3544 0.2849 0.5389 0.0176  -0.0242 0.0332  144 ARG A CD  
863  N NE  . ARG A 116 ? 0.3962 0.3095 0.5849 0.0283  -0.0278 0.0164  144 ARG A NE  
864  C CZ  . ARG A 116 ? 0.4066 0.3225 0.5935 0.0393  -0.0236 0.0211  144 ARG A CZ  
865  N NH1 . ARG A 116 ? 0.4361 0.3343 0.6331 0.0504  -0.0270 0.0053  144 ARG A NH1 
866  N NH2 . ARG A 116 ? 0.3607 0.2981 0.5354 0.0404  -0.0167 0.0390  144 ARG A NH2 
867  N N   . ALA A 117 ? 0.1983 0.1832 0.2830 0.0155  -0.0187 -0.0112 145 ALA A N   
868  C CA  . ALA A 117 ? 0.1917 0.1889 0.2527 0.0202  -0.0138 -0.0139 145 ALA A CA  
869  C C   . ALA A 117 ? 0.1837 0.1904 0.2336 0.0174  -0.0152 -0.0169 145 ALA A C   
870  O O   . ALA A 117 ? 0.1834 0.1884 0.2388 0.0151  -0.0222 -0.0254 145 ALA A O   
871  C CB  . ALA A 117 ? 0.2067 0.2036 0.2603 0.0288  -0.0141 -0.0262 145 ALA A CB  
872  N N   . VAL A 118 ? 0.1622 0.1781 0.1984 0.0178  -0.0099 -0.0104 146 VAL A N   
873  C CA  . VAL A 118 ? 0.1763 0.2006 0.2030 0.0168  -0.0106 -0.0105 146 VAL A CA  
874  C C   . VAL A 118 ? 0.1675 0.1997 0.1787 0.0199  -0.0071 -0.0093 146 VAL A C   
875  O O   . VAL A 118 ? 0.1769 0.2094 0.1856 0.0203  -0.0029 -0.0047 146 VAL A O   
876  C CB  . VAL A 118 ? 0.1649 0.1906 0.1962 0.0134  -0.0077 -0.0010 146 VAL A CB  
877  C CG1 . VAL A 118 ? 0.1780 0.2030 0.2273 0.0095  -0.0114 0.0003  146 VAL A CG1 
878  C CG2 . VAL A 118 ? 0.1674 0.1918 0.1947 0.0135  -0.0016 0.0061  146 VAL A CG2 
879  N N   . ASP A 119 ? 0.1621 0.2034 0.1648 0.0214  -0.0094 -0.0116 147 ASP A N   
880  C CA  . ASP A 119 ? 0.1606 0.2115 0.1526 0.0225  -0.0060 -0.0049 147 ASP A CA  
881  C C   . ASP A 119 ? 0.1506 0.1989 0.1446 0.0195  -0.0060 0.0036  147 ASP A C   
882  O O   . ASP A 119 ? 0.1423 0.1917 0.1407 0.0195  -0.0098 0.0024  147 ASP A O   
883  C CB  . ASP A 119 ? 0.1763 0.2426 0.1573 0.0276  -0.0077 -0.0101 147 ASP A CB  
884  C CG  . ASP A 119 ? 0.1925 0.2606 0.1718 0.0335  -0.0064 -0.0210 147 ASP A CG  
885  O OD1 . ASP A 119 ? 0.1910 0.2515 0.1778 0.0334  -0.0031 -0.0194 147 ASP A OD1 
886  O OD2 . ASP A 119 ? 0.2017 0.2778 0.1734 0.0387  -0.0096 -0.0319 147 ASP A OD2 
887  N N   . ILE A 120 ? 0.1501 0.1950 0.1432 0.0172  -0.0025 0.0112  148 ILE A N   
888  C CA  . ILE A 120 ? 0.1528 0.1896 0.1499 0.0160  -0.0021 0.0166  148 ILE A CA  
889  C C   . ILE A 120 ? 0.1594 0.1961 0.1555 0.0142  -0.0016 0.0258  148 ILE A C   
890  O O   . ILE A 120 ? 0.1600 0.2032 0.1534 0.0119  -0.0004 0.0297  148 ILE A O   
891  C CB  . ILE A 120 ? 0.1618 0.1882 0.1620 0.0147  0.0005  0.0140  148 ILE A CB  
892  C CG1 . ILE A 120 ? 0.1723 0.1971 0.1689 0.0116  0.0018  0.0139  148 ILE A CG1 
893  C CG2 . ILE A 120 ? 0.1527 0.1805 0.1588 0.0156  0.0003  0.0102  148 ILE A CG2 
894  C CD1 . ILE A 120 ? 0.1836 0.2016 0.1789 0.0107  0.0034  0.0114  148 ILE A CD1 
895  N N   . THR A 121 ? 0.1568 0.1856 0.1584 0.0156  -0.0024 0.0302  149 THR A N   
896  C CA  . THR A 121 ? 0.1733 0.1944 0.1799 0.0136  -0.0029 0.0398  149 THR A CA  
897  C C   . THR A 121 ? 0.1817 0.1854 0.1948 0.0165  -0.0024 0.0359  149 THR A C   
898  O O   . THR A 121 ? 0.1803 0.1844 0.1929 0.0202  -0.0006 0.0281  149 THR A O   
899  C CB  . THR A 121 ? 0.1855 0.2189 0.1933 0.0157  -0.0051 0.0528  149 THR A CB  
900  O OG1 . THR A 121 ? 0.1831 0.2174 0.1954 0.0215  -0.0072 0.0534  149 THR A OG1 
901  C CG2 . THR A 121 ? 0.1806 0.2366 0.1781 0.0163  -0.0050 0.0539  149 THR A CG2 
902  N N   . THR A 122 ? 0.2003 0.1902 0.2212 0.0155  -0.0039 0.0419  150 THR A N   
903  C CA  . THR A 122 ? 0.2125 0.1861 0.2419 0.0220  -0.0035 0.0389  150 THR A CA  
904  C C   . THR A 122 ? 0.2204 0.2028 0.2576 0.0283  -0.0049 0.0507  150 THR A C   
905  O O   . THR A 122 ? 0.2131 0.2116 0.2485 0.0259  -0.0072 0.0627  150 THR A O   
906  C CB  . THR A 122 ? 0.2381 0.1881 0.2748 0.0184  -0.0060 0.0373  150 THR A CB  
907  O OG1 . THR A 122 ? 0.2507 0.2028 0.2951 0.0114  -0.0092 0.0534  150 THR A OG1 
908  C CG2 . THR A 122 ? 0.2360 0.1791 0.2641 0.0130  -0.0064 0.0233  150 THR A CG2 
909  N N   . SER A 123 ? 0.2081 0.1851 0.2534 0.0372  -0.0033 0.0477  151 SER A N   
910  C CA  . SER A 123 ? 0.2170 0.2060 0.2725 0.0447  -0.0052 0.0589  151 SER A CA  
911  C C   . SER A 123 ? 0.2381 0.2215 0.3032 0.0445  -0.0091 0.0768  151 SER A C   
912  O O   . SER A 123 ? 0.2444 0.2468 0.3132 0.0478  -0.0126 0.0911  151 SER A O   
913  C CB  . SER A 123 ? 0.2312 0.2153 0.2966 0.0556  -0.0014 0.0522  151 SER A CB  
914  O OG  . SER A 123 ? 0.2373 0.1949 0.3077 0.0598  0.0007  0.0450  151 SER A OG  
915  N N   . ASP A 124 ? 0.2543 0.2146 0.3247 0.0400  -0.0096 0.0775  152 ASP A N   
916  C CA  . ASP A 124 ? 0.2876 0.2391 0.3733 0.0387  -0.0134 0.0980  152 ASP A CA  
917  C C   . ASP A 124 ? 0.2826 0.2536 0.3609 0.0286  -0.0147 0.1124  152 ASP A C   
918  O O   . ASP A 124 ? 0.2903 0.2597 0.3815 0.0262  -0.0173 0.1337  152 ASP A O   
919  C CB  . ASP A 124 ? 0.3145 0.2295 0.4149 0.0379  -0.0150 0.0927  152 ASP A CB  
920  C CG  . ASP A 124 ? 0.3133 0.2171 0.4048 0.0270  -0.0154 0.0776  152 ASP A CG  
921  O OD1 . ASP A 124 ? 0.3023 0.2270 0.3770 0.0214  -0.0132 0.0727  152 ASP A OD1 
922  O OD2 . ASP A 124 ? 0.3330 0.2067 0.4358 0.0248  -0.0187 0.0702  152 ASP A OD2 
923  N N   . ARG A 125 ? 0.2643 0.2530 0.3248 0.0238  -0.0126 0.1023  153 ARG A N   
924  C CA  . ARG A 125 ? 0.2739 0.2854 0.3249 0.0167  -0.0119 0.1120  153 ARG A CA  
925  C C   . ARG A 125 ? 0.2944 0.2940 0.3591 0.0073  -0.0128 0.1254  153 ARG A C   
926  O O   . ARG A 125 ? 0.2908 0.3109 0.3567 0.0034  -0.0121 0.1452  153 ARG A O   
927  C CB  . ARG A 125 ? 0.2896 0.3306 0.3340 0.0221  -0.0135 0.1261  153 ARG A CB  
928  C CG  . ARG A 125 ? 0.2971 0.3504 0.3294 0.0278  -0.0144 0.1097  153 ARG A CG  
929  C CD  . ARG A 125 ? 0.3258 0.4037 0.3554 0.0343  -0.0192 0.1201  153 ARG A CD  
930  N NE  . ARG A 125 ? 0.3363 0.4428 0.3470 0.0327  -0.0194 0.1205  153 ARG A NE  
931  C CZ  . ARG A 125 ? 0.3720 0.5074 0.3721 0.0375  -0.0246 0.1253  153 ARG A CZ  
932  N NH1 . ARG A 125 ? 0.3693 0.5308 0.3495 0.0377  -0.0242 0.1220  153 ARG A NH1 
933  N NH2 . ARG A 125 ? 0.3484 0.4877 0.3583 0.0428  -0.0302 0.1328  153 ARG A NH2 
934  N N   . ASP A 126 ? 0.2942 0.2645 0.3680 0.0033  -0.0144 0.1135  154 ASP A N   
935  C CA  . ASP A 126 ? 0.3200 0.2750 0.4095 -0.0083 -0.0176 0.1210  154 ASP A CA  
936  C C   . ASP A 126 ? 0.3053 0.2764 0.3844 -0.0167 -0.0157 0.1138  154 ASP A C   
937  O O   . ASP A 126 ? 0.2807 0.2408 0.3520 -0.0176 -0.0164 0.0928  154 ASP A O   
938  C CB  . ASP A 126 ? 0.3431 0.2590 0.4458 -0.0080 -0.0221 0.1074  154 ASP A CB  
939  C CG  . ASP A 126 ? 0.3662 0.2632 0.4875 -0.0221 -0.0282 0.1117  154 ASP A CG  
940  O OD1 . ASP A 126 ? 0.3702 0.2877 0.4969 -0.0324 -0.0279 0.1292  154 ASP A OD1 
941  O OD2 . ASP A 126 ? 0.3937 0.2570 0.5246 -0.0220 -0.0333 0.0967  154 ASP A OD2 
942  N N   . ARG A 127 ? 0.2956 0.2949 0.3750 -0.0213 -0.0131 0.1322  155 ARG A N   
943  C CA  . ARG A 127 ? 0.2979 0.3198 0.3677 -0.0258 -0.0097 0.1275  155 ARG A CA  
944  C C   . ARG A 127 ? 0.2975 0.3008 0.3790 -0.0368 -0.0146 0.1186  155 ARG A C   
945  O O   . ARG A 127 ? 0.2849 0.2988 0.3572 -0.0382 -0.0133 0.1068  155 ARG A O   
946  C CB  . ARG A 127 ? 0.3051 0.3623 0.3761 -0.0275 -0.0050 0.1508  155 ARG A CB  
947  C CG  . ARG A 127 ? 0.3222 0.4044 0.3746 -0.0157 -0.0011 0.1541  155 ARG A CG  
948  C CD  . ARG A 127 ? 0.3408 0.4622 0.3918 -0.0165 0.0044  0.1761  155 ARG A CD  
949  N NE  . ARG A 127 ? 0.3647 0.5163 0.3917 -0.0046 0.0080  0.1727  155 ARG A NE  
950  C CZ  . ARG A 127 ? 0.3993 0.5914 0.4164 -0.0007 0.0142  0.1864  155 ARG A CZ  
951  N NH1 . ARG A 127 ? 0.4013 0.6115 0.4340 -0.0087 0.0188  0.2093  155 ARG A NH1 
952  N NH2 . ARG A 127 ? 0.4208 0.6371 0.4134 0.0108  0.0155  0.1779  155 ARG A NH2 
953  N N   . SER A 128 ? 0.3109 0.2863 0.4126 -0.0440 -0.0212 0.1230  156 SER A N   
954  C CA  . SER A 128 ? 0.3247 0.2821 0.4394 -0.0565 -0.0287 0.1138  156 SER A CA  
955  C C   . SER A 128 ? 0.3237 0.2652 0.4209 -0.0511 -0.0306 0.0837  156 SER A C   
956  O O   . SER A 128 ? 0.3235 0.2599 0.4234 -0.0601 -0.0367 0.0725  156 SER A O   
957  C CB  . SER A 128 ? 0.3529 0.2815 0.4962 -0.0660 -0.0368 0.1250  156 SER A CB  
958  O OG  . SER A 128 ? 0.3652 0.2607 0.5084 -0.0564 -0.0392 0.1124  156 SER A OG  
959  N N   . LYS A 129 ? 0.3110 0.2491 0.3915 -0.0375 -0.0259 0.0725  157 LYS A N   
960  C CA  . LYS A 129 ? 0.2950 0.2227 0.3588 -0.0311 -0.0259 0.0472  157 LYS A CA  
961  C C   . LYS A 129 ? 0.2682 0.2223 0.3153 -0.0292 -0.0212 0.0425  157 LYS A C   
962  O O   . LYS A 129 ? 0.2753 0.2266 0.3094 -0.0254 -0.0211 0.0257  157 LYS A O   
963  C CB  . LYS A 129 ? 0.3027 0.2175 0.3615 -0.0176 -0.0225 0.0402  157 LYS A CB  
964  C CG  . LYS A 129 ? 0.3355 0.2181 0.4106 -0.0160 -0.0273 0.0385  157 LYS A CG  
965  C CD  . LYS A 129 ? 0.3464 0.2198 0.4176 -0.0005 -0.0229 0.0302  157 LYS A CD  
966  C CE  . LYS A 129 ? 0.3789 0.2185 0.4688 0.0039  -0.0273 0.0279  157 LYS A CE  
967  N NZ  . LYS A 129 ? 0.3881 0.2268 0.4978 0.0041  -0.0282 0.0537  157 LYS A NZ  
968  N N   . TYR A 130 ? 0.2350 0.2145 0.2818 -0.0300 -0.0171 0.0563  158 TYR A N   
969  C CA  . TYR A 130 ? 0.2106 0.2109 0.2422 -0.0236 -0.0117 0.0505  158 TYR A CA  
970  C C   . TYR A 130 ? 0.2065 0.2132 0.2358 -0.0288 -0.0142 0.0428  158 TYR A C   
971  O O   . TYR A 130 ? 0.2013 0.2138 0.2190 -0.0226 -0.0116 0.0335  158 TYR A O   
972  C CB  . TYR A 130 ? 0.1941 0.2190 0.2240 -0.0202 -0.0066 0.0639  158 TYR A CB  
973  C CG  . TYR A 130 ? 0.1972 0.2215 0.2242 -0.0129 -0.0050 0.0692  158 TYR A CG  
974  C CD1 . TYR A 130 ? 0.1987 0.2014 0.2290 -0.0094 -0.0073 0.0652  158 TYR A CD1 
975  C CD2 . TYR A 130 ? 0.1923 0.2407 0.2145 -0.0090 -0.0016 0.0800  158 TYR A CD2 
976  C CE1 . TYR A 130 ? 0.2074 0.2134 0.2381 -0.0028 -0.0068 0.0730  158 TYR A CE1 
977  C CE2 . TYR A 130 ? 0.1965 0.2489 0.2159 -0.0030 -0.0018 0.0867  158 TYR A CE2 
978  C CZ  . TYR A 130 ? 0.2016 0.2331 0.2266 -0.0002 -0.0048 0.0844  158 TYR A CZ  
979  O OH  . TYR A 130 ? 0.2184 0.2569 0.2430 0.0060  -0.0059 0.0929  158 TYR A OH  
980  N N   . GLY A 131 ? 0.2174 0.2266 0.2598 -0.0399 -0.0194 0.0488  159 GLY A N   
981  C CA  . GLY A 131 ? 0.2171 0.2341 0.2592 -0.0455 -0.0241 0.0418  159 GLY A CA  
982  C C   . GLY A 131 ? 0.2356 0.2359 0.2642 -0.0422 -0.0276 0.0230  159 GLY A C   
983  O O   . GLY A 131 ? 0.2293 0.2417 0.2479 -0.0389 -0.0269 0.0174  159 GLY A O   
984  N N   . MET A 132 ? 0.2507 0.2258 0.2800 -0.0423 -0.0311 0.0147  160 MET A N   
985  C CA  . MET A 132 ? 0.2774 0.2393 0.2917 -0.0369 -0.0331 -0.0046 160 MET A CA  
986  C C   . MET A 132 ? 0.2558 0.2249 0.2563 -0.0239 -0.0237 -0.0064 160 MET A C   
987  O O   . MET A 132 ? 0.2617 0.2389 0.2486 -0.0196 -0.0225 -0.0146 160 MET A O   
988  C CB  . MET A 132 ? 0.3171 0.2488 0.3370 -0.0374 -0.0383 -0.0150 160 MET A CB  
989  C CG  . MET A 132 ? 0.3544 0.2770 0.3560 -0.0294 -0.0390 -0.0368 160 MET A CG  
990  S SD  . MET A 132 ? 0.3963 0.3342 0.3855 -0.0373 -0.0483 -0.0488 160 MET A SD  
991  C CE  . MET A 132 ? 0.4360 0.3572 0.4494 -0.0553 -0.0627 -0.0479 160 MET A CE  
992  N N   . LEU A 133 ? 0.2335 0.2045 0.2381 -0.0185 -0.0176 0.0033  161 LEU A N   
993  C CA  . LEU A 133 ? 0.2058 0.1848 0.2016 -0.0085 -0.0105 0.0022  161 LEU A CA  
994  C C   . LEU A 133 ? 0.1987 0.1960 0.1886 -0.0086 -0.0090 0.0034  161 LEU A C   
995  O O   . LEU A 133 ? 0.1933 0.1953 0.1755 -0.0029 -0.0055 -0.0004 161 LEU A O   
996  C CB  . LEU A 133 ? 0.1994 0.1816 0.2015 -0.0049 -0.0071 0.0126  161 LEU A CB  
997  C CG  . LEU A 133 ? 0.1836 0.1748 0.1813 0.0028  -0.0021 0.0123  161 LEU A CG  
998  C CD1 . LEU A 133 ? 0.1882 0.1712 0.1836 0.0097  0.0003  0.0046  161 LEU A CD1 
999  C CD2 . LEU A 133 ? 0.1812 0.1796 0.1837 0.0046  -0.0016 0.0219  161 LEU A CD2 
1000 N N   . ALA A 134 ? 0.1846 0.1940 0.1806 -0.0138 -0.0105 0.0112  162 ALA A N   
1001 C CA  . ALA A 134 ? 0.1816 0.2079 0.1757 -0.0120 -0.0091 0.0136  162 ALA A CA  
1002 C C   . ALA A 134 ? 0.1942 0.2229 0.1808 -0.0136 -0.0129 0.0072  162 ALA A C   
1003 O O   . ALA A 134 ? 0.1839 0.2211 0.1657 -0.0084 -0.0103 0.0082  162 ALA A O   
1004 C CB  . ALA A 134 ? 0.1758 0.2165 0.1795 -0.0160 -0.0095 0.0228  162 ALA A CB  
1005 N N   . ARG A 135 ? 0.2079 0.2294 0.1939 -0.0205 -0.0198 0.0011  163 ARG A N   
1006 C CA  . ARG A 135 ? 0.2140 0.2403 0.1892 -0.0221 -0.0254 -0.0075 163 ARG A CA  
1007 C C   . ARG A 135 ? 0.2229 0.2454 0.1837 -0.0127 -0.0198 -0.0145 163 ARG A C   
1008 O O   . ARG A 135 ? 0.2173 0.2542 0.1689 -0.0089 -0.0186 -0.0131 163 ARG A O   
1009 C CB  . ARG A 135 ? 0.2378 0.2537 0.2156 -0.0319 -0.0358 -0.0168 163 ARG A CB  
1010 C CG  . ARG A 135 ? 0.2673 0.2878 0.2286 -0.0320 -0.0425 -0.0305 163 ARG A CG  
1011 C CD  . ARG A 135 ? 0.2710 0.3186 0.2271 -0.0312 -0.0440 -0.0230 163 ARG A CD  
1012 N NE  . ARG A 135 ? 0.2680 0.3304 0.2409 -0.0397 -0.0494 -0.0120 163 ARG A NE  
1013 C CZ  . ARG A 135 ? 0.2733 0.3597 0.2489 -0.0376 -0.0496 -0.0012 163 ARG A CZ  
1014 N NH1 . ARG A 135 ? 0.2979 0.3947 0.2605 -0.0286 -0.0455 0.0013  163 ARG A NH1 
1015 N NH2 . ARG A 135 ? 0.2762 0.3780 0.2693 -0.0444 -0.0540 0.0084  163 ARG A NH2 
1016 N N   . LEU A 136 ? 0.2236 0.2301 0.1851 -0.0083 -0.0158 -0.0190 164 LEU A N   
1017 C CA  . LEU A 136 ? 0.2385 0.2457 0.1900 0.0013  -0.0089 -0.0236 164 LEU A CA  
1018 C C   . LEU A 136 ? 0.2111 0.2337 0.1653 0.0054  -0.0026 -0.0116 164 LEU A C   
1019 O O   . LEU A 136 ? 0.2153 0.2487 0.1610 0.0110  0.0017  -0.0112 164 LEU A O   
1020 C CB  . LEU A 136 ? 0.2524 0.2418 0.2086 0.0060  -0.0060 -0.0287 164 LEU A CB  
1021 C CG  . LEU A 136 ? 0.2904 0.2597 0.2461 0.0036  -0.0126 -0.0421 164 LEU A CG  
1022 C CD1 . LEU A 136 ? 0.2942 0.2465 0.2592 0.0102  -0.0089 -0.0427 164 LEU A CD1 
1023 C CD2 . LEU A 136 ? 0.3186 0.2901 0.2561 0.0076  -0.0147 -0.0588 164 LEU A CD2 
1024 N N   . ALA A 137 ? 0.1831 0.2066 0.1491 0.0036  -0.0017 -0.0026 165 ALA A N   
1025 C CA  . ALA A 137 ? 0.1722 0.2048 0.1443 0.0070  0.0024  0.0063  165 ALA A CA  
1026 C C   . ALA A 137 ? 0.1776 0.2245 0.1468 0.0067  0.0009  0.0120  165 ALA A C   
1027 O O   . ALA A 137 ? 0.1718 0.2266 0.1428 0.0104  0.0046  0.0194  165 ALA A O   
1028 C CB  . ALA A 137 ? 0.1649 0.1950 0.1476 0.0061  0.0024  0.0101  165 ALA A CB  
1029 N N   . VAL A 138 ? 0.1923 0.2441 0.1596 0.0020  -0.0049 0.0108  166 VAL A N   
1030 C CA  . VAL A 138 ? 0.1972 0.2661 0.1622 0.0021  -0.0079 0.0176  166 VAL A CA  
1031 C C   . VAL A 138 ? 0.2149 0.2915 0.1638 0.0052  -0.0068 0.0147  166 VAL A C   
1032 O O   . VAL A 138 ? 0.2131 0.3038 0.1620 0.0093  -0.0039 0.0263  166 VAL A O   
1033 C CB  . VAL A 138 ? 0.1911 0.2673 0.1590 -0.0044 -0.0158 0.0168  166 VAL A CB  
1034 C CG1 . VAL A 138 ? 0.1916 0.2886 0.1561 -0.0038 -0.0204 0.0239  166 VAL A CG1 
1035 C CG2 . VAL A 138 ? 0.1763 0.2520 0.1597 -0.0052 -0.0143 0.0221  166 VAL A CG2 
1036 N N   . GLU A 139 ? 0.2328 0.3015 0.1696 0.0043  -0.0087 0.0006  167 GLU A N   
1037 C CA  . GLU A 139 ? 0.2620 0.3419 0.1795 0.0094  -0.0072 -0.0052 167 GLU A CA  
1038 C C   . GLU A 139 ? 0.2500 0.3357 0.1696 0.0171  0.0036  0.0035  167 GLU A C   
1039 O O   . GLU A 139 ? 0.2570 0.3628 0.1641 0.0222  0.0070  0.0083  167 GLU A O   
1040 C CB  . GLU A 139 ? 0.3061 0.3731 0.2111 0.0082  -0.0123 -0.0259 167 GLU A CB  
1041 C CG  . GLU A 139 ? 0.3320 0.3955 0.2393 -0.0021 -0.0250 -0.0328 167 GLU A CG  
1042 C CD  . GLU A 139 ? 0.3777 0.4659 0.2797 -0.0058 -0.0325 -0.0260 167 GLU A CD  
1043 O OE1 . GLU A 139 ? 0.4036 0.5096 0.2872 -0.0005 -0.0322 -0.0276 167 GLU A OE1 
1044 O OE2 . GLU A 139 ? 0.4058 0.4991 0.3229 -0.0128 -0.0380 -0.0170 167 GLU A OE2 
1045 N N   . ALA A 140 ? 0.2210 0.2934 0.1550 0.0180  0.0085  0.0059  168 ALA A N   
1046 C CA  . ALA A 140 ? 0.2248 0.3031 0.1671 0.0230  0.0173  0.0154  168 ALA A CA  
1047 C C   . ALA A 140 ? 0.2148 0.3049 0.1693 0.0219  0.0185  0.0341  168 ALA A C   
1048 O O   . ALA A 140 ? 0.2195 0.3186 0.1828 0.0244  0.0249  0.0451  168 ALA A O   
1049 C CB  . ALA A 140 ? 0.2153 0.2773 0.1714 0.0226  0.0188  0.0125  168 ALA A CB  
1050 N N   . GLY A 141 ? 0.2130 0.3030 0.1714 0.0184  0.0125  0.0384  169 GLY A N   
1051 C CA  . GLY A 141 ? 0.2149 0.3147 0.1859 0.0189  0.0126  0.0562  169 GLY A CA  
1052 C C   . GLY A 141 ? 0.2002 0.2847 0.1931 0.0175  0.0116  0.0598  169 GLY A C   
1053 O O   . GLY A 141 ? 0.1775 0.2649 0.1860 0.0187  0.0119  0.0744  169 GLY A O   
1054 N N   . PHE A 142 ? 0.1931 0.2624 0.1881 0.0156  0.0098  0.0474  170 PHE A N   
1055 C CA  . PHE A 142 ? 0.1746 0.2328 0.1859 0.0159  0.0079  0.0474  170 PHE A CA  
1056 C C   . PHE A 142 ? 0.1728 0.2378 0.1896 0.0181  0.0047  0.0544  170 PHE A C   
1057 O O   . PHE A 142 ? 0.1752 0.2511 0.1813 0.0168  0.0017  0.0534  170 PHE A O   
1058 C CB  . PHE A 142 ? 0.1692 0.2168 0.1779 0.0145  0.0068  0.0348  170 PHE A CB  
1059 C CG  . PHE A 142 ? 0.1545 0.1954 0.1664 0.0141  0.0089  0.0312  170 PHE A CG  
1060 C CD1 . PHE A 142 ? 0.1502 0.1843 0.1769 0.0142  0.0078  0.0316  170 PHE A CD1 
1061 C CD2 . PHE A 142 ? 0.1659 0.2072 0.1679 0.0139  0.0110  0.0265  170 PHE A CD2 
1062 C CE1 . PHE A 142 ? 0.1474 0.1788 0.1794 0.0129  0.0081  0.0291  170 PHE A CE1 
1063 C CE2 . PHE A 142 ? 0.1576 0.1957 0.1655 0.0145  0.0126  0.0247  170 PHE A CE2 
1064 C CZ  . PHE A 142 ? 0.1482 0.1835 0.1712 0.0134  0.0110  0.0269  170 PHE A CZ  
1065 N N   . ASP A 143 ? 0.1748 0.2336 0.2099 0.0214  0.0045  0.0614  171 ASP A N   
1066 C CA  . ASP A 143 ? 0.1731 0.2376 0.2188 0.0261  0.0021  0.0705  171 ASP A CA  
1067 C C   . ASP A 143 ? 0.1626 0.2279 0.2079 0.0286  0.0005  0.0607  171 ASP A C   
1068 O O   . ASP A 143 ? 0.1684 0.2451 0.2202 0.0327  -0.0013 0.0676  171 ASP A O   
1069 C CB  . ASP A 143 ? 0.1904 0.2441 0.2589 0.0294  0.0023  0.0809  171 ASP A CB  
1070 C CG  . ASP A 143 ? 0.2075 0.2679 0.2776 0.0257  0.0049  0.0955  171 ASP A CG  
1071 O OD1 . ASP A 143 ? 0.2009 0.2810 0.2602 0.0260  0.0055  0.1068  171 ASP A OD1 
1072 O OD2 . ASP A 143 ? 0.2025 0.2519 0.2846 0.0226  0.0062  0.0957  171 ASP A OD2 
1073 N N   . TRP A 144 ? 0.1560 0.2129 0.1960 0.0270  0.0016  0.0473  172 TRP A N   
1074 C CA  . TRP A 144 ? 0.1459 0.2087 0.1847 0.0292  0.0016  0.0405  172 TRP A CA  
1075 C C   . TRP A 144 ? 0.1463 0.2059 0.1729 0.0240  0.0024  0.0312  172 TRP A C   
1076 O O   . TRP A 144 ? 0.1471 0.1949 0.1720 0.0231  0.0032  0.0257  172 TRP A O   
1077 C CB  . TRP A 144 ? 0.1537 0.2107 0.2062 0.0386  0.0029  0.0360  172 TRP A CB  
1078 C CG  . TRP A 144 ? 0.1433 0.2157 0.1975 0.0438  0.0046  0.0340  172 TRP A CG  
1079 C CD1 . TRP A 144 ? 0.1431 0.2337 0.2043 0.0462  0.0038  0.0436  172 TRP A CD1 
1080 C CD2 . TRP A 144 ? 0.1490 0.2250 0.1994 0.0483  0.0079  0.0233  172 TRP A CD2 
1081 N NE1 . TRP A 144 ? 0.1463 0.2520 0.2109 0.0515  0.0071  0.0403  172 TRP A NE1 
1082 C CE2 . TRP A 144 ? 0.1477 0.2452 0.2043 0.0533  0.0103  0.0280  172 TRP A CE2 
1083 C CE3 . TRP A 144 ? 0.1525 0.2195 0.1944 0.0484  0.0088  0.0115  172 TRP A CE3 
1084 C CZ2 . TRP A 144 ? 0.1548 0.2661 0.2093 0.0594  0.0153  0.0222  172 TRP A CZ2 
1085 C CZ3 . TRP A 144 ? 0.1601 0.2402 0.1972 0.0546  0.0126  0.0048  172 TRP A CZ3 
1086 C CH2 . TRP A 144 ? 0.1604 0.2626 0.2034 0.0603  0.0166  0.0103  172 TRP A CH2 
1087 N N   . VAL A 145 ? 0.1424 0.2129 0.1637 0.0201  0.0014  0.0314  173 VAL A N   
1088 C CA  . VAL A 145 ? 0.1423 0.2097 0.1552 0.0147  0.0015  0.0263  173 VAL A CA  
1089 C C   . VAL A 145 ? 0.1454 0.2269 0.1625 0.0149  0.0026  0.0282  173 VAL A C   
1090 O O   . VAL A 145 ? 0.1586 0.2549 0.1819 0.0130  0.0006  0.0344  173 VAL A O   
1091 C CB  . VAL A 145 ? 0.1486 0.2120 0.1523 0.0073  -0.0013 0.0255  173 VAL A CB  
1092 C CG1 . VAL A 145 ? 0.1504 0.2079 0.1506 0.0025  -0.0017 0.0221  173 VAL A CG1 
1093 C CG2 . VAL A 145 ? 0.1521 0.2074 0.1510 0.0088  -0.0001 0.0247  173 VAL A CG2 
1094 N N   . TYR A 146 ? 0.1354 0.2162 0.1493 0.0165  0.0054  0.0247  174 TYR A N   
1095 C CA  . TYR A 146 ? 0.1329 0.2325 0.1506 0.0193  0.0088  0.0282  174 TYR A CA  
1096 C C   . TYR A 146 ? 0.1372 0.2373 0.1495 0.0137  0.0092  0.0311  174 TYR A C   
1097 O O   . TYR A 146 ? 0.1413 0.2314 0.1460 0.0157  0.0094  0.0259  174 TYR A O   
1098 C CB  . TYR A 146 ? 0.1384 0.2435 0.1585 0.0318  0.0129  0.0219  174 TYR A CB  
1099 C CG  . TYR A 146 ? 0.1415 0.2696 0.1616 0.0377  0.0185  0.0237  174 TYR A CG  
1100 C CD1 . TYR A 146 ? 0.1467 0.2980 0.1751 0.0335  0.0206  0.0359  174 TYR A CD1 
1101 C CD2 . TYR A 146 ? 0.1523 0.2826 0.1660 0.0490  0.0219  0.0126  174 TYR A CD2 
1102 C CE1 . TYR A 146 ? 0.1503 0.3289 0.1803 0.0405  0.0277  0.0399  174 TYR A CE1 
1103 C CE2 . TYR A 146 ? 0.1642 0.3205 0.1751 0.0575  0.0286  0.0131  174 TYR A CE2 
1104 C CZ  . TYR A 146 ? 0.1632 0.3453 0.1824 0.0534  0.0326  0.0283  174 TYR A CZ  
1105 O OH  . TYR A 146 ? 0.1636 0.3768 0.1816 0.0631  0.0409  0.0310  174 TYR A OH  
1106 N N   . TYR A 147 ? 0.1446 0.2556 0.1634 0.0056  0.0081  0.0408  175 TYR A N   
1107 C CA  . TYR A 147 ? 0.1534 0.2665 0.1723 -0.0002 0.0085  0.0486  175 TYR A CA  
1108 C C   . TYR A 147 ? 0.1596 0.2966 0.1763 0.0080  0.0155  0.0529  175 TYR A C   
1109 O O   . TYR A 147 ? 0.1511 0.3123 0.1765 0.0067  0.0191  0.0642  175 TYR A O   
1110 C CB  . TYR A 147 ? 0.1589 0.2729 0.1897 -0.0131 0.0035  0.0577  175 TYR A CB  
1111 C CG  . TYR A 147 ? 0.1656 0.2729 0.2014 -0.0212 0.0017  0.0670  175 TYR A CG  
1112 C CD1 . TYR A 147 ? 0.1721 0.2685 0.2195 -0.0339 -0.0056 0.0706  175 TYR A CD1 
1113 C CD2 . TYR A 147 ? 0.1649 0.2754 0.1947 -0.0162 0.0059  0.0720  175 TYR A CD2 
1114 C CE1 . TYR A 147 ? 0.1890 0.2737 0.2450 -0.0412 -0.0082 0.0795  175 TYR A CE1 
1115 C CE2 . TYR A 147 ? 0.1771 0.2813 0.2146 -0.0233 0.0038  0.0841  175 TYR A CE2 
1116 C CZ  . TYR A 147 ? 0.1918 0.2814 0.2443 -0.0360 -0.0030 0.0887  175 TYR A CZ  
1117 O OH  . TYR A 147 ? 0.2000 0.2787 0.2645 -0.0430 -0.0059 0.1015  175 TYR A OH  
1118 N N   . GLU A 148 ? 0.1573 0.2897 0.1621 0.0173  0.0173  0.0426  176 GLU A N   
1119 C CA  . GLU A 148 ? 0.1679 0.3214 0.1657 0.0294  0.0234  0.0383  176 GLU A CA  
1120 C C   . GLU A 148 ? 0.1763 0.3523 0.1694 0.0288  0.0273  0.0510  176 GLU A C   
1121 O O   . GLU A 148 ? 0.1740 0.3792 0.1649 0.0370  0.0344  0.0542  176 GLU A O   
1122 C CB  . GLU A 148 ? 0.1734 0.3117 0.1610 0.0376  0.0210  0.0209  176 GLU A CB  
1123 C CG  . GLU A 148 ? 0.1985 0.3546 0.1757 0.0510  0.0252  0.0105  176 GLU A CG  
1124 C CD  . GLU A 148 ? 0.2204 0.3575 0.1937 0.0582  0.0208  -0.0097 176 GLU A CD  
1125 O OE1 . GLU A 148 ? 0.2355 0.3505 0.2104 0.0516  0.0144  -0.0128 176 GLU A OE1 
1126 O OE2 . GLU A 148 ? 0.2588 0.4031 0.2305 0.0705  0.0237  -0.0220 176 GLU A OE2 
1127 N N   . SER A 149 ? 0.1732 0.3386 0.1657 0.0206  0.0235  0.0593  177 SER A N   
1128 C CA  . SER A 149 ? 0.1897 0.3765 0.1797 0.0197  0.0266  0.0757  177 SER A CA  
1129 C C   . SER A 149 ? 0.1785 0.3478 0.1809 0.0067  0.0215  0.0900  177 SER A C   
1130 O O   . SER A 149 ? 0.1845 0.3250 0.1908 0.0017  0.0158  0.0817  177 SER A O   
1131 C CB  . SER A 149 ? 0.2035 0.3992 0.1741 0.0301  0.0269  0.0669  177 SER A CB  
1132 O OG  . SER A 149 ? 0.2026 0.3786 0.1709 0.0260  0.0204  0.0675  177 SER A OG  
1133 N N   . LYS A 150 ? 0.1956 0.3823 0.2029 0.0031  0.0237  0.1108  178 LYS A N   
1134 C CA  . LYS A 150 ? 0.2164 0.3831 0.2376 -0.0076 0.0182  0.1251  178 LYS A CA  
1135 C C   . LYS A 150 ? 0.2029 0.3454 0.2150 -0.0036 0.0131  0.1149  178 LYS A C   
1136 O O   . LYS A 150 ? 0.2081 0.3242 0.2319 -0.0102 0.0078  0.1185  178 LYS A O   
1137 C CB  . LYS A 150 ? 0.2549 0.4485 0.2843 -0.0108 0.0221  0.1532  178 LYS A CB  
1138 C CG  . LYS A 150 ? 0.2961 0.5155 0.3421 -0.0177 0.0270  0.1690  178 LYS A CG  
1139 C CD  . LYS A 150 ? 0.3490 0.5930 0.4081 -0.0232 0.0304  0.2016  178 LYS A CD  
1140 C CE  . LYS A 150 ? 0.4026 0.6704 0.4865 -0.0340 0.0339  0.2211  178 LYS A CE  
1141 N NZ  . LYS A 150 ? 0.4142 0.7190 0.4885 -0.0235 0.0435  0.2140  178 LYS A NZ  
1142 N N   . ALA A 151 ? 0.1978 0.3491 0.1914 0.0071  0.0141  0.1019  179 ALA A N   
1143 C CA  . ALA A 151 ? 0.1878 0.3262 0.1740 0.0114  0.0091  0.0954  179 ALA A CA  
1144 C C   . ALA A 151 ? 0.1762 0.2892 0.1611 0.0125  0.0057  0.0738  179 ALA A C   
1145 O O   . ALA A 151 ? 0.1731 0.2751 0.1569 0.0148  0.0016  0.0696  179 ALA A O   
1146 C CB  . ALA A 151 ? 0.1975 0.3648 0.1656 0.0210  0.0102  0.0948  179 ALA A CB  
1147 N N   . HIS A 152 ? 0.1750 0.2829 0.1608 0.0117  0.0074  0.0626  180 HIS A N   
1148 C CA  . HIS A 152 ? 0.1673 0.2558 0.1522 0.0132  0.0049  0.0458  180 HIS A CA  
1149 C C   . HIS A 152 ? 0.1533 0.2373 0.1428 0.0108  0.0065  0.0403  180 HIS A C   
1150 O O   . HIS A 152 ? 0.1524 0.2527 0.1441 0.0108  0.0098  0.0452  180 HIS A O   
1151 C CB  . HIS A 152 ? 0.1683 0.2628 0.1432 0.0208  0.0031  0.0331  180 HIS A CB  
1152 C CG  . HIS A 152 ? 0.1770 0.2842 0.1460 0.0268  0.0060  0.0237  180 HIS A CG  
1153 N ND1 . HIS A 152 ? 0.1835 0.3166 0.1441 0.0320  0.0101  0.0282  180 HIS A ND1 
1154 C CD2 . HIS A 152 ? 0.1676 0.2662 0.1392 0.0297  0.0060  0.0111  180 HIS A CD2 
1155 C CE1 . HIS A 152 ? 0.1999 0.3387 0.1579 0.0390  0.0127  0.0160  180 HIS A CE1 
1156 N NE2 . HIS A 152 ? 0.1774 0.2930 0.1434 0.0374  0.0096  0.0057  180 HIS A NE2 
1157 N N   . ILE A 153 ? 0.1595 0.2254 0.1508 0.0099  0.0043  0.0315  181 ILE A N   
1158 C CA  . ILE A 153 ? 0.1521 0.2140 0.1462 0.0092  0.0047  0.0257  181 ILE A CA  
1159 C C   . ILE A 153 ? 0.1558 0.2144 0.1480 0.0153  0.0045  0.0156  181 ILE A C   
1160 O O   . ILE A 153 ? 0.1669 0.2191 0.1579 0.0167  0.0024  0.0116  181 ILE A O   
1161 C CB  . ILE A 153 ? 0.1562 0.2025 0.1529 0.0037  0.0022  0.0250  181 ILE A CB  
1162 C CG1 . ILE A 153 ? 0.1647 0.2067 0.1665 -0.0032 0.0001  0.0324  181 ILE A CG1 
1163 C CG2 . ILE A 153 ? 0.1647 0.2119 0.1625 0.0035  0.0019  0.0215  181 ILE A CG2 
1164 C CD1 . ILE A 153 ? 0.1669 0.2241 0.1755 -0.0082 0.0003  0.0412  181 ILE A CD1 
1165 N N   . HIS A 154 ? 0.1565 0.2207 0.1512 0.0192  0.0060  0.0125  182 HIS A N   
1166 C CA  . HIS A 154 ? 0.1564 0.2144 0.1541 0.0247  0.0050  0.0034  182 HIS A CA  
1167 C C   . HIS A 154 ? 0.1575 0.2064 0.1623 0.0223  0.0044  0.0063  182 HIS A C   
1168 O O   . HIS A 154 ? 0.1556 0.2112 0.1626 0.0211  0.0054  0.0118  182 HIS A O   
1169 C CB  . HIS A 154 ? 0.1741 0.2431 0.1714 0.0333  0.0071  -0.0028 182 HIS A CB  
1170 C CG  . HIS A 154 ? 0.1885 0.2452 0.1941 0.0385  0.0050  -0.0117 182 HIS A CG  
1171 N ND1 . HIS A 154 ? 0.2362 0.2837 0.2420 0.0410  0.0006  -0.0238 182 HIS A ND1 
1172 C CD2 . HIS A 154 ? 0.1925 0.2438 0.2092 0.0409  0.0054  -0.0094 182 HIS A CD2 
1173 C CE1 . HIS A 154 ? 0.2405 0.2750 0.2592 0.0445  -0.0013 -0.0287 182 HIS A CE1 
1174 N NE2 . HIS A 154 ? 0.2051 0.2425 0.2303 0.0458  0.0022  -0.0193 182 HIS A NE2 
1175 N N   . CYS A 155 ? 0.1540 0.1919 0.1632 0.0214  0.0026  0.0043  183 CYS A N   
1176 C CA  . CYS A 155 ? 0.1535 0.1867 0.1686 0.0196  0.0029  0.0100  183 CYS A CA  
1177 C C   . CYS A 155 ? 0.1623 0.1875 0.1902 0.0221  0.0012  0.0085  183 CYS A C   
1178 O O   . CYS A 155 ? 0.1707 0.1901 0.2025 0.0219  -0.0014 0.0019  183 CYS A O   
1179 C CB  . CYS A 155 ? 0.1608 0.1915 0.1718 0.0153  0.0037  0.0131  183 CYS A CB  
1180 S SG  . CYS A 155 ? 0.1916 0.2239 0.1918 0.0119  0.0038  0.0127  183 CYS A SG  
1181 N N   . SER A 156 ? 0.1547 0.1793 0.1913 0.0238  0.0016  0.0155  184 SER A N   
1182 C CA  . SER A 156 ? 0.1635 0.1769 0.2177 0.0251  -0.0006 0.0170  184 SER A CA  
1183 C C   . SER A 156 ? 0.1675 0.1841 0.2298 0.0234  0.0009  0.0329  184 SER A C   
1184 O O   . SER A 156 ? 0.1702 0.1991 0.2218 0.0228  0.0030  0.0399  184 SER A O   
1185 C CB  . SER A 156 ? 0.1715 0.1780 0.2341 0.0326  -0.0026 0.0081  184 SER A CB  
1186 O OG  . SER A 156 ? 0.1725 0.1881 0.2353 0.0381  0.0000  0.0141  184 SER A OG  
1187 N N   . VAL A 157 ? 0.1844 0.1912 0.2659 0.0221  -0.0010 0.0385  185 VAL A N   
1188 C CA  . VAL A 157 ? 0.1811 0.1932 0.2737 0.0206  0.0007  0.0580  185 VAL A CA  
1189 C C   . VAL A 157 ? 0.2028 0.2009 0.3205 0.0241  -0.0027 0.0641  185 VAL A C   
1190 O O   . VAL A 157 ? 0.2003 0.1795 0.3315 0.0255  -0.0075 0.0513  185 VAL A O   
1191 C CB  . VAL A 157 ? 0.1774 0.1959 0.2736 0.0142  0.0032  0.0671  185 VAL A CB  
1192 C CG1 . VAL A 157 ? 0.1639 0.1956 0.2364 0.0132  0.0073  0.0618  185 VAL A CG1 
1193 C CG2 . VAL A 157 ? 0.1824 0.1868 0.2990 0.0094  -0.0013 0.0617  185 VAL A CG2 
1194 N N   . LYS A 158 ? 0.2025 0.2095 0.3278 0.0253  -0.0010 0.0845  186 LYS A N   
1195 C CA  . LYS A 158 ? 0.2349 0.2284 0.3901 0.0276  -0.0040 0.0979  186 LYS A CA  
1196 C C   . LYS A 158 ? 0.2442 0.2222 0.4228 0.0197  -0.0072 0.1000  186 LYS A C   
1197 O O   . LYS A 158 ? 0.2218 0.2092 0.3943 0.0123  -0.0050 0.1009  186 LYS A O   
1198 C CB  . LYS A 158 ? 0.2503 0.2630 0.4071 0.0293  -0.0013 0.1242  186 LYS A CB  
1199 C CG  . LYS A 158 ? 0.2690 0.2978 0.4082 0.0361  -0.0008 0.1232  186 LYS A CG  
1200 C CD  . LYS A 158 ? 0.3038 0.3592 0.4362 0.0360  0.0009  0.1477  186 LYS A CD  
1201 C CE  . LYS A 158 ? 0.3172 0.3921 0.4334 0.0411  -0.0009 0.1467  186 LYS A CE  
1202 N NZ  . LYS A 158 ? 0.3317 0.3977 0.4685 0.0505  -0.0040 0.1481  186 LYS A NZ  
1203 N N   . ALA A 159 ? 0.2846 0.2396 0.4929 0.0214  -0.0128 0.1020  187 ALA A N   
1204 C CA  . ALA A 159 ? 0.3239 0.2617 0.5646 0.0122  -0.0181 0.1089  187 ALA A CA  
1205 C C   . ALA A 159 ? 0.3337 0.2904 0.5879 0.0048  -0.0132 0.1425  187 ALA A C   
1206 O O   . ALA A 159 ? 0.3327 0.3094 0.5772 0.0095  -0.0077 0.1617  187 ALA A O   
1207 C CB  . ALA A 159 ? 0.3462 0.2523 0.6169 0.0175  -0.0258 0.1033  187 ALA A CB  
1208 N N   . GLU A 160 ? 0.3581 0.3110 0.6361 -0.0065 -0.0159 0.1498  188 GLU A N   
1209 C CA  . GLU A 160 ? 0.3702 0.3408 0.6706 -0.0147 -0.0115 0.1844  188 GLU A CA  
1210 C C   . GLU A 160 ? 0.4052 0.3576 0.7418 -0.0133 -0.0158 0.2069  188 GLU A C   
1211 O O   . GLU A 160 ? 0.4258 0.4013 0.7522 -0.0082 -0.0090 0.2298  188 GLU A O   
1212 C CB  . GLU A 160 ? 0.3674 0.3380 0.6909 -0.0283 -0.0147 0.1854  188 GLU A CB  
1213 C CG  . GLU A 160 ? 0.3494 0.3307 0.6472 -0.0298 -0.0137 0.1613  188 GLU A CG  
1214 C CD  . GLU A 160 ? 0.3299 0.3456 0.5909 -0.0241 -0.0014 0.1658  188 GLU A CD  
1215 O OE1 . GLU A 160 ? 0.3470 0.3891 0.6123 -0.0253 0.0072  0.1937  188 GLU A OE1 
1216 O OE2 . GLU A 160 ? 0.2738 0.2908 0.5025 -0.0182 -0.0003 0.1424  188 GLU A OE2 
1217 N N   . GLN B 1   ? 0.6198 0.6009 0.5613 -0.1525 0.1453  0.0313  1   GLN H N   
1218 C CA  . GLN B 1   ? 0.5965 0.5581 0.5394 -0.1322 0.1318  0.0361  1   GLN H CA  
1219 C C   . GLN B 1   ? 0.5160 0.5091 0.4784 -0.1114 0.1168  0.0325  1   GLN H C   
1220 O O   . GLN B 1   ? 0.4516 0.4811 0.4383 -0.1111 0.1114  0.0201  1   GLN H O   
1221 C CB  . GLN B 1   ? 0.6461 0.6011 0.5989 -0.1408 0.1310  0.0282  1   GLN H CB  
1222 C CG  . GLN B 1   ? 0.6849 0.6295 0.6437 -0.1212 0.1173  0.0304  1   GLN H CG  
1223 C CD  . GLN B 1   ? 0.7568 0.6596 0.6899 -0.1077 0.1165  0.0454  1   GLN H CD  
1224 O OE1 . GLN B 1   ? 0.8633 0.7293 0.7704 -0.1161 0.1272  0.0535  1   GLN H OE1 
1225 N NE2 . GLN B 1   ? 0.7391 0.6476 0.6781 -0.0866 0.1040  0.0489  1   GLN H NE2 
1226 N N   . VAL B 2   ? 0.4673 0.4455 0.4183 -0.0934 0.1097  0.0427  2   VAL H N   
1227 C CA  . VAL B 2   ? 0.3909 0.3937 0.3571 -0.0755 0.0963  0.0393  2   VAL H CA  
1228 C C   . VAL B 2   ? 0.3377 0.3425 0.3199 -0.0693 0.0866  0.0338  2   VAL H C   
1229 O O   . VAL B 2   ? 0.3578 0.3352 0.3316 -0.0690 0.0870  0.0387  2   VAL H O   
1230 C CB  . VAL B 2   ? 0.3937 0.3807 0.3430 -0.0599 0.0914  0.0506  2   VAL H CB  
1231 C CG1 . VAL B 2   ? 0.3659 0.3735 0.3303 -0.0445 0.0780  0.0461  2   VAL H CG1 
1232 C CG2 . VAL B 2   ? 0.4205 0.4063 0.3521 -0.0646 0.1004  0.0563  2   VAL H CG2 
1233 N N   . GLN B 3   ? 0.2963 0.3308 0.2985 -0.0633 0.0783  0.0241  3   GLN H N   
1234 C CA  A GLN B 3   ? 0.2710 0.3073 0.2861 -0.0561 0.0687  0.0195  3   GLN H CA  
1235 C CA  B GLN B 3   ? 0.2776 0.3136 0.2925 -0.0561 0.0687  0.0196  3   GLN H CA  
1236 C C   . GLN B 3   ? 0.2378 0.2931 0.2624 -0.0420 0.0579  0.0156  3   GLN H C   
1237 O O   . GLN B 3   ? 0.2240 0.3022 0.2544 -0.0417 0.0584  0.0097  3   GLN H O   
1238 C CB  A GLN B 3   ? 0.2812 0.3320 0.3098 -0.0682 0.0715  0.0088  3   GLN H CB  
1239 C CB  B GLN B 3   ? 0.2982 0.3474 0.3265 -0.0678 0.0712  0.0091  3   GLN H CB  
1240 C CG  A GLN B 3   ? 0.3154 0.3410 0.3333 -0.0829 0.0813  0.0115  3   GLN H CG  
1241 C CG  B GLN B 3   ? 0.3072 0.3463 0.3408 -0.0620 0.0637  0.0078  3   GLN H CG  
1242 C CD  A GLN B 3   ? 0.3197 0.3615 0.3522 -0.0941 0.0821  -0.0005 3   GLN H CD  
1243 C CD  B GLN B 3   ? 0.3218 0.3839 0.3721 -0.0658 0.0602  -0.0044 3   GLN H CD  
1244 O OE1 A GLN B 3   ? 0.3175 0.3691 0.3618 -0.0859 0.0728  -0.0059 3   GLN H OE1 
1245 O OE1 B GLN B 3   ? 0.3496 0.4397 0.4102 -0.0726 0.0629  -0.0135 3   GLN H OE1 
1246 N NE2 A GLN B 3   ? 0.3458 0.3872 0.3749 -0.1139 0.0938  -0.0043 3   GLN H NE2 
1247 N NE2 B GLN B 3   ? 0.3253 0.3778 0.3780 -0.0603 0.0538  -0.0050 3   GLN H NE2 
1248 N N   . LEU B 4   ? 0.2109 0.2557 0.2359 -0.0317 0.0494  0.0185  4   LEU H N   
1249 C CA  . LEU B 4   ? 0.2032 0.2601 0.2356 -0.0205 0.0394  0.0141  4   LEU H CA  
1250 C C   . LEU B 4   ? 0.1976 0.2550 0.2394 -0.0198 0.0344  0.0090  4   LEU H C   
1251 O O   . LEU B 4   ? 0.2074 0.2479 0.2460 -0.0195 0.0335  0.0134  4   LEU H O   
1252 C CB  . LEU B 4   ? 0.2030 0.2476 0.2261 -0.0115 0.0346  0.0215  4   LEU H CB  
1253 C CG  . LEU B 4   ? 0.2204 0.2663 0.2326 -0.0108 0.0384  0.0261  4   LEU H CG  
1254 C CD1 . LEU B 4   ? 0.2251 0.2635 0.2294 -0.0015 0.0324  0.0319  4   LEU H CD1 
1255 C CD2 . LEU B 4   ? 0.2320 0.2994 0.2490 -0.0106 0.0389  0.0186  4   LEU H CD2 
1256 N N   . GLN B 5   ? 0.2065 0.2835 0.2581 -0.0175 0.0308  0.0000  5   GLN H N   
1257 C CA  . GLN B 5   ? 0.2184 0.2988 0.2775 -0.0155 0.0254  -0.0057 5   GLN H CA  
1258 C C   . GLN B 5   ? 0.1847 0.2634 0.2419 -0.0031 0.0161  -0.0068 5   GLN H C   
1259 O O   . GLN B 5   ? 0.1696 0.2614 0.2277 0.0035  0.0131  -0.0120 5   GLN H O   
1260 C CB  . GLN B 5   ? 0.2484 0.3531 0.3183 -0.0219 0.0283  -0.0158 5   GLN H CB  
1261 C CG  . GLN B 5   ? 0.3041 0.4150 0.3807 -0.0195 0.0225  -0.0224 5   GLN H CG  
1262 C CD  . GLN B 5   ? 0.3757 0.4661 0.4491 -0.0259 0.0244  -0.0183 5   GLN H CD  
1263 O OE1 . GLN B 5   ? 0.3945 0.4680 0.4617 -0.0342 0.0316  -0.0122 5   GLN H OE1 
1264 N NE2 . GLN B 5   ? 0.3776 0.4675 0.4528 -0.0205 0.0178  -0.0215 5   GLN H NE2 
1265 N N   . GLN B 6   ? 0.1591 0.2217 0.2126 -0.0006 0.0122  -0.0028 6   GLN H N   
1266 C CA  . GLN B 6   ? 0.1591 0.2155 0.2077 0.0082  0.0047  -0.0033 6   GLN H CA  
1267 C C   . GLN B 6   ? 0.1722 0.2329 0.2231 0.0124  -0.0001 -0.0092 6   GLN H C   
1268 O O   . GLN B 6   ? 0.1748 0.2409 0.2318 0.0073  0.0017  -0.0119 6   GLN H O   
1269 C CB  . GLN B 6   ? 0.1654 0.2052 0.2079 0.0079  0.0037  0.0036  6   GLN H CB  
1270 C CG  . GLN B 6   ? 0.1709 0.2090 0.2091 0.0072  0.0063  0.0087  6   GLN H CG  
1271 C CD  . GLN B 6   ? 0.1713 0.1996 0.2049 0.0079  0.0046  0.0141  6   GLN H CD  
1272 O OE1 . GLN B 6   ? 0.1691 0.1938 0.2015 0.0065  0.0079  0.0194  6   GLN H OE1 
1273 N NE2 . GLN B 6   ? 0.1857 0.2097 0.2156 0.0101  -0.0002 0.0125  6   GLN H NE2 
1274 N N   . SER B 7   ? 0.1763 0.2313 0.2198 0.0214  -0.0062 -0.0108 7   SER H N   
1275 C CA  . SER B 7   ? 0.1807 0.2341 0.2204 0.0287  -0.0122 -0.0148 7   SER H CA  
1276 C C   . SER B 7   ? 0.1837 0.2219 0.2197 0.0245  -0.0125 -0.0101 7   SER H C   
1277 O O   . SER B 7   ? 0.1687 0.1974 0.2044 0.0181  -0.0090 -0.0041 7   SER H O   
1278 C CB  . SER B 7   ? 0.1942 0.2396 0.2222 0.0401  -0.0178 -0.0170 7   SER H CB  
1279 O OG  . SER B 7   ? 0.1892 0.2151 0.2077 0.0373  -0.0173 -0.0113 7   SER H OG  
1280 N N   . GLY B 8   ? 0.1847 0.2240 0.2181 0.0292  -0.0166 -0.0136 8   GLY H N   
1281 C CA  . GLY B 8   ? 0.1931 0.2220 0.2234 0.0255  -0.0165 -0.0108 8   GLY H CA  
1282 C C   . GLY B 8   ? 0.2025 0.2099 0.2199 0.0256  -0.0175 -0.0048 8   GLY H C   
1283 O O   . GLY B 8   ? 0.2157 0.2128 0.2241 0.0287  -0.0192 -0.0032 8   GLY H O   
1284 N N   . PRO B 9   ? 0.2046 0.2047 0.2192 0.0220  -0.0166 -0.0025 9   PRO H N   
1285 C CA  . PRO B 9   ? 0.2110 0.1940 0.2142 0.0194  -0.0162 0.0024  9   PRO H CA  
1286 C C   . PRO B 9   ? 0.2364 0.2033 0.2213 0.0264  -0.0210 0.0023  9   PRO H C   
1287 O O   . PRO B 9   ? 0.2640 0.2336 0.2445 0.0355  -0.0255 -0.0013 9   PRO H O   
1288 C CB  . PRO B 9   ? 0.2095 0.1926 0.2143 0.0152  -0.0139 0.0032  9   PRO H CB  
1289 C CG  . PRO B 9   ? 0.2059 0.2016 0.2172 0.0184  -0.0158 -0.0024 9   PRO H CG  
1290 C CD  . PRO B 9   ? 0.2038 0.2130 0.2256 0.0192  -0.0154 -0.0056 9   PRO H CD  
1291 N N   . GLU B 10  ? 0.2521 0.2016 0.2249 0.0222  -0.0198 0.0061  10  GLU H N   
1292 C CA  . GLU B 10  ? 0.2988 0.2248 0.2493 0.0277  -0.0232 0.0067  10  GLU H CA  
1293 C C   . GLU B 10  ? 0.3048 0.2119 0.2403 0.0196  -0.0203 0.0112  10  GLU H C   
1294 O O   . GLU B 10  ? 0.3103 0.2217 0.2523 0.0082  -0.0156 0.0131  10  GLU H O   
1295 C CB  . GLU B 10  ? 0.3080 0.2271 0.2550 0.0273  -0.0233 0.0060  10  GLU H CB  
1296 C CG  . GLU B 10  ? 0.3188 0.2571 0.2792 0.0346  -0.0251 0.0015  10  GLU H CG  
1297 C CD  . GLU B 10  ? 0.3734 0.3085 0.3242 0.0496  -0.0308 -0.0028 10  GLU H CD  
1298 O OE1 . GLU B 10  ? 0.3828 0.2961 0.3130 0.0566  -0.0343 -0.0017 10  GLU H OE1 
1299 O OE2 . GLU B 10  ? 0.3782 0.3319 0.3403 0.0549  -0.0316 -0.0073 10  GLU H OE2 
1300 N N   . LEU B 11  ? 0.3034 0.1907 0.2179 0.0256  -0.0231 0.0125  11  LEU H N   
1301 C CA  . LEU B 11  ? 0.3261 0.1883 0.2190 0.0173  -0.0197 0.0170  11  LEU H CA  
1302 C C   . LEU B 11  ? 0.3555 0.1874 0.2248 0.0205  -0.0215 0.0176  11  LEU H C   
1303 O O   . LEU B 11  ? 0.3682 0.1901 0.2257 0.0362  -0.0275 0.0160  11  LEU H O   
1304 C CB  . LEU B 11  ? 0.3326 0.1884 0.2130 0.0228  -0.0213 0.0187  11  LEU H CB  
1305 C CG  . LEU B 11  ? 0.3778 0.2020 0.2290 0.0159  -0.0178 0.0241  11  LEU H CG  
1306 C CD1 . LEU B 11  ? 0.3673 0.1999 0.2274 -0.0029 -0.0094 0.0257  11  LEU H CD1 
1307 C CD2 . LEU B 11  ? 0.3895 0.2059 0.2244 0.0255  -0.0210 0.0258  11  LEU H CD2 
1308 N N   . VAL B 12  ? 0.3607 0.1782 0.2218 0.0068  -0.0166 0.0191  12  VAL H N   
1309 C CA  A VAL B 12  ? 0.4068 0.1909 0.2430 0.0077  -0.0175 0.0188  12  VAL H CA  
1310 C CA  B VAL B 12  ? 0.3976 0.1824 0.2346 0.0071  -0.0173 0.0187  12  VAL H CA  
1311 C C   . VAL B 12  ? 0.4432 0.1974 0.2549 -0.0085 -0.0111 0.0225  12  VAL H C   
1312 O O   . VAL B 12  ? 0.4181 0.1888 0.2425 -0.0251 -0.0051 0.0227  12  VAL H O   
1313 C CB  A VAL B 12  ? 0.4003 0.2004 0.2535 0.0065  -0.0182 0.0142  12  VAL H CB  
1314 C CB  B VAL B 12  ? 0.3820 0.1803 0.2342 0.0037  -0.0173 0.0143  12  VAL H CB  
1315 C CG1 A VAL B 12  ? 0.3886 0.2070 0.2548 0.0245  -0.0243 0.0107  12  VAL H CG1 
1316 C CG1 B VAL B 12  ? 0.4095 0.1775 0.2385 0.0135  -0.0210 0.0119  12  VAL H CG1 
1317 C CG2 A VAL B 12  ? 0.3682 0.1986 0.2470 -0.0077 -0.0135 0.0137  12  VAL H CG2 
1318 C CG2 B VAL B 12  ? 0.3318 0.1697 0.2160 0.0099  -0.0193 0.0116  12  VAL H CG2 
1319 N N   . ARG B 13  ? 0.4928 0.2035 0.2690 -0.0035 -0.0122 0.0248  13  ARG H N   
1320 C CA  A ARG B 13  ? 0.5523 0.2269 0.2990 -0.0209 -0.0049 0.0285  13  ARG H CA  
1321 C CA  B ARG B 13  ? 0.5544 0.2284 0.3006 -0.0207 -0.0050 0.0285  13  ARG H CA  
1322 C C   . ARG B 13  ? 0.5484 0.2225 0.2996 -0.0382 -0.0006 0.0239  13  ARG H C   
1323 O O   . ARG B 13  ? 0.5350 0.2141 0.2943 -0.0308 -0.0048 0.0192  13  ARG H O   
1324 C CB  A ARG B 13  ? 0.6241 0.2445 0.3258 -0.0103 -0.0069 0.0327  13  ARG H CB  
1325 C CB  B ARG B 13  ? 0.6289 0.2483 0.3302 -0.0100 -0.0071 0.0324  13  ARG H CB  
1326 C CG  A ARG B 13  ? 0.6610 0.2762 0.3502 0.0070  -0.0115 0.0375  13  ARG H CG  
1327 C CG  B ARG B 13  ? 0.6695 0.2831 0.3581 0.0104  -0.0129 0.0367  13  ARG H CG  
1328 C CD  A ARG B 13  ? 0.7376 0.2930 0.3756 0.0140  -0.0116 0.0433  13  ARG H CD  
1329 C CD  B ARG B 13  ? 0.7440 0.3010 0.3853 0.0247  -0.0161 0.0404  13  ARG H CD  
1330 N NE  A ARG B 13  ? 0.7766 0.2983 0.3899 -0.0115 -0.0009 0.0467  13  ARG H NE  
1331 N NE  B ARG B 13  ? 0.7934 0.3067 0.4064 0.0071  -0.0089 0.0412  13  ARG H NE  
1332 C CZ  A ARG B 13  ? 0.7838 0.3037 0.3891 -0.0269 0.0065  0.0517  13  ARG H CZ  
1333 C CZ  B ARG B 13  ? 0.8305 0.3081 0.4206 0.0149  -0.0113 0.0386  13  ARG H CZ  
1334 N NH1 A ARG B 13  ? 0.7619 0.3078 0.3794 -0.0174 0.0037  0.0541  13  ARG H NH1 
1335 N NH1 B ARG B 13  ? 0.8361 0.3165 0.4268 0.0424  -0.0210 0.0353  13  ARG H NH1 
1336 N NH2 A ARG B 13  ? 0.8179 0.3115 0.4031 -0.0526 0.0171  0.0535  13  ARG H NH2 
1337 N NH2 B ARG B 13  ? 0.8691 0.3093 0.4355 -0.0056 -0.0035 0.0384  13  ARG H NH2 
1338 N N   . PRO B 14  ? 0.5620 0.2300 0.3062 -0.0618 0.0079  0.0244  14  PRO H N   
1339 C CA  . PRO B 14  ? 0.5748 0.2395 0.3186 -0.0804 0.0121  0.0189  14  PRO H CA  
1340 C C   . PRO B 14  ? 0.6192 0.2344 0.3294 -0.0746 0.0098  0.0175  14  PRO H C   
1341 O O   . PRO B 14  ? 0.6458 0.2171 0.3213 -0.0666 0.0096  0.0227  14  PRO H O   
1342 C CB  . PRO B 14  ? 0.6131 0.2700 0.3447 -0.1066 0.0225  0.0202  14  PRO H CB  
1343 C CG  . PRO B 14  ? 0.6060 0.2767 0.3427 -0.1010 0.0236  0.0261  14  PRO H CG  
1344 C CD  . PRO B 14  ? 0.5863 0.2526 0.3223 -0.0726 0.0142  0.0293  14  PRO H CD  
1345 N N   . GLY B 15  ? 0.6030 0.2233 0.3208 -0.0789 0.0086  0.0105  15  GLY H N   
1346 C CA  . GLY B 15  ? 0.6532 0.2279 0.3403 -0.0737 0.0066  0.0072  15  GLY H CA  
1347 C C   . GLY B 15  ? 0.6487 0.2300 0.3433 -0.0448 -0.0028 0.0055  15  GLY H C   
1348 O O   . GLY B 15  ? 0.6907 0.2501 0.3713 -0.0393 -0.0052 0.0002  15  GLY H O   
1349 N N   . VAL B 16  ? 0.6203 0.2312 0.3354 -0.0277 -0.0077 0.0089  16  VAL H N   
1350 C CA  . VAL B 16  ? 0.6297 0.2516 0.3526 -0.0001 -0.0162 0.0071  16  VAL H CA  
1351 C C   . VAL B 16  ? 0.5763 0.2467 0.3373 -0.0004 -0.0180 0.0016  16  VAL H C   
1352 O O   . VAL B 16  ? 0.5600 0.2589 0.3431 -0.0182 -0.0137 0.0011  16  VAL H O   
1353 C CB  . VAL B 16  ? 0.6434 0.2733 0.3676 0.0136  -0.0194 0.0130  16  VAL H CB  
1354 C CG1 . VAL B 16  ? 0.6310 0.2884 0.3730 0.0381  -0.0274 0.0102  16  VAL H CG1 
1355 C CG2 . VAL B 16  ? 0.7106 0.2869 0.3906 0.0163  -0.0181 0.0190  16  VAL H CG2 
1356 N N   . SER B 17  ? 0.5417 0.2218 0.3091 0.0183  -0.0238 -0.0026 17  SER H N   
1357 C CA  A SER B 17  ? 0.4917 0.2173 0.2933 0.0195  -0.0250 -0.0067 17  SER H CA  
1358 C CA  B SER B 17  ? 0.4990 0.2245 0.3005 0.0201  -0.0252 -0.0067 17  SER H CA  
1359 C C   . SER B 17  ? 0.4575 0.2193 0.2842 0.0316  -0.0280 -0.0044 17  SER H C   
1360 O O   . SER B 17  ? 0.4721 0.2235 0.2882 0.0431  -0.0308 -0.0017 17  SER H O   
1361 C CB  A SER B 17  ? 0.5024 0.2179 0.2953 0.0287  -0.0278 -0.0136 17  SER H CB  
1362 C CB  B SER B 17  ? 0.5138 0.2325 0.3086 0.0318  -0.0285 -0.0135 17  SER H CB  
1363 O OG  A SER B 17  ? 0.5205 0.1959 0.2856 0.0159  -0.0246 -0.0160 17  SER H OG  
1364 O OG  B SER B 17  ? 0.5251 0.2377 0.3113 0.0558  -0.0341 -0.0146 17  SER H OG  
1365 N N   . VAL B 18  ? 0.4022 0.2038 0.2592 0.0282  -0.0271 -0.0058 18  VAL H N   
1366 C CA  . VAL B 18  ? 0.3728 0.2082 0.2534 0.0379  -0.0290 -0.0053 18  VAL H CA  
1367 C C   . VAL B 18  ? 0.3600 0.2223 0.2589 0.0414  -0.0293 -0.0097 18  VAL H C   
1368 O O   . VAL B 18  ? 0.3473 0.2124 0.2490 0.0313  -0.0269 -0.0110 18  VAL H O   
1369 C CB  . VAL B 18  ? 0.3550 0.2083 0.2517 0.0267  -0.0256 -0.0003 18  VAL H CB  
1370 C CG1 . VAL B 18  ? 0.3312 0.2040 0.2446 0.0125  -0.0216 0.0000  18  VAL H CG1 
1371 C CG2 . VAL B 18  ? 0.3504 0.2285 0.2641 0.0360  -0.0275 -0.0002 18  VAL H CG2 
1372 N N   . LYS B 19  ? 0.3529 0.2367 0.2638 0.0542  -0.0317 -0.0122 19  LYS H N   
1373 C CA  . LYS B 19  ? 0.3332 0.2441 0.2609 0.0569  -0.0308 -0.0162 19  LYS H CA  
1374 C C   . LYS B 19  ? 0.2999 0.2421 0.2510 0.0552  -0.0289 -0.0145 19  LYS H C   
1375 O O   . LYS B 19  ? 0.3081 0.2573 0.2614 0.0638  -0.0315 -0.0160 19  LYS H O   
1376 C CB  . LYS B 19  ? 0.3772 0.2832 0.2940 0.0735  -0.0346 -0.0230 19  LYS H CB  
1377 C CG  . LYS B 19  ? 0.3793 0.3135 0.3111 0.0764  -0.0328 -0.0277 19  LYS H CG  
1378 C CD  . LYS B 19  ? 0.4435 0.3700 0.3614 0.0943  -0.0367 -0.0354 19  LYS H CD  
1379 C CE  . LYS B 19  ? 0.4796 0.4390 0.4123 0.1008  -0.0351 -0.0416 19  LYS H CE  
1380 N NZ  . LYS B 19  ? 0.5309 0.4846 0.4497 0.1216  -0.0395 -0.0502 19  LYS H NZ  
1381 N N   . ILE B 20  ? 0.2681 0.2280 0.2344 0.0453  -0.0247 -0.0122 20  ILE H N   
1382 C CA  . ILE B 20  ? 0.2483 0.2319 0.2337 0.0414  -0.0217 -0.0100 20  ILE H CA  
1383 C C   . ILE B 20  ? 0.2380 0.2438 0.2346 0.0424  -0.0188 -0.0126 20  ILE H C   
1384 O O   . ILE B 20  ? 0.2340 0.2378 0.2249 0.0436  -0.0187 -0.0146 20  ILE H O   
1385 C CB  . ILE B 20  ? 0.2640 0.2449 0.2540 0.0299  -0.0188 -0.0039 20  ILE H CB  
1386 C CG1 . ILE B 20  ? 0.2788 0.2616 0.2697 0.0227  -0.0166 -0.0019 20  ILE H CG1 
1387 C CG2 . ILE B 20  ? 0.2957 0.2556 0.2728 0.0284  -0.0207 -0.0021 20  ILE H CG2 
1388 C CD1 . ILE B 20  ? 0.2874 0.2715 0.2833 0.0137  -0.0143 0.0030  20  ILE H CD1 
1389 N N   . SER B 21  ? 0.2051 0.2312 0.2155 0.0414  -0.0161 -0.0136 21  SER H N   
1390 C CA  . SER B 21  ? 0.1954 0.2436 0.2146 0.0424  -0.0126 -0.0173 21  SER H CA  
1391 C C   . SER B 21  ? 0.1831 0.2411 0.2129 0.0312  -0.0060 -0.0124 21  SER H C   
1392 O O   . SER B 21  ? 0.1792 0.2314 0.2125 0.0253  -0.0049 -0.0082 21  SER H O   
1393 C CB  . SER B 21  ? 0.1985 0.2633 0.2217 0.0522  -0.0150 -0.0254 21  SER H CB  
1394 O OG  . SER B 21  ? 0.2080 0.2836 0.2410 0.0487  -0.0144 -0.0262 21  SER H OG  
1395 N N   . CYS B 22  ? 0.1675 0.2385 0.2003 0.0291  -0.0015 -0.0130 22  CYS H N   
1396 C CA  . CYS B 22  ? 0.1681 0.2444 0.2057 0.0194  0.0056  -0.0078 22  CYS H CA  
1397 C C   . CYS B 22  ? 0.1736 0.2708 0.2161 0.0176  0.0111  -0.0123 22  CYS H C   
1398 O O   . CYS B 22  ? 0.1732 0.2760 0.2109 0.0219  0.0113  -0.0144 22  CYS H O   
1399 C CB  . CYS B 22  ? 0.1792 0.2434 0.2088 0.0176  0.0058  -0.0009 22  CYS H CB  
1400 S SG  . CYS B 22  ? 0.1845 0.2498 0.2132 0.0096  0.0141  0.0067  22  CYS H SG  
1401 N N   . LYS B 23  ? 0.1796 0.2895 0.2312 0.0106  0.0159  -0.0148 23  LYS H N   
1402 C CA  . LYS B 23  ? 0.1861 0.3211 0.2443 0.0066  0.0222  -0.0210 23  LYS H CA  
1403 C C   . LYS B 23  ? 0.1828 0.3123 0.2377 -0.0067 0.0321  -0.0140 23  LYS H C   
1404 O O   . LYS B 23  ? 0.1697 0.2864 0.2249 -0.0153 0.0352  -0.0096 23  LYS H O   
1405 C CB  . LYS B 23  ? 0.2123 0.3695 0.2828 0.0068  0.0210  -0.0308 23  LYS H CB  
1406 C CG  . LYS B 23  ? 0.2446 0.4345 0.3241 0.0021  0.0276  -0.0393 23  LYS H CG  
1407 C CD  . LYS B 23  ? 0.2874 0.5053 0.3805 0.0037  0.0252  -0.0508 23  LYS H CD  
1408 C CE  . LYS B 23  ? 0.3456 0.5983 0.4496 -0.0072 0.0344  -0.0591 23  LYS H CE  
1409 N NZ  . LYS B 23  ? 0.3894 0.6764 0.5012 0.0071  0.0300  -0.0714 23  LYS H NZ  
1410 N N   . GLY B 24  ? 0.1927 0.3309 0.2430 -0.0084 0.0375  -0.0135 24  GLY H N   
1411 C CA  . GLY B 24  ? 0.2090 0.3388 0.2512 -0.0203 0.0475  -0.0059 24  GLY H CA  
1412 C C   . GLY B 24  ? 0.2274 0.3796 0.2768 -0.0326 0.0572  -0.0123 24  GLY H C   
1413 O O   . GLY B 24  ? 0.2474 0.4281 0.3052 -0.0289 0.0570  -0.0221 24  GLY H O   
1414 N N   . SER B 25  ? 0.2243 0.3634 0.2685 -0.0471 0.0662  -0.0071 25  SER H N   
1415 C CA  . SER B 25  ? 0.2446 0.4012 0.2922 -0.0638 0.0780  -0.0122 25  SER H CA  
1416 C C   . SER B 25  ? 0.2640 0.3923 0.2921 -0.0758 0.0889  -0.0005 25  SER H C   
1417 O O   . SER B 25  ? 0.2497 0.3464 0.2653 -0.0703 0.0858  0.0098  25  SER H O   
1418 C CB  . SER B 25  ? 0.2390 0.4099 0.3022 -0.0713 0.0772  -0.0219 25  SER H CB  
1419 O OG  . SER B 25  ? 0.2467 0.3869 0.3041 -0.0734 0.0753  -0.0153 25  SER H OG  
1420 N N   . GLY B 26  ? 0.2934 0.4334 0.3185 -0.0921 0.1018  -0.0029 26  GLY H N   
1421 C CA  . GLY B 26  ? 0.3425 0.4501 0.3450 -0.1060 0.1139  0.0082  26  GLY H CA  
1422 C C   . GLY B 26  ? 0.3725 0.4683 0.3550 -0.0991 0.1164  0.0186  26  GLY H C   
1423 O O   . GLY B 26  ? 0.4312 0.4943 0.3901 -0.1056 0.1245  0.0303  26  GLY H O   
1424 N N   . TYR B 27  ? 0.3606 0.4807 0.3504 -0.0856 0.1095  0.0142  27  TYR H N   
1425 C CA  . TYR B 27  ? 0.3827 0.4986 0.3556 -0.0777 0.1104  0.0214  27  TYR H CA  
1426 C C   . TYR B 27  ? 0.3683 0.5215 0.3561 -0.0676 0.1047  0.0097  27  TYR H C   
1427 O O   . TYR B 27  ? 0.3386 0.5139 0.3470 -0.0636 0.0985  -0.0015 27  TYR H O   
1428 C CB  . TYR B 27  ? 0.3863 0.4701 0.3444 -0.0639 0.1018  0.0333  27  TYR H CB  
1429 C CG  . TYR B 27  ? 0.3613 0.4510 0.3327 -0.0472 0.0865  0.0291  27  TYR H CG  
1430 C CD1 . TYR B 27  ? 0.3501 0.4461 0.3175 -0.0337 0.0790  0.0293  27  TYR H CD1 
1431 C CD2 . TYR B 27  ? 0.3276 0.4141 0.3134 -0.0456 0.0799  0.0252  27  TYR H CD2 
1432 C CE1 . TYR B 27  ? 0.3353 0.4324 0.3116 -0.0210 0.0662  0.0258  27  TYR H CE1 
1433 C CE2 . TYR B 27  ? 0.3173 0.4054 0.3117 -0.0319 0.0672  0.0225  27  TYR H CE2 
1434 C CZ  . TYR B 27  ? 0.3228 0.4149 0.3121 -0.0203 0.0606  0.0229  27  TYR H CZ  
1435 O OH  . TYR B 27  ? 0.3204 0.4114 0.3158 -0.0095 0.0493  0.0200  27  TYR H OH  
1436 N N   . THR B 28  ? 0.3946 0.5549 0.3706 -0.0634 0.1076  0.0117  28  THR H N   
1437 C CA  . THR B 28  ? 0.3981 0.5895 0.3845 -0.0513 0.1019  0.0006  28  THR H CA  
1438 C C   . THR B 28  ? 0.3734 0.5522 0.3616 -0.0332 0.0865  0.0012  28  THR H C   
1439 O O   . THR B 28  ? 0.3659 0.5255 0.3378 -0.0269 0.0833  0.0101  28  THR H O   
1440 C CB  . THR B 28  ? 0.4228 0.6238 0.3937 -0.0529 0.1102  0.0026  28  THR H CB  
1441 O OG1 . THR B 28  ? 0.4861 0.6825 0.4481 -0.0732 0.1256  0.0076  28  THR H OG1 
1442 C CG2 . THR B 28  ? 0.4212 0.6604 0.4048 -0.0443 0.1083  -0.0118 28  THR H CG2 
1443 N N   . PHE B 29  ? 0.3728 0.5618 0.3787 -0.0261 0.0778  -0.0077 29  PHE H N   
1444 C CA  . PHE B 29  ? 0.3770 0.5515 0.3851 -0.0120 0.0641  -0.0078 29  PHE H CA  
1445 C C   . PHE B 29  ? 0.3754 0.5480 0.3724 -0.0003 0.0585  -0.0082 29  PHE H C   
1446 O O   . PHE B 29  ? 0.3607 0.5122 0.3494 0.0051  0.0513  -0.0018 29  PHE H O   
1447 C CB  . PHE B 29  ? 0.3810 0.5726 0.4064 -0.0053 0.0576  -0.0195 29  PHE H CB  
1448 C CG  . PHE B 29  ? 0.3762 0.5493 0.4015 0.0061  0.0453  -0.0190 29  PHE H CG  
1449 C CD1 . PHE B 29  ? 0.3592 0.5086 0.3826 0.0028  0.0424  -0.0106 29  PHE H CD1 
1450 C CD2 . PHE B 29  ? 0.4008 0.5785 0.4254 0.0200  0.0375  -0.0269 29  PHE H CD2 
1451 C CE1 . PHE B 29  ? 0.3845 0.5186 0.4073 0.0114  0.0323  -0.0104 29  PHE H CE1 
1452 C CE2 . PHE B 29  ? 0.3911 0.5484 0.4127 0.0280  0.0276  -0.0261 29  PHE H CE2 
1453 C CZ  . PHE B 29  ? 0.3642 0.5018 0.3860 0.0229  0.0253  -0.0182 29  PHE H CZ  
1454 N N   . ILE B 30  ? 0.3682 0.5638 0.3649 0.0029  0.0620  -0.0163 30  ILE H N   
1455 C CA  . ILE B 30  ? 0.3846 0.5803 0.3707 0.0145  0.0566  -0.0196 30  ILE H CA  
1456 C C   . ILE B 30  ? 0.3740 0.5522 0.3414 0.0123  0.0579  -0.0083 30  ILE H C   
1457 O O   . ILE B 30  ? 0.3905 0.5603 0.3498 0.0211  0.0498  -0.0092 30  ILE H O   
1458 C CB  . ILE B 30  ? 0.3947 0.6203 0.3834 0.0186  0.0615  -0.0310 30  ILE H CB  
1459 C CG1 . ILE B 30  ? 0.4269 0.6498 0.4060 0.0327  0.0539  -0.0375 30  ILE H CG1 
1460 C CG2 . ILE B 30  ? 0.4180 0.6583 0.4000 0.0061  0.0755  -0.0273 30  ILE H CG2 
1461 C CD1 . ILE B 30  ? 0.4270 0.6784 0.4113 0.0423  0.0556  -0.0521 30  ILE H CD1 
1462 N N   . ASP B 31  ? 0.3768 0.5486 0.3362 0.0013  0.0673  0.0016  31  ASP H N   
1463 C CA  . ASP B 31  ? 0.3941 0.5518 0.3319 0.0004  0.0703  0.0128  31  ASP H CA  
1464 C C   . ASP B 31  ? 0.3624 0.4956 0.2940 0.0055  0.0615  0.0218  31  ASP H C   
1465 O O   . ASP B 31  ? 0.3662 0.4922 0.2806 0.0095  0.0606  0.0286  31  ASP H O   
1466 C CB  . ASP B 31  ? 0.4460 0.5987 0.3738 -0.0134 0.0842  0.0214  31  ASP H CB  
1467 C CG  . ASP B 31  ? 0.5089 0.6853 0.4328 -0.0205 0.0960  0.0164  31  ASP H CG  
1468 O OD1 . ASP B 31  ? 0.4927 0.6954 0.4264 -0.0134 0.0934  0.0036  31  ASP H OD1 
1469 O OD2 . ASP B 31  ? 0.5556 0.7227 0.4654 -0.0335 0.1085  0.0252  31  ASP H OD2 
1470 N N   . GLU B 32  ? 0.3110 0.4337 0.2552 0.0059  0.0556  0.0219  32  GLU H N   
1471 C CA  . GLU B 32  ? 0.3062 0.4094 0.2446 0.0105  0.0486  0.0302  32  GLU H CA  
1472 C C   . GLU B 32  ? 0.2783 0.3830 0.2273 0.0175  0.0370  0.0228  32  GLU H C   
1473 O O   . GLU B 32  ? 0.2820 0.3936 0.2443 0.0177  0.0349  0.0139  32  GLU H O   
1474 C CB  . GLU B 32  ? 0.3082 0.3933 0.2469 0.0038  0.0533  0.0387  32  GLU H CB  
1475 C CG  . GLU B 32  ? 0.3322 0.4092 0.2561 -0.0055 0.0663  0.0466  32  GLU H CG  
1476 C CD  . GLU B 32  ? 0.3589 0.4269 0.2574 -0.0015 0.0693  0.0565  32  GLU H CD  
1477 O OE1 . GLU B 32  ? 0.3459 0.4153 0.2381 0.0097  0.0603  0.0577  32  GLU H OE1 
1478 O OE2 . GLU B 32  ? 0.4008 0.4602 0.2842 -0.0104 0.0812  0.0629  32  GLU H OE2 
1479 N N   . ALA B 33  ? 0.2737 0.3718 0.2155 0.0231  0.0298  0.0264  33  ALA H N   
1480 C CA  . ALA B 33  ? 0.2549 0.3515 0.2047 0.0268  0.0198  0.0204  33  ALA H CA  
1481 C C   . ALA B 33  ? 0.2562 0.3424 0.2179 0.0238  0.0188  0.0228  33  ALA H C   
1482 O O   . ALA B 33  ? 0.2696 0.3466 0.2289 0.0215  0.0232  0.0316  33  ALA H O   
1483 C CB  . ALA B 33  ? 0.2645 0.3622 0.2043 0.0316  0.0136  0.0230  33  ALA H CB  
1484 N N   . LEU B 34  ? 0.2330 0.3181 0.2042 0.0244  0.0131  0.0155  34  LEU H N   
1485 C CA  A LEU B 34  ? 0.2267 0.3029 0.2085 0.0220  0.0113  0.0164  34  LEU H CA  
1486 C CA  B LEU B 34  ? 0.2156 0.2919 0.1975 0.0220  0.0113  0.0163  34  LEU H CA  
1487 C C   . LEU B 34  ? 0.2107 0.2827 0.1927 0.0233  0.0035  0.0145  34  LEU H C   
1488 O O   . LEU B 34  ? 0.2024 0.2750 0.1818 0.0244  -0.0009 0.0067  34  LEU H O   
1489 C CB  A LEU B 34  ? 0.2298 0.3091 0.2201 0.0217  0.0120  0.0087  34  LEU H CB  
1490 C CB  B LEU B 34  ? 0.2057 0.2850 0.1964 0.0216  0.0121  0.0087  34  LEU H CB  
1491 C CG  A LEU B 34  ? 0.2425 0.3203 0.2426 0.0174  0.0159  0.0102  34  LEU H CG  
1492 C CG  B LEU B 34  ? 0.1965 0.2692 0.1974 0.0192  0.0114  0.0089  34  LEU H CG  
1493 C CD1 A LEU B 34  ? 0.2452 0.3184 0.2422 0.0120  0.0230  0.0191  34  LEU H CD1 
1494 C CD1 B LEU B 34  ? 0.1855 0.2480 0.1870 0.0207  0.0042  0.0069  34  LEU H CD1 
1495 C CD2 A LEU B 34  ? 0.2535 0.3446 0.2597 0.0185  0.0182  0.0019  34  LEU H CD2 
1496 C CD2 B LEU B 34  ? 0.1987 0.2660 0.2009 0.0141  0.0169  0.0171  34  LEU H CD2 
1497 N N   . HIS B 35  ? 0.1924 0.2600 0.1769 0.0227  0.0025  0.0205  35  HIS H N   
1498 C CA  . HIS B 35  ? 0.1777 0.2458 0.1642 0.0223  -0.0036 0.0187  35  HIS H CA  
1499 C C   . HIS B 35  ? 0.1730 0.2327 0.1686 0.0190  -0.0045 0.0177  35  HIS H C   
1500 O O   . HIS B 35  ? 0.1748 0.2289 0.1750 0.0184  -0.0004 0.0205  35  HIS H O   
1501 C CB  . HIS B 35  ? 0.1824 0.2561 0.1649 0.0263  -0.0045 0.0256  35  HIS H CB  
1502 C CG  . HIS B 35  ? 0.1812 0.2621 0.1518 0.0307  -0.0037 0.0283  35  HIS H CG  
1503 N ND1 . HIS B 35  ? 0.1843 0.2782 0.1495 0.0336  -0.0093 0.0258  35  HIS H ND1 
1504 C CD2 . HIS B 35  ? 0.1899 0.2672 0.1522 0.0323  0.0024  0.0335  35  HIS H CD2 
1505 C CE1 . HIS B 35  ? 0.1947 0.2920 0.1476 0.0382  -0.0071 0.0296  35  HIS H CE1 
1506 N NE2 . HIS B 35  ? 0.1983 0.2845 0.1484 0.0371  0.0005  0.0349  35  HIS H NE2 
1507 N N   . TRP B 36  ? 0.1693 0.2282 0.1659 0.0159  -0.0091 0.0133  36  TRP H N   
1508 C CA  . TRP B 36  ? 0.1662 0.2172 0.1689 0.0123  -0.0097 0.0129  36  TRP H CA  
1509 C C   . TRP B 36  ? 0.1637 0.2233 0.1695 0.0105  -0.0119 0.0143  36  TRP H C   
1510 O O   . TRP B 36  ? 0.1655 0.2361 0.1682 0.0093  -0.0151 0.0114  36  TRP H O   
1511 C CB  . TRP B 36  ? 0.1794 0.2193 0.1781 0.0095  -0.0120 0.0060  36  TRP H CB  
1512 C CG  . TRP B 36  ? 0.1787 0.2141 0.1759 0.0139  -0.0103 0.0036  36  TRP H CG  
1513 C CD1 . TRP B 36  ? 0.1913 0.2299 0.1826 0.0174  -0.0103 -0.0004 36  TRP H CD1 
1514 C CD2 . TRP B 36  ? 0.1837 0.2139 0.1856 0.0159  -0.0088 0.0036  36  TRP H CD2 
1515 N NE1 . TRP B 36  ? 0.2081 0.2454 0.2011 0.0219  -0.0088 -0.0032 36  TRP H NE1 
1516 C CE2 . TRP B 36  ? 0.1906 0.2242 0.1906 0.0210  -0.0080 -0.0007 36  TRP H CE2 
1517 C CE3 . TRP B 36  ? 0.1845 0.2103 0.1924 0.0143  -0.0080 0.0064  36  TRP H CE3 
1518 C CZ2 . TRP B 36  ? 0.1974 0.2321 0.2019 0.0247  -0.0072 -0.0033 36  TRP H CZ2 
1519 C CZ3 . TRP B 36  ? 0.1774 0.2022 0.1887 0.0172  -0.0072 0.0043  36  TRP H CZ3 
1520 C CH2 . TRP B 36  ? 0.1825 0.2130 0.1926 0.0224  -0.0071 -0.0006 36  TRP H CH2 
1521 N N   . VAL B 37  ? 0.1601 0.2171 0.1720 0.0107  -0.0103 0.0178  37  VAL H N   
1522 C CA  . VAL B 37  ? 0.1630 0.2313 0.1796 0.0113  -0.0114 0.0195  37  VAL H CA  
1523 C C   . VAL B 37  ? 0.1673 0.2291 0.1886 0.0060  -0.0106 0.0177  37  VAL H C   
1524 O O   . VAL B 37  ? 0.1742 0.2230 0.1964 0.0065  -0.0081 0.0193  37  VAL H O   
1525 C CB  . VAL B 37  ? 0.1662 0.2364 0.1824 0.0203  -0.0091 0.0268  37  VAL H CB  
1526 C CG1 . VAL B 37  ? 0.1663 0.2489 0.1874 0.0240  -0.0106 0.0277  37  VAL H CG1 
1527 C CG2 . VAL B 37  ? 0.1747 0.2496 0.1827 0.0258  -0.0095 0.0296  37  VAL H CG2 
1528 N N   . LYS B 38  ? 0.1663 0.2378 0.1896 0.0001  -0.0124 0.0139  38  LYS H N   
1529 C CA  . LYS B 38  ? 0.1735 0.2407 0.1997 -0.0061 -0.0108 0.0124  38  LYS H CA  
1530 C C   . LYS B 38  ? 0.1831 0.2656 0.2173 -0.0011 -0.0097 0.0148  38  LYS H C   
1531 O O   . LYS B 38  ? 0.1736 0.2766 0.2109 0.0032  -0.0118 0.0144  38  LYS H O   
1532 C CB  . LYS B 38  ? 0.1778 0.2450 0.1992 -0.0179 -0.0120 0.0059  38  LYS H CB  
1533 C CG  . LYS B 38  ? 0.1790 0.2432 0.2006 -0.0270 -0.0096 0.0041  38  LYS H CG  
1534 C CD  . LYS B 38  ? 0.1853 0.2461 0.1990 -0.0412 -0.0095 -0.0021 38  LYS H CD  
1535 C CE  . LYS B 38  ? 0.2014 0.2579 0.2126 -0.0522 -0.0056 -0.0034 38  LYS H CE  
1536 N NZ  . LYS B 38  ? 0.2181 0.2664 0.2182 -0.0687 -0.0043 -0.0097 38  LYS H NZ  
1537 N N   . GLN B 39  ? 0.1914 0.2654 0.2280 -0.0009 -0.0069 0.0165  39  GLN H N   
1538 C CA  . GLN B 39  ? 0.1906 0.2780 0.2338 0.0041  -0.0055 0.0175  39  GLN H CA  
1539 C C   . GLN B 39  ? 0.2055 0.2924 0.2500 -0.0050 -0.0033 0.0142  39  GLN H C   
1540 O O   . GLN B 39  ? 0.1863 0.2552 0.2274 -0.0063 -0.0014 0.0156  39  GLN H O   
1541 C CB  . GLN B 39  ? 0.1972 0.2734 0.2399 0.0146  -0.0033 0.0230  39  GLN H CB  
1542 C CG  . GLN B 39  ? 0.2091 0.2964 0.2564 0.0222  -0.0020 0.0234  39  GLN H CG  
1543 C CD  . GLN B 39  ? 0.2261 0.3008 0.2688 0.0342  -0.0002 0.0289  39  GLN H CD  
1544 O OE1 . GLN B 39  ? 0.1950 0.2490 0.2333 0.0330  0.0022  0.0315  39  GLN H OE1 
1545 N NE2 . GLN B 39  ? 0.2382 0.3256 0.2808 0.0461  -0.0013 0.0302  39  GLN H NE2 
1546 N N   . SER B 40  ? 0.2214 0.3298 0.2704 -0.0109 -0.0033 0.0097  40  SER H N   
1547 C CA  . SER B 40  ? 0.2837 0.3939 0.3329 -0.0210 0.0002  0.0067  40  SER H CA  
1548 C C   . SER B 40  ? 0.3490 0.4853 0.4084 -0.0146 0.0018  0.0051  40  SER H C   
1549 O O   . SER B 40  ? 0.3892 0.5466 0.4548 -0.0047 -0.0008 0.0047  40  SER H O   
1550 C CB  . SER B 40  ? 0.2915 0.4030 0.3354 -0.0369 0.0005  0.0015  40  SER H CB  
1551 O OG  . SER B 40  ? 0.3035 0.4413 0.3533 -0.0388 -0.0021 -0.0030 40  SER H OG  
1552 N N   . HIS B 41  ? 0.4811 0.6216 0.5416 -0.0212 0.0060  0.0027  41  HIS H N   
1553 C CA  . HIS B 41  ? 0.4861 0.6601 0.5575 -0.0175 0.0079  -0.0015 41  HIS H CA  
1554 C C   . HIS B 41  ? 0.4941 0.7018 0.5730 -0.0235 0.0057  -0.0079 41  HIS H C   
1555 O O   . HIS B 41  ? 0.5112 0.7456 0.5986 -0.0094 0.0023  -0.0092 41  HIS H O   
1556 C CB  . HIS B 41  ? 0.6063 0.7790 0.6759 -0.0265 0.0138  -0.0035 41  HIS H CB  
1557 C CG  . HIS B 41  ? 0.6785 0.8271 0.7431 -0.0177 0.0153  0.0009  41  HIS H CG  
1558 N ND1 . HIS B 41  ? 0.7502 0.8654 0.8049 -0.0177 0.0137  0.0057  41  HIS H ND1 
1559 C CD2 . HIS B 41  ? 0.7356 0.8903 0.8037 -0.0086 0.0180  0.0002  41  HIS H CD2 
1560 C CE1 . HIS B 41  ? 0.7590 0.8622 0.8121 -0.0102 0.0153  0.0074  41  HIS H CE1 
1561 N NE2 . HIS B 41  ? 0.8000 0.9247 0.8602 -0.0047 0.0181  0.0043  41  HIS H NE2 
1562 N N   . ALA B 42  ? 0.4966 0.7012 0.5703 -0.0428 0.0072  -0.0119 42  ALA H N   
1563 C CA  . ALA B 42  ? 0.5027 0.7391 0.5823 -0.0561 0.0068  -0.0206 42  ALA H CA  
1564 C C   . ALA B 42  ? 0.4925 0.7470 0.5770 -0.0462 -0.0001 -0.0219 42  ALA H C   
1565 O O   . ALA B 42  ? 0.4180 0.7134 0.5133 -0.0483 -0.0016 -0.0296 42  ALA H O   
1566 C CB  . ALA B 42  ? 0.5150 0.7298 0.5818 -0.0792 0.0105  -0.0233 42  ALA H CB  
1567 N N   . GLU B 43  ? 0.4952 0.7235 0.5719 -0.0364 -0.0040 -0.0155 43  GLU H N   
1568 C CA  . GLU B 43  ? 0.5333 0.7744 0.6104 -0.0294 -0.0102 -0.0166 43  GLU H CA  
1569 C C   . GLU B 43  ? 0.5000 0.7297 0.5745 -0.0070 -0.0136 -0.0079 43  GLU H C   
1570 O O   . GLU B 43  ? 0.5168 0.7529 0.5882 -0.0013 -0.0183 -0.0077 43  GLU H O   
1571 C CB  . GLU B 43  ? 0.5638 0.7838 0.6301 -0.0450 -0.0107 -0.0193 43  GLU H CB  
1572 C CG  . GLU B 43  ? 0.6145 0.8447 0.6799 -0.0686 -0.0073 -0.0287 43  GLU H CG  
1573 C CD  . GLU B 43  ? 0.6559 0.9283 0.7300 -0.0759 -0.0105 -0.0391 43  GLU H CD  
1574 O OE1 . GLU B 43  ? 0.6542 0.9395 0.7297 -0.0640 -0.0169 -0.0391 43  GLU H OE1 
1575 O OE2 . GLU B 43  ? 0.6795 0.9731 0.7581 -0.0943 -0.0066 -0.0478 43  GLU H OE2 
1576 N N   . SER B 44  ? 0.4082 0.6246 0.4828 0.0050  -0.0111 -0.0018 44  SER H N   
1577 C CA  . SER B 44  ? 0.3464 0.5438 0.4150 0.0233  -0.0121 0.0067  44  SER H CA  
1578 C C   . SER B 44  ? 0.3070 0.4798 0.3660 0.0200  -0.0134 0.0104  44  SER H C   
1579 O O   . SER B 44  ? 0.3361 0.4900 0.3915 0.0063  -0.0114 0.0089  44  SER H O   
1580 C CB  . SER B 44  ? 0.3716 0.5896 0.4414 0.0431  -0.0157 0.0084  44  SER H CB  
1581 O OG  . SER B 44  ? 0.4265 0.6649 0.5039 0.0522  -0.0145 0.0058  44  SER H OG  
1582 N N   . LEU B 45  ? 0.2258 0.4001 0.2793 0.0317  -0.0166 0.0144  45  LEU H N   
1583 C CA  . LEU B 45  ? 0.2034 0.3553 0.2475 0.0301  -0.0167 0.0182  45  LEU H CA  
1584 C C   . LEU B 45  ? 0.1860 0.3527 0.2290 0.0219  -0.0207 0.0122  45  LEU H C   
1585 O O   . LEU B 45  ? 0.1670 0.3628 0.2131 0.0262  -0.0249 0.0085  45  LEU H O   
1586 C CB  . LEU B 45  ? 0.2105 0.3509 0.2458 0.0458  -0.0165 0.0265  45  LEU H CB  
1587 C CG  . LEU B 45  ? 0.2113 0.3279 0.2436 0.0518  -0.0117 0.0324  45  LEU H CG  
1588 C CD1 . LEU B 45  ? 0.2337 0.3379 0.2533 0.0669  -0.0110 0.0405  45  LEU H CD1 
1589 C CD2 . LEU B 45  ? 0.2020 0.2944 0.2335 0.0405  -0.0079 0.0326  45  LEU H CD2 
1590 N N   . GLU B 46  ? 0.1735 0.3218 0.2115 0.0113  -0.0196 0.0104  46  GLU H N   
1591 C CA  . GLU B 46  ? 0.1840 0.3405 0.2184 0.0025  -0.0228 0.0037  46  GLU H CA  
1592 C C   . GLU B 46  ? 0.1747 0.3089 0.1995 0.0043  -0.0222 0.0066  46  GLU H C   
1593 O O   . GLU B 46  ? 0.1576 0.2684 0.1802 0.0024  -0.0189 0.0091  46  GLU H O   
1594 C CB  . GLU B 46  ? 0.2086 0.3649 0.2446 -0.0146 -0.0216 -0.0041 46  GLU H CB  
1595 C CG  . GLU B 46  ? 0.2246 0.4084 0.2707 -0.0205 -0.0213 -0.0093 46  GLU H CG  
1596 C CD  . GLU B 46  ? 0.2629 0.4382 0.3052 -0.0411 -0.0186 -0.0166 46  GLU H CD  
1597 O OE1 . GLU B 46  ? 0.3014 0.4510 0.3392 -0.0456 -0.0146 -0.0137 46  GLU H OE1 
1598 O OE2 . GLU B 46  ? 0.2821 0.4732 0.3238 -0.0525 -0.0205 -0.0251 46  GLU H OE2 
1599 N N   . TRP B 47  ? 0.1631 0.3072 0.1822 0.0080  -0.0254 0.0053  47  TRP H N   
1600 C CA  . TRP B 47  ? 0.1736 0.3007 0.1834 0.0091  -0.0245 0.0065  47  TRP H CA  
1601 C C   . TRP B 47  ? 0.1772 0.2933 0.1825 -0.0031 -0.0251 -0.0018 47  TRP H C   
1602 O O   . TRP B 47  ? 0.1789 0.3087 0.1839 -0.0115 -0.0280 -0.0095 47  TRP H O   
1603 C CB  . TRP B 47  ? 0.1752 0.3166 0.1784 0.0182  -0.0274 0.0085  47  TRP H CB  
1604 C CG  . TRP B 47  ? 0.1741 0.3030 0.1675 0.0202  -0.0258 0.0098  47  TRP H CG  
1605 C CD1 . TRP B 47  ? 0.1835 0.2992 0.1717 0.0272  -0.0214 0.0176  47  TRP H CD1 
1606 C CD2 . TRP B 47  ? 0.1821 0.3136 0.1686 0.0152  -0.0283 0.0021  47  TRP H CD2 
1607 N NE1 . TRP B 47  ? 0.1904 0.3027 0.1703 0.0269  -0.0207 0.0155  47  TRP H NE1 
1608 C CE2 . TRP B 47  ? 0.1923 0.3139 0.1705 0.0208  -0.0252 0.0060  47  TRP H CE2 
1609 C CE3 . TRP B 47  ? 0.1919 0.3328 0.1775 0.0055  -0.0323 -0.0082 47  TRP H CE3 
1610 C CZ2 . TRP B 47  ? 0.2005 0.3226 0.1698 0.0192  -0.0265 -0.0001 47  TRP H CZ2 
1611 C CZ3 . TRP B 47  ? 0.2039 0.3419 0.1795 0.0033  -0.0337 -0.0145 47  TRP H CZ3 
1612 C CH2 . TRP B 47  ? 0.2058 0.3355 0.1735 0.0112  -0.0311 -0.0104 47  TRP H CH2 
1613 N N   . ILE B 48  ? 0.1745 0.2672 0.1756 -0.0039 -0.0223 -0.0009 48  ILE H N   
1614 C CA  . ILE B 48  ? 0.1899 0.2655 0.1828 -0.0127 -0.0228 -0.0084 48  ILE H CA  
1615 C C   . ILE B 48  ? 0.1962 0.2707 0.1798 -0.0097 -0.0244 -0.0123 48  ILE H C   
1616 O O   . ILE B 48  ? 0.2134 0.2844 0.1888 -0.0174 -0.0266 -0.0208 48  ILE H O   
1617 C CB  . ILE B 48  ? 0.1889 0.2407 0.1804 -0.0119 -0.0199 -0.0059 48  ILE H CB  
1618 C CG1 . ILE B 48  ? 0.1883 0.2407 0.1871 -0.0157 -0.0182 -0.0029 48  ILE H CG1 
1619 C CG2 . ILE B 48  ? 0.2080 0.2376 0.1866 -0.0166 -0.0207 -0.0127 48  ILE H CG2 
1620 C CD1 . ILE B 48  ? 0.1848 0.2193 0.1838 -0.0122 -0.0158 0.0006  48  ILE H CD1 
1621 N N   . GLY B 49  ? 0.1974 0.2733 0.1808 0.0000  -0.0226 -0.0070 49  GLY H N   
1622 C CA  . GLY B 49  ? 0.1996 0.2747 0.1737 0.0034  -0.0231 -0.0108 49  GLY H CA  
1623 C C   . GLY B 49  ? 0.1969 0.2727 0.1713 0.0122  -0.0192 -0.0044 49  GLY H C   
1624 O O   . GLY B 49  ? 0.1821 0.2560 0.1634 0.0149  -0.0160 0.0029  49  GLY H O   
1625 N N   . VAL B 50  ? 0.2019 0.2795 0.1680 0.0155  -0.0188 -0.0080 50  VAL H N   
1626 C CA  . VAL B 50  ? 0.2000 0.2805 0.1646 0.0218  -0.0139 -0.0034 50  VAL H CA  
1627 C C   . VAL B 50  ? 0.2164 0.2915 0.1750 0.0242  -0.0129 -0.0112 50  VAL H C   
1628 O O   . VAL B 50  ? 0.2395 0.3121 0.1898 0.0228  -0.0166 -0.0192 50  VAL H O   
1629 C CB  . VAL B 50  ? 0.1987 0.2930 0.1573 0.0260  -0.0131 0.0025  50  VAL H CB  
1630 C CG1 . VAL B 50  ? 0.2102 0.3149 0.1598 0.0257  -0.0180 -0.0042 50  VAL H CG1 
1631 C CG2 . VAL B 50  ? 0.2049 0.2996 0.1599 0.0297  -0.0062 0.0082  50  VAL H CG2 
1632 N N   . ILE B 51  ? 0.2068 0.2820 0.1691 0.0276  -0.0080 -0.0093 51  ILE H N   
1633 C CA  . ILE B 51  ? 0.2236 0.3008 0.1810 0.0326  -0.0061 -0.0165 51  ILE H CA  
1634 C C   . ILE B 51  ? 0.2342 0.3260 0.1907 0.0341  0.0005  -0.0115 51  ILE H C   
1635 O O   . ILE B 51  ? 0.2149 0.3088 0.1777 0.0315  0.0053  -0.0034 51  ILE H O   
1636 C CB  . ILE B 51  ? 0.2266 0.2934 0.1888 0.0355  -0.0067 -0.0212 51  ILE H CB  
1637 C CG1 . ILE B 51  ? 0.2433 0.3113 0.1986 0.0434  -0.0066 -0.0308 51  ILE H CG1 
1638 C CG2 . ILE B 51  ? 0.2180 0.2894 0.1925 0.0341  -0.0025 -0.0149 51  ILE H CG2 
1639 C CD1 . ILE B 51  ? 0.2482 0.3022 0.2027 0.0498  -0.0096 -0.0370 51  ILE H CD1 
1640 N N   . ARG B 52  ? 0.2468 0.3466 0.1943 0.0377  0.0015  -0.0170 52  ARG H N   
1641 C CA  A ARG B 52  ? 0.2672 0.3814 0.2106 0.0386  0.0090  -0.0139 52  ARG H CA  
1642 C CA  B ARG B 52  ? 0.2641 0.3781 0.2076 0.0385  0.0090  -0.0138 52  ARG H CA  
1643 C C   . ARG B 52  ? 0.2650 0.3872 0.2124 0.0428  0.0125  -0.0224 52  ARG H C   
1644 O O   . ARG B 52  ? 0.2921 0.4165 0.2322 0.0486  0.0104  -0.0318 52  ARG H O   
1645 C CB  A ARG B 52  ? 0.2841 0.4051 0.2129 0.0404  0.0077  -0.0143 52  ARG H CB  
1646 C CB  B ARG B 52  ? 0.2771 0.3977 0.2064 0.0400  0.0076  -0.0133 52  ARG H CB  
1647 C CG  A ARG B 52  ? 0.3031 0.4213 0.2281 0.0386  0.0027  -0.0076 52  ARG H CG  
1648 C CG  B ARG B 52  ? 0.2878 0.4041 0.2150 0.0379  0.0024  -0.0066 52  ARG H CG  
1649 C CD  A ARG B 52  ? 0.3237 0.4517 0.2340 0.0413  -0.0001 -0.0089 52  ARG H CD  
1650 C CD  B ARG B 52  ? 0.3055 0.4315 0.2184 0.0405  0.0013  -0.0030 52  ARG H CD  
1651 N NE  A ARG B 52  ? 0.3377 0.4666 0.2479 0.0401  -0.0077 -0.0075 52  ARG H NE  
1652 N NE  B ARG B 52  ? 0.3135 0.4374 0.2276 0.0406  -0.0013 0.0063  52  ARG H NE  
1653 C CZ  A ARG B 52  ? 0.3452 0.4746 0.2569 0.0412  -0.0082 0.0028  52  ARG H CZ  
1654 C CZ  B ARG B 52  ? 0.3081 0.4340 0.2259 0.0396  -0.0092 0.0034  52  ARG H CZ  
1655 N NH1 A ARG B 52  ? 0.3442 0.4684 0.2547 0.0425  -0.0011 0.0136  52  ARG H NH1 
1656 N NH1 B ARG B 52  ? 0.3119 0.4386 0.2300 0.0366  -0.0146 -0.0081 52  ARG H NH1 
1657 N NH2 A ARG B 52  ? 0.3539 0.4894 0.2674 0.0409  -0.0155 0.0017  52  ARG H NH2 
1658 N NH2 B ARG B 52  ? 0.3062 0.4333 0.2257 0.0418  -0.0112 0.0116  52  ARG H NH2 
1659 N N   . PRO B 53  ? 0.2735 0.4021 0.2321 0.0405  0.0180  -0.0203 53  PRO H N   
1660 C CA  . PRO B 53  ? 0.2907 0.4319 0.2559 0.0458  0.0203  -0.0297 53  PRO H CA  
1661 C C   . PRO B 53  ? 0.3189 0.4779 0.2763 0.0497  0.0252  -0.0359 53  PRO H C   
1662 O O   . PRO B 53  ? 0.3452 0.5118 0.3031 0.0586  0.0238  -0.0466 53  PRO H O   
1663 C CB  . PRO B 53  ? 0.2836 0.4325 0.2619 0.0388  0.0263  -0.0249 53  PRO H CB  
1664 C CG  . PRO B 53  ? 0.2845 0.4146 0.2637 0.0331  0.0232  -0.0152 53  PRO H CG  
1665 C CD  . PRO B 53  ? 0.2760 0.3994 0.2417 0.0331  0.0212  -0.0101 53  PRO H CD  
1666 N N   . TYR B 54  ? 0.3193 0.4837 0.2680 0.0441  0.0308  -0.0287 54  TYR H N   
1667 C CA  . TYR B 54  ? 0.3361 0.5196 0.2762 0.0455  0.0379  -0.0326 54  TYR H CA  
1668 C C   . TYR B 54  ? 0.3930 0.5740 0.3217 0.0551  0.0316  -0.0424 54  TYR H C   
1669 O O   . TYR B 54  ? 0.4094 0.6079 0.3341 0.0603  0.0360  -0.0508 54  TYR H O   
1670 C CB  . TYR B 54  ? 0.3295 0.5129 0.2585 0.0372  0.0451  -0.0203 54  TYR H CB  
1671 C CG  . TYR B 54  ? 0.3236 0.4886 0.2426 0.0364  0.0392  -0.0106 54  TYR H CG  
1672 C CD1 . TYR B 54  ? 0.3432 0.5078 0.2473 0.0413  0.0344  -0.0120 54  TYR H CD1 
1673 C CD2 . TYR B 54  ? 0.3081 0.4589 0.2318 0.0312  0.0387  -0.0004 54  TYR H CD2 
1674 C CE1 . TYR B 54  ? 0.3405 0.4942 0.2369 0.0415  0.0284  -0.0043 54  TYR H CE1 
1675 C CE2 . TYR B 54  ? 0.3155 0.4536 0.2309 0.0325  0.0333  0.0076  54  TYR H CE2 
1676 C CZ  . TYR B 54  ? 0.3375 0.4792 0.2391 0.0378  0.0283  0.0060  54  TYR H CZ  
1677 O OH  . TYR B 54  ? 0.3677 0.5024 0.2625 0.0401  0.0222  0.0129  54  TYR H OH  
1678 N N   . SER B 55  ? 0.3943 0.5557 0.3175 0.0565  0.0222  -0.0424 55  SER H N   
1679 C CA  . SER B 55  ? 0.4138 0.5684 0.3240 0.0630  0.0159  -0.0525 55  SER H CA  
1680 C C   . SER B 55  ? 0.4411 0.5753 0.3532 0.0678  0.0080  -0.0605 55  SER H C   
1681 O O   . SER B 55  ? 0.5022 0.6284 0.4026 0.0736  0.0041  -0.0707 55  SER H O   
1682 C CB  . SER B 55  ? 0.4190 0.5692 0.3178 0.0585  0.0123  -0.0471 55  SER H CB  
1683 O OG  . SER B 55  ? 0.4061 0.5421 0.3112 0.0530  0.0068  -0.0403 55  SER H OG  
1684 N N   . GLY B 56  ? 0.4136 0.5371 0.3370 0.0652  0.0059  -0.0560 56  GLY H N   
1685 C CA  . GLY B 56  ? 0.4071 0.5061 0.3288 0.0677  -0.0013 -0.0607 56  GLY H CA  
1686 C C   . GLY B 56  ? 0.4027 0.4853 0.3164 0.0598  -0.0072 -0.0591 56  GLY H C   
1687 O O   . GLY B 56  ? 0.4311 0.4916 0.3409 0.0586  -0.0122 -0.0623 56  GLY H O   
1688 N N   . GLU B 57  ? 0.3832 0.4772 0.2944 0.0539  -0.0063 -0.0535 57  GLU H N   
1689 C CA  . GLU B 57  ? 0.3688 0.4555 0.2754 0.0462  -0.0120 -0.0524 57  GLU H CA  
1690 C C   . GLU B 57  ? 0.3347 0.4110 0.2523 0.0399  -0.0141 -0.0455 57  GLU H C   
1691 O O   . GLU B 57  ? 0.2910 0.3728 0.2196 0.0401  -0.0104 -0.0371 57  GLU H O   
1692 C CB  . GLU B 57  ? 0.3957 0.5014 0.2986 0.0443  -0.0105 -0.0461 57  GLU H CB  
1693 C CG  . GLU B 57  ? 0.4451 0.5514 0.3440 0.0379  -0.0170 -0.0466 57  GLU H CG  
1694 C CD  . GLU B 57  ? 0.4744 0.6000 0.3654 0.0394  -0.0172 -0.0423 57  GLU H CD  
1695 O OE1 . GLU B 57  ? 0.5068 0.6400 0.3865 0.0440  -0.0149 -0.0470 57  GLU H OE1 
1696 O OE2 . GLU B 57  ? 0.5029 0.6356 0.3978 0.0374  -0.0194 -0.0341 57  GLU H OE2 
1697 N N   . THR B 58  ? 0.3222 0.3838 0.2357 0.0335  -0.0194 -0.0498 58  THR H N   
1698 C CA  . THR B 58  ? 0.3117 0.3662 0.2341 0.0261  -0.0213 -0.0440 58  THR H CA  
1699 C C   . THR B 58  ? 0.3139 0.3760 0.2338 0.0174  -0.0255 -0.0456 58  THR H C   
1700 O O   . THR B 58  ? 0.3351 0.3962 0.2434 0.0148  -0.0284 -0.0550 58  THR H O   
1701 C CB  . THR B 58  ? 0.3223 0.3510 0.2417 0.0254  -0.0227 -0.0483 58  THR H CB  
1702 O OG1 . THR B 58  ? 0.3395 0.3512 0.2424 0.0248  -0.0254 -0.0597 58  THR H OG1 
1703 C CG2 . THR B 58  ? 0.3170 0.3431 0.2425 0.0346  -0.0196 -0.0459 58  THR H CG2 
1704 N N   . ASN B 59  ? 0.2940 0.3658 0.2244 0.0133  -0.0261 -0.0378 59  ASN H N   
1705 C CA  A ASN B 59  ? 0.2938 0.3781 0.2248 0.0051  -0.0306 -0.0402 59  ASN H CA  
1706 C CA  B ASN B 59  ? 0.2938 0.3775 0.2246 0.0050  -0.0306 -0.0405 59  ASN H CA  
1707 C C   . ASN B 59  ? 0.2776 0.3550 0.2186 -0.0014 -0.0305 -0.0366 59  ASN H C   
1708 O O   . ASN B 59  ? 0.2577 0.3362 0.2084 0.0036  -0.0274 -0.0270 59  ASN H O   
1709 C CB  A ASN B 59  ? 0.3000 0.4102 0.2321 0.0104  -0.0317 -0.0343 59  ASN H CB  
1710 C CB  B ASN B 59  ? 0.3000 0.4098 0.2315 0.0100  -0.0319 -0.0351 59  ASN H CB  
1711 C CG  A ASN B 59  ? 0.3200 0.4382 0.2401 0.0165  -0.0314 -0.0375 59  ASN H CG  
1712 C CG  B ASN B 59  ? 0.3116 0.4401 0.2439 0.0032  -0.0376 -0.0401 59  ASN H CG  
1713 O OD1 A ASN B 59  ? 0.3581 0.4829 0.2695 0.0127  -0.0355 -0.0470 59  ASN H OD1 
1714 O OD1 B ASN B 59  ? 0.3239 0.4575 0.2660 -0.0021 -0.0389 -0.0385 59  ASN H OD1 
1715 N ND2 A ASN B 59  ? 0.3181 0.4370 0.2370 0.0247  -0.0261 -0.0302 59  ASN H ND2 
1716 N ND2 B ASN B 59  ? 0.3325 0.4742 0.2549 0.0034  -0.0411 -0.0473 59  ASN H ND2 
1717 N N   . TYR B 60  ? 0.2801 0.3487 0.2173 -0.0130 -0.0328 -0.0445 60  TYR H N   
1718 C CA  . TYR B 60  ? 0.2690 0.3307 0.2136 -0.0211 -0.0319 -0.0420 60  TYR H CA  
1719 C C   . TYR B 60  ? 0.2605 0.3487 0.2127 -0.0292 -0.0348 -0.0441 60  TYR H C   
1720 O O   . TYR B 60  ? 0.2660 0.3654 0.2125 -0.0364 -0.0380 -0.0532 60  TYR H O   
1721 C CB  . TYR B 60  ? 0.2951 0.3250 0.2276 -0.0296 -0.0310 -0.0489 60  TYR H CB  
1722 C CG  . TYR B 60  ? 0.3077 0.3124 0.2328 -0.0194 -0.0290 -0.0475 60  TYR H CG  
1723 C CD1 . TYR B 60  ? 0.3212 0.3188 0.2352 -0.0118 -0.0296 -0.0533 60  TYR H CD1 
1724 C CD2 . TYR B 60  ? 0.3009 0.2932 0.2310 -0.0160 -0.0268 -0.0409 60  TYR H CD2 
1725 C CE1 . TYR B 60  ? 0.3240 0.3036 0.2324 -0.0006 -0.0281 -0.0532 60  TYR H CE1 
1726 C CE2 . TYR B 60  ? 0.3064 0.2803 0.2304 -0.0053 -0.0258 -0.0407 60  TYR H CE2 
1727 C CZ  . TYR B 60  ? 0.3221 0.2905 0.2357 0.0027  -0.0265 -0.0470 60  TYR H CZ  
1728 O OH  . TYR B 60  ? 0.3141 0.2700 0.2228 0.0154  -0.0260 -0.0481 60  TYR H OH  
1729 N N   . ASN B 61  ? 0.2411 0.3397 0.2058 -0.0289 -0.0337 -0.0373 61  ASN H N   
1730 C CA  . ASN B 61  ? 0.2474 0.3684 0.2201 -0.0393 -0.0356 -0.0414 61  ASN H CA  
1731 C C   . ASN B 61  ? 0.2739 0.3790 0.2378 -0.0577 -0.0348 -0.0521 61  ASN H C   
1732 O O   . ASN B 61  ? 0.2660 0.3390 0.2224 -0.0616 -0.0313 -0.0510 61  ASN H O   
1733 C CB  . ASN B 61  ? 0.2260 0.3531 0.2116 -0.0359 -0.0333 -0.0330 61  ASN H CB  
1734 C CG  . ASN B 61  ? 0.2099 0.3681 0.2061 -0.0428 -0.0352 -0.0369 61  ASN H CG  
1735 O OD1 . ASN B 61  ? 0.2281 0.3997 0.2228 -0.0560 -0.0372 -0.0474 61  ASN H OD1 
1736 N ND2 . ASN B 61  ? 0.2025 0.3733 0.2097 -0.0340 -0.0343 -0.0294 61  ASN H ND2 
1737 N N   . GLN B 62  ? 0.2983 0.4244 0.2614 -0.0692 -0.0379 -0.0625 62  GLN H N   
1738 C CA  . GLN B 62  ? 0.3519 0.4591 0.3033 -0.0897 -0.0362 -0.0738 62  GLN H CA  
1739 C C   . GLN B 62  ? 0.3361 0.4288 0.2900 -0.1001 -0.0311 -0.0707 62  GLN H C   
1740 O O   . GLN B 62  ? 0.3631 0.4217 0.3011 -0.1126 -0.0278 -0.0753 62  GLN H O   
1741 C CB  . GLN B 62  ? 0.4041 0.5424 0.3567 -0.1033 -0.0399 -0.0868 62  GLN H CB  
1742 C CG  . GLN B 62  ? 0.4826 0.6165 0.4222 -0.0995 -0.0435 -0.0938 62  GLN H CG  
1743 C CD  . GLN B 62  ? 0.5666 0.6566 0.4839 -0.1103 -0.0409 -0.1023 62  GLN H CD  
1744 O OE1 . GLN B 62  ? 0.6244 0.6925 0.5299 -0.0985 -0.0413 -0.1014 62  GLN H OE1 
1745 N NE2 . GLN B 62  ? 0.6425 0.7197 0.5523 -0.1331 -0.0379 -0.1117 62  GLN H NE2 
1746 N N   . LYS B 63  ? 0.3063 0.4223 0.2770 -0.0949 -0.0304 -0.0635 63  LYS H N   
1747 C CA  . LYS B 63  ? 0.3169 0.4236 0.2908 -0.1044 -0.0253 -0.0606 63  LYS H CA  
1748 C C   . LYS B 63  ? 0.3085 0.3694 0.2693 -0.0989 -0.0219 -0.0535 63  LYS H C   
1749 O O   . LYS B 63  ? 0.3281 0.3701 0.2827 -0.1102 -0.0174 -0.0531 63  LYS H O   
1750 C CB  . LYS B 63  ? 0.3007 0.4423 0.2949 -0.0956 -0.0256 -0.0543 63  LYS H CB  
1751 C CG  . LYS B 63  ? 0.3204 0.5105 0.3273 -0.1013 -0.0291 -0.0627 63  LYS H CG  
1752 C CD  . LYS B 63  ? 0.3120 0.5360 0.3373 -0.0923 -0.0292 -0.0580 63  LYS H CD  
1753 C CE  . LYS B 63  ? 0.3110 0.5880 0.3492 -0.0906 -0.0346 -0.0658 63  LYS H CE  
1754 N NZ  . LYS B 63  ? 0.3080 0.6124 0.3617 -0.0783 -0.0344 -0.0606 63  LYS H NZ  
1755 N N   . PHE B 64  ? 0.2915 0.3377 0.2478 -0.0827 -0.0238 -0.0488 64  PHE H N   
1756 C CA  . PHE B 64  ? 0.3037 0.3144 0.2504 -0.0734 -0.0218 -0.0424 64  PHE H CA  
1757 C C   . PHE B 64  ? 0.3491 0.3279 0.2755 -0.0725 -0.0226 -0.0483 64  PHE H C   
1758 O O   . PHE B 64  ? 0.3366 0.2887 0.2541 -0.0626 -0.0219 -0.0445 64  PHE H O   
1759 C CB  . PHE B 64  ? 0.2766 0.2989 0.2361 -0.0550 -0.0225 -0.0328 64  PHE H CB  
1760 C CG  . PHE B 64  ? 0.2631 0.3051 0.2381 -0.0544 -0.0208 -0.0266 64  PHE H CG  
1761 C CD1 . PHE B 64  ? 0.2673 0.2931 0.2413 -0.0568 -0.0176 -0.0226 64  PHE H CD1 
1762 C CD2 . PHE B 64  ? 0.2412 0.3180 0.2300 -0.0512 -0.0227 -0.0257 64  PHE H CD2 
1763 C CE1 . PHE B 64  ? 0.2527 0.2970 0.2400 -0.0567 -0.0158 -0.0184 64  PHE H CE1 
1764 C CE2 . PHE B 64  ? 0.2385 0.3326 0.2400 -0.0492 -0.0212 -0.0212 64  PHE H CE2 
1765 C CZ  . PHE B 64  ? 0.2425 0.3205 0.2437 -0.0524 -0.0175 -0.0178 64  PHE H CZ  
1766 N N   . LYS B 65  ? 0.3749 0.3581 0.2938 -0.0813 -0.0245 -0.0579 65  LYS H N   
1767 C CA  . LYS B 65  ? 0.4467 0.4010 0.3457 -0.0775 -0.0256 -0.0643 65  LYS H CA  
1768 C C   . LYS B 65  ? 0.4629 0.3686 0.3398 -0.0807 -0.0226 -0.0647 65  LYS H C   
1769 O O   . LYS B 65  ? 0.4829 0.3636 0.3466 -0.0670 -0.0237 -0.0651 65  LYS H O   
1770 C CB  . LYS B 65  ? 0.4874 0.4529 0.3803 -0.0901 -0.0277 -0.0763 65  LYS H CB  
1771 C CG  . LYS B 65  ? 0.5960 0.5280 0.4656 -0.0878 -0.0284 -0.0845 65  LYS H CG  
1772 C CD  . LYS B 65  ? 0.6523 0.5972 0.5158 -0.0980 -0.0310 -0.0970 65  LYS H CD  
1773 C CE  . LYS B 65  ? 0.7252 0.6320 0.5631 -0.0944 -0.0313 -0.1058 65  LYS H CE  
1774 N NZ  . LYS B 65  ? 0.7458 0.6771 0.5841 -0.0923 -0.0352 -0.1143 65  LYS H NZ  
1775 N N   . ASP B 66  ? 0.4725 0.3651 0.3436 -0.0971 -0.0189 -0.0648 66  ASP H N   
1776 C CA  . ASP B 66  ? 0.5331 0.3737 0.3773 -0.1005 -0.0157 -0.0644 66  ASP H CA  
1777 C C   . ASP B 66  ? 0.4993 0.3311 0.3474 -0.0871 -0.0149 -0.0532 66  ASP H C   
1778 O O   . ASP B 66  ? 0.5852 0.3761 0.4110 -0.0872 -0.0128 -0.0512 66  ASP H O   
1779 C CB  . ASP B 66  ? 0.5825 0.4075 0.4129 -0.1274 -0.0109 -0.0708 66  ASP H CB  
1780 C CG  . ASP B 66  ? 0.6272 0.4472 0.4453 -0.1404 -0.0117 -0.0839 66  ASP H CG  
1781 O OD1 . ASP B 66  ? 0.6391 0.4441 0.4466 -0.1269 -0.0152 -0.0876 66  ASP H OD1 
1782 O OD2 . ASP B 66  ? 0.6621 0.4966 0.4824 -0.1638 -0.0089 -0.0911 66  ASP H OD2 
1783 N N   . LYS B 67  ? 0.4304 0.2973 0.3035 -0.0767 -0.0164 -0.0463 67  LYS H N   
1784 C CA  . LYS B 67  ? 0.4158 0.2820 0.2962 -0.0683 -0.0152 -0.0368 67  LYS H CA  
1785 C C   . LYS B 67  ? 0.3861 0.2579 0.2738 -0.0463 -0.0184 -0.0330 67  LYS H C   
1786 O O   . LYS B 67  ? 0.3934 0.2471 0.2746 -0.0360 -0.0187 -0.0286 67  LYS H O   
1787 C CB  . LYS B 67  ? 0.3879 0.2925 0.2923 -0.0751 -0.0136 -0.0329 67  LYS H CB  
1788 C CG  . LYS B 67  ? 0.3764 0.2849 0.2905 -0.0677 -0.0121 -0.0241 67  LYS H CG  
1789 C CD  . LYS B 67  ? 0.4039 0.2772 0.2982 -0.0734 -0.0089 -0.0216 67  LYS H CD  
1790 C CE  . LYS B 67  ? 0.4218 0.2863 0.3049 -0.0964 -0.0040 -0.0259 67  LYS H CE  
1791 N NZ  . LYS B 67  ? 0.4356 0.2660 0.2984 -0.1013 0.0000  -0.0216 67  LYS H NZ  
1792 N N   . ALA B 68  ? 0.3426 0.2438 0.2453 -0.0402 -0.0205 -0.0342 68  ALA H N   
1793 C CA  . ALA B 68  ? 0.3163 0.2323 0.2308 -0.0229 -0.0219 -0.0301 68  ALA H CA  
1794 C C   . ALA B 68  ? 0.3183 0.2248 0.2221 -0.0121 -0.0240 -0.0359 68  ALA H C   
1795 O O   . ALA B 68  ? 0.3408 0.2445 0.2357 -0.0174 -0.0249 -0.0430 68  ALA H O   
1796 C CB  . ALA B 68  ? 0.2879 0.2410 0.2241 -0.0227 -0.0216 -0.0259 68  ALA H CB  
1797 N N   . THR B 69  ? 0.3106 0.2159 0.2163 0.0030  -0.0246 -0.0339 69  THR H N   
1798 C CA  . THR B 69  ? 0.3133 0.2218 0.2152 0.0160  -0.0259 -0.0390 69  THR H CA  
1799 C C   . THR B 69  ? 0.2808 0.2187 0.2024 0.0253  -0.0245 -0.0343 69  THR H C   
1800 O O   . THR B 69  ? 0.2712 0.2092 0.1989 0.0301  -0.0243 -0.0302 69  THR H O   
1801 C CB  . THR B 69  ? 0.3454 0.2203 0.2256 0.0266  -0.0279 -0.0440 69  THR H CB  
1802 O OG1 . THR B 69  ? 0.3739 0.2154 0.2325 0.0154  -0.0279 -0.0477 69  THR H OG1 
1803 C CG2 . THR B 69  ? 0.3589 0.2391 0.2346 0.0404  -0.0290 -0.0510 69  THR H CG2 
1804 N N   . MET B 70  ? 0.2643 0.2247 0.1930 0.0273  -0.0234 -0.0355 70  MET H N   
1805 C CA  . MET B 70  ? 0.2410 0.2275 0.1853 0.0339  -0.0206 -0.0316 70  MET H CA  
1806 C C   . MET B 70  ? 0.2528 0.2425 0.1920 0.0464  -0.0204 -0.0385 70  MET H C   
1807 O O   . MET B 70  ? 0.2630 0.2464 0.1900 0.0487  -0.0216 -0.0453 70  MET H O   
1808 C CB  . MET B 70  ? 0.2365 0.2453 0.1897 0.0277  -0.0184 -0.0271 70  MET H CB  
1809 C CG  . MET B 70  ? 0.2255 0.2368 0.1862 0.0183  -0.0185 -0.0206 70  MET H CG  
1810 S SD  . MET B 70  ? 0.2327 0.2674 0.1979 0.0150  -0.0178 -0.0167 70  MET H SD  
1811 C CE  . MET B 70  ? 0.2679 0.3001 0.2187 0.0127  -0.0212 -0.0264 70  MET H CE  
1812 N N   . THR B 71  ? 0.2375 0.2382 0.1857 0.0545  -0.0191 -0.0379 71  THR H N   
1813 C CA  . THR B 71  ? 0.2471 0.2600 0.1946 0.0671  -0.0183 -0.0449 71  THR H CA  
1814 C C   . THR B 71  ? 0.2343 0.2773 0.2002 0.0659  -0.0133 -0.0415 71  THR H C   
1815 O O   . THR B 71  ? 0.2132 0.2605 0.1893 0.0573  -0.0113 -0.0340 71  THR H O   
1816 C CB  . THR B 71  ? 0.2610 0.2547 0.1967 0.0805  -0.0227 -0.0511 71  THR H CB  
1817 O OG1 . THR B 71  ? 0.2578 0.2484 0.1999 0.0798  -0.0240 -0.0461 71  THR H OG1 
1818 C CG2 . THR B 71  ? 0.2974 0.2558 0.2101 0.0805  -0.0264 -0.0551 71  THR H CG2 
1819 N N   . VAL B 72  ? 0.2528 0.3160 0.2218 0.0741  -0.0107 -0.0478 72  VAL H N   
1820 C CA  . VAL B 72  ? 0.2623 0.3549 0.2481 0.0711  -0.0047 -0.0461 72  VAL H CA  
1821 C C   . VAL B 72  ? 0.2919 0.4027 0.2808 0.0848  -0.0052 -0.0563 72  VAL H C   
1822 O O   . VAL B 72  ? 0.3267 0.4325 0.3036 0.0965  -0.0078 -0.0644 72  VAL H O   
1823 C CB  . VAL B 72  ? 0.2807 0.3868 0.2682 0.0618  0.0016  -0.0414 72  VAL H CB  
1824 C CG1 . VAL B 72  ? 0.3110 0.4267 0.2898 0.0688  0.0030  -0.0490 72  VAL H CG1 
1825 C CG2 . VAL B 72  ? 0.2784 0.4044 0.2791 0.0530  0.0090  -0.0365 72  VAL H CG2 
1826 N N   . ASP B 73  ? 0.2664 0.3990 0.2702 0.0838  -0.0028 -0.0572 73  ASP H N   
1827 C CA  . ASP B 73  ? 0.2886 0.4525 0.3006 0.0945  -0.0013 -0.0678 73  ASP H CA  
1828 C C   . ASP B 73  ? 0.2667 0.4620 0.2925 0.0812  0.0088  -0.0666 73  ASP H C   
1829 O O   . ASP B 73  ? 0.2565 0.4584 0.2936 0.0690  0.0124  -0.0616 73  ASP H O   
1830 C CB  . ASP B 73  ? 0.2979 0.4646 0.3153 0.1034  -0.0070 -0.0714 73  ASP H CB  
1831 C CG  . ASP B 73  ? 0.3393 0.5428 0.3659 0.1166  -0.0067 -0.0839 73  ASP H CG  
1832 O OD1 . ASP B 73  ? 0.3616 0.5933 0.3956 0.1125  0.0005  -0.0882 73  ASP H OD1 
1833 O OD2 . ASP B 73  ? 0.3870 0.5910 0.4118 0.1312  -0.0135 -0.0893 73  ASP H OD2 
1834 N N   . ILE B 74  ? 0.2893 0.5008 0.3123 0.0825  0.0140  -0.0709 74  ILE H N   
1835 C CA  . ILE B 74  ? 0.2925 0.5290 0.3237 0.0680  0.0252  -0.0684 74  ILE H CA  
1836 C C   . ILE B 74  ? 0.2821 0.5536 0.3315 0.0656  0.0291  -0.0758 74  ILE H C   
1837 O O   . ILE B 74  ? 0.2736 0.5548 0.3314 0.0482  0.0373  -0.0709 74  ILE H O   
1838 C CB  . ILE B 74  ? 0.3220 0.5696 0.3443 0.0707  0.0301  -0.0721 74  ILE H CB  
1839 C CG1 . ILE B 74  ? 0.3505 0.5664 0.3550 0.0713  0.0260  -0.0657 74  ILE H CG1 
1840 C CG2 . ILE B 74  ? 0.3186 0.5921 0.3476 0.0551  0.0429  -0.0696 74  ILE H CG2 
1841 C CD1 . ILE B 74  ? 0.3536 0.5483 0.3562 0.0575  0.0268  -0.0521 74  ILE H CD1 
1842 N N   . SER B 75  ? 0.2754 0.5646 0.3296 0.0824  0.0234  -0.0876 75  SER H N   
1843 C CA  . SER B 75  ? 0.2746 0.6073 0.3479 0.0811  0.0272  -0.0976 75  SER H CA  
1844 C C   . SER B 75  ? 0.2608 0.5893 0.3443 0.0696  0.0261  -0.0929 75  SER H C   
1845 O O   . SER B 75  ? 0.2549 0.6169 0.3541 0.0598  0.0320  -0.0988 75  SER H O   
1846 C CB  . SER B 75  ? 0.2980 0.6526 0.3729 0.1052  0.0203  -0.1118 75  SER H CB  
1847 O OG  . SER B 75  ? 0.3258 0.6547 0.3937 0.1193  0.0086  -0.1109 75  SER H OG  
1848 N N   . SER B 76  ? 0.2327 0.5231 0.3076 0.0702  0.0191  -0.0837 76  SER H N   
1849 C CA  . SER B 76  ? 0.2321 0.5159 0.3149 0.0590  0.0185  -0.0789 76  SER H CA  
1850 C C   . SER B 76  ? 0.2062 0.4614 0.2829 0.0410  0.0242  -0.0650 76  SER H C   
1851 O O   . SER B 76  ? 0.2005 0.4408 0.2795 0.0335  0.0228  -0.0595 76  SER H O   
1852 C CB  . SER B 76  ? 0.2456 0.5108 0.3229 0.0742  0.0067  -0.0798 76  SER H CB  
1853 O OG  . SER B 76  ? 0.2702 0.4936 0.3295 0.0788  0.0019  -0.0712 76  SER H OG  
1854 N N   . SER B 77  ? 0.2057 0.4513 0.2728 0.0363  0.0294  -0.0592 77  SER H N   
1855 C CA  . SER B 77  ? 0.2158 0.4343 0.2744 0.0230  0.0338  -0.0459 77  SER H CA  
1856 C C   . SER B 77  ? 0.2099 0.3970 0.2635 0.0261  0.0256  -0.0390 77  SER H C   
1857 O O   . SER B 77  ? 0.2051 0.3773 0.2587 0.0152  0.0284  -0.0308 77  SER H O   
1858 C CB  . SER B 77  ? 0.2240 0.4533 0.2894 0.0043  0.0446  -0.0433 77  SER H CB  
1859 O OG  . SER B 77  ? 0.2277 0.4860 0.2962 -0.0010 0.0538  -0.0492 77  SER H OG  
1860 N N   . THR B 78  ? 0.2121 0.3866 0.2590 0.0402  0.0163  -0.0418 78  THR H N   
1861 C CA  . THR B 78  ? 0.1994 0.3465 0.2411 0.0426  0.0091  -0.0367 78  THR H CA  
1862 C C   . THR B 78  ? 0.2031 0.3265 0.2302 0.0481  0.0044  -0.0336 78  THR H C   
1863 O O   . THR B 78  ? 0.2246 0.3505 0.2449 0.0585  0.0018  -0.0403 78  THR H O   
1864 C CB  . THR B 78  ? 0.2028 0.3552 0.2489 0.0525  0.0026  -0.0436 78  THR H CB  
1865 O OG1 . THR B 78  ? 0.1971 0.3757 0.2581 0.0454  0.0070  -0.0478 78  THR H OG1 
1866 C CG2 . THR B 78  ? 0.2062 0.3297 0.2448 0.0537  -0.0035 -0.0378 78  THR H CG2 
1867 N N   . ALA B 79  ? 0.2012 0.3047 0.2238 0.0408  0.0039  -0.0248 79  ALA H N   
1868 C CA  . ALA B 79  ? 0.1980 0.2797 0.2083 0.0427  -0.0008 -0.0223 79  ALA H CA  
1869 C C   . ALA B 79  ? 0.2065 0.2691 0.2132 0.0454  -0.0068 -0.0220 79  ALA H C   
1870 O O   . ALA B 79  ? 0.1947 0.2584 0.2092 0.0420  -0.0064 -0.0194 79  ALA H O   
1871 C CB  . ALA B 79  ? 0.1908 0.2677 0.1991 0.0339  0.0021  -0.0139 79  ALA H CB  
1872 N N   . TYR B 80  ? 0.2104 0.2541 0.2040 0.0498  -0.0116 -0.0243 80  TYR H N   
1873 C CA  . TYR B 80  ? 0.2211 0.2418 0.2063 0.0514  -0.0165 -0.0237 80  TYR H CA  
1874 C C   . TYR B 80  ? 0.2314 0.2342 0.2072 0.0434  -0.0177 -0.0206 80  TYR H C   
1875 O O   . TYR B 80  ? 0.2365 0.2389 0.2058 0.0425  -0.0176 -0.0232 80  TYR H O   
1876 C CB  . TYR B 80  ? 0.2517 0.2626 0.2255 0.0652  -0.0211 -0.0311 80  TYR H CB  
1877 C CG  . TYR B 80  ? 0.2633 0.2970 0.2469 0.0751  -0.0211 -0.0364 80  TYR H CG  
1878 C CD1 . TYR B 80  ? 0.2712 0.3070 0.2594 0.0780  -0.0234 -0.0359 80  TYR H CD1 
1879 C CD2 . TYR B 80  ? 0.2743 0.3310 0.2632 0.0809  -0.0186 -0.0427 80  TYR H CD2 
1880 C CE1 . TYR B 80  ? 0.2756 0.3369 0.2735 0.0870  -0.0242 -0.0424 80  TYR H CE1 
1881 C CE2 . TYR B 80  ? 0.2847 0.3681 0.2843 0.0891  -0.0183 -0.0492 80  TYR H CE2 
1882 C CZ  . TYR B 80  ? 0.2889 0.3759 0.2940 0.0916  -0.0213 -0.0492 80  TYR H CZ  
1883 O OH  . TYR B 80  ? 0.3140 0.4319 0.3313 0.0985  -0.0214 -0.0567 80  TYR H OH  
1884 N N   . LEU B 81  ? 0.2345 0.2243 0.2089 0.0377  -0.0188 -0.0165 81  LEU H N   
1885 C CA  . LEU B 81  ? 0.2492 0.2233 0.2149 0.0287  -0.0198 -0.0149 81  LEU H CA  
1886 C C   . LEU B 81  ? 0.2614 0.2084 0.2119 0.0303  -0.0226 -0.0162 81  LEU H C   
1887 O O   . LEU B 81  ? 0.2590 0.2039 0.2126 0.0318  -0.0228 -0.0131 81  LEU H O   
1888 C CB  . LEU B 81  ? 0.2315 0.2173 0.2092 0.0195  -0.0172 -0.0083 81  LEU H CB  
1889 C CG  . LEU B 81  ? 0.2461 0.2235 0.2179 0.0094  -0.0179 -0.0078 81  LEU H CG  
1890 C CD1 . LEU B 81  ? 0.2588 0.2402 0.2251 0.0065  -0.0189 -0.0120 81  LEU H CD1 
1891 C CD2 . LEU B 81  ? 0.2325 0.2236 0.2166 0.0038  -0.0158 -0.0021 81  LEU H CD2 
1892 N N   . GLU B 82  ? 0.2891 0.2135 0.2215 0.0303  -0.0245 -0.0207 82  GLU H N   
1893 C CA  . GLU B 82  ? 0.3260 0.2174 0.2383 0.0303  -0.0262 -0.0210 82  GLU H CA  
1894 C C   . GLU B 82  ? 0.3340 0.2155 0.2412 0.0131  -0.0240 -0.0194 82  GLU H C   
1895 O O   . GLU B 82  ? 0.3352 0.2208 0.2414 0.0060  -0.0236 -0.0231 82  GLU H O   
1896 C CB  . GLU B 82  ? 0.3856 0.2510 0.2757 0.0419  -0.0292 -0.0273 82  GLU H CB  
1897 C CG  . GLU B 82  ? 0.4357 0.2642 0.3023 0.0451  -0.0309 -0.0260 82  GLU H CG  
1898 C CD  . GLU B 82  ? 0.5288 0.3309 0.3722 0.0634  -0.0348 -0.0316 82  GLU H CD  
1899 O OE1 . GLU B 82  ? 0.5656 0.3786 0.4114 0.0724  -0.0359 -0.0379 82  GLU H OE1 
1900 O OE2 . GLU B 82  ? 0.6296 0.3973 0.4496 0.0683  -0.0364 -0.0297 82  GLU H OE2 
1901 N N   . LEU B 83  ? 0.3281 0.1986 0.2317 0.0068  -0.0228 -0.0150 83  LEU H N   
1902 C CA  . LEU B 83  ? 0.3477 0.2096 0.2456 -0.0107 -0.0198 -0.0142 83  LEU H CA  
1903 C C   . LEU B 83  ? 0.3766 0.1954 0.2450 -0.0131 -0.0194 -0.0149 83  LEU H C   
1904 O O   . LEU B 83  ? 0.4010 0.2051 0.2607 -0.0038 -0.0206 -0.0113 83  LEU H O   
1905 C CB  . LEU B 83  ? 0.3339 0.2183 0.2501 -0.0157 -0.0175 -0.0085 83  LEU H CB  
1906 C CG  . LEU B 83  ? 0.3163 0.2367 0.2572 -0.0129 -0.0172 -0.0067 83  LEU H CG  
1907 C CD1 . LEU B 83  ? 0.3125 0.2470 0.2668 -0.0151 -0.0150 -0.0014 83  LEU H CD1 
1908 C CD2 . LEU B 83  ? 0.3120 0.2478 0.2580 -0.0214 -0.0168 -0.0098 83  LEU H CD2 
1909 N N   . ALA B 84  ? 0.4073 0.2047 0.2586 -0.0251 -0.0178 -0.0196 84  ALA H N   
1910 C CA  . ALA B 84  ? 0.4572 0.2050 0.2740 -0.0268 -0.0170 -0.0211 84  ALA H CA  
1911 C C   . ALA B 84  ? 0.4831 0.2192 0.2914 -0.0480 -0.0114 -0.0185 84  ALA H C   
1912 O O   . ALA B 84  ? 0.4497 0.2178 0.2784 -0.0623 -0.0088 -0.0194 84  ALA H O   
1913 C CB  . ALA B 84  ? 0.4942 0.2213 0.2939 -0.0271 -0.0182 -0.0293 84  ALA H CB  
1914 N N   . ARG B 85  ? 0.5371 0.2304 0.3160 -0.0485 -0.0096 -0.0153 85  ARG H N   
1915 C CA  . ARG B 85  ? 0.5868 0.2581 0.3483 -0.0714 -0.0026 -0.0139 85  ARG H CA  
1916 C C   . ARG B 85  ? 0.5287 0.2423 0.3184 -0.0822 0.0006  -0.0105 85  ARG H C   
1917 O O   . ARG B 85  ? 0.4998 0.2283 0.2962 -0.1033 0.0054  -0.0142 85  ARG H O   
1918 C CB  . ARG B 85  ? 0.6549 0.3101 0.4027 -0.0911 0.0007  -0.0223 85  ARG H CB  
1919 C CG  . ARG B 85  ? 0.7555 0.3551 0.4655 -0.0841 -0.0004 -0.0258 85  ARG H CG  
1920 C CD  . ARG B 85  ? 0.8193 0.4019 0.5149 -0.1073 0.0037  -0.0352 85  ARG H CD  
1921 N NE  . ARG B 85  ? 0.8233 0.4535 0.5494 -0.1088 0.0005  -0.0423 85  ARG H NE  
1922 C CZ  . ARG B 85  ? 0.8645 0.5062 0.5991 -0.0889 -0.0056 -0.0455 85  ARG H CZ  
1923 N NH1 . ARG B 85  ? 0.9129 0.5243 0.6292 -0.0657 -0.0095 -0.0436 85  ARG H NH1 
1924 N NH2 . ARG B 85  ? 0.8589 0.5440 0.6195 -0.0915 -0.0079 -0.0509 85  ARG H NH2 
1925 N N   . LEU B 86  ? 0.4945 0.2244 0.2974 -0.0683 -0.0016 -0.0043 86  LEU H N   
1926 C CA  . LEU B 86  ? 0.4581 0.2296 0.2892 -0.0742 0.0006  -0.0017 86  LEU H CA  
1927 C C   . LEU B 86  ? 0.4620 0.2256 0.2827 -0.0954 0.0083  -0.0003 86  LEU H C   
1928 O O   . LEU B 86  ? 0.5023 0.2246 0.2923 -0.0997 0.0115  0.0027  86  LEU H O   
1929 C CB  . LEU B 86  ? 0.4553 0.2388 0.2978 -0.0548 -0.0033 0.0034  86  LEU H CB  
1930 C CG  . LEU B 86  ? 0.4627 0.2591 0.3174 -0.0365 -0.0095 0.0011  86  LEU H CG  
1931 C CD1 . LEU B 86  ? 0.4839 0.2839 0.3424 -0.0182 -0.0135 0.0046  86  LEU H CD1 
1932 C CD2 . LEU B 86  ? 0.4505 0.2869 0.3336 -0.0406 -0.0095 -0.0014 86  LEU H CD2 
1933 N N   . THR B 87  ? 0.4190 0.2234 0.2649 -0.1064 0.0112  -0.0024 87  THR H N   
1934 C CA  . THR B 87  ? 0.4300 0.2438 0.2759 -0.1246 0.0187  -0.0017 87  THR H CA  
1935 C C   . THR B 87  ? 0.3890 0.2454 0.2646 -0.1162 0.0179  0.0008  87  THR H C   
1936 O O   . THR B 87  ? 0.3333 0.2098 0.2282 -0.0991 0.0120  0.0016  87  THR H O   
1937 C CB  . THR B 87  ? 0.4438 0.2693 0.2909 -0.1482 0.0234  -0.0097 87  THR H CB  
1938 O OG1 . THR B 87  ? 0.4035 0.2780 0.2833 -0.1430 0.0195  -0.0137 87  THR H OG1 
1939 C CG2 . THR B 87  ? 0.4893 0.2736 0.3090 -0.1552 0.0233  -0.0140 87  THR H CG2 
1940 N N   . SER B 88  ? 0.3985 0.2693 0.2773 -0.1290 0.0244  0.0012  88  SER H N   
1941 C CA  . SER B 88  ? 0.3823 0.2916 0.2873 -0.1203 0.0241  0.0028  88  SER H CA  
1942 C C   . SER B 88  ? 0.3417 0.2916 0.2751 -0.1147 0.0201  -0.0014 88  SER H C   
1943 O O   . SER B 88  ? 0.3026 0.2738 0.2541 -0.1006 0.0174  0.0008  88  SER H O   
1944 C CB  . SER B 88  ? 0.4039 0.3246 0.3073 -0.1358 0.0324  0.0024  88  SER H CB  
1945 O OG  . SER B 88  ? 0.4610 0.3947 0.3647 -0.1574 0.0375  -0.0043 88  SER H OG  
1946 N N   . GLU B 89  ? 0.3652 0.3237 0.3003 -0.1251 0.0198  -0.0076 89  GLU H N   
1947 C CA  . GLU B 89  ? 0.3557 0.3538 0.3153 -0.1188 0.0156  -0.0116 89  GLU H CA  
1948 C C   . GLU B 89  ? 0.3348 0.3267 0.2993 -0.0985 0.0088  -0.0078 89  GLU H C   
1949 O O   . GLU B 89  ? 0.2970 0.3183 0.2798 -0.0902 0.0055  -0.0088 89  GLU H O   
1950 C CB  . GLU B 89  ? 0.4144 0.4238 0.3732 -0.1349 0.0161  -0.0201 89  GLU H CB  
1951 C CG  . GLU B 89  ? 0.4910 0.5270 0.4555 -0.1549 0.0227  -0.0260 89  GLU H CG  
1952 C CD  . GLU B 89  ? 0.6163 0.6182 0.5550 -0.1765 0.0305  -0.0269 89  GLU H CD  
1953 O OE1 . GLU B 89  ? 0.7304 0.6867 0.6464 -0.1712 0.0310  -0.0200 89  GLU H OE1 
1954 O OE2 . GLU B 89  ? 0.7328 0.7531 0.6723 -0.1992 0.0363  -0.0349 89  GLU H OE2 
1955 N N   . ASP B 90  ? 0.3136 0.2694 0.2610 -0.0913 0.0069  -0.0043 90  ASP H N   
1956 C CA  . ASP B 90  ? 0.2851 0.2366 0.2370 -0.0727 0.0013  -0.0014 90  ASP H CA  
1957 C C   . ASP B 90  ? 0.2569 0.2157 0.2192 -0.0601 0.0009  0.0039  90  ASP H C   
1958 O O   . ASP B 90  ? 0.2387 0.2024 0.2093 -0.0470 -0.0025 0.0056  90  ASP H O   
1959 C CB  . ASP B 90  ? 0.3042 0.2185 0.2337 -0.0698 -0.0008 -0.0020 90  ASP H CB  
1960 C CG  . ASP B 90  ? 0.3346 0.2393 0.2528 -0.0821 -0.0003 -0.0083 90  ASP H CG  
1961 O OD1 . ASP B 90  ? 0.3113 0.2444 0.2444 -0.0848 -0.0018 -0.0124 90  ASP H OD1 
1962 O OD2 . ASP B 90  ? 0.3557 0.2240 0.2485 -0.0896 0.0016  -0.0093 90  ASP H OD2 
1963 N N   . SER B 91  ? 0.2563 0.2188 0.2193 -0.0644 0.0047  0.0058  91  SER H N   
1964 C CA  . SER B 91  ? 0.2404 0.2105 0.2133 -0.0529 0.0042  0.0095  91  SER H CA  
1965 C C   . SER B 91  ? 0.2212 0.2218 0.2156 -0.0459 0.0031  0.0091  91  SER H C   
1966 O O   . SER B 91  ? 0.2124 0.2348 0.2151 -0.0523 0.0050  0.0065  91  SER H O   
1967 C CB  . SER B 91  ? 0.2557 0.2238 0.2233 -0.0592 0.0087  0.0108  91  SER H CB  
1968 O OG  . SER B 91  ? 0.2760 0.2119 0.2194 -0.0650 0.0101  0.0123  91  SER H OG  
1969 N N   . ALA B 92  ? 0.2099 0.2108 0.2110 -0.0338 0.0004  0.0113  92  ALA H N   
1970 C CA  . ALA B 92  ? 0.2050 0.2261 0.2207 -0.0259 -0.0004 0.0123  92  ALA H CA  
1971 C C   . ALA B 92  ? 0.1993 0.2123 0.2170 -0.0159 -0.0020 0.0146  92  ALA H C   
1972 O O   . ALA B 92  ? 0.1873 0.1840 0.1971 -0.0143 -0.0034 0.0144  92  ALA H O   
1973 C CB  . ALA B 92  ? 0.2157 0.2481 0.2334 -0.0282 -0.0024 0.0100  92  ALA H CB  
1974 N N   . ILE B 93  ? 0.1799 0.2047 0.2069 -0.0092 -0.0017 0.0166  93  ILE H N   
1975 C CA  . ILE B 93  ? 0.1778 0.1976 0.2066 -0.0025 -0.0020 0.0183  93  ILE H CA  
1976 C C   . ILE B 93  ? 0.1728 0.1964 0.2000 -0.0018 -0.0040 0.0180  93  ILE H C   
1977 O O   . ILE B 93  ? 0.1813 0.2178 0.2104 -0.0024 -0.0047 0.0179  93  ILE H O   
1978 C CB  . ILE B 93  ? 0.2187 0.2434 0.2538 0.0033  0.0004  0.0212  93  ILE H CB  
1979 C CG1 . ILE B 93  ? 0.2530 0.2747 0.2894 0.0033  0.0026  0.0206  93  ILE H CG1 
1980 C CG2 . ILE B 93  ? 0.2406 0.2592 0.2755 0.0066  0.0013  0.0227  93  ILE H CG2 
1981 C CD1 . ILE B 93  ? 0.2844 0.3098 0.3245 0.0099  0.0052  0.0226  93  ILE H CD1 
1982 N N   . TYR B 94  ? 0.1808 0.1962 0.2045 0.0000  -0.0050 0.0170  94  TYR H N   
1983 C CA  . TYR B 94  ? 0.1724 0.1909 0.1936 0.0016  -0.0064 0.0161  94  TYR H CA  
1984 C C   . TYR B 94  ? 0.1768 0.1980 0.2019 0.0063  -0.0039 0.0186  94  TYR H C   
1985 O O   . TYR B 94  ? 0.1801 0.1970 0.2071 0.0072  -0.0027 0.0176  94  TYR H O   
1986 C CB  . TYR B 94  ? 0.1775 0.1848 0.1898 0.0005  -0.0090 0.0119  94  TYR H CB  
1987 C CG  . TYR B 94  ? 0.1811 0.1816 0.1860 -0.0066 -0.0101 0.0096  94  TYR H CG  
1988 C CD1 . TYR B 94  ? 0.1842 0.1746 0.1849 -0.0102 -0.0094 0.0099  94  TYR H CD1 
1989 C CD2 . TYR B 94  ? 0.1764 0.1815 0.1778 -0.0113 -0.0114 0.0069  94  TYR H CD2 
1990 C CE1 . TYR B 94  ? 0.1962 0.1794 0.1884 -0.0194 -0.0089 0.0081  94  TYR H CE1 
1991 C CE2 . TYR B 94  ? 0.1929 0.1915 0.1866 -0.0211 -0.0114 0.0038  94  TYR H CE2 
1992 C CZ  . TYR B 94  ? 0.2043 0.1922 0.1937 -0.0259 -0.0095 0.0048  94  TYR H CZ  
1993 O OH  . TYR B 94  ? 0.2097 0.1910 0.1903 -0.0378 -0.0082 0.0018  94  TYR H OH  
1994 N N   . TYR B 95  ? 0.1608 0.1895 0.1855 0.0087  -0.0031 0.0212  95  TYR H N   
1995 C CA  . TYR B 95  ? 0.1563 0.1848 0.1809 0.0113  0.0005  0.0242  95  TYR H CA  
1996 C C   . TYR B 95  ? 0.1748 0.2080 0.1950 0.0122  -0.0001 0.0224  95  TYR H C   
1997 O O   . TYR B 95  ? 0.1645 0.2026 0.1809 0.0123  -0.0035 0.0206  95  TYR H O   
1998 C CB  . TYR B 95  ? 0.1749 0.2049 0.1977 0.0152  0.0026  0.0302  95  TYR H CB  
1999 C CG  . TYR B 95  ? 0.1729 0.1986 0.1988 0.0166  0.0039  0.0320  95  TYR H CG  
2000 C CD1 . TYR B 95  ? 0.1818 0.1967 0.2082 0.0154  0.0080  0.0331  95  TYR H CD1 
2001 C CD2 . TYR B 95  ? 0.1874 0.2214 0.2152 0.0189  0.0013  0.0319  95  TYR H CD2 
2002 C CE1 . TYR B 95  ? 0.1973 0.2069 0.2252 0.0173  0.0093  0.0338  95  TYR H CE1 
2003 C CE2 . TYR B 95  ? 0.2004 0.2324 0.2309 0.0215  0.0027  0.0327  95  TYR H CE2 
2004 C CZ  . TYR B 95  ? 0.2001 0.2182 0.2298 0.0213  0.0067  0.0339  95  TYR H CZ  
2005 O OH  . TYR B 95  ? 0.2314 0.2461 0.2624 0.0244  0.0082  0.0340  95  TYR H OH  
2006 N N   . CYS B 96  ? 0.1678 0.2014 0.1885 0.0120  0.0033  0.0219  96  CYS H N   
2007 C CA  . CYS B 96  ? 0.1706 0.2106 0.1861 0.0134  0.0050  0.0219  96  CYS H CA  
2008 C C   . CYS B 96  ? 0.1839 0.2215 0.1949 0.0137  0.0101  0.0292  96  CYS H C   
2009 O O   . CYS B 96  ? 0.1769 0.2064 0.1893 0.0122  0.0133  0.0325  96  CYS H O   
2010 C CB  . CYS B 96  ? 0.1827 0.2278 0.2004 0.0131  0.0063  0.0162  96  CYS H CB  
2011 S SG  . CYS B 96  ? 0.1900 0.2365 0.2154 0.0084  0.0122  0.0157  96  CYS H SG  
2012 N N   . ALA B 97  ? 0.1798 0.2218 0.1825 0.0163  0.0109  0.0319  97  ALA H N   
2013 C CA  . ALA B 97  ? 0.1958 0.2312 0.1887 0.0182  0.0157  0.0400  97  ALA H CA  
2014 C C   . ALA B 97  ? 0.2019 0.2442 0.1858 0.0191  0.0177  0.0406  97  ALA H C   
2015 O O   . ALA B 97  ? 0.2029 0.2556 0.1871 0.0210  0.0129  0.0354  97  ALA H O   
2016 C CB  . ALA B 97  ? 0.2147 0.2482 0.2045 0.0247  0.0119  0.0446  97  ALA H CB  
2017 N N   . ARG B 98  ? 0.2157 0.2511 0.1906 0.0165  0.0253  0.0460  98  ARG H N   
2018 C CA  . ARG B 98  ? 0.2264 0.2690 0.1909 0.0170  0.0282  0.0468  98  ARG H CA  
2019 C C   . ARG B 98  ? 0.2393 0.2747 0.1867 0.0245  0.0278  0.0560  98  ARG H C   
2020 O O   . ARG B 98  ? 0.2385 0.2598 0.1807 0.0282  0.0282  0.0627  98  ARG H O   
2021 C CB  . ARG B 98  ? 0.2498 0.2924 0.2134 0.0081  0.0379  0.0461  98  ARG H CB  
2022 C CG  . ARG B 98  ? 0.2831 0.3059 0.2338 0.0037  0.0464  0.0554  98  ARG H CG  
2023 C CD  . ARG B 98  ? 0.3013 0.3283 0.2457 -0.0058 0.0568  0.0550  98  ARG H CD  
2024 N NE  . ARG B 98  ? 0.3362 0.3382 0.2600 -0.0093 0.0653  0.0660  98  ARG H NE  
2025 C CZ  . ARG B 98  ? 0.3640 0.3609 0.2767 -0.0205 0.0771  0.0686  98  ARG H CZ  
2026 N NH1 . ARG B 98  ? 0.3521 0.3732 0.2757 -0.0289 0.0813  0.0598  98  ARG H NH1 
2027 N NH2 . ARG B 98  ? 0.3965 0.3636 0.2860 -0.0233 0.0850  0.0796  98  ARG H NH2 
2028 N N   . ASP B 99  ? 0.2431 0.2882 0.1808 0.0278  0.0269  0.0559  99  ASP H N   
2029 C CA  . ASP B 99  ? 0.2685 0.3061 0.1851 0.0350  0.0284  0.0656  99  ASP H CA  
2030 C C   . ASP B 99  ? 0.2845 0.3149 0.1877 0.0280  0.0395  0.0699  99  ASP H C   
2031 O O   . ASP B 99  ? 0.2905 0.3288 0.2044 0.0185  0.0444  0.0632  99  ASP H O   
2032 C CB  . ASP B 99  ? 0.2696 0.3240 0.1824 0.0436  0.0193  0.0628  99  ASP H CB  
2033 C CG  . ASP B 99  ? 0.2704 0.3404 0.1809 0.0417  0.0189  0.0559  99  ASP H CG  
2034 O OD1 . ASP B 99  ? 0.2963 0.3639 0.1929 0.0406  0.0255  0.0600  99  ASP H OD1 
2035 O OD2 . ASP B 99  ? 0.2642 0.3472 0.1844 0.0416  0.0120  0.0467  99  ASP H OD2 
2036 N N   . TRP B 100 ? 0.3012 0.3182 0.1809 0.0327  0.0437  0.0804  100 TRP H N   
2037 C CA  . TRP B 100 ? 0.3247 0.3341 0.1892 0.0239  0.0558  0.0847  100 TRP H CA  
2038 C C   . TRP B 100 ? 0.3298 0.3440 0.1726 0.0320  0.0549  0.0896  100 TRP H C   
2039 O O   . TRP B 100 ? 0.3615 0.3610 0.1821 0.0286  0.0644  0.0981  100 TRP H O   
2040 C CB  . TRP B 100 ? 0.3663 0.3453 0.2186 0.0171  0.0657  0.0936  100 TRP H CB  
2041 C CG  . TRP B 100 ? 0.4049 0.3555 0.2309 0.0280  0.0660  0.1069  100 TRP H CG  
2042 C CD1 . TRP B 100 ? 0.4592 0.3845 0.2541 0.0275  0.0753  0.1187  100 TRP H CD1 
2043 C CD2 . TRP B 100 ? 0.4085 0.3503 0.2359 0.0412  0.0574  0.1098  100 TRP H CD2 
2044 N NE1 . TRP B 100 ? 0.4783 0.3783 0.2533 0.0421  0.0719  0.1290  100 TRP H NE1 
2045 C CE2 . TRP B 100 ? 0.4531 0.3650 0.2489 0.0510  0.0609  0.1232  100 TRP H CE2 
2046 C CE3 . TRP B 100 ? 0.3761 0.3336 0.2267 0.0465  0.0471  0.1023  100 TRP H CE3 
2047 C CZ2 . TRP B 100 ? 0.4657 0.3649 0.2542 0.0675  0.0540  0.1285  100 TRP H CZ2 
2048 C CZ3 . TRP B 100 ? 0.3921 0.3388 0.2368 0.0603  0.0414  0.1073  100 TRP H CZ3 
2049 C CH2 . TRP B 100 ? 0.4284 0.3486 0.2433 0.0719  0.0441  0.1197  100 TRP H CH2 
2050 N N   . GLU B 101 ? 0.3052 0.3411 0.1557 0.0399  0.0444  0.0826  101 GLU H N   
2051 C CA  . GLU B 101 ? 0.3139 0.3626 0.1482 0.0461  0.0424  0.0828  101 GLU H CA  
2052 C C   . GLU B 101 ? 0.3436 0.3779 0.1520 0.0593  0.0398  0.0954  101 GLU H C   
2053 O O   . GLU B 101 ? 0.3563 0.3892 0.1408 0.0635  0.0429  0.1014  101 GLU H O   
2054 C CB  . GLU B 101 ? 0.3188 0.3740 0.1484 0.0358  0.0531  0.0800  101 GLU H CB  
2055 C CG  . GLU B 101 ? 0.3217 0.3976 0.1447 0.0410  0.0489  0.0739  101 GLU H CG  
2056 C CD  . GLU B 101 ? 0.3207 0.4098 0.1412 0.0327  0.0585  0.0683  101 GLU H CD  
2057 O OE1 . GLU B 101 ? 0.3108 0.4168 0.1269 0.0379  0.0541  0.0617  101 GLU H OE1 
2058 O OE2 . GLU B 101 ? 0.3261 0.4112 0.1513 0.0211  0.0695  0.0687  101 GLU H OE2 
2059 N N   . ARG B 102 ? 0.3508 0.3770 0.1638 0.0675  0.0333  0.0986  102 ARG H N   
2060 C CA  . ARG B 102 ? 0.3907 0.4079 0.1809 0.0847  0.0280  0.1089  102 ARG H CA  
2061 C C   . ARG B 102 ? 0.3723 0.4156 0.1780 0.0954  0.0134  0.1012  102 ARG H C   
2062 O O   . ARG B 102 ? 0.4039 0.4474 0.1945 0.1119  0.0070  0.1075  102 ARG H O   
2063 C CB  . ARG B 102 ? 0.4204 0.4031 0.1970 0.0880  0.0340  0.1205  102 ARG H CB  
2064 C CG  . ARG B 102 ? 0.4431 0.3982 0.2106 0.0725  0.0492  0.1258  102 ARG H CG  
2065 C CD  . ARG B 102 ? 0.4685 0.4170 0.2095 0.0698  0.0574  0.1326  102 ARG H CD  
2066 N NE  . ARG B 102 ? 0.5185 0.4396 0.2236 0.0852  0.0578  0.1473  102 ARG H NE  
2067 C CZ  . ARG B 102 ? 0.5521 0.4585 0.2245 0.0867  0.0649  0.1572  102 ARG H CZ  
2068 N NH1 . ARG B 102 ? 0.5952 0.4727 0.2325 0.1031  0.0644  0.1713  102 ARG H NH1 
2069 N NH2 . ARG B 102 ? 0.5449 0.4668 0.2183 0.0735  0.0721  0.1527  102 ARG H NH2 
2070 N N   . GLY B 103 ? 0.3462 0.4115 0.1772 0.0870  0.0086  0.0879  103 GLY H N   
2071 C CA  . GLY B 103 ? 0.3331 0.4210 0.1825 0.0912  -0.0029 0.0790  103 GLY H CA  
2072 C C   . GLY B 103 ? 0.3099 0.3975 0.1850 0.0807  -0.0027 0.0715  103 GLY H C   
2073 O O   . GLY B 103 ? 0.3175 0.3878 0.1977 0.0712  0.0056  0.0730  103 GLY H O   
2074 N N   . ASP B 104 ? 0.2907 0.3991 0.1821 0.0806  -0.0117 0.0621  104 ASP H N   
2075 C CA  . ASP B 104 ? 0.2824 0.3919 0.1962 0.0704  -0.0124 0.0541  104 ASP H CA  
2076 C C   . ASP B 104 ? 0.2616 0.3600 0.1803 0.0752  -0.0115 0.0601  104 ASP H C   
2077 O O   . ASP B 104 ? 0.2531 0.3669 0.1822 0.0785  -0.0180 0.0559  104 ASP H O   
2078 C CB  . ASP B 104 ? 0.2921 0.4254 0.2164 0.0659  -0.0207 0.0416  104 ASP H CB  
2079 C CG  . ASP B 104 ? 0.3224 0.4600 0.2407 0.0606  -0.0200 0.0350  104 ASP H CG  
2080 O OD1 . ASP B 104 ? 0.3495 0.4757 0.2732 0.0527  -0.0149 0.0320  104 ASP H OD1 
2081 O OD2 . ASP B 104 ? 0.3349 0.4881 0.2430 0.0654  -0.0248 0.0325  104 ASP H OD2 
2082 N N   . PHE B 105 ? 0.2654 0.3384 0.1752 0.0756  -0.0033 0.0692  105 PHE H N   
2083 C CA  . PHE B 105 ? 0.2519 0.3089 0.1647 0.0791  -0.0010 0.0742  105 PHE H CA  
2084 C C   . PHE B 105 ? 0.2590 0.2911 0.1704 0.0684  0.0093  0.0775  105 PHE H C   
2085 O O   . PHE B 105 ? 0.2531 0.2810 0.1563 0.0622  0.0150  0.0787  105 PHE H O   
2086 C CB  . PHE B 105 ? 0.2798 0.3312 0.1748 0.0967  -0.0036 0.0833  105 PHE H CB  
2087 C CG  . PHE B 105 ? 0.2993 0.3364 0.1671 0.1038  0.0002  0.0932  105 PHE H CG  
2088 C CD1 . PHE B 105 ? 0.3179 0.3211 0.1685 0.0998  0.0110  0.1026  105 PHE H CD1 
2089 C CD2 . PHE B 105 ? 0.3080 0.3654 0.1651 0.1139  -0.0067 0.0930  105 PHE H CD2 
2090 C CE1 . PHE B 105 ? 0.3507 0.3389 0.1733 0.1052  0.0155  0.1123  105 PHE H CE1 
2091 C CE2 . PHE B 105 ? 0.3352 0.3790 0.1648 0.1202  -0.0028 0.1023  105 PHE H CE2 
2092 C CZ  . PHE B 105 ? 0.3609 0.3684 0.1717 0.1165  0.0085  0.1129  105 PHE H CZ  
2093 N N   . PHE B 106 ? 0.2492 0.2679 0.1686 0.0656  0.0120  0.0779  106 PHE H N   
2094 C CA  . PHE B 106 ? 0.2436 0.2534 0.1742 0.0513  0.0184  0.0738  106 PHE H CA  
2095 C C   . PHE B 106 ? 0.2748 0.2559 0.1953 0.0498  0.0266  0.0810  106 PHE H C   
2096 O O   . PHE B 106 ? 0.2732 0.2448 0.1939 0.0564  0.0250  0.0830  106 PHE H O   
2097 C CB  . PHE B 106 ? 0.2221 0.2468 0.1747 0.0462  0.0130  0.0641  106 PHE H CB  
2098 C CG  . PHE B 106 ? 0.2160 0.2640 0.1742 0.0485  0.0048  0.0578  106 PHE H CG  
2099 C CD1 . PHE B 106 ? 0.2145 0.2721 0.1678 0.0465  0.0041  0.0548  106 PHE H CD1 
2100 C CD2 . PHE B 106 ? 0.2155 0.2766 0.1824 0.0524  -0.0017 0.0543  106 PHE H CD2 
2101 C CE1 . PHE B 106 ? 0.2097 0.2867 0.1657 0.0478  -0.0032 0.0482  106 PHE H CE1 
2102 C CE2 . PHE B 106 ? 0.2141 0.2969 0.1849 0.0523  -0.0086 0.0476  106 PHE H CE2 
2103 C CZ  . PHE B 106 ? 0.2167 0.3060 0.1818 0.0495  -0.0095 0.0444  106 PHE H CZ  
2104 N N   . ASP B 107 ? 0.3007 0.2676 0.2105 0.0409  0.0359  0.0843  107 ASP H N   
2105 C CA  . ASP B 107 ? 0.3328 0.2691 0.2302 0.0354  0.0454  0.0902  107 ASP H CA  
2106 C C   . ASP B 107 ? 0.3225 0.2607 0.2396 0.0230  0.0477  0.0819  107 ASP H C   
2107 O O   . ASP B 107 ? 0.3667 0.2832 0.2795 0.0223  0.0511  0.0841  107 ASP H O   
2108 C CB  . ASP B 107 ? 0.3760 0.2961 0.2512 0.0295  0.0555  0.0975  107 ASP H CB  
2109 C CG  . ASP B 107 ? 0.3681 0.3072 0.2518 0.0164  0.0599  0.0913  107 ASP H CG  
2110 O OD1 . ASP B 107 ? 0.3323 0.2983 0.2363 0.0157  0.0535  0.0819  107 ASP H OD1 
2111 O OD2 . ASP B 107 ? 0.4269 0.3532 0.2938 0.0086  0.0699  0.0963  107 ASP H OD2 
2112 N N   . TYR B 108 ? 0.2790 0.2392 0.2132 0.0141  0.0468  0.0731  108 TYR H N   
2113 C CA  . TYR B 108 ? 0.2643 0.2293 0.2159 0.0032  0.0485  0.0648  108 TYR H CA  
2114 C C   . TYR B 108 ? 0.2379 0.2232 0.2080 0.0075  0.0388  0.0571  108 TYR H C   
2115 O O   . TYR B 108 ? 0.2074 0.2095 0.1810 0.0112  0.0337  0.0542  108 TYR H O   
2116 C CB  . TYR B 108 ? 0.2673 0.2401 0.2219 -0.0104 0.0565  0.0603  108 TYR H CB  
2117 C CG  . TYR B 108 ? 0.3123 0.2600 0.2484 -0.0192 0.0681  0.0670  108 TYR H CG  
2118 C CD1 . TYR B 108 ? 0.3340 0.2636 0.2699 -0.0279 0.0734  0.0659  108 TYR H CD1 
2119 C CD2 . TYR B 108 ? 0.3481 0.2875 0.2640 -0.0192 0.0741  0.0747  108 TYR H CD2 
2120 C CE1 . TYR B 108 ? 0.3788 0.2786 0.2936 -0.0366 0.0845  0.0724  108 TYR H CE1 
2121 C CE2 . TYR B 108 ? 0.3956 0.3063 0.2899 -0.0283 0.0857  0.0820  108 TYR H CE2 
2122 C CZ  . TYR B 108 ? 0.4144 0.3038 0.3079 -0.0372 0.0909  0.0808  108 TYR H CZ  
2123 O OH  . TYR B 108 ? 0.4854 0.3418 0.3550 -0.0478 0.1033  0.0876  108 TYR H OH  
2124 N N   . TRP B 109 ? 0.2197 0.2012 0.1996 0.0063  0.0368  0.0537  109 TRP H N   
2125 C CA  . TRP B 109 ? 0.1961 0.1914 0.1905 0.0092  0.0288  0.0474  109 TRP H CA  
2126 C C   . TRP B 109 ? 0.1965 0.1956 0.2028 0.0010  0.0300  0.0400  109 TRP H C   
2127 O O   . TRP B 109 ? 0.2014 0.1895 0.2056 -0.0057 0.0363  0.0402  109 TRP H O   
2128 C CB  . TRP B 109 ? 0.2028 0.1917 0.1963 0.0171  0.0250  0.0504  109 TRP H CB  
2129 C CG  . TRP B 109 ? 0.2042 0.1948 0.1880 0.0276  0.0218  0.0561  109 TRP H CG  
2130 C CD1 . TRP B 109 ? 0.2310 0.2086 0.1980 0.0332  0.0255  0.0642  109 TRP H CD1 
2131 C CD2 . TRP B 109 ? 0.1941 0.2011 0.1838 0.0340  0.0142  0.0538  109 TRP H CD2 
2132 N NE1 . TRP B 109 ? 0.2284 0.2162 0.1910 0.0449  0.0194  0.0668  109 TRP H NE1 
2133 C CE2 . TRP B 109 ? 0.2047 0.2124 0.1824 0.0445  0.0127  0.0598  109 TRP H CE2 
2134 C CE3 . TRP B 109 ? 0.1771 0.1977 0.1793 0.0313  0.0090  0.0471  109 TRP H CE3 
2135 C CZ2 . TRP B 109 ? 0.1968 0.2238 0.1781 0.0519  0.0056  0.0579  109 TRP H CZ2 
2136 C CZ3 . TRP B 109 ? 0.1754 0.2115 0.1800 0.0362  0.0033  0.0456  109 TRP H CZ3 
2137 C CH2 . TRP B 109 ? 0.1839 0.2260 0.1796 0.0463  0.0013  0.0503  109 TRP H CH2 
2138 N N   . GLY B 110 ? 0.1797 0.1929 0.1961 0.0019  0.0242  0.0334  110 GLY H N   
2139 C CA  . GLY B 110 ? 0.1746 0.1916 0.2009 -0.0019 0.0229  0.0266  110 GLY H CA  
2140 C C   . GLY B 110 ? 0.1878 0.1938 0.2150 -0.0008 0.0219  0.0281  110 GLY H C   
2141 O O   . GLY B 110 ? 0.1798 0.1784 0.2017 0.0043  0.0211  0.0334  110 GLY H O   
2142 N N   . GLN B 111 ? 0.1913 0.1990 0.2254 -0.0048 0.0216  0.0225  111 GLN H N   
2143 C CA  . GLN B 111 ? 0.1950 0.1931 0.2296 -0.0041 0.0210  0.0226  111 GLN H CA  
2144 C C   . GLN B 111 ? 0.1719 0.1740 0.2085 0.0013  0.0147  0.0223  111 GLN H C   
2145 O O   . GLN B 111 ? 0.1711 0.1676 0.2076 0.0028  0.0143  0.0227  111 GLN H O   
2146 C CB  . GLN B 111 ? 0.2099 0.2098 0.2500 -0.0113 0.0232  0.0160  111 GLN H CB  
2147 C CG  . GLN B 111 ? 0.2029 0.2163 0.2498 -0.0094 0.0171  0.0093  111 GLN H CG  
2148 C CD  . GLN B 111 ? 0.2073 0.2365 0.2581 -0.0092 0.0157  0.0049  111 GLN H CD  
2149 O OE1 . GLN B 111 ? 0.1927 0.2253 0.2415 -0.0097 0.0184  0.0072  111 GLN H OE1 
2150 N NE2 . GLN B 111 ? 0.2052 0.2457 0.2608 -0.0072 0.0113  -0.0020 111 GLN H NE2 
2151 N N   . GLY B 112 ? 0.1595 0.1695 0.1961 0.0037  0.0104  0.0213  112 GLY H N   
2152 C CA  . GLY B 112 ? 0.1519 0.1630 0.1880 0.0059  0.0056  0.0206  112 GLY H CA  
2153 C C   . GLY B 112 ? 0.1626 0.1733 0.1993 0.0053  0.0024  0.0156  112 GLY H C   
2154 O O   . GLY B 112 ? 0.1680 0.1794 0.2081 0.0037  0.0037  0.0124  112 GLY H O   
2155 N N   . THR B 113 ? 0.1590 0.1681 0.1910 0.0064  -0.0014 0.0144  113 THR H N   
2156 C CA  . THR B 113 ? 0.1624 0.1654 0.1892 0.0076  -0.0050 0.0111  113 THR H CA  
2157 C C   . THR B 113 ? 0.1703 0.1668 0.1920 0.0046  -0.0055 0.0130  113 THR H C   
2158 O O   . THR B 113 ? 0.1780 0.1746 0.1965 0.0019  -0.0060 0.0140  113 THR H O   
2159 C CB  . THR B 113 ? 0.1713 0.1732 0.1926 0.0116  -0.0083 0.0079  113 THR H CB  
2160 O OG1 . THR B 113 ? 0.1777 0.1907 0.2052 0.0139  -0.0070 0.0052  113 THR H OG1 
2161 C CG2 . THR B 113 ? 0.1846 0.1753 0.1957 0.0153  -0.0123 0.0054  113 THR H CG2 
2162 N N   . LEU B 114 ? 0.1748 0.1671 0.1948 0.0039  -0.0054 0.0126  114 LEU H N   
2163 C CA  . LEU B 114 ? 0.1861 0.1732 0.2002 -0.0001 -0.0048 0.0139  114 LEU H CA  
2164 C C   . LEU B 114 ? 0.2055 0.1780 0.2052 -0.0002 -0.0078 0.0128  114 LEU H C   
2165 O O   . LEU B 114 ? 0.2230 0.1888 0.2168 0.0044  -0.0102 0.0113  114 LEU H O   
2166 C CB  . LEU B 114 ? 0.1882 0.1766 0.2048 -0.0004 -0.0027 0.0138  114 LEU H CB  
2167 C CG  . LEU B 114 ? 0.2065 0.1945 0.2189 -0.0054 -0.0005 0.0149  114 LEU H CG  
2168 C CD1 . LEU B 114 ? 0.2025 0.2032 0.2219 -0.0080 0.0017  0.0161  114 LEU H CD1 
2169 C CD2 . LEU B 114 ? 0.2152 0.2037 0.2284 -0.0043 0.0013  0.0139  114 LEU H CD2 
2170 N N   . VAL B 115 ? 0.1998 0.1670 0.1927 -0.0061 -0.0072 0.0134  115 VAL H N   
2171 C CA  . VAL B 115 ? 0.2322 0.1785 0.2067 -0.0083 -0.0087 0.0129  115 VAL H CA  
2172 C C   . VAL B 115 ? 0.2482 0.1899 0.2159 -0.0177 -0.0051 0.0145  115 VAL H C   
2173 O O   . VAL B 115 ? 0.2422 0.1981 0.2180 -0.0257 -0.0019 0.0143  115 VAL H O   
2174 C CB  . VAL B 115 ? 0.2378 0.1789 0.2072 -0.0100 -0.0101 0.0111  115 VAL H CB  
2175 C CG1 . VAL B 115 ? 0.2697 0.1836 0.2165 -0.0140 -0.0106 0.0105  115 VAL H CG1 
2176 C CG2 . VAL B 115 ? 0.2306 0.1783 0.2061 -0.0005 -0.0129 0.0091  115 VAL H CG2 
2177 N N   . THR B 116 ? 0.2417 0.1662 0.1943 -0.0165 -0.0054 0.0158  116 THR H N   
2178 C CA  . THR B 116 ? 0.2621 0.1782 0.2033 -0.0266 -0.0010 0.0175  116 THR H CA  
2179 C C   . THR B 116 ? 0.2918 0.1760 0.2062 -0.0308 -0.0011 0.0186  116 THR H C   
2180 O O   . THR B 116 ? 0.3206 0.1854 0.2201 -0.0206 -0.0052 0.0196  116 THR H O   
2181 C CB  . THR B 116 ? 0.2455 0.1643 0.1863 -0.0231 -0.0001 0.0188  116 THR H CB  
2182 O OG1 . THR B 116 ? 0.2295 0.1725 0.1922 -0.0192 0.0002  0.0173  116 THR H OG1 
2183 C CG2 . THR B 116 ? 0.2737 0.1841 0.2008 -0.0342 0.0053  0.0206  116 THR H CG2 
2184 N N   . VAL B 117 ? 0.2996 0.1793 0.2077 -0.0453 0.0033  0.0179  117 VAL H N   
2185 C CA  . VAL B 117 ? 0.3337 0.1775 0.2126 -0.0527 0.0048  0.0188  117 VAL H CA  
2186 C C   . VAL B 117 ? 0.3638 0.1947 0.2263 -0.0621 0.0105  0.0221  117 VAL H C   
2187 O O   . VAL B 117 ? 0.3591 0.2117 0.2329 -0.0751 0.0164  0.0209  117 VAL H O   
2188 C CB  . VAL B 117 ? 0.3384 0.1828 0.2176 -0.0656 0.0069  0.0147  117 VAL H CB  
2189 C CG1 . VAL B 117 ? 0.3811 0.1814 0.2260 -0.0740 0.0092  0.0153  117 VAL H CG1 
2190 C CG2 . VAL B 117 ? 0.3140 0.1739 0.2095 -0.0554 0.0015  0.0116  117 VAL H CG2 
2191 N N   . SER B 118 ? 0.3923 0.1898 0.2277 -0.0549 0.0087  0.0260  118 SER H N   
2192 C CA  . SER B 118 ? 0.4095 0.1925 0.2257 -0.0614 0.0139  0.0303  118 SER H CA  
2193 C C   . SER B 118 ? 0.4554 0.1920 0.2338 -0.0525 0.0111  0.0349  118 SER H C   
2194 O O   . SER B 118 ? 0.4502 0.1814 0.2279 -0.0336 0.0029  0.0343  118 SER H O   
2195 C CB  . SER B 118 ? 0.3870 0.1988 0.2224 -0.0532 0.0127  0.0305  118 SER H CB  
2196 O OG  . SER B 118 ? 0.4075 0.2053 0.2228 -0.0572 0.0170  0.0345  118 SER H OG  
2197 N N   . SER B 119 ? 0.4960 0.2037 0.2451 -0.0643 0.0177  0.0394  119 SER H N   
2198 C CA  . SER B 119 ? 0.5581 0.2186 0.2656 -0.0548 0.0159  0.0456  119 SER H CA  
2199 C C   . SER B 119 ? 0.5452 0.2158 0.2526 -0.0385 0.0113  0.0485  119 SER H C   
2200 O O   . SER B 119 ? 0.6089 0.2445 0.2830 -0.0249 0.0073  0.0534  119 SER H O   
2201 C CB  . SER B 119 ? 0.6092 0.2348 0.2841 -0.0765 0.0264  0.0497  119 SER H CB  
2202 O OG  . SER B 119 ? 0.6646 0.2779 0.3370 -0.0908 0.0297  0.0457  119 SER H OG  
2203 N N   . ALA B 120 ? 0.5029 0.2153 0.2408 -0.0403 0.0123  0.0457  120 ALA H N   
2204 C CA  . ALA B 120 ? 0.4903 0.2116 0.2257 -0.0282 0.0091  0.0475  120 ALA H CA  
2205 C C   . ALA B 120 ? 0.4725 0.2043 0.2184 -0.0046 -0.0024 0.0444  120 ALA H C   
2206 O O   . ALA B 120 ? 0.4463 0.1942 0.2144 -0.0004 -0.0062 0.0398  120 ALA H O   
2207 C CB  . ALA B 120 ? 0.4587 0.2174 0.2199 -0.0377 0.0145  0.0447  120 ALA H CB  
2208 N N   . SER B 121 ? 0.5016 0.2260 0.2307 0.0096  -0.0075 0.0464  121 SER H N   
2209 C CA  . SER B 121 ? 0.5059 0.2426 0.2421 0.0323  -0.0188 0.0424  121 SER H CA  
2210 C C   . SER B 121 ? 0.4417 0.2249 0.2174 0.0321  -0.0201 0.0355  121 SER H C   
2211 O O   . SER B 121 ? 0.4353 0.2338 0.2216 0.0205  -0.0140 0.0354  121 SER H O   
2212 C CB  . SER B 121 ? 0.5629 0.2771 0.2654 0.0484  -0.0244 0.0463  121 SER H CB  
2213 O OG  . SER B 121 ? 0.6506 0.3166 0.3135 0.0513  -0.0237 0.0528  121 SER H OG  
2214 N N   . THR B 122 ? 0.4223 0.2261 0.2168 0.0448  -0.0276 0.0297  122 THR H N   
2215 C CA  . THR B 122 ? 0.3793 0.2223 0.2060 0.0455  -0.0292 0.0229  122 THR H CA  
2216 C C   . THR B 122 ? 0.3873 0.2362 0.2044 0.0516  -0.0320 0.0218  122 THR H C   
2217 O O   . THR B 122 ? 0.3879 0.2174 0.1765 0.0639  -0.0371 0.0246  122 THR H O   
2218 C CB  . THR B 122 ? 0.3787 0.2412 0.2243 0.0562  -0.0358 0.0166  122 THR H CB  
2219 O OG1 . THR B 122 ? 0.3872 0.2823 0.2640 0.0495  -0.0336 0.0110  122 THR H OG1 
2220 C CG2 . THR B 122 ? 0.3981 0.2596 0.2295 0.0764  -0.0456 0.0137  122 THR H CG2 
2221 N N   . LYS B 123 ? 0.3566 0.2316 0.1961 0.0447  -0.0291 0.0173  123 LYS H N   
2222 C CA  . LYS B 123 ? 0.3661 0.2530 0.2021 0.0494  -0.0317 0.0138  123 LYS H CA  
2223 C C   . LYS B 123 ? 0.3145 0.2347 0.1832 0.0466  -0.0322 0.0048  123 LYS H C   
2224 O O   . LYS B 123 ? 0.2877 0.2167 0.1764 0.0352  -0.0255 0.0043  123 LYS H O   
2225 C CB  . LYS B 123 ? 0.3985 0.2719 0.2178 0.0394  -0.0242 0.0190  123 LYS H CB  
2226 C CG  . LYS B 123 ? 0.4311 0.3133 0.2415 0.0451  -0.0270 0.0157  123 LYS H CG  
2227 C CD  . LYS B 123 ? 0.4957 0.3640 0.2868 0.0356  -0.0188 0.0211  123 LYS H CD  
2228 C CE  . LYS B 123 ? 0.5246 0.4078 0.3131 0.0389  -0.0202 0.0160  123 LYS H CE  
2229 N NZ  . LYS B 123 ? 0.5957 0.4735 0.3626 0.0558  -0.0306 0.0153  123 LYS H NZ  
2230 N N   . GLY B 124 ? 0.3078 0.2452 0.1799 0.0567  -0.0397 -0.0022 124 GLY H N   
2231 C CA  . GLY B 124 ? 0.2896 0.2560 0.1888 0.0527  -0.0399 -0.0118 124 GLY H CA  
2232 C C   . GLY B 124 ? 0.2858 0.2567 0.1858 0.0452  -0.0353 -0.0143 124 GLY H C   
2233 O O   . GLY B 124 ? 0.3051 0.2651 0.1836 0.0480  -0.0355 -0.0113 124 GLY H O   
2234 N N   . PRO B 125 ? 0.2752 0.2611 0.1981 0.0362  -0.0308 -0.0202 125 PRO H N   
2235 C CA  . PRO B 125 ? 0.2725 0.2615 0.1957 0.0304  -0.0262 -0.0236 125 PRO H CA  
2236 C C   . PRO B 125 ? 0.2901 0.2928 0.2076 0.0358  -0.0325 -0.0327 125 PRO H C   
2237 O O   . PRO B 125 ? 0.2724 0.2903 0.1952 0.0415  -0.0397 -0.0391 125 PRO H O   
2238 C CB  . PRO B 125 ? 0.2561 0.2531 0.2031 0.0215  -0.0204 -0.0275 125 PRO H CB  
2239 C CG  . PRO B 125 ? 0.2501 0.2575 0.2101 0.0234  -0.0248 -0.0305 125 PRO H CG  
2240 C CD  . PRO B 125 ? 0.2558 0.2529 0.2020 0.0316  -0.0292 -0.0233 125 PRO H CD  
2241 N N   . SER B 126 ? 0.3106 0.3106 0.2186 0.0333  -0.0292 -0.0341 126 SER H N   
2242 C CA  . SER B 126 ? 0.3167 0.3317 0.2239 0.0343  -0.0328 -0.0451 126 SER H CA  
2243 C C   . SER B 126 ? 0.2970 0.3189 0.2250 0.0239  -0.0267 -0.0529 126 SER H C   
2244 O O   . SER B 126 ? 0.3012 0.3123 0.2341 0.0184  -0.0185 -0.0481 126 SER H O   
2245 C CB  . SER B 126 ? 0.3620 0.3677 0.2451 0.0374  -0.0316 -0.0420 126 SER H CB  
2246 O OG  . SER B 126 ? 0.4080 0.4034 0.2675 0.0482  -0.0379 -0.0348 126 SER H OG  
2247 N N   . VAL B 127 ? 0.2801 0.3187 0.2186 0.0213  -0.0303 -0.0650 127 VAL H N   
2248 C CA  . VAL B 127 ? 0.2763 0.3156 0.2310 0.0105  -0.0240 -0.0727 127 VAL H CA  
2249 C C   . VAL B 127 ? 0.2923 0.3377 0.2404 0.0082  -0.0246 -0.0841 127 VAL H C   
2250 O O   . VAL B 127 ? 0.3013 0.3647 0.2463 0.0105  -0.0322 -0.0934 127 VAL H O   
2251 C CB  . VAL B 127 ? 0.2669 0.3179 0.2400 0.0053  -0.0256 -0.0774 127 VAL H CB  
2252 C CG1 . VAL B 127 ? 0.2747 0.3203 0.2594 -0.0066 -0.0183 -0.0848 127 VAL H CG1 
2253 C CG2 . VAL B 127 ? 0.2512 0.2961 0.2285 0.0088  -0.0253 -0.0664 127 VAL H CG2 
2254 N N   . PHE B 128 ? 0.2877 0.3201 0.2331 0.0047  -0.0169 -0.0844 128 PHE H N   
2255 C CA  . PHE B 128 ? 0.3013 0.3359 0.2384 0.0027  -0.0162 -0.0955 128 PHE H CA  
2256 C C   . PHE B 128 ? 0.3048 0.3301 0.2525 -0.0067 -0.0093 -0.1041 128 PHE H C   
2257 O O   . PHE B 128 ? 0.2865 0.2974 0.2420 -0.0086 -0.0027 -0.0979 128 PHE H O   
2258 C CB  . PHE B 128 ? 0.3109 0.3369 0.2312 0.0084  -0.0124 -0.0892 128 PHE H CB  
2259 C CG  . PHE B 128 ? 0.3147 0.3419 0.2188 0.0166  -0.0173 -0.0793 128 PHE H CG  
2260 C CD1 . PHE B 128 ? 0.3282 0.3678 0.2205 0.0228  -0.0268 -0.0836 128 PHE H CD1 
2261 C CD2 . PHE B 128 ? 0.3152 0.3304 0.2141 0.0182  -0.0125 -0.0662 128 PHE H CD2 
2262 C CE1 . PHE B 128 ? 0.3448 0.3793 0.2173 0.0319  -0.0310 -0.0735 128 PHE H CE1 
2263 C CE2 . PHE B 128 ? 0.3335 0.3436 0.2135 0.0243  -0.0159 -0.0568 128 PHE H CE2 
2264 C CZ  . PHE B 128 ? 0.3428 0.3599 0.2081 0.0319  -0.0251 -0.0597 128 PHE H CZ  
2265 N N   . PRO B 129 ? 0.3117 0.3427 0.2574 -0.0126 -0.0105 -0.1189 129 PRO H N   
2266 C CA  . PRO B 129 ? 0.3289 0.3441 0.2799 -0.0220 -0.0032 -0.1273 129 PRO H CA  
2267 C C   . PRO B 129 ? 0.3378 0.3340 0.2790 -0.0169 0.0044  -0.1251 129 PRO H C   
2268 O O   . PRO B 129 ? 0.3410 0.3422 0.2697 -0.0096 0.0035  -0.1239 129 PRO H O   
2269 C CB  . PRO B 129 ? 0.3443 0.3737 0.2935 -0.0302 -0.0077 -0.1448 129 PRO H CB  
2270 C CG  . PRO B 129 ? 0.3490 0.3954 0.2847 -0.0203 -0.0152 -0.1450 129 PRO H CG  
2271 C CD  . PRO B 129 ? 0.3322 0.3820 0.2676 -0.0102 -0.0185 -0.1287 129 PRO H CD  
2272 N N   . LEU B 130 ? 0.3559 0.3310 0.3018 -0.0202 0.0120  -0.1248 130 LEU H N   
2273 C CA  . LEU B 130 ? 0.3817 0.3364 0.3192 -0.0158 0.0199  -0.1275 130 LEU H CA  
2274 C C   . LEU B 130 ? 0.4138 0.3536 0.3475 -0.0262 0.0225  -0.1431 130 LEU H C   
2275 O O   . LEU B 130 ? 0.4099 0.3316 0.3482 -0.0337 0.0267  -0.1437 130 LEU H O   
2276 C CB  . LEU B 130 ? 0.3680 0.3088 0.3118 -0.0099 0.0255  -0.1151 130 LEU H CB  
2277 C CG  . LEU B 130 ? 0.3470 0.3021 0.2947 -0.0024 0.0236  -0.1009 130 LEU H CG  
2278 C CD1 . LEU B 130 ? 0.3363 0.2812 0.2924 0.0010  0.0277  -0.0907 130 LEU H CD1 
2279 C CD2 . LEU B 130 ? 0.3477 0.3106 0.2851 0.0054  0.0255  -0.0999 130 LEU H CD2 
2280 N N   . ALA B 131 ? 0.4681 0.4164 0.3922 -0.0282 0.0197  -0.1556 131 ALA H N   
2281 C CA  . ALA B 131 ? 0.5173 0.4592 0.4372 -0.0413 0.0200  -0.1736 131 ALA H CA  
2282 C C   . ALA B 131 ? 0.5377 0.4438 0.4474 -0.0411 0.0295  -0.1792 131 ALA H C   
2283 O O   . ALA B 131 ? 0.5493 0.4481 0.4499 -0.0287 0.0330  -0.1772 131 ALA H O   
2284 C CB  . ALA B 131 ? 0.5233 0.4877 0.4346 -0.0408 0.0133  -0.1845 131 ALA H CB  
2285 N N   . PRO B 132 ? 0.5812 0.4638 0.4905 -0.0544 0.0343  -0.1867 132 PRO H N   
2286 C CA  . PRO B 132 ? 0.6299 0.4743 0.5236 -0.0558 0.0426  -0.1962 132 PRO H CA  
2287 C C   . PRO B 132 ? 0.6566 0.5063 0.5398 -0.0640 0.0405  -0.2159 132 PRO H C   
2288 O O   . PRO B 132 ? 0.7301 0.5726 0.6016 -0.0519 0.0427  -0.2184 132 PRO H O   
2289 C CB  . PRO B 132 ? 0.6543 0.4728 0.5496 -0.0706 0.0481  -0.1968 132 PRO H CB  
2290 C CG  . PRO B 132 ? 0.6285 0.4822 0.5406 -0.0845 0.0411  -0.1983 132 PRO H CG  
2291 C CD  . PRO B 132 ? 0.5815 0.4728 0.5029 -0.0705 0.0323  -0.1885 132 PRO H CD  
2292 N N   . GLY B 139 ? 1.0702 0.4205 0.7356 0.0266  0.1208  -0.2376 139 GLY H N   
2293 C CA  . GLY B 139 ? 1.0519 0.4044 0.7279 0.0268  0.1201  -0.2175 139 GLY H CA  
2294 C C   . GLY B 139 ? 1.0615 0.4122 0.7445 -0.0096 0.1213  -0.2190 139 GLY H C   
2295 O O   . GLY B 139 ? 1.0707 0.4487 0.7646 -0.0325 0.1183  -0.2334 139 GLY H O   
2296 N N   . GLY B 140 ? 1.0649 0.3796 0.7373 -0.0145 0.1263  -0.2066 140 GLY H N   
2297 C CA  . GLY B 140 ? 1.0599 0.3687 0.7362 -0.0490 0.1295  -0.2073 140 GLY H CA  
2298 C C   . GLY B 140 ? 0.9876 0.3608 0.7011 -0.0558 0.1215  -0.1954 140 GLY H C   
2299 O O   . GLY B 140 ? 0.9823 0.3637 0.7048 -0.0840 0.1230  -0.1966 140 GLY H O   
2300 N N   . THR B 141 ? 0.9233 0.3422 0.6576 -0.0319 0.1136  -0.1855 141 THR H N   
2301 C CA  . THR B 141 ? 0.8569 0.3311 0.6231 -0.0328 0.1061  -0.1716 141 THR H CA  
2302 C C   . THR B 141 ? 0.7993 0.3336 0.5897 -0.0300 0.0971  -0.1769 141 THR H C   
2303 O O   . THR B 141 ? 0.8227 0.3615 0.6076 -0.0104 0.0960  -0.1817 141 THR H O   
2304 C CB  . THR B 141 ? 0.8427 0.3121 0.6086 -0.0071 0.1056  -0.1527 141 THR H CB  
2305 O OG1 . THR B 141 ? 0.8875 0.2973 0.6269 -0.0099 0.1141  -0.1473 141 THR H OG1 
2306 C CG2 . THR B 141 ? 0.7793 0.3018 0.5755 -0.0070 0.0983  -0.1393 141 THR H CG2 
2307 N N   . ALA B 142 ? 0.7510 0.3295 0.5658 -0.0479 0.0912  -0.1754 142 ALA H N   
2308 C CA  . ALA B 142 ? 0.6842 0.3196 0.5208 -0.0464 0.0820  -0.1778 142 ALA H CA  
2309 C C   . ALA B 142 ? 0.6181 0.2896 0.4766 -0.0386 0.0764  -0.1603 142 ALA H C   
2310 O O   . ALA B 142 ? 0.6301 0.2908 0.4912 -0.0434 0.0786  -0.1505 142 ALA H O   
2311 C CB  . ALA B 142 ? 0.6869 0.3419 0.5298 -0.0710 0.0791  -0.1929 142 ALA H CB  
2312 N N   . ALA B 143 ? 0.5659 0.2770 0.4376 -0.0272 0.0699  -0.1569 143 ALA H N   
2313 C CA  . ALA B 143 ? 0.5105 0.2555 0.4018 -0.0218 0.0645  -0.1419 143 ALA H CA  
2314 C C   . ALA B 143 ? 0.4711 0.2581 0.3766 -0.0314 0.0565  -0.1462 143 ALA H C   
2315 O O   . ALA B 143 ? 0.4648 0.2631 0.3656 -0.0315 0.0543  -0.1571 143 ALA H O   
2316 C CB  . ALA B 143 ? 0.5019 0.2541 0.3941 0.0011  0.0645  -0.1319 143 ALA H CB  
2317 N N   . LEU B 144 ? 0.4478 0.2562 0.3685 -0.0379 0.0524  -0.1378 144 LEU H N   
2318 C CA  . LEU B 144 ? 0.4248 0.2742 0.3587 -0.0427 0.0438  -0.1390 144 LEU H CA  
2319 C C   . LEU B 144 ? 0.3815 0.2499 0.3287 -0.0361 0.0402  -0.1233 144 LEU H C   
2320 O O   . LEU B 144 ? 0.3890 0.2411 0.3372 -0.0314 0.0442  -0.1129 144 LEU H O   
2321 C CB  . LEU B 144 ? 0.4433 0.2999 0.3804 -0.0629 0.0421  -0.1519 144 LEU H CB  
2322 C CG  . LEU B 144 ? 0.4601 0.2994 0.4000 -0.0767 0.0473  -0.1502 144 LEU H CG  
2323 C CD1 . LEU B 144 ? 0.4382 0.3110 0.3961 -0.0824 0.0414  -0.1450 144 LEU H CD1 
2324 C CD2 . LEU B 144 ? 0.5093 0.3291 0.4395 -0.0961 0.0523  -0.1672 144 LEU H CD2 
2325 N N   . GLY B 145 ? 0.3601 0.2609 0.3158 -0.0353 0.0326  -0.1215 145 GLY H N   
2326 C CA  . GLY B 145 ? 0.3285 0.2446 0.2951 -0.0301 0.0292  -0.1075 145 GLY H CA  
2327 C C   . GLY B 145 ? 0.3093 0.2561 0.2811 -0.0293 0.0207  -0.1068 145 GLY H C   
2328 O O   . GLY B 145 ? 0.3163 0.2753 0.2841 -0.0330 0.0166  -0.1173 145 GLY H O   
2329 N N   . CYS B 146 ? 0.2966 0.2529 0.2748 -0.0230 0.0182  -0.0941 146 CYS H N   
2330 C CA  . CYS B 146 ? 0.2794 0.2582 0.2590 -0.0189 0.0106  -0.0898 146 CYS H CA  
2331 C C   . CYS B 146 ? 0.2604 0.2381 0.2363 -0.0090 0.0118  -0.0777 146 CYS H C   
2332 O O   . CYS B 146 ? 0.2679 0.2367 0.2489 -0.0066 0.0160  -0.0696 146 CYS H O   
2333 C CB  . CYS B 146 ? 0.2688 0.2589 0.2595 -0.0240 0.0068  -0.0882 146 CYS H CB  
2334 S SG  . CYS B 146 ? 0.3127 0.3168 0.3070 -0.0365 0.0036  -0.1055 146 CYS H SG  
2335 N N   . LEU B 147 ? 0.2654 0.2524 0.2316 -0.0043 0.0088  -0.0773 147 LEU H N   
2336 C CA  . LEU B 147 ? 0.2572 0.2461 0.2187 0.0018  0.0097  -0.0661 147 LEU H CA  
2337 C C   . LEU B 147 ? 0.2514 0.2481 0.2138 0.0027  0.0031  -0.0594 147 LEU H C   
2338 O O   . LEU B 147 ? 0.2593 0.2653 0.2154 0.0039  -0.0035 -0.0638 147 LEU H O   
2339 C CB  . LEU B 147 ? 0.2663 0.2582 0.2134 0.0053  0.0109  -0.0690 147 LEU H CB  
2340 C CG  . LEU B 147 ? 0.2720 0.2666 0.2106 0.0086  0.0125  -0.0587 147 LEU H CG  
2341 C CD1 . LEU B 147 ? 0.2721 0.2636 0.2204 0.0093  0.0190  -0.0522 147 LEU H CD1 
2342 C CD2 . LEU B 147 ? 0.2874 0.2856 0.2093 0.0108  0.0141  -0.0621 147 LEU H CD2 
2343 N N   . VAL B 148 ? 0.2315 0.2248 0.1998 0.0035  0.0047  -0.0498 148 VAL H N   
2344 C CA  . VAL B 148 ? 0.2336 0.2304 0.2021 0.0051  -0.0005 -0.0432 148 VAL H CA  
2345 C C   . VAL B 148 ? 0.2476 0.2398 0.2043 0.0076  0.0010  -0.0339 148 VAL H C   
2346 O O   . VAL B 148 ? 0.2297 0.2186 0.1914 0.0062  0.0057  -0.0277 148 VAL H O   
2347 C CB  . VAL B 148 ? 0.2300 0.2253 0.2131 0.0023  0.0004  -0.0404 148 VAL H CB  
2348 C CG1 . VAL B 148 ? 0.2233 0.2222 0.2065 0.0049  -0.0048 -0.0351 148 VAL H CG1 
2349 C CG2 . VAL B 148 ? 0.2438 0.2413 0.2360 -0.0030 0.0007  -0.0497 148 VAL H CG2 
2350 N N   . LYS B 149 ? 0.2598 0.2520 0.2000 0.0109  -0.0027 -0.0334 149 LYS H N   
2351 C CA  . LYS B 149 ? 0.2745 0.2598 0.1988 0.0107  0.0011  -0.0262 149 LYS H CA  
2352 C C   . LYS B 149 ? 0.2804 0.2562 0.1905 0.0134  -0.0033 -0.0183 149 LYS H C   
2353 O O   . LYS B 149 ? 0.2767 0.2534 0.1794 0.0199  -0.0113 -0.0204 149 LYS H O   
2354 C CB  . LYS B 149 ? 0.3055 0.2933 0.2160 0.0120  0.0022  -0.0313 149 LYS H CB  
2355 C CG  . LYS B 149 ? 0.3250 0.3081 0.2205 0.0093  0.0089  -0.0252 149 LYS H CG  
2356 C CD  . LYS B 149 ? 0.3400 0.3281 0.2262 0.0099  0.0123  -0.0311 149 LYS H CD  
2357 C CE  . LYS B 149 ? 0.3591 0.3410 0.2217 0.0079  0.0164  -0.0244 149 LYS H CE  
2358 N NZ  . LYS B 149 ? 0.3631 0.3454 0.2288 0.0005  0.0251  -0.0181 149 LYS H NZ  
2359 N N   . ASP B 150 ? 0.2797 0.2468 0.1834 0.0090  0.0019  -0.0102 150 ASP H N   
2360 C CA  . ASP B 150 ? 0.3050 0.2552 0.1865 0.0096  0.0004  -0.0019 150 ASP H CA  
2361 C C   . ASP B 150 ? 0.2954 0.2397 0.1806 0.0142  -0.0060 0.0004  150 ASP H C   
2362 O O   . ASP B 150 ? 0.3127 0.2494 0.1828 0.0227  -0.0131 0.0011  150 ASP H O   
2363 C CB  . ASP B 150 ? 0.3448 0.2875 0.2004 0.0145  -0.0022 -0.0015 150 ASP H CB  
2364 C CG  . ASP B 150 ? 0.3639 0.3086 0.2100 0.0085  0.0060  -0.0015 150 ASP H CG  
2365 O OD1 . ASP B 150 ? 0.3760 0.3262 0.2323 0.0000  0.0143  -0.0003 150 ASP H OD1 
2366 O OD2 . ASP B 150 ? 0.4014 0.3427 0.2277 0.0129  0.0039  -0.0025 150 ASP H OD2 
2367 N N   . TYR B 151 ? 0.2829 0.2312 0.1863 0.0097  -0.0036 0.0015  151 TYR H N   
2368 C CA  . TYR B 151 ? 0.2708 0.2148 0.1784 0.0137  -0.0088 0.0031  151 TYR H CA  
2369 C C   . TYR B 151 ? 0.2750 0.2091 0.1818 0.0064  -0.0040 0.0095  151 TYR H C   
2370 O O   . TYR B 151 ? 0.2766 0.2149 0.1878 -0.0022 0.0031  0.0109  151 TYR H O   
2371 C CB  . TYR B 151 ? 0.2518 0.2126 0.1827 0.0159  -0.0116 -0.0034 151 TYR H CB  
2372 C CG  . TYR B 151 ? 0.2292 0.1986 0.1798 0.0091  -0.0053 -0.0044 151 TYR H CG  
2373 C CD1 . TYR B 151 ? 0.2222 0.1995 0.1802 0.0071  -0.0016 -0.0095 151 TYR H CD1 
2374 C CD2 . TYR B 151 ? 0.2232 0.1916 0.1830 0.0062  -0.0035 -0.0007 151 TYR H CD2 
2375 C CE1 . TYR B 151 ? 0.2055 0.1875 0.1781 0.0039  0.0036  -0.0099 151 TYR H CE1 
2376 C CE2 . TYR B 151 ? 0.2078 0.1839 0.1835 0.0027  0.0011  -0.0012 151 TYR H CE2 
2377 C CZ  . TYR B 151 ? 0.2065 0.1884 0.1877 0.0022  0.0048  -0.0054 151 TYR H CZ  
2378 O OH  . TYR B 151 ? 0.2163 0.2027 0.2101 0.0015  0.0090  -0.0054 151 TYR H OH  
2379 N N   . PHE B 152 ? 0.2725 0.1966 0.1749 0.0103  -0.0084 0.0119  152 PHE H N   
2380 C CA  . PHE B 152 ? 0.2774 0.1906 0.1775 0.0034  -0.0050 0.0167  152 PHE H CA  
2381 C C   . PHE B 152 ? 0.2766 0.1849 0.1782 0.0110  -0.0112 0.0162  152 PHE H C   
2382 O O   . PHE B 152 ? 0.2928 0.1949 0.1831 0.0223  -0.0180 0.0151  152 PHE H O   
2383 C CB  . PHE B 152 ? 0.3094 0.1994 0.1820 -0.0028 -0.0009 0.0227  152 PHE H CB  
2384 C CG  . PHE B 152 ? 0.3160 0.1976 0.1878 -0.0134 0.0036  0.0257  152 PHE H CG  
2385 C CD1 . PHE B 152 ? 0.3077 0.2072 0.1960 -0.0245 0.0103  0.0244  152 PHE H CD1 
2386 C CD2 . PHE B 152 ? 0.3400 0.1991 0.1970 -0.0111 0.0004  0.0284  152 PHE H CD2 
2387 C CE1 . PHE B 152 ? 0.3218 0.2196 0.2126 -0.0346 0.0138  0.0254  152 PHE H CE1 
2388 C CE2 . PHE B 152 ? 0.3544 0.2080 0.2127 -0.0219 0.0044  0.0295  152 PHE H CE2 
2389 C CZ  . PHE B 152 ? 0.3347 0.2088 0.2100 -0.0346 0.0110  0.0278  152 PHE H CZ  
2390 N N   . PRO B 153 ? 0.2677 0.1799 0.1821 0.0065  -0.0095 0.0166  153 PRO H N   
2391 C CA  . PRO B 153 ? 0.2495 0.1751 0.1806 -0.0034 -0.0033 0.0166  153 PRO H CA  
2392 C C   . PRO B 153 ? 0.2218 0.1694 0.1767 -0.0009 -0.0031 0.0122  153 PRO H C   
2393 O O   . PRO B 153 ? 0.2094 0.1623 0.1679 0.0055  -0.0069 0.0085  153 PRO H O   
2394 C CB  . PRO B 153 ? 0.2542 0.1732 0.1857 -0.0055 -0.0041 0.0181  153 PRO H CB  
2395 C CG  . PRO B 153 ? 0.2597 0.1779 0.1922 0.0059  -0.0109 0.0157  153 PRO H CG  
2396 C CD  . PRO B 153 ? 0.2731 0.1810 0.1880 0.0136  -0.0147 0.0157  153 PRO H CD  
2397 N N   . GLU B 154 ? 0.2168 0.1761 0.1863 -0.0058 0.0010  0.0123  154 GLU H N   
2398 C CA  . GLU B 154 ? 0.2173 0.1898 0.2051 -0.0027 0.0010  0.0095  154 GLU H CA  
2399 C C   . GLU B 154 ? 0.2130 0.1845 0.2044 0.0012  -0.0033 0.0089  154 GLU H C   
2400 O O   . GLU B 154 ? 0.2202 0.1827 0.2028 0.0013  -0.0054 0.0109  154 GLU H O   
2401 C CB  . GLU B 154 ? 0.2305 0.2135 0.2291 -0.0061 0.0056  0.0106  154 GLU H CB  
2402 C CG  . GLU B 154 ? 0.2646 0.2538 0.2627 -0.0078 0.0101  0.0093  154 GLU H CG  
2403 C CD  . GLU B 154 ? 0.3105 0.3041 0.3174 -0.0027 0.0112  0.0058  154 GLU H CD  
2404 O OE1 . GLU B 154 ? 0.3039 0.3060 0.3183 -0.0011 0.0146  0.0056  154 GLU H OE1 
2405 O OE2 . GLU B 154 ? 0.2836 0.2722 0.2893 -0.0001 0.0085  0.0025  154 GLU H OE2 
2406 N N   . PRO B 155 ? 0.2098 0.1898 0.2132 0.0035  -0.0037 0.0059  155 PRO H N   
2407 C CA  . PRO B 155 ? 0.1936 0.1794 0.2052 0.0028  -0.0007 0.0029  155 PRO H CA  
2408 C C   . PRO B 155 ? 0.2071 0.1956 0.2175 0.0048  -0.0036 -0.0028 155 PRO H C   
2409 O O   . PRO B 155 ? 0.2067 0.1964 0.2125 0.0085  -0.0085 -0.0046 155 PRO H O   
2410 C CB  . PRO B 155 ? 0.2045 0.1944 0.2271 0.0023  0.0012  0.0034  155 PRO H CB  
2411 C CG  . PRO B 155 ? 0.1986 0.1901 0.2205 0.0041  -0.0028 0.0029  155 PRO H CG  
2412 C CD  . PRO B 155 ? 0.2146 0.1983 0.2242 0.0057  -0.0059 0.0051  155 PRO H CD  
2413 N N   . VAL B 156 ? 0.2118 0.2025 0.2271 0.0028  -0.0006 -0.0067 156 VAL H N   
2414 C CA  . VAL B 156 ? 0.2304 0.2270 0.2480 0.0021  -0.0026 -0.0143 156 VAL H CA  
2415 C C   . VAL B 156 ? 0.2352 0.2312 0.2624 -0.0028 0.0020  -0.0169 156 VAL H C   
2416 O O   . VAL B 156 ? 0.2400 0.2284 0.2684 -0.0029 0.0065  -0.0127 156 VAL H O   
2417 C CB  . VAL B 156 ? 0.2681 0.2639 0.2780 0.0026  -0.0030 -0.0185 156 VAL H CB  
2418 C CG1 . VAL B 156 ? 0.2937 0.2873 0.2899 0.0074  -0.0075 -0.0161 156 VAL H CG1 
2419 C CG2 . VAL B 156 ? 0.2763 0.2661 0.2866 0.0010  0.0028  -0.0178 156 VAL H CG2 
2420 N N   . THR B 157 ? 0.2306 0.2349 0.2634 -0.0064 0.0009  -0.0232 157 THR H N   
2421 C CA  . THR B 157 ? 0.2435 0.2431 0.2816 -0.0140 0.0066  -0.0268 157 THR H CA  
2422 C C   . THR B 157 ? 0.2382 0.2394 0.2749 -0.0188 0.0070  -0.0363 157 THR H C   
2423 O O   . THR B 157 ? 0.2355 0.2500 0.2710 -0.0167 0.0013  -0.0418 157 THR H O   
2424 C CB  . THR B 157 ? 0.2552 0.2636 0.3007 -0.0182 0.0073  -0.0278 157 THR H CB  
2425 O OG1 . THR B 157 ? 0.2539 0.2820 0.3033 -0.0176 0.0017  -0.0348 157 THR H OG1 
2426 C CG2 . THR B 157 ? 0.2678 0.2729 0.3132 -0.0137 0.0074  -0.0189 157 THR H CG2 
2427 N N   . VAL B 158 ? 0.2371 0.2234 0.2718 -0.0241 0.0133  -0.0382 158 VAL H N   
2428 C CA  . VAL B 158 ? 0.2602 0.2448 0.2926 -0.0307 0.0147  -0.0486 158 VAL H CA  
2429 C C   . VAL B 158 ? 0.2752 0.2476 0.3086 -0.0420 0.0218  -0.0519 158 VAL H C   
2430 O O   . VAL B 158 ? 0.3025 0.2549 0.3312 -0.0400 0.0271  -0.0446 158 VAL H O   
2431 C CB  . VAL B 158 ? 0.2580 0.2302 0.2815 -0.0254 0.0162  -0.0487 158 VAL H CB  
2432 C CG1 . VAL B 158 ? 0.2703 0.2408 0.2904 -0.0323 0.0172  -0.0605 158 VAL H CG1 
2433 C CG2 . VAL B 158 ? 0.2417 0.2233 0.2619 -0.0162 0.0110  -0.0439 158 VAL H CG2 
2434 N N   . SER B 159 ? 0.2978 0.2831 0.3362 -0.0530 0.0216  -0.0624 159 SER H N   
2435 C CA  . SER B 159 ? 0.3301 0.3012 0.3666 -0.0679 0.0299  -0.0679 159 SER H CA  
2436 C C   . SER B 159 ? 0.3327 0.3029 0.3654 -0.0757 0.0301  -0.0808 159 SER H C   
2437 O O   . SER B 159 ? 0.3222 0.3089 0.3557 -0.0690 0.0229  -0.0856 159 SER H O   
2438 C CB  . SER B 159 ? 0.3307 0.3203 0.3772 -0.0774 0.0312  -0.0699 159 SER H CB  
2439 O OG  . SER B 159 ? 0.3581 0.3803 0.4143 -0.0815 0.0251  -0.0819 159 SER H OG  
2440 N N   . TRP B 160 ? 0.3588 0.3071 0.3846 -0.0895 0.0385  -0.0864 160 TRP H N   
2441 C CA  . TRP B 160 ? 0.3718 0.3172 0.3934 -0.1015 0.0402  -0.1011 160 TRP H CA  
2442 C C   . TRP B 160 ? 0.3807 0.3352 0.4078 -0.1235 0.0457  -0.1113 160 TRP H C   
2443 O O   . TRP B 160 ? 0.4013 0.3361 0.4239 -0.1315 0.0541  -0.1052 160 TRP H O   
2444 C CB  . TRP B 160 ? 0.3877 0.2923 0.3918 -0.0986 0.0466  -0.0998 160 TRP H CB  
2445 C CG  . TRP B 160 ? 0.3615 0.2666 0.3623 -0.0798 0.0412  -0.0944 160 TRP H CG  
2446 C CD1 . TRP B 160 ? 0.3496 0.2486 0.3491 -0.0639 0.0402  -0.0808 160 TRP H CD1 
2447 C CD2 . TRP B 160 ? 0.3441 0.2602 0.3427 -0.0760 0.0363  -0.1031 160 TRP H CD2 
2448 N NE1 . TRP B 160 ? 0.3252 0.2293 0.3217 -0.0519 0.0362  -0.0807 160 TRP H NE1 
2449 C CE2 . TRP B 160 ? 0.3323 0.2473 0.3278 -0.0584 0.0335  -0.0935 160 TRP H CE2 
2450 C CE3 . TRP B 160 ? 0.3554 0.2850 0.3541 -0.0859 0.0338  -0.1183 160 TRP H CE3 
2451 C CZ2 . TRP B 160 ? 0.3226 0.2463 0.3137 -0.0512 0.0294  -0.0980 160 TRP H CZ2 
2452 C CZ3 . TRP B 160 ? 0.3567 0.2947 0.3506 -0.0772 0.0287  -0.1228 160 TRP H CZ3 
2453 C CH2 . TRP B 160 ? 0.3394 0.2733 0.3288 -0.0600 0.0270  -0.1123 160 TRP H CH2 
2454 N N   . ASN B 161 ? 0.3940 0.3790 0.4299 -0.1326 0.0412  -0.1263 161 ASN H N   
2455 C CA  . ASN B 161 ? 0.4338 0.4355 0.4770 -0.1565 0.0463  -0.1403 161 ASN H CA  
2456 C C   . ASN B 161 ? 0.4354 0.4499 0.4879 -0.1597 0.0494  -0.1329 161 ASN H C   
2457 O O   . ASN B 161 ? 0.4303 0.4284 0.4784 -0.1783 0.0604  -0.1340 161 ASN H O   
2458 C CB  . ASN B 161 ? 0.4766 0.4405 0.5039 -0.1748 0.0567  -0.1489 161 ASN H CB  
2459 C CG  . ASN B 161 ? 0.4918 0.4518 0.5120 -0.1723 0.0525  -0.1596 161 ASN H CG  
2460 O OD1 . ASN B 161 ? 0.4835 0.4766 0.5122 -0.1613 0.0417  -0.1642 161 ASN H OD1 
2461 N ND2 . ASN B 161 ? 0.5386 0.4573 0.5410 -0.1839 0.0615  -0.1652 161 ASN H ND2 
2462 N N   . SER B 162 ? 0.4202 0.4567 0.4817 -0.1410 0.0409  -0.1237 162 SER H N   
2463 C CA  . SER B 162 ? 0.4268 0.4817 0.4983 -0.1389 0.0412  -0.1170 162 SER H CA  
2464 C C   . SER B 162 ? 0.4726 0.4906 0.5329 -0.1439 0.0519  -0.1049 162 SER H C   
2465 O O   . SER B 162 ? 0.4801 0.5099 0.5462 -0.1526 0.0568  -0.1038 162 SER H O   
2466 C CB  . SER B 162 ? 0.4236 0.5210 0.5108 -0.1532 0.0409  -0.1314 162 SER H CB  
2467 O OG  . SER B 162 ? 0.4203 0.5494 0.5148 -0.1500 0.0314  -0.1446 162 SER H OG  
2468 N N   . GLY B 163 ? 0.4751 0.4518 0.5193 -0.1369 0.0552  -0.0958 163 GLY H N   
2469 C CA  . GLY B 163 ? 0.5009 0.4418 0.5318 -0.1360 0.0636  -0.0824 163 GLY H CA  
2470 C C   . GLY B 163 ? 0.5288 0.4334 0.5435 -0.1552 0.0758  -0.0867 163 GLY H C   
2471 O O   . GLY B 163 ? 0.5965 0.4657 0.5955 -0.1532 0.0829  -0.0754 163 GLY H O   
2472 N N   . ALA B 164 ? 0.5320 0.4443 0.5486 -0.1720 0.0776  -0.1025 164 ALA H N   
2473 C CA  . ALA B 164 ? 0.5968 0.4734 0.5965 -0.1938 0.0893  -0.1104 164 ALA H CA  
2474 C C   . ALA B 164 ? 0.6190 0.4447 0.5959 -0.1819 0.0917  -0.1040 164 ALA H C   
2475 O O   . ALA B 164 ? 0.6513 0.4308 0.6061 -0.1935 0.1029  -0.1031 164 ALA H O   
2476 C CB  . ALA B 164 ? 0.6064 0.5133 0.6172 -0.2121 0.0877  -0.1308 164 ALA H CB  
2477 N N   . LEU B 165 ? 0.5636 0.3961 0.5440 -0.1593 0.0822  -0.1000 165 LEU H N   
2478 C CA  . LEU B 165 ? 0.5644 0.3561 0.5256 -0.1463 0.0837  -0.0965 165 LEU H CA  
2479 C C   . LEU B 165 ? 0.5402 0.3266 0.5001 -0.1213 0.0794  -0.0798 165 LEU H C   
2480 O O   . LEU B 165 ? 0.4977 0.3195 0.4740 -0.1088 0.0699  -0.0767 165 LEU H O   
2481 C CB  . LEU B 165 ? 0.5559 0.3647 0.5223 -0.1455 0.0773  -0.1100 165 LEU H CB  
2482 C CG  . LEU B 165 ? 0.5676 0.3451 0.5180 -0.1303 0.0773  -0.1090 165 LEU H CG  
2483 C CD1 . LEU B 165 ? 0.6264 0.3462 0.5500 -0.1374 0.0889  -0.1093 165 LEU H CD1 
2484 C CD2 . LEU B 165 ? 0.5483 0.3494 0.5051 -0.1322 0.0709  -0.1236 165 LEU H CD2 
2485 N N   . THR B 166 ? 0.5576 0.3033 0.4984 -0.1154 0.0863  -0.0690 166 THR H N   
2486 C CA  . THR B 166 ? 0.5588 0.3024 0.4985 -0.0921 0.0824  -0.0536 166 THR H CA  
2487 C C   . THR B 166 ? 0.5881 0.2895 0.5057 -0.0770 0.0857  -0.0499 166 THR H C   
2488 O O   . THR B 166 ? 0.5956 0.3054 0.5164 -0.0563 0.0802  -0.0427 166 THR H O   
2489 C CB  . THR B 166 ? 0.5626 0.3091 0.5034 -0.0946 0.0851  -0.0429 166 THR H CB  
2490 O OG1 . THR B 166 ? 0.6122 0.3155 0.5302 -0.1067 0.0966  -0.0408 166 THR H OG1 
2491 C CG2 . THR B 166 ? 0.5393 0.3317 0.5031 -0.1060 0.0809  -0.0478 166 THR H CG2 
2492 N N   . SER B 167 ? 0.6310 0.2889 0.5264 -0.0873 0.0948  -0.0552 167 SER H N   
2493 C CA  . SER B 167 ? 0.6644 0.2774 0.5352 -0.0712 0.0983  -0.0530 167 SER H CA  
2494 C C   . SER B 167 ? 0.6273 0.2565 0.5055 -0.0607 0.0922  -0.0623 167 SER H C   
2495 O O   . SER B 167 ? 0.5884 0.2341 0.4752 -0.0755 0.0908  -0.0760 167 SER H O   
2496 C CB  . SER B 167 ? 0.7253 0.2814 0.5664 -0.0861 0.1104  -0.0563 167 SER H CB  
2497 O OG  . SER B 167 ? 0.7590 0.3039 0.5949 -0.0976 0.1126  -0.0721 167 SER H OG  
2498 N N   . GLY B 168 ? 0.6233 0.2507 0.4982 -0.0354 0.0885  -0.0556 168 GLY H N   
2499 C CA  . GLY B 168 ? 0.5957 0.2366 0.4749 -0.0241 0.0840  -0.0639 168 GLY H CA  
2500 C C   . GLY B 168 ? 0.5315 0.2282 0.4381 -0.0219 0.0746  -0.0639 168 GLY H C   
2501 O O   . GLY B 168 ? 0.5035 0.2152 0.4140 -0.0134 0.0710  -0.0697 168 GLY H O   
2502 N N   . VAL B 169 ? 0.4863 0.2108 0.4091 -0.0289 0.0710  -0.0578 169 VAL H N   
2503 C CA  . VAL B 169 ? 0.4368 0.2085 0.3817 -0.0259 0.0623  -0.0568 169 VAL H CA  
2504 C C   . VAL B 169 ? 0.4131 0.1959 0.3613 -0.0052 0.0589  -0.0465 169 VAL H C   
2505 O O   . VAL B 169 ? 0.4324 0.2017 0.3748 0.0030  0.0609  -0.0367 169 VAL H O   
2506 C CB  . VAL B 169 ? 0.4162 0.2116 0.3754 -0.0394 0.0598  -0.0548 169 VAL H CB  
2507 C CG1 . VAL B 169 ? 0.3813 0.2173 0.3583 -0.0329 0.0511  -0.0513 169 VAL H CG1 
2508 C CG2 . VAL B 169 ? 0.4232 0.2191 0.3830 -0.0601 0.0621  -0.0676 169 VAL H CG2 
2509 N N   . HIS B 170 ? 0.3848 0.1940 0.3421 0.0021  0.0539  -0.0488 170 HIS H N   
2510 C CA  . HIS B 170 ? 0.3527 0.1823 0.3173 0.0174  0.0504  -0.0403 170 HIS H CA  
2511 C C   . HIS B 170 ? 0.3170 0.1816 0.2961 0.0125  0.0442  -0.0408 170 HIS H C   
2512 O O   . HIS B 170 ? 0.3054 0.1788 0.2842 0.0103  0.0428  -0.0485 170 HIS H O   
2513 C CB  . HIS B 170 ? 0.3706 0.1935 0.3270 0.0335  0.0524  -0.0428 170 HIS H CB  
2514 C CG  . HIS B 170 ? 0.4069 0.1931 0.3457 0.0439  0.0579  -0.0413 170 HIS H CG  
2515 N ND1 . HIS B 170 ? 0.4171 0.1932 0.3517 0.0525  0.0586  -0.0310 170 HIS H ND1 
2516 C CD2 . HIS B 170 ? 0.4422 0.1972 0.3639 0.0481  0.0627  -0.0486 170 HIS H CD2 
2517 C CE1 . HIS B 170 ? 0.4580 0.1960 0.3720 0.0626  0.0637  -0.0315 170 HIS H CE1 
2518 N NE2 . HIS B 170 ? 0.4726 0.1962 0.3783 0.0602  0.0665  -0.0425 170 HIS H NE2 
2519 N N   . THR B 171 ? 0.3030 0.1839 0.2918 0.0115  0.0408  -0.0329 171 THR H N   
2520 C CA  . THR B 171 ? 0.2698 0.1793 0.2690 0.0091  0.0351  -0.0313 171 THR H CA  
2521 C C   . THR B 171 ? 0.2578 0.1803 0.2599 0.0202  0.0344  -0.0251 171 THR H C   
2522 O O   . THR B 171 ? 0.2667 0.1883 0.2706 0.0255  0.0349  -0.0181 171 THR H O   
2523 C CB  . THR B 171 ? 0.2539 0.1718 0.2605 0.0004  0.0320  -0.0283 171 THR H CB  
2524 O OG1 . THR B 171 ? 0.2691 0.1783 0.2732 -0.0103 0.0336  -0.0367 171 THR H OG1 
2525 C CG2 . THR B 171 ? 0.2450 0.1860 0.2581 0.0000  0.0262  -0.0264 171 THR H CG2 
2526 N N   . PHE B 172 ? 0.2322 0.1679 0.2340 0.0231  0.0338  -0.0280 172 PHE H N   
2527 C CA  . PHE B 172 ? 0.2250 0.1766 0.2298 0.0318  0.0346  -0.0243 172 PHE H CA  
2528 C C   . PHE B 172 ? 0.2166 0.1856 0.2288 0.0276  0.0310  -0.0176 172 PHE H C   
2529 O O   . PHE B 172 ? 0.2095 0.1809 0.2223 0.0194  0.0275  -0.0172 172 PHE H O   
2530 C CB  . PHE B 172 ? 0.2231 0.1830 0.2236 0.0339  0.0363  -0.0304 172 PHE H CB  
2531 C CG  . PHE B 172 ? 0.2339 0.1767 0.2263 0.0419  0.0406  -0.0370 172 PHE H CG  
2532 C CD1 . PHE B 172 ? 0.2421 0.1851 0.2335 0.0556  0.0436  -0.0362 172 PHE H CD1 
2533 C CD2 . PHE B 172 ? 0.2489 0.1741 0.2336 0.0362  0.0413  -0.0448 172 PHE H CD2 
2534 C CE1 . PHE B 172 ? 0.2649 0.1875 0.2458 0.0650  0.0475  -0.0424 172 PHE H CE1 
2535 C CE2 . PHE B 172 ? 0.2733 0.1773 0.2478 0.0428  0.0456  -0.0515 172 PHE H CE2 
2536 C CZ  . PHE B 172 ? 0.2832 0.1838 0.2547 0.0582  0.0488  -0.0500 172 PHE H CZ  
2537 N N   . PRO B 173 ? 0.2251 0.2075 0.2421 0.0335  0.0316  -0.0132 173 PRO H N   
2538 C CA  . PRO B 173 ? 0.2215 0.2208 0.2437 0.0279  0.0290  -0.0086 173 PRO H CA  
2539 C C   . PRO B 173 ? 0.2166 0.2230 0.2341 0.0209  0.0289  -0.0110 173 PRO H C   
2540 O O   . PRO B 173 ? 0.2194 0.2286 0.2329 0.0236  0.0320  -0.0157 173 PRO H O   
2541 C CB  . PRO B 173 ? 0.2166 0.2332 0.2445 0.0353  0.0306  -0.0067 173 PRO H CB  
2542 C CG  . PRO B 173 ? 0.2381 0.2422 0.2633 0.0479  0.0325  -0.0078 173 PRO H CG  
2543 C CD  . PRO B 173 ? 0.2381 0.2203 0.2550 0.0463  0.0343  -0.0129 173 PRO H CD  
2544 N N   . ALA B 174 ? 0.2174 0.2248 0.2336 0.0133  0.0256  -0.0075 174 ALA H N   
2545 C CA  . ALA B 174 ? 0.2362 0.2465 0.2438 0.0072  0.0254  -0.0076 174 ALA H CA  
2546 C C   . ALA B 174 ? 0.2444 0.2711 0.2521 0.0059  0.0302  -0.0075 174 ALA H C   
2547 O O   . ALA B 174 ? 0.2337 0.2728 0.2500 0.0077  0.0315  -0.0060 174 ALA H O   
2548 C CB  . ALA B 174 ? 0.2538 0.2583 0.2574 0.0016  0.0210  -0.0032 174 ALA H CB  
2549 N N   . VAL B 175 ? 0.2606 0.2890 0.2586 0.0026  0.0328  -0.0096 175 VAL H N   
2550 C CA  . VAL B 175 ? 0.2780 0.3225 0.2732 -0.0031 0.0383  -0.0094 175 VAL H CA  
2551 C C   . VAL B 175 ? 0.2764 0.3101 0.2569 -0.0134 0.0374  -0.0047 175 VAL H C   
2552 O O   . VAL B 175 ? 0.2550 0.2729 0.2243 -0.0125 0.0338  -0.0042 175 VAL H O   
2553 C CB  . VAL B 175 ? 0.3185 0.3731 0.3108 0.0007  0.0437  -0.0153 175 VAL H CB  
2554 C CG1 . VAL B 175 ? 0.3281 0.3892 0.3319 0.0131  0.0446  -0.0199 175 VAL H CG1 
2555 C CG2 . VAL B 175 ? 0.3445 0.3854 0.3222 0.0000  0.0426  -0.0175 175 VAL H CG2 
2556 N N   . LEU B 176 ? 0.2890 0.3313 0.2684 -0.0227 0.0409  -0.0020 176 LEU H N   
2557 C CA  . LEU B 176 ? 0.3172 0.3447 0.2774 -0.0338 0.0421  0.0026  176 LEU H CA  
2558 C C   . LEU B 176 ? 0.3281 0.3600 0.2752 -0.0387 0.0487  0.0011  176 LEU H C   
2559 O O   . LEU B 176 ? 0.3314 0.3872 0.2871 -0.0415 0.0553  -0.0027 176 LEU H O   
2560 C CB  . LEU B 176 ? 0.3359 0.3701 0.3006 -0.0436 0.0438  0.0048  176 LEU H CB  
2561 C CG  . LEU B 176 ? 0.3781 0.3931 0.3214 -0.0569 0.0461  0.0096  176 LEU H CG  
2562 C CD1 . LEU B 176 ? 0.3945 0.3787 0.3222 -0.0511 0.0389  0.0140  176 LEU H CD1 
2563 C CD2 . LEU B 176 ? 0.3862 0.4110 0.3369 -0.0675 0.0480  0.0095  176 LEU H CD2 
2564 N N   . GLN B 177 ? 0.3375 0.3493 0.2644 -0.0381 0.0468  0.0034  177 GLN H N   
2565 C CA  . GLN B 177 ? 0.3566 0.3678 0.2654 -0.0427 0.0528  0.0031  177 GLN H CA  
2566 C C   . GLN B 177 ? 0.3870 0.3889 0.2776 -0.0584 0.0591  0.0087  177 GLN H C   
2567 O O   . GLN B 177 ? 0.3746 0.3645 0.2638 -0.0637 0.0569  0.0127  177 GLN H O   
2568 C CB  . GLN B 177 ? 0.3685 0.3614 0.2615 -0.0343 0.0468  0.0033  177 GLN H CB  
2569 C CG  . GLN B 177 ? 0.3538 0.3549 0.2640 -0.0221 0.0417  -0.0034 177 GLN H CG  
2570 C CD  . GLN B 177 ? 0.3696 0.3559 0.2674 -0.0150 0.0341  -0.0043 177 GLN H CD  
2571 O OE1 . GLN B 177 ? 0.3752 0.3645 0.2653 -0.0117 0.0349  -0.0088 177 GLN H OE1 
2572 N NE2 . GLN B 177 ? 0.3667 0.3392 0.2615 -0.0123 0.0267  -0.0006 177 GLN H NE2 
2573 N N   . SER B 178 ? 0.4384 0.4441 0.3138 -0.0663 0.0674  0.0086  178 SER H N   
2574 C CA  . SER B 178 ? 0.4734 0.4689 0.3282 -0.0845 0.0758  0.0136  178 SER H CA  
2575 C C   . SER B 178 ? 0.5053 0.4587 0.3307 -0.0844 0.0706  0.0222  178 SER H C   
2576 O O   . SER B 178 ? 0.5608 0.4955 0.3676 -0.0988 0.0757  0.0274  178 SER H O   
2577 C CB  . SER B 178 ? 0.4945 0.5045 0.3391 -0.0919 0.0862  0.0112  178 SER H CB  
2578 O OG  . SER B 178 ? 0.5352 0.5268 0.3583 -0.0833 0.0833  0.0133  178 SER H OG  
2579 N N   . SER B 179 ? 0.4859 0.4247 0.3047 -0.0689 0.0614  0.0231  179 SER H N   
2580 C CA  . SER B 179 ? 0.4896 0.3921 0.2831 -0.0629 0.0538  0.0300  179 SER H CA  
2581 C C   . SER B 179 ? 0.4736 0.3671 0.2769 -0.0634 0.0490  0.0316  179 SER H C   
2582 O O   . SER B 179 ? 0.5232 0.3849 0.3037 -0.0598 0.0442  0.0374  179 SER H O   
2583 C CB  . SER B 179 ? 0.4913 0.3928 0.2843 -0.0451 0.0441  0.0273  179 SER H CB  
2584 O OG  . SER B 179 ? 0.4434 0.3662 0.2696 -0.0365 0.0381  0.0207  179 SER H OG  
2585 N N   . GLY B 180 ? 0.4097 0.3288 0.2441 -0.0651 0.0493  0.0267  180 GLY H N   
2586 C CA  . GLY B 180 ? 0.4002 0.3140 0.2460 -0.0637 0.0439  0.0273  180 GLY H CA  
2587 C C   . GLY B 180 ? 0.3754 0.2896 0.2335 -0.0465 0.0331  0.0252  180 GLY H C   
2588 O O   . GLY B 180 ? 0.3839 0.2899 0.2469 -0.0431 0.0277  0.0262  180 GLY H O   
2589 N N   . LEU B 181 ? 0.3530 0.2764 0.2149 -0.0369 0.0303  0.0217  181 LEU H N   
2590 C CA  . LEU B 181 ? 0.3224 0.2515 0.1988 -0.0234 0.0214  0.0178  181 LEU H CA  
2591 C C   . LEU B 181 ? 0.3008 0.2561 0.2052 -0.0218 0.0235  0.0114  181 LEU H C   
2592 O O   . LEU B 181 ? 0.2967 0.2659 0.2049 -0.0260 0.0302  0.0090  181 LEU H O   
2593 C CB  . LEU B 181 ? 0.3289 0.2487 0.1880 -0.0141 0.0162  0.0171  181 LEU H CB  
2594 C CG  . LEU B 181 ? 0.3638 0.2540 0.1895 -0.0122 0.0138  0.0241  181 LEU H CG  
2595 C CD1 . LEU B 181 ? 0.3818 0.2692 0.1914 -0.0013 0.0083  0.0224  181 LEU H CD1 
2596 C CD2 . LEU B 181 ? 0.3620 0.2367 0.1854 -0.0075 0.0077  0.0270  181 LEU H CD2 
2597 N N   . TYR B 182 ? 0.2784 0.2388 0.1997 -0.0150 0.0180  0.0087  182 TYR H N   
2598 C CA  . TYR B 182 ? 0.2536 0.2315 0.1971 -0.0117 0.0194  0.0033  182 TYR H CA  
2599 C C   . TYR B 182 ? 0.2493 0.2292 0.1922 -0.0055 0.0170  -0.0025 182 TYR H C   
2600 O O   . TYR B 182 ? 0.2581 0.2301 0.1887 -0.0018 0.0119  -0.0032 182 TYR H O   
2601 C CB  . TYR B 182 ? 0.2411 0.2203 0.1998 -0.0092 0.0155  0.0038  182 TYR H CB  
2602 C CG  . TYR B 182 ? 0.2434 0.2243 0.2054 -0.0153 0.0178  0.0078  182 TYR H CG  
2603 C CD1 . TYR B 182 ? 0.2535 0.2508 0.2281 -0.0180 0.0227  0.0067  182 TYR H CD1 
2604 C CD2 . TYR B 182 ? 0.2661 0.2325 0.2169 -0.0181 0.0150  0.0120  182 TYR H CD2 
2605 C CE1 . TYR B 182 ? 0.2680 0.2710 0.2470 -0.0241 0.0242  0.0090  182 TYR H CE1 
2606 C CE2 . TYR B 182 ? 0.2845 0.2519 0.2375 -0.0251 0.0170  0.0144  182 TYR H CE2 
2607 C CZ  . TYR B 182 ? 0.2923 0.2796 0.2598 -0.0291 0.0217  0.0126  182 TYR H CZ  
2608 O OH  . TYR B 182 ? 0.3253 0.3169 0.2952 -0.0368 0.0233  0.0137  182 TYR H OH  
2609 N N   . SER B 183 ? 0.2435 0.2343 0.1996 -0.0034 0.0204  -0.0075 183 SER H N   
2610 C CA  . SER B 183 ? 0.2525 0.2447 0.2099 0.0010  0.0194  -0.0150 183 SER H CA  
2611 C C   . SER B 183 ? 0.2374 0.2335 0.2113 0.0040  0.0217  -0.0185 183 SER H C   
2612 O O   . SER B 183 ? 0.2273 0.2306 0.2089 0.0045  0.0260  -0.0164 183 SER H O   
2613 C CB  . SER B 183 ? 0.2815 0.2770 0.2265 0.0006  0.0235  -0.0177 183 SER H CB  
2614 O OG  . SER B 183 ? 0.3117 0.3064 0.2546 0.0044  0.0210  -0.0255 183 SER H OG  
2615 N N   . LEU B 184 ? 0.2331 0.2243 0.2111 0.0058  0.0188  -0.0238 184 LEU H N   
2616 C CA  . LEU B 184 ? 0.2381 0.2261 0.2257 0.0087  0.0220  -0.0276 184 LEU H CA  
2617 C C   . LEU B 184 ? 0.2400 0.2215 0.2248 0.0082  0.0210  -0.0366 184 LEU H C   
2618 O O   . LEU B 184 ? 0.2348 0.2186 0.2138 0.0058  0.0165  -0.0399 184 LEU H O   
2619 C CB  . LEU B 184 ? 0.2442 0.2293 0.2420 0.0084  0.0209  -0.0229 184 LEU H CB  
2620 C CG  . LEU B 184 ? 0.2318 0.2130 0.2329 0.0049  0.0162  -0.0236 184 LEU H CG  
2621 C CD1 . LEU B 184 ? 0.2494 0.2232 0.2522 0.0025  0.0169  -0.0315 184 LEU H CD1 
2622 C CD2 . LEU B 184 ? 0.2351 0.2164 0.2441 0.0050  0.0161  -0.0171 184 LEU H CD2 
2623 N N   . SER B 185 ? 0.2389 0.2122 0.2262 0.0111  0.0253  -0.0408 185 SER H N   
2624 C CA  . SER B 185 ? 0.2525 0.2149 0.2370 0.0085  0.0256  -0.0504 185 SER H CA  
2625 C C   . SER B 185 ? 0.2416 0.1903 0.2320 0.0062  0.0273  -0.0496 185 SER H C   
2626 O O   . SER B 185 ? 0.2272 0.1723 0.2215 0.0111  0.0297  -0.0429 185 SER H O   
2627 C CB  . SER B 185 ? 0.2849 0.2426 0.2620 0.0134  0.0302  -0.0569 185 SER H CB  
2628 O OG  . SER B 185 ? 0.3272 0.2955 0.2957 0.0127  0.0285  -0.0606 185 SER H OG  
2629 N N   . SER B 186 ? 0.2441 0.1864 0.2340 -0.0014 0.0262  -0.0568 186 SER H N   
2630 C CA  . SER B 186 ? 0.2557 0.1801 0.2470 -0.0063 0.0299  -0.0581 186 SER H CA  
2631 C C   . SER B 186 ? 0.2744 0.1824 0.2568 -0.0105 0.0334  -0.0696 186 SER H C   
2632 O O   . SER B 186 ? 0.2871 0.2057 0.2680 -0.0162 0.0301  -0.0784 186 SER H O   
2633 C CB  . SER B 186 ? 0.2449 0.1776 0.2442 -0.0152 0.0266  -0.0572 186 SER H CB  
2634 O OG  . SER B 186 ? 0.2574 0.1710 0.2555 -0.0216 0.0318  -0.0582 186 SER H OG  
2635 N N   . VAL B 187 ? 0.2943 0.1768 0.2690 -0.0066 0.0396  -0.0696 187 VAL H N   
2636 C CA  . VAL B 187 ? 0.3238 0.1841 0.2865 -0.0100 0.0440  -0.0811 187 VAL H CA  
2637 C C   . VAL B 187 ? 0.3560 0.1868 0.3123 -0.0184 0.0496  -0.0819 187 VAL H C   
2638 O O   . VAL B 187 ? 0.3524 0.1773 0.3112 -0.0162 0.0509  -0.0719 187 VAL H O   
2639 C CB  . VAL B 187 ? 0.3362 0.1875 0.2897 0.0044  0.0473  -0.0823 187 VAL H CB  
2640 C CG1 . VAL B 187 ? 0.3134 0.1938 0.2713 0.0101  0.0433  -0.0818 187 VAL H CG1 
2641 C CG2 . VAL B 187 ? 0.3418 0.1774 0.2922 0.0173  0.0511  -0.0731 187 VAL H CG2 
2642 N N   . VAL B 188 ? 0.3996 0.2105 0.3453 -0.0277 0.0532  -0.0939 188 VAL H N   
2643 C CA  . VAL B 188 ? 0.4413 0.2160 0.3753 -0.0373 0.0606  -0.0955 188 VAL H CA  
2644 C C   . VAL B 188 ? 0.4759 0.2205 0.3919 -0.0384 0.0656  -0.1076 188 VAL H C   
2645 O O   . VAL B 188 ? 0.4612 0.2215 0.3788 -0.0421 0.0624  -0.1188 188 VAL H O   
2646 C CB  . VAL B 188 ? 0.4507 0.2365 0.3936 -0.0577 0.0603  -0.0987 188 VAL H CB  
2647 C CG1 . VAL B 188 ? 0.4565 0.2643 0.4050 -0.0710 0.0565  -0.1138 188 VAL H CG1 
2648 C CG2 . VAL B 188 ? 0.4918 0.2385 0.4208 -0.0687 0.0694  -0.0978 188 VAL H CG2 
2649 N N   . THR B 189 ? 0.5241 0.2255 0.4219 -0.0337 0.0730  -0.1048 189 THR H N   
2650 C CA  . THR B 189 ? 0.5857 0.2468 0.4611 -0.0346 0.0793  -0.1161 189 THR H CA  
2651 C C   . THR B 189 ? 0.6307 0.2642 0.4963 -0.0595 0.0858  -0.1232 189 THR H C   
2652 O O   . THR B 189 ? 0.6262 0.2486 0.4910 -0.0649 0.0890  -0.1134 189 THR H O   
2653 C CB  . THR B 189 ? 0.6105 0.2382 0.4680 -0.0112 0.0834  -0.1093 189 THR H CB  
2654 O OG1 . THR B 189 ? 0.6145 0.2217 0.4662 -0.0084 0.0866  -0.0962 189 THR H OG1 
2655 C CG2 . THR B 189 ? 0.5778 0.2390 0.4468 0.0102  0.0778  -0.1050 189 THR H CG2 
2656 N N   . VAL B 190 ? 0.6768 0.3082 0.5381 -0.0750 0.0868  -0.1400 190 VAL H N   
2657 C CA  . VAL B 190 ? 0.7261 0.3384 0.5799 -0.1036 0.0930  -0.1514 190 VAL H CA  
2658 C C   . VAL B 190 ? 0.7947 0.3600 0.6218 -0.1075 0.1000  -0.1651 190 VAL H C   
2659 O O   . VAL B 190 ? 0.7984 0.3610 0.6191 -0.0901 0.0977  -0.1691 190 VAL H O   
2660 C CB  . VAL B 190 ? 0.6920 0.3566 0.5696 -0.1219 0.0862  -0.1610 190 VAL H CB  
2661 C CG1 . VAL B 190 ? 0.6405 0.3461 0.5412 -0.1166 0.0798  -0.1476 190 VAL H CG1 
2662 C CG2 . VAL B 190 ? 0.6782 0.3698 0.5606 -0.1182 0.0793  -0.1739 190 VAL H CG2 
2663 N N   . PRO B 191 ? 0.8716 0.3984 0.6816 -0.1312 0.1093  -0.1732 191 PRO H N   
2664 C CA  . PRO B 191 ? 0.9354 0.4189 0.7200 -0.1402 0.1159  -0.1896 191 PRO H CA  
2665 C C   . PRO B 191 ? 0.9445 0.4669 0.7415 -0.1446 0.1085  -0.2069 191 PRO H C   
2666 O O   . PRO B 191 ? 0.9536 0.5257 0.7736 -0.1594 0.1022  -0.2135 191 PRO H O   
2667 C CB  . PRO B 191 ? 0.9767 0.4266 0.7473 -0.1728 0.1264  -0.1967 191 PRO H CB  
2668 C CG  . PRO B 191 ? 0.9449 0.4312 0.7384 -0.1821 0.1245  -0.1851 191 PRO H CG  
2669 C CD  . PRO B 191 ? 0.8826 0.4036 0.6947 -0.1520 0.1150  -0.1678 191 PRO H CD  
2670 N N   . SER B 192 ? 0.9909 0.4921 0.7718 -0.1289 0.1088  -0.2139 192 SER H N   
2671 C CA  . SER B 192 ? 0.9992 0.5308 0.7862 -0.1327 0.1028  -0.2314 192 SER H CA  
2672 C C   . SER B 192 ? 1.0123 0.5542 0.8029 -0.1678 0.1044  -0.2496 192 SER H C   
2673 O O   . SER B 192 ? 0.9703 0.5663 0.7807 -0.1753 0.0953  -0.2601 192 SER H O   
2674 C CB  . SER B 192 ? 1.0670 0.5584 0.8283 -0.1162 0.1068  -0.2392 192 SER H CB  
2675 O OG  . SER B 192 ? 1.0640 0.5900 0.8366 -0.0895 0.0994  -0.2331 192 SER H OG  
2676 N N   . SER B 193 ? 1.0681 0.5588 0.8383 -0.1883 0.1157  -0.2533 193 SER H N   
2677 C CA  . SER B 193 ? 1.1102 0.5972 0.8768 -0.2254 0.1208  -0.2734 193 SER H CA  
2678 C C   . SER B 193 ? 1.0949 0.6510 0.8959 -0.2407 0.1131  -0.2742 193 SER H C   
2679 O O   . SER B 193 ? 1.0913 0.6894 0.9054 -0.2551 0.1068  -0.2922 193 SER H O   
2680 C CB  . SER B 193 ? 1.1407 0.5571 0.8771 -0.2444 0.1357  -0.2739 193 SER H CB  
2681 O OG  . SER B 193 ? 1.1104 0.5126 0.8472 -0.2412 0.1403  -0.2537 193 SER H OG  
2682 N N   . SER B 194 ? 1.1029 0.6740 0.9181 -0.2327 0.1120  -0.2550 194 SER H N   
2683 C CA  . SER B 194 ? 1.0643 0.6963 0.9104 -0.2445 0.1056  -0.2534 194 SER H CA  
2684 C C   . SER B 194 ? 0.9920 0.6858 0.8625 -0.2244 0.0907  -0.2512 194 SER H C   
2685 O O   . SER B 194 ? 0.9630 0.6880 0.8522 -0.2139 0.0855  -0.2368 194 SER H O   
2686 C CB  . SER B 194 ? 1.0800 0.6994 0.9284 -0.2420 0.1106  -0.2339 194 SER H CB  
2687 O OG  . SER B 194 ? 1.0820 0.7157 0.9398 -0.2103 0.1034  -0.2146 194 SER H OG  
2688 N N   . LEU B 195 ? 0.9823 0.6919 0.8509 -0.2198 0.0845  -0.2649 195 LEU H N   
2689 C CA  . LEU B 195 ? 0.9195 0.6865 0.8078 -0.2023 0.0707  -0.2631 195 LEU H CA  
2690 C C   . LEU B 195 ? 0.9434 0.7605 0.8463 -0.2218 0.0636  -0.2829 195 LEU H C   
2691 O O   . LEU B 195 ? 0.9242 0.7870 0.8489 -0.2235 0.0570  -0.2793 195 LEU H O   
2692 C CB  . LEU B 195 ? 0.9268 0.6784 0.8015 -0.1776 0.0684  -0.2604 195 LEU H CB  
2693 C CG  . LEU B 195 ? 0.9017 0.6442 0.7777 -0.1502 0.0680  -0.2374 195 LEU H CG  
2694 C CD1 . LEU B 195 ? 0.9038 0.6151 0.7607 -0.1298 0.0709  -0.2366 195 LEU H CD1 
2695 C CD2 . LEU B 195 ? 0.8458 0.6428 0.7445 -0.1375 0.0568  -0.2268 195 LEU H CD2 
2696 N N   . GLY B 196 ? 1.0283 0.8386 0.9196 -0.2362 0.0647  -0.3043 196 GLY H N   
2697 C CA  . GLY B 196 ? 1.0557 0.9137 0.9602 -0.2586 0.0588  -0.3262 196 GLY H CA  
2698 C C   . GLY B 196 ? 1.0593 0.9423 0.9822 -0.2810 0.0616  -0.3276 196 GLY H C   
2699 O O   . GLY B 196 ? 1.0507 0.9953 0.9951 -0.2857 0.0517  -0.3364 196 GLY H O   
2700 N N   . THR B 197 ? 1.0625 0.8993 0.9754 -0.2930 0.0746  -0.3192 197 THR H N   
2701 C CA  . THR B 197 ? 1.0352 0.8835 0.9609 -0.3145 0.0810  -0.3171 197 THR H CA  
2702 C C   . THR B 197 ? 0.9875 0.8806 0.9376 -0.2955 0.0723  -0.2994 197 THR H C   
2703 O O   . THR B 197 ? 0.9241 0.8791 0.8978 -0.3023 0.0641  -0.3083 197 THR H O   
2704 C CB  . THR B 197 ? 1.0591 0.8342 0.9599 -0.3245 0.0973  -0.3077 197 THR H CB  
2705 O OG1 . THR B 197 ? 1.1246 0.8645 1.0043 -0.3480 0.1053  -0.3282 197 THR H OG1 
2706 C CG2 . THR B 197 ? 1.0626 0.8403 0.9719 -0.3417 0.1053  -0.2999 197 THR H CG2 
2707 N N   . GLN B 198 ? 0.9390 0.8022 0.8829 -0.2726 0.0741  -0.2760 198 GLN H N   
2708 C CA  . GLN B 198 ? 0.8882 0.7748 0.8494 -0.2638 0.0720  -0.2588 198 GLN H CA  
2709 C C   . GLN B 198 ? 0.7853 0.7126 0.7614 -0.2347 0.0578  -0.2482 198 GLN H C   
2710 O O   . GLN B 198 ? 0.7619 0.6749 0.7279 -0.2143 0.0537  -0.2431 198 GLN H O   
2711 C CB  . GLN B 198 ? 0.9138 0.7465 0.8599 -0.2594 0.0829  -0.2400 198 GLN H CB  
2712 C CG  . GLN B 198 ? 0.9399 0.7879 0.8979 -0.2764 0.0885  -0.2363 198 GLN H CG  
2713 C CD  . GLN B 198 ? 0.9574 0.7913 0.9155 -0.2555 0.0889  -0.2122 198 GLN H CD  
2714 O OE1 . GLN B 198 ? 1.0385 0.8257 0.9778 -0.2392 0.0924  -0.1996 198 GLN H OE1 
2715 N NE2 . GLN B 198 ? 0.8983 0.7746 0.8777 -0.2543 0.0847  -0.2065 198 GLN H NE2 
2716 N N   . THR B 199 ? 0.7182 0.6938 0.7164 -0.2344 0.0516  -0.2460 199 THR H N   
2717 C CA  . THR B 199 ? 0.6537 0.6699 0.6659 -0.2091 0.0382  -0.2362 199 THR H CA  
2718 C C   . THR B 199 ? 0.5912 0.5781 0.5985 -0.1891 0.0407  -0.2121 199 THR H C   
2719 O O   . THR B 199 ? 0.5858 0.5497 0.5917 -0.1966 0.0496  -0.2031 199 THR H O   
2720 C CB  . THR B 199 ? 0.6351 0.7120 0.6702 -0.2164 0.0309  -0.2456 199 THR H CB  
2721 O OG1 . THR B 199 ? 0.6733 0.7787 0.7106 -0.2290 0.0261  -0.2681 199 THR H OG1 
2722 C CG2 . THR B 199 ? 0.5995 0.7109 0.6461 -0.1905 0.0186  -0.2336 199 THR H CG2 
2723 N N   . TYR B 200 ? 0.5629 0.5501 0.5663 -0.1650 0.0335  -0.2023 200 TYR H N   
2724 C CA  . TYR B 200 ? 0.5191 0.4883 0.5204 -0.1450 0.0339  -0.1809 200 TYR H CA  
2725 C C   . TYR B 200 ? 0.4624 0.4725 0.4761 -0.1281 0.0220  -0.1744 200 TYR H C   
2726 O O   . TYR B 200 ? 0.4536 0.4829 0.4649 -0.1190 0.0138  -0.1799 200 TYR H O   
2727 C CB  . TYR B 200 ? 0.5328 0.4594 0.5152 -0.1345 0.0388  -0.1760 200 TYR H CB  
2728 C CG  . TYR B 200 ? 0.5663 0.4455 0.5331 -0.1485 0.0511  -0.1797 200 TYR H CG  
2729 C CD1 . TYR B 200 ? 0.5809 0.4335 0.5444 -0.1514 0.0590  -0.1681 200 TYR H CD1 
2730 C CD2 . TYR B 200 ? 0.6097 0.4669 0.5619 -0.1579 0.0550  -0.1945 200 TYR H CD2 
2731 C CE1 . TYR B 200 ? 0.6288 0.4324 0.5734 -0.1634 0.0707  -0.1702 200 TYR H CE1 
2732 C CE2 . TYR B 200 ? 0.6474 0.4542 0.5810 -0.1701 0.0668  -0.1976 200 TYR H CE2 
2733 C CZ  . TYR B 200 ? 0.6658 0.4439 0.5944 -0.1724 0.0748  -0.1848 200 TYR H CZ  
2734 O OH  . TYR B 200 ? 0.7272 0.4500 0.6328 -0.1839 0.0869  -0.1867 200 TYR H OH  
2735 N N   . ILE B 201 ? 0.4437 0.4642 0.4679 -0.1247 0.0216  -0.1636 201 ILE H N   
2736 C CA  . ILE B 201 ? 0.4145 0.4680 0.4487 -0.1087 0.0113  -0.1561 201 ILE H CA  
2737 C C   . ILE B 201 ? 0.3611 0.3936 0.3932 -0.0957 0.0139  -0.1367 201 ILE H C   
2738 O O   . ILE B 201 ? 0.3535 0.3679 0.3870 -0.1028 0.0218  -0.1305 201 ILE H O   
2739 C CB  . ILE B 201 ? 0.4340 0.5285 0.4849 -0.1179 0.0075  -0.1653 201 ILE H CB  
2740 C CG1 . ILE B 201 ? 0.4677 0.5898 0.5224 -0.1314 0.0041  -0.1865 201 ILE H CG1 
2741 C CG2 . ILE B 201 ? 0.4229 0.5430 0.4802 -0.0986 -0.0023 -0.1560 201 ILE H CG2 
2742 C CD1 . ILE B 201 ? 0.4641 0.6359 0.5371 -0.1390 -0.0008 -0.1981 201 ILE H CD1 
2743 N N   . CYS B 202 ? 0.3289 0.3633 0.3565 -0.0776 0.0079  -0.1270 202 CYS H N   
2744 C CA  . CYS B 202 ? 0.3076 0.3291 0.3354 -0.0664 0.0094  -0.1100 202 CYS H CA  
2745 C C   . CYS B 202 ? 0.2810 0.3312 0.3186 -0.0596 0.0019  -0.1064 202 CYS H C   
2746 O O   . CYS B 202 ? 0.2789 0.3530 0.3163 -0.0533 -0.0067 -0.1121 202 CYS H O   
2747 C CB  . CYS B 202 ? 0.3061 0.3107 0.3230 -0.0527 0.0092  -0.1009 202 CYS H CB  
2748 S SG  . CYS B 202 ? 0.3018 0.3280 0.3125 -0.0401 -0.0009 -0.1019 202 CYS H SG  
2749 N N   . ASN B 203 ? 0.2712 0.3179 0.3153 -0.0611 0.0053  -0.0986 203 ASN H N   
2750 C CA  . ASN B 203 ? 0.2559 0.3270 0.3090 -0.0550 -0.0004 -0.0956 203 ASN H CA  
2751 C C   . ASN B 203 ? 0.2246 0.2822 0.2716 -0.0405 -0.0023 -0.0807 203 ASN H C   
2752 O O   . ASN B 203 ? 0.2400 0.2781 0.2862 -0.0415 0.0037  -0.0718 203 ASN H O   
2753 C CB  . ASN B 203 ? 0.2686 0.3470 0.3324 -0.0674 0.0052  -0.0981 203 ASN H CB  
2754 C CG  . ASN B 203 ? 0.2942 0.3720 0.3600 -0.0871 0.0117  -0.1112 203 ASN H CG  
2755 O OD1 . ASN B 203 ? 0.3514 0.4018 0.4121 -0.0973 0.0214  -0.1081 203 ASN H OD1 
2756 N ND2 . ASN B 203 ? 0.2937 0.3985 0.3644 -0.0918 0.0066  -0.1255 203 ASN H ND2 
2757 N N   . VAL B 204 ? 0.2209 0.2872 0.2616 -0.0281 -0.0101 -0.0786 204 VAL H N   
2758 C CA  . VAL B 204 ? 0.2124 0.2649 0.2449 -0.0166 -0.0115 -0.0655 204 VAL H CA  
2759 C C   . VAL B 204 ? 0.2132 0.2792 0.2484 -0.0085 -0.0173 -0.0621 204 VAL H C   
2760 O O   . VAL B 204 ? 0.2070 0.2935 0.2424 -0.0031 -0.0246 -0.0689 204 VAL H O   
2761 C CB  . VAL B 204 ? 0.2240 0.2697 0.2428 -0.0094 -0.0144 -0.0641 204 VAL H CB  
2762 C CG1 . VAL B 204 ? 0.2277 0.2595 0.2374 -0.0009 -0.0144 -0.0513 204 VAL H CG1 
2763 C CG2 . VAL B 204 ? 0.2302 0.2637 0.2465 -0.0164 -0.0084 -0.0690 204 VAL H CG2 
2764 N N   . ASN B 205 ? 0.2150 0.2692 0.2506 -0.0060 -0.0147 -0.0521 205 ASN H N   
2765 C CA  . ASN B 205 ? 0.2313 0.2930 0.2667 0.0026  -0.0197 -0.0483 205 ASN H CA  
2766 C C   . ASN B 205 ? 0.2121 0.2533 0.2358 0.0090  -0.0194 -0.0368 205 ASN H C   
2767 O O   . ASN B 205 ? 0.2065 0.2336 0.2308 0.0046  -0.0135 -0.0308 205 ASN H O   
2768 C CB  . ASN B 205 ? 0.2833 0.3553 0.3316 -0.0031 -0.0163 -0.0500 205 ASN H CB  
2769 C CG  . ASN B 205 ? 0.3523 0.4399 0.4018 0.0066  -0.0225 -0.0510 205 ASN H CG  
2770 O OD1 . ASN B 205 ? 0.4513 0.5345 0.4890 0.0191  -0.0291 -0.0478 205 ASN H OD1 
2771 N ND2 . ASN B 205 ? 0.3843 0.4903 0.4463 0.0016  -0.0204 -0.0563 205 ASN H ND2 
2772 N N   . HIS B 206 ? 0.2092 0.2486 0.2204 0.0195  -0.0259 -0.0344 206 HIS H N   
2773 C CA  . HIS B 206 ? 0.2083 0.2278 0.2067 0.0238  -0.0255 -0.0244 206 HIS H CA  
2774 C C   . HIS B 206 ? 0.2172 0.2395 0.2122 0.0328  -0.0309 -0.0238 206 HIS H C   
2775 O O   . HIS B 206 ? 0.2208 0.2453 0.2037 0.0439  -0.0380 -0.0260 206 HIS H O   
2776 C CB  . HIS B 206 ? 0.2142 0.2212 0.1944 0.0274  -0.0270 -0.0213 206 HIS H CB  
2777 C CG  . HIS B 206 ? 0.2177 0.2042 0.1842 0.0280  -0.0251 -0.0119 206 HIS H CG  
2778 N ND1 . HIS B 206 ? 0.2376 0.2098 0.1827 0.0364  -0.0297 -0.0081 206 HIS H ND1 
2779 C CD2 . HIS B 206 ? 0.2173 0.1950 0.1870 0.0207  -0.0188 -0.0062 206 HIS H CD2 
2780 C CE1 . HIS B 206 ? 0.2431 0.1968 0.1787 0.0316  -0.0254 -0.0006 206 HIS H CE1 
2781 N NE2 . HIS B 206 ? 0.2250 0.1849 0.1771 0.0218  -0.0189 0.0001  206 HIS H NE2 
2782 N N   . LYS B 207 ? 0.2182 0.2416 0.2227 0.0298  -0.0279 -0.0217 207 LYS H N   
2783 C CA  . LYS B 207 ? 0.2488 0.2780 0.2521 0.0388  -0.0325 -0.0232 207 LYS H CA  
2784 C C   . LYS B 207 ? 0.2542 0.2620 0.2355 0.0490  -0.0369 -0.0175 207 LYS H C   
2785 O O   . LYS B 207 ? 0.2501 0.2619 0.2237 0.0615  -0.0434 -0.0207 207 LYS H O   
2786 C CB  . LYS B 207 ? 0.2774 0.3111 0.2936 0.0327  -0.0276 -0.0218 207 LYS H CB  
2787 C CG  . LYS B 207 ? 0.3579 0.4106 0.3920 0.0231  -0.0232 -0.0279 207 LYS H CG  
2788 C CD  . LYS B 207 ? 0.3994 0.4584 0.4440 0.0179  -0.0183 -0.0271 207 LYS H CD  
2789 C CE  . LYS B 207 ? 0.4572 0.5351 0.5155 0.0081  -0.0142 -0.0348 207 LYS H CE  
2790 N NZ  . LYS B 207 ? 0.4824 0.5663 0.5488 0.0018  -0.0084 -0.0340 207 LYS H NZ  
2791 N N   . PRO B 208 ? 0.2621 0.2465 0.2314 0.0442  -0.0334 -0.0096 208 PRO H N   
2792 C CA  . PRO B 208 ? 0.2926 0.2518 0.2377 0.0515  -0.0363 -0.0043 208 PRO H CA  
2793 C C   . PRO B 208 ? 0.3018 0.2552 0.2275 0.0644  -0.0433 -0.0057 208 PRO H C   
2794 O O   . PRO B 208 ? 0.3383 0.2726 0.2434 0.0752  -0.0475 -0.0032 208 PRO H O   
2795 C CB  . PRO B 208 ? 0.2876 0.2298 0.2269 0.0397  -0.0297 0.0024  208 PRO H CB  
2796 C CG  . PRO B 208 ? 0.2703 0.2294 0.2333 0.0301  -0.0244 0.0011  208 PRO H CG  
2797 C CD  . PRO B 208 ? 0.2531 0.2340 0.2304 0.0317  -0.0260 -0.0058 208 PRO H CD  
2798 N N   . SER B 209 ? 0.2819 0.2501 0.2119 0.0642  -0.0447 -0.0099 209 SER H N   
2799 C CA  . SER B 209 ? 0.3056 0.2712 0.2165 0.0771  -0.0519 -0.0115 209 SER H CA  
2800 C C   . SER B 209 ? 0.2992 0.2983 0.2244 0.0864  -0.0588 -0.0225 209 SER H C   
2801 O O   . SER B 209 ? 0.3185 0.3236 0.2310 0.0984  -0.0661 -0.0259 209 SER H O   
2802 C CB  . SER B 209 ? 0.3063 0.2660 0.2096 0.0702  -0.0487 -0.0093 209 SER H CB  
2803 O OG  . SER B 209 ? 0.2756 0.2606 0.2025 0.0609  -0.0459 -0.0164 209 SER H OG  
2804 N N   . ASN B 210 ? 0.2886 0.3108 0.2390 0.0803  -0.0564 -0.0282 210 ASN H N   
2805 C CA  A ASN B 210 ? 0.2930 0.3529 0.2617 0.0839  -0.0609 -0.0403 210 ASN H CA  
2806 C CA  B ASN B 210 ? 0.2850 0.3445 0.2527 0.0848  -0.0613 -0.0403 210 ASN H CA  
2807 C C   . ASN B 210 ? 0.2804 0.3550 0.2521 0.0795  -0.0622 -0.0465 210 ASN H C   
2808 O O   . ASN B 210 ? 0.2818 0.3800 0.2534 0.0895  -0.0699 -0.0552 210 ASN H O   
2809 C CB  A ASN B 210 ? 0.3280 0.3963 0.2876 0.1040  -0.0698 -0.0440 210 ASN H CB  
2810 C CB  B ASN B 210 ? 0.3091 0.3759 0.2650 0.1061  -0.0710 -0.0439 210 ASN H CB  
2811 C CG  A ASN B 210 ? 0.3424 0.4012 0.3049 0.1047  -0.0668 -0.0405 210 ASN H CG  
2812 C CG  B ASN B 210 ? 0.3044 0.4151 0.2831 0.1087  -0.0742 -0.0570 210 ASN H CG  
2813 O OD1 A ASN B 210 ? 0.4190 0.4453 0.3607 0.1106  -0.0670 -0.0323 210 ASN H OD1 
2814 O OD1 B ASN B 210 ? 0.2948 0.4211 0.2956 0.0950  -0.0676 -0.0603 210 ASN H OD1 
2815 N ND2 A ASN B 210 ? 0.3386 0.4231 0.3251 0.0966  -0.0630 -0.0466 210 ASN H ND2 
2816 N ND2 B ASN B 210 ? 0.3169 0.4485 0.2894 0.1262  -0.0841 -0.0647 210 ASN H ND2 
2817 N N   . THR B 211 ? 0.2808 0.3419 0.2542 0.0657  -0.0550 -0.0424 211 THR H N   
2818 C CA  . THR B 211 ? 0.2775 0.3489 0.2534 0.0596  -0.0547 -0.0484 211 THR H CA  
2819 C C   . THR B 211 ? 0.2701 0.3605 0.2705 0.0442  -0.0487 -0.0563 211 THR H C   
2820 O O   . THR B 211 ? 0.2614 0.3382 0.2694 0.0336  -0.0405 -0.0509 211 THR H O   
2821 C CB  . THR B 211 ? 0.2935 0.3385 0.2531 0.0558  -0.0505 -0.0402 211 THR H CB  
2822 O OG1 . THR B 211 ? 0.3031 0.3290 0.2372 0.0689  -0.0556 -0.0331 211 THR H OG1 
2823 C CG2 . THR B 211 ? 0.3040 0.3596 0.2646 0.0508  -0.0504 -0.0474 211 THR H CG2 
2824 N N   . LYS B 212 ? 0.2554 0.3745 0.2655 0.0428  -0.0525 -0.0689 212 LYS H N   
2825 C CA  . LYS B 212 ? 0.2558 0.3900 0.2854 0.0256  -0.0462 -0.0780 212 LYS H CA  
2826 C C   . LYS B 212 ? 0.2446 0.3904 0.2713 0.0225  -0.0491 -0.0878 212 LYS H C   
2827 O O   . LYS B 212 ? 0.2261 0.3940 0.2487 0.0334  -0.0583 -0.0949 212 LYS H O   
2828 C CB  . LYS B 212 ? 0.2838 0.4492 0.3308 0.0236  -0.0475 -0.0871 212 LYS H CB  
2829 C CG  . LYS B 212 ? 0.3487 0.5064 0.4065 0.0144  -0.0392 -0.0820 212 LYS H CG  
2830 C CD  . LYS B 212 ? 0.3785 0.5694 0.4528 0.0115  -0.0395 -0.0917 212 LYS H CD  
2831 C CE  . LYS B 212 ? 0.4522 0.6521 0.5216 0.0307  -0.0472 -0.0895 212 LYS H CE  
2832 N NZ  . LYS B 212 ? 0.4938 0.7385 0.5773 0.0344  -0.0519 -0.1035 212 LYS H NZ  
2833 N N   . VAL B 213 ? 0.2384 0.3700 0.2665 0.0097  -0.0418 -0.0884 213 VAL H N   
2834 C CA  . VAL B 213 ? 0.2746 0.4125 0.2989 0.0047  -0.0430 -0.0982 213 VAL H CA  
2835 C C   . VAL B 213 ? 0.2954 0.4337 0.3332 -0.0145 -0.0344 -0.1066 213 VAL H C   
2836 O O   . VAL B 213 ? 0.2718 0.3862 0.3112 -0.0216 -0.0257 -0.0991 213 VAL H O   
2837 C CB  . VAL B 213 ? 0.2931 0.4053 0.2990 0.0101  -0.0418 -0.0897 213 VAL H CB  
2838 C CG1 . VAL B 213 ? 0.3085 0.4297 0.3086 0.0068  -0.0440 -0.1008 213 VAL H CG1 
2839 C CG2 . VAL B 213 ? 0.2987 0.4014 0.2879 0.0262  -0.0477 -0.0791 213 VAL H CG2 
2840 N N   . ASP B 214 ? 0.3241 0.4884 0.3699 -0.0230 -0.0367 -0.1222 214 ASP H N   
2841 C CA  . ASP B 214 ? 0.3560 0.5161 0.4113 -0.0440 -0.0274 -0.1310 214 ASP H CA  
2842 C C   . ASP B 214 ? 0.3779 0.5354 0.4245 -0.0480 -0.0285 -0.1404 214 ASP H C   
2843 O O   . ASP B 214 ? 0.3717 0.5599 0.4236 -0.0520 -0.0340 -0.1553 214 ASP H O   
2844 C CB  . ASP B 214 ? 0.3553 0.5478 0.4283 -0.0560 -0.0268 -0.1432 214 ASP H CB  
2845 C CG  . ASP B 214 ? 0.3768 0.5677 0.4591 -0.0580 -0.0218 -0.1354 214 ASP H CG  
2846 O OD1 . ASP B 214 ? 0.3987 0.5564 0.4756 -0.0584 -0.0148 -0.1223 214 ASP H OD1 
2847 O OD2 . ASP B 214 ? 0.4070 0.6327 0.5021 -0.0583 -0.0252 -0.1430 214 ASP H OD2 
2848 N N   . LYS B 215 ? 0.3907 0.5158 0.4246 -0.0462 -0.0236 -0.1331 215 LYS H N   
2849 C CA  . LYS B 215 ? 0.3923 0.5142 0.4136 -0.0441 -0.0261 -0.1396 215 LYS H CA  
2850 C C   . LYS B 215 ? 0.4026 0.5104 0.4237 -0.0614 -0.0181 -0.1513 215 LYS H C   
2851 O O   . LYS B 215 ? 0.3844 0.4630 0.4056 -0.0692 -0.0081 -0.1461 215 LYS H O   
2852 C CB  . LYS B 215 ? 0.4221 0.5203 0.4281 -0.0309 -0.0255 -0.1261 215 LYS H CB  
2853 C CG  . LYS B 215 ? 0.4574 0.5444 0.4514 -0.0330 -0.0232 -0.1328 215 LYS H CG  
2854 C CD  . LYS B 215 ? 0.4860 0.5771 0.4637 -0.0194 -0.0296 -0.1294 215 LYS H CD  
2855 C CE  . LYS B 215 ? 0.5029 0.6200 0.4756 -0.0184 -0.0383 -0.1436 215 LYS H CE  
2856 N NZ  . LYS B 215 ? 0.5417 0.6704 0.5017 -0.0013 -0.0478 -0.1364 215 LYS H NZ  
2857 N N   . LYS B 216 ? 0.4075 0.5354 0.4269 -0.0670 -0.0227 -0.1674 216 LYS H N   
2858 C CA  . LYS B 216 ? 0.4237 0.5408 0.4419 -0.0855 -0.0160 -0.1821 216 LYS H CA  
2859 C C   . LYS B 216 ? 0.4156 0.5057 0.4164 -0.0794 -0.0133 -0.1805 216 LYS H C   
2860 O O   . LYS B 216 ? 0.4474 0.5502 0.4386 -0.0672 -0.0208 -0.1812 216 LYS H O   
2861 C CB  . LYS B 216 ? 0.4368 0.5923 0.4625 -0.0966 -0.0222 -0.2029 216 LYS H CB  
2862 C CG  . LYS B 216 ? 0.4582 0.6009 0.4832 -0.1203 -0.0138 -0.2190 216 LYS H CG  
2863 C CD  . LYS B 216 ? 0.4683 0.6556 0.5027 -0.1325 -0.0205 -0.2410 216 LYS H CD  
2864 C CE  . LYS B 216 ? 0.5059 0.6795 0.5355 -0.1565 -0.0130 -0.2593 216 LYS H CE  
2865 N NZ  . LYS B 216 ? 0.5084 0.7324 0.5487 -0.1679 -0.0208 -0.2816 216 LYS H NZ  
2866 N N   . VAL B 217 ? 0.4276 0.4817 0.4232 -0.0874 -0.0026 -0.1790 217 VAL H N   
2867 C CA  . VAL B 217 ? 0.4410 0.4657 0.4208 -0.0807 0.0020  -0.1769 217 VAL H CA  
2868 C C   . VAL B 217 ? 0.4942 0.5084 0.4674 -0.0965 0.0063  -0.1954 217 VAL H C   
2869 O O   . VAL B 217 ? 0.5027 0.4981 0.4784 -0.1122 0.0141  -0.1999 217 VAL H O   
2870 C CB  . VAL B 217 ? 0.4271 0.4177 0.4044 -0.0751 0.0107  -0.1617 217 VAL H CB  
2871 C CG1 . VAL B 217 ? 0.4377 0.4023 0.4000 -0.0667 0.0156  -0.1607 217 VAL H CG1 
2872 C CG2 . VAL B 217 ? 0.4056 0.4077 0.3900 -0.0626 0.0066  -0.1452 217 VAL H CG2 
2873 N N   . GLU B 218 ? 0.5470 0.5719 0.5108 -0.0932 0.0015  -0.2056 218 GLU H N   
2874 C CA  . GLU B 218 ? 0.6586 0.6725 0.6143 -0.1089 0.0054  -0.2252 218 GLU H CA  
2875 C C   . GLU B 218 ? 0.6793 0.6750 0.6170 -0.0983 0.0070  -0.2273 218 GLU H C   
2876 O O   . GLU B 218 ? 0.6501 0.6571 0.5826 -0.0812 0.0020  -0.2184 218 GLU H O   
2877 C CB  . GLU B 218 ? 0.7162 0.7712 0.6809 -0.1216 -0.0025 -0.2431 218 GLU H CB  
2878 C CG  . GLU B 218 ? 0.7556 0.8492 0.7188 -0.1062 -0.0156 -0.2438 218 GLU H CG  
2879 C CD  . GLU B 218 ? 0.7873 0.9297 0.7649 -0.1130 -0.0253 -0.2560 218 GLU H CD  
2880 O OE1 . GLU B 218 ? 0.7863 0.9363 0.7752 -0.1343 -0.0214 -0.2691 218 GLU H OE1 
2881 O OE2 . GLU B 218 ? 0.8145 0.9872 0.7913 -0.0967 -0.0366 -0.2522 218 GLU H OE2 
2882 N N   . PRO B 219 ? 0.7625 0.7296 0.6886 -0.1093 0.0144  -0.2406 219 PRO H N   
2883 C CA  . PRO B 219 ? 0.7648 0.7164 0.6730 -0.1003 0.0161  -0.2465 219 PRO H CA  
2884 C C   . PRO B 219 ? 0.7729 0.7603 0.6766 -0.0910 0.0057  -0.2516 219 PRO H C   
2885 O O   . PRO B 219 ? 0.7985 0.7796 0.6895 -0.0763 0.0065  -0.2471 219 PRO H O   
2886 C CB  . PRO B 219 ? 0.8215 0.7477 0.7204 -0.1199 0.0228  -0.2660 219 PRO H CB  
2887 C CG  . PRO B 219 ? 0.8213 0.7278 0.7286 -0.1345 0.0299  -0.2617 219 PRO H CG  
2888 C CD  . PRO B 219 ? 0.7863 0.7327 0.7140 -0.1317 0.0221  -0.2511 219 PRO H CD  
2889 N N   . ASP C 1   ? 0.4687 0.5215 0.2910 -0.0637 0.0078  -0.0091 1   ASP L N   
2890 C CA  . ASP C 1   ? 0.4344 0.4896 0.2765 -0.0438 0.0040  -0.0018 1   ASP L CA  
2891 C C   . ASP C 1   ? 0.3931 0.4884 0.2599 -0.0405 0.0057  0.0017  1   ASP L C   
2892 O O   . ASP C 1   ? 0.3933 0.5061 0.2580 -0.0532 0.0093  -0.0012 1   ASP L O   
2893 C CB  . ASP C 1   ? 0.4547 0.4751 0.2835 -0.0403 0.0024  -0.0001 1   ASP L CB  
2894 C CG  . ASP C 1   ? 0.4740 0.4515 0.2777 -0.0366 -0.0004 -0.0026 1   ASP L CG  
2895 O OD1 . ASP C 1   ? 0.4847 0.4573 0.2794 -0.0388 -0.0008 -0.0064 1   ASP L OD1 
2896 O OD2 . ASP C 1   ? 0.4802 0.4306 0.2723 -0.0314 -0.0023 -0.0013 1   ASP L OD2 
2897 N N   . ILE C 2   ? 0.3335 0.4428 0.2211 -0.0239 0.0033  0.0074  2   ILE L N   
2898 C CA  . ILE C 2   ? 0.2915 0.4355 0.1999 -0.0174 0.0046  0.0114  2   ILE L CA  
2899 C C   . ILE C 2   ? 0.2816 0.4183 0.1915 -0.0157 0.0052  0.0139  2   ILE L C   
2900 O O   . ILE C 2   ? 0.2714 0.3813 0.1779 -0.0091 0.0030  0.0163  2   ILE L O   
2901 C CB  . ILE C 2   ? 0.2642 0.4216 0.1894 -0.0020 0.0027  0.0165  2   ILE L CB  
2902 C CG1 . ILE C 2   ? 0.2668 0.4306 0.1889 -0.0049 0.0021  0.0132  2   ILE L CG1 
2903 C CG2 . ILE C 2   ? 0.2488 0.4364 0.1902 0.0061  0.0042  0.0209  2   ILE L CG2 
2904 C CD1 . ILE C 2   ? 0.2637 0.4396 0.1996 0.0081  0.0006  0.0177  2   ILE L CD1 
2905 N N   . VAL C 3   ? 0.2707 0.4344 0.1864 -0.0204 0.0079  0.0130  3   VAL L N   
2906 C CA  . VAL C 3   ? 0.2711 0.4339 0.1898 -0.0187 0.0088  0.0149  3   VAL L CA  
2907 C C   . VAL C 3   ? 0.2522 0.4367 0.1897 -0.0028 0.0086  0.0206  3   VAL L C   
2908 O O   . VAL C 3   ? 0.2438 0.4601 0.1902 0.0010  0.0095  0.0205  3   VAL L O   
2909 C CB  . VAL C 3   ? 0.2943 0.4711 0.2039 -0.0355 0.0123  0.0090  3   VAL L CB  
2910 C CG1 . VAL C 3   ? 0.2883 0.4649 0.2014 -0.0329 0.0131  0.0109  3   VAL L CG1 
2911 C CG2 . VAL C 3   ? 0.3272 0.4773 0.2130 -0.0530 0.0135  0.0034  3   VAL L CG2 
2912 N N   . MET C 4   ? 0.2525 0.4183 0.1935 0.0059  0.0075  0.0249  4   MET L N   
2913 C CA  . MET C 4   ? 0.2382 0.4145 0.1925 0.0208  0.0077  0.0305  4   MET L CA  
2914 C C   . MET C 4   ? 0.2323 0.4168 0.1877 0.0197  0.0094  0.0298  4   MET L C   
2915 O O   . MET C 4   ? 0.2329 0.3963 0.1822 0.0153  0.0092  0.0292  4   MET L O   
2916 C CB  . MET C 4   ? 0.2324 0.3841 0.1895 0.0300  0.0060  0.0347  4   MET L CB  
2917 C CG  . MET C 4   ? 0.2360 0.3822 0.1928 0.0319  0.0042  0.0348  4   MET L CG  
2918 S SD  . MET C 4   ? 0.2358 0.4120 0.1997 0.0364  0.0051  0.0362  4   MET L SD  
2919 C CE  . MET C 4   ? 0.2372 0.4237 0.2101 0.0514  0.0069  0.0429  4   MET L CE  
2920 N N   . THR C 5   ? 0.2377 0.4534 0.1998 0.0248  0.0110  0.0297  5   THR L N   
2921 C CA  . THR C 5   ? 0.2407 0.4694 0.2047 0.0258  0.0125  0.0285  5   THR L CA  
2922 C C   . THR C 5   ? 0.2321 0.4583 0.2035 0.0438  0.0125  0.0346  5   THR L C   
2923 O O   . THR C 5   ? 0.2213 0.4639 0.1972 0.0564  0.0126  0.0375  5   THR L O   
2924 C CB  . THR C 5   ? 0.2495 0.5175 0.2138 0.0192  0.0142  0.0225  5   THR L CB  
2925 O OG1 . THR C 5   ? 0.2742 0.5378 0.2283 0.0003  0.0149  0.0169  5   THR L OG1 
2926 C CG2 . THR C 5   ? 0.2575 0.5426 0.2235 0.0198  0.0158  0.0200  5   THR L CG2 
2927 N N   . GLN C 6   ? 0.2206 0.4243 0.1911 0.0451  0.0126  0.0364  6   GLN L N   
2928 C CA  . GLN C 6   ? 0.2435 0.4371 0.2177 0.0596  0.0133  0.0416  6   GLN L CA  
2929 C C   . GLN C 6   ? 0.2721 0.4812 0.2475 0.0640  0.0147  0.0401  6   GLN L C   
2930 O O   . GLN C 6   ? 0.2733 0.4793 0.2462 0.0539  0.0150  0.0365  6   GLN L O   
2931 C CB  . GLN C 6   ? 0.2658 0.4262 0.2383 0.0574  0.0125  0.0436  6   GLN L CB  
2932 C CG  . GLN C 6   ? 0.2751 0.4225 0.2497 0.0697  0.0139  0.0486  6   GLN L CG  
2933 C CD  . GLN C 6   ? 0.2509 0.3717 0.2246 0.0671  0.0133  0.0495  6   GLN L CD  
2934 O OE1 . GLN C 6   ? 0.2445 0.3568 0.2163 0.0597  0.0111  0.0473  6   GLN L OE1 
2935 N NE2 . GLN C 6   ? 0.2677 0.3759 0.2414 0.0736  0.0153  0.0521  6   GLN L NE2 
2936 N N   . THR C 7   ? 0.2739 0.4950 0.2511 0.0797  0.0156  0.0430  7   THR L N   
2937 C CA  . THR C 7   ? 0.2855 0.5196 0.2628 0.0880  0.0168  0.0418  7   THR L CA  
2938 C C   . THR C 7   ? 0.3114 0.5267 0.2856 0.1054  0.0180  0.0478  7   THR L C   
2939 O O   . THR C 7   ? 0.2902 0.4925 0.2617 0.1127  0.0183  0.0527  7   THR L O   
2940 C CB  . THR C 7   ? 0.3072 0.5845 0.2863 0.0917  0.0166  0.0372  7   THR L CB  
2941 O OG1 . THR C 7   ? 0.2703 0.5582 0.2490 0.1035  0.0160  0.0404  7   THR L OG1 
2942 C CG2 . THR C 7   ? 0.3047 0.6022 0.2843 0.0719  0.0166  0.0299  7   THR L CG2 
2943 N N   . PRO C 8   ? 0.3100 0.5216 0.2825 0.1120  0.0192  0.0474  8   PRO L N   
2944 C CA  . PRO C 8   ? 0.3162 0.5381 0.2914 0.1016  0.0192  0.0419  8   PRO L CA  
2945 C C   . PRO C 8   ? 0.3359 0.5294 0.3112 0.0866  0.0189  0.0417  8   PRO L C   
2946 O O   . PRO C 8   ? 0.3067 0.4748 0.2810 0.0857  0.0186  0.0454  8   PRO L O   
2947 C CB  . PRO C 8   ? 0.3173 0.5386 0.2894 0.1169  0.0206  0.0428  8   PRO L CB  
2948 C CG  . PRO C 8   ? 0.3329 0.5196 0.2989 0.1269  0.0221  0.0496  8   PRO L CG  
2949 C CD  . PRO C 8   ? 0.3201 0.5101 0.2858 0.1279  0.0211  0.0525  8   PRO L CD  
2950 N N   . LYS C 9   ? 0.3305 0.5274 0.3057 0.0764  0.0190  0.0375  9   LYS L N   
2951 C CA  . LYS C 9   ? 0.3621 0.5312 0.3350 0.0650  0.0185  0.0375  9   LYS L CA  
2952 C C   . LYS C 9   ? 0.3327 0.4792 0.3057 0.0733  0.0196  0.0404  9   LYS L C   
2953 O O   . LYS C 9   ? 0.3186 0.4412 0.2904 0.0681  0.0190  0.0414  9   LYS L O   
2954 C CB  . LYS C 9   ? 0.4311 0.6084 0.4006 0.0498  0.0184  0.0321  9   LYS L CB  
2955 C CG  . LYS C 9   ? 0.4827 0.6751 0.4485 0.0370  0.0180  0.0285  9   LYS L CG  
2956 C CD  . LYS C 9   ? 0.5354 0.7039 0.4915 0.0213  0.0171  0.0269  9   LYS L CD  
2957 C CE  . LYS C 9   ? 0.5824 0.7619 0.5309 0.0067  0.0175  0.0227  9   LYS L CE  
2958 N NZ  . LYS C 9   ? 0.6300 0.8344 0.5745 -0.0050 0.0200  0.0167  9   LYS L NZ  
2959 N N   . PHE C 10  ? 0.3266 0.4805 0.2997 0.0856  0.0213  0.0410  10  PHE L N   
2960 C CA  . PHE C 10  ? 0.3614 0.4902 0.3321 0.0929  0.0231  0.0437  10  PHE L CA  
2961 C C   . PHE C 10  ? 0.3419 0.4742 0.3083 0.1106  0.0251  0.0459  10  PHE L C   
2962 O O   . PHE C 10  ? 0.3333 0.4927 0.3000 0.1176  0.0245  0.0442  10  PHE L O   
2963 C CB  . PHE C 10  ? 0.4528 0.5747 0.4240 0.0857  0.0234  0.0406  10  PHE L CB  
2964 C CG  . PHE C 10  ? 0.5124 0.6602 0.4845 0.0869  0.0237  0.0365  10  PHE L CG  
2965 C CD1 . PHE C 10  ? 0.5836 0.7371 0.5539 0.1014  0.0254  0.0365  10  PHE L CD1 
2966 C CD2 . PHE C 10  ? 0.5857 0.7523 0.5586 0.0735  0.0225  0.0322  10  PHE L CD2 
2967 C CE1 . PHE C 10  ? 0.6202 0.8026 0.5919 0.1036  0.0254  0.0317  10  PHE L CE1 
2968 C CE2 . PHE C 10  ? 0.6546 0.8495 0.6284 0.0730  0.0232  0.0274  10  PHE L CE2 
2969 C CZ  . PHE C 10  ? 0.6722 0.8771 0.6466 0.0885  0.0244  0.0269  10  PHE L CZ  
2970 N N   . LEU C 11  ? 0.3517 0.4564 0.3124 0.1167  0.0276  0.0489  11  LEU L N   
2971 C CA  . LEU C 11  ? 0.3804 0.4753 0.3310 0.1341  0.0302  0.0521  11  LEU L CA  
2972 C C   . LEU C 11  ? 0.3753 0.4442 0.3206 0.1344  0.0331  0.0518  11  LEU L C   
2973 O O   . LEU C 11  ? 0.3673 0.4172 0.3146 0.1232  0.0339  0.0517  11  LEU L O   
2974 C CB  . LEU C 11  ? 0.3982 0.4781 0.3416 0.1399  0.0315  0.0574  11  LEU L CB  
2975 C CG  . LEU C 11  ? 0.4194 0.5253 0.3635 0.1477  0.0294  0.0584  11  LEU L CG  
2976 C CD1 . LEU C 11  ? 0.4331 0.5244 0.3726 0.1478  0.0301  0.0633  11  LEU L CD1 
2977 C CD2 . LEU C 11  ? 0.4529 0.5733 0.3887 0.1677  0.0297  0.0584  11  LEU L CD2 
2978 N N   . LEU C 12  ? 0.3618 0.4322 0.3000 0.1479  0.0346  0.0510  12  LEU L N   
2979 C CA  . LEU C 12  ? 0.3814 0.4237 0.3105 0.1511  0.0383  0.0510  12  LEU L CA  
2980 C C   . LEU C 12  ? 0.3942 0.4149 0.3050 0.1682  0.0415  0.0555  12  LEU L C   
2981 O O   . LEU C 12  ? 0.4025 0.4394 0.3077 0.1846  0.0403  0.0562  12  LEU L O   
2982 C CB  . LEU C 12  ? 0.3948 0.4536 0.3279 0.1532  0.0375  0.0460  12  LEU L CB  
2983 C CG  . LEU C 12  ? 0.4155 0.4470 0.3393 0.1565  0.0413  0.0450  12  LEU L CG  
2984 C CD1 . LEU C 12  ? 0.4048 0.4177 0.3340 0.1389  0.0424  0.0439  12  LEU L CD1 
2985 C CD2 . LEU C 12  ? 0.4298 0.4814 0.3551 0.1643  0.0405  0.0403  12  LEU L CD2 
2986 N N   . VAL C 13  ? 0.4112 0.3960 0.3112 0.1641  0.0456  0.0582  13  VAL L N   
2987 C CA  . VAL C 13  ? 0.4256 0.3826 0.3034 0.1779  0.0495  0.0634  13  VAL L CA  
2988 C C   . VAL C 13  ? 0.4407 0.3572 0.3035 0.1730  0.0554  0.0632  13  VAL L C   
2989 O O   . VAL C 13  ? 0.4113 0.3233 0.2843 0.1551  0.0563  0.0599  13  VAL L O   
2990 C CB  . VAL C 13  ? 0.4461 0.4054 0.3251 0.1743  0.0486  0.0675  13  VAL L CB  
2991 C CG1 . VAL C 13  ? 0.4225 0.3753 0.3125 0.1530  0.0490  0.0661  13  VAL L CG1 
2992 C CG2 . VAL C 13  ? 0.4916 0.4235 0.3458 0.1893  0.0523  0.0734  13  VAL L CG2 
2993 N N   . SER C 14  ? 0.4649 0.3528 0.3029 0.1885  0.0595  0.0662  14  SER L N   
2994 C CA  . SER C 14  ? 0.5057 0.3496 0.3230 0.1847  0.0664  0.0661  14  SER L CA  
2995 C C   . SER C 14  ? 0.5202 0.3370 0.3254 0.1742  0.0708  0.0699  14  SER L C   
2996 O O   . SER C 14  ? 0.5210 0.3441 0.3231 0.1811  0.0692  0.0746  14  SER L O   
2997 C CB  . SER C 14  ? 0.5436 0.3669 0.3365 0.2069  0.0688  0.0671  14  SER L CB  
2998 O OG  . SER C 14  ? 0.5438 0.3920 0.3496 0.2117  0.0656  0.0618  14  SER L OG  
2999 N N   . ALA C 15  ? 0.5304 0.3218 0.3300 0.1571  0.0762  0.0673  15  ALA L N   
3000 C CA  . ALA C 15  ? 0.5564 0.3166 0.3383 0.1461  0.0824  0.0700  15  ALA L CA  
3001 C C   . ALA C 15  ? 0.5949 0.3239 0.3448 0.1651  0.0858  0.0768  15  ALA L C   
3002 O O   . ALA C 15  ? 0.6259 0.3332 0.3554 0.1811  0.0879  0.0774  15  ALA L O   
3003 C CB  . ALA C 15  ? 0.5756 0.3107 0.3500 0.1277  0.0890  0.0649  15  ALA L CB  
3004 N N   . GLY C 16  ? 0.5996 0.3256 0.3437 0.1640  0.0862  0.0817  16  GLY L N   
3005 C CA  . GLY C 16  ? 0.6432 0.3388 0.3554 0.1806  0.0894  0.0890  16  GLY L CA  
3006 C C   . GLY C 16  ? 0.6237 0.3523 0.3452 0.2012  0.0821  0.0927  16  GLY L C   
3007 O O   . GLY C 16  ? 0.6602 0.3705 0.3585 0.2152  0.0835  0.0989  16  GLY L O   
3008 N N   . ASP C 17  ? 0.5882 0.3637 0.3406 0.2030  0.0748  0.0888  17  ASP L N   
3009 C CA  . ASP C 17  ? 0.5925 0.4055 0.3552 0.2211  0.0679  0.0905  17  ASP L CA  
3010 C C   . ASP C 17  ? 0.5717 0.4160 0.3573 0.2090  0.0638  0.0910  17  ASP L C   
3011 O O   . ASP C 17  ? 0.5600 0.4029 0.3582 0.1870  0.0651  0.0889  17  ASP L O   
3012 C CB  . ASP C 17  ? 0.5901 0.4353 0.3695 0.2293  0.0632  0.0851  17  ASP L CB  
3013 C CG  . ASP C 17  ? 0.6440 0.4644 0.3985 0.2494  0.0659  0.0851  17  ASP L CG  
3014 O OD1 . ASP C 17  ? 0.6818 0.4587 0.4024 0.2615  0.0709  0.0900  17  ASP L OD1 
3015 O OD2 . ASP C 17  ? 0.6508 0.4943 0.4182 0.2533  0.0630  0.0800  17  ASP L OD2 
3016 N N   . LYS C 18  ? 0.5645 0.4378 0.3546 0.2239  0.0590  0.0931  18  LYS L N   
3017 C CA  . LYS C 18  ? 0.5485 0.4489 0.3554 0.2158  0.0554  0.0941  18  LYS L CA  
3018 C C   . LYS C 18  ? 0.5046 0.4497 0.3438 0.2049  0.0496  0.0879  18  LYS L C   
3019 O O   . LYS C 18  ? 0.5069 0.4717 0.3531 0.2121  0.0471  0.0841  18  LYS L O   
3020 C CB  . LYS C 18  ? 0.5894 0.4963 0.3811 0.2378  0.0538  0.0992  18  LYS L CB  
3021 C CG  . LYS C 18  ? 0.6024 0.5377 0.4084 0.2326  0.0502  0.1005  18  LYS L CG  
3022 C CD  . LYS C 18  ? 0.6460 0.5961 0.4388 0.2576  0.0476  0.1041  18  LYS L CD  
3023 C CE  . LYS C 18  ? 0.6733 0.6312 0.4668 0.2548  0.0467  0.1080  18  LYS L CE  
3024 N NZ  . LYS C 18  ? 0.7403 0.6835 0.5050 0.2795  0.0476  0.1146  18  LYS L NZ  
3025 N N   . VAL C 19  ? 0.4484 0.4068 0.3044 0.1880  0.0478  0.0869  19  VAL L N   
3026 C CA  . VAL C 19  ? 0.4251 0.4213 0.3076 0.1765  0.0425  0.0818  19  VAL L CA  
3027 C C   . VAL C 19  ? 0.4232 0.4409 0.3107 0.1782  0.0396  0.0839  19  VAL L C   
3028 O O   . VAL C 19  ? 0.4240 0.4231 0.3032 0.1744  0.0420  0.0879  19  VAL L O   
3029 C CB  . VAL C 19  ? 0.4049 0.3928 0.2996 0.1553  0.0431  0.0782  19  VAL L CB  
3030 C CG1 . VAL C 19  ? 0.3809 0.3989 0.2967 0.1431  0.0381  0.0745  19  VAL L CG1 
3031 C CG2 . VAL C 19  ? 0.4238 0.4000 0.3180 0.1527  0.0448  0.0748  19  VAL L CG2 
3032 N N   . THR C 20  ? 0.3908 0.4467 0.2911 0.1816  0.0351  0.0806  20  THR L N   
3033 C CA  . THR C 20  ? 0.3693 0.4518 0.2767 0.1816  0.0320  0.0810  20  THR L CA  
3034 C C   . THR C 20  ? 0.3444 0.4556 0.2723 0.1658  0.0283  0.0747  20  THR L C   
3035 O O   . THR C 20  ? 0.3587 0.4893 0.2925 0.1667  0.0268  0.0701  20  THR L O   
3036 C CB  . THR C 20  ? 0.3827 0.4852 0.2805 0.2032  0.0306  0.0827  20  THR L CB  
3037 O OG1 . THR C 20  ? 0.4036 0.4714 0.2773 0.2189  0.0344  0.0888  20  THR L OG1 
3038 C CG2 . THR C 20  ? 0.3731 0.5028 0.2780 0.2019  0.0278  0.0829  20  THR L CG2 
3039 N N   . ILE C 21  ? 0.3100 0.4195 0.2460 0.1513  0.0273  0.0742  21  ILE L N   
3040 C CA  . ILE C 21  ? 0.3075 0.4379 0.2583 0.1360  0.0240  0.0687  21  ILE L CA  
3041 C C   . ILE C 21  ? 0.3010 0.4540 0.2555 0.1353  0.0218  0.0686  21  ILE L C   
3042 O O   . ILE C 21  ? 0.3243 0.4666 0.2732 0.1392  0.0228  0.0730  21  ILE L O   
3043 C CB  . ILE C 21  ? 0.3154 0.4238 0.2707 0.1210  0.0243  0.0673  21  ILE L CB  
3044 C CG1 . ILE C 21  ? 0.3450 0.4341 0.2971 0.1212  0.0265  0.0667  21  ILE L CG1 
3045 C CG2 . ILE C 21  ? 0.3079 0.4317 0.2733 0.1070  0.0209  0.0623  21  ILE L CG2 
3046 C CD1 . ILE C 21  ? 0.3590 0.4240 0.3120 0.1104  0.0278  0.0659  21  ILE L CD1 
3047 N N   . THR C 22  ? 0.2702 0.4527 0.2328 0.1289  0.0194  0.0633  22  THR L N   
3048 C CA  . THR C 22  ? 0.2666 0.4746 0.2331 0.1261  0.0174  0.0615  22  THR L CA  
3049 C C   . THR C 22  ? 0.2518 0.4591 0.2249 0.1070  0.0158  0.0570  22  THR L C   
3050 O O   . THR C 22  ? 0.2406 0.4451 0.2160 0.0967  0.0154  0.0531  22  THR L O   
3051 C CB  . THR C 22  ? 0.2844 0.5306 0.2516 0.1350  0.0165  0.0581  22  THR L CB  
3052 O OG1 . THR C 22  ? 0.3019 0.5425 0.2590 0.1559  0.0177  0.0632  22  THR L OG1 
3053 C CG2 . THR C 22  ? 0.2883 0.5642 0.2598 0.1295  0.0148  0.0547  22  THR L CG2 
3054 N N   . CYS C 23  ? 0.2341 0.4438 0.2083 0.1031  0.0148  0.0576  23  CYS L N   
3055 C CA  A CYS C 23  ? 0.2420 0.4519 0.2193 0.0871  0.0130  0.0530  23  CYS L CA  
3056 C CA  B CYS C 23  ? 0.2280 0.4387 0.2054 0.0868  0.0130  0.0528  23  CYS L CA  
3057 C C   . CYS C 23  ? 0.2385 0.4769 0.2173 0.0852  0.0120  0.0504  23  CYS L C   
3058 O O   . CYS C 23  ? 0.2337 0.4764 0.2115 0.0950  0.0121  0.0545  23  CYS L O   
3059 C CB  A CYS C 23  ? 0.2590 0.4397 0.2355 0.0843  0.0129  0.0557  23  CYS L CB  
3060 C CB  B CYS C 23  ? 0.2263 0.4087 0.2032 0.0815  0.0125  0.0545  23  CYS L CB  
3061 S SG  A CYS C 23  ? 0.2931 0.4674 0.2698 0.0687  0.0103  0.0505  23  CYS L SG  
3062 S SG  B CYS C 23  ? 0.2120 0.3713 0.1880 0.0716  0.0119  0.0514  23  CYS L SG  
3063 N N   . LYS C 24  ? 0.2260 0.4820 0.2053 0.0724  0.0115  0.0438  24  LYS L N   
3064 C CA  . LYS C 24  ? 0.2390 0.5250 0.2193 0.0682  0.0110  0.0399  24  LYS L CA  
3065 C C   . LYS C 24  ? 0.2268 0.5006 0.2036 0.0509  0.0103  0.0355  24  LYS L C   
3066 O O   . LYS C 24  ? 0.2436 0.5063 0.2157 0.0381  0.0106  0.0314  24  LYS L O   
3067 C CB  . LYS C 24  ? 0.2645 0.5885 0.2461 0.0675  0.0118  0.0344  24  LYS L CB  
3068 C CG  . LYS C 24  ? 0.3064 0.6439 0.2891 0.0882  0.0121  0.0384  24  LYS L CG  
3069 C CD  . LYS C 24  ? 0.3429 0.7270 0.3274 0.0926  0.0123  0.0324  24  LYS L CD  
3070 C CE  . LYS C 24  ? 0.3742 0.7650 0.3562 0.1177  0.0120  0.0376  24  LYS L CE  
3071 N NZ  . LYS C 24  ? 0.4115 0.8518 0.3951 0.1258  0.0116  0.0315  24  LYS L NZ  
3072 N N   . ALA C 25  ? 0.2153 0.4895 0.1923 0.0508  0.0093  0.0362  25  ALA L N   
3073 C CA  . ALA C 25  ? 0.2108 0.4740 0.1822 0.0360  0.0085  0.0315  25  ALA L CA  
3074 C C   . ALA C 25  ? 0.2203 0.5134 0.1888 0.0237  0.0098  0.0240  25  ALA L C   
3075 O O   . ALA C 25  ? 0.1980 0.5257 0.1718 0.0304  0.0102  0.0234  25  ALA L O   
3076 C CB  . ALA C 25  ? 0.2057 0.4585 0.1787 0.0412  0.0071  0.0347  25  ALA L CB  
3077 N N   . SER C 26  ? 0.2367 0.5153 0.1949 0.0064  0.0102  0.0183  26  SER L N   
3078 C CA  . SER C 26  ? 0.2459 0.5483 0.1974 -0.0101 0.0124  0.0098  26  SER L CA  
3079 C C   . SER C 26  ? 0.2454 0.5656 0.1993 -0.0095 0.0119  0.0083  26  SER L C   
3080 O O   . SER C 26  ? 0.2492 0.5982 0.2003 -0.0209 0.0139  0.0013  26  SER L O   
3081 C CB  . SER C 26  ? 0.2626 0.5369 0.1973 -0.0294 0.0137  0.0045  26  SER L CB  
3082 O OG  . SER C 26  ? 0.2536 0.4906 0.1804 -0.0289 0.0116  0.0064  26  SER L OG  
3083 N N   . GLN C 27  ? 0.2377 0.5422 0.1957 0.0016  0.0096  0.0139  27  GLN L N   
3084 C CA  . GLN C 27  ? 0.2487 0.5731 0.2107 0.0051  0.0089  0.0135  27  GLN L CA  
3085 C C   . GLN C 27  ? 0.2307 0.5455 0.2010 0.0240  0.0070  0.0224  27  GLN L C   
3086 O O   . GLN C 27  ? 0.2161 0.5047 0.1869 0.0299  0.0065  0.0271  27  GLN L O   
3087 C CB  . GLN C 27  ? 0.2881 0.5962 0.2390 -0.0093 0.0089  0.0078  27  GLN L CB  
3088 C CG  . GLN C 27  ? 0.3232 0.5894 0.2690 -0.0060 0.0066  0.0110  27  GLN L CG  
3089 C CD  . GLN C 27  ? 0.3704 0.6199 0.3039 -0.0163 0.0061  0.0056  27  GLN L CD  
3090 O OE1 . GLN C 27  ? 0.4531 0.6845 0.3705 -0.0312 0.0075  -0.0002 27  GLN L OE1 
3091 N NE2 . GLN C 27  ? 0.3925 0.6434 0.3312 -0.0082 0.0042  0.0077  27  GLN L NE2 
3092 N N   . SER C 28  ? 0.2150 0.5502 0.1903 0.0320  0.0065  0.0243  28  SER L N   
3093 C CA  . SER C 28  ? 0.2066 0.5324 0.1868 0.0485  0.0055  0.0328  28  SER L CA  
3094 C C   . SER C 28  ? 0.2042 0.4934 0.1819 0.0461  0.0043  0.0344  28  SER L C   
3095 O O   . SER C 28  ? 0.1942 0.4732 0.1668 0.0356  0.0033  0.0293  28  SER L O   
3096 C CB  . SER C 28  ? 0.2126 0.5659 0.1961 0.0568  0.0053  0.0344  28  SER L CB  
3097 O OG  . SER C 28  ? 0.2044 0.5903 0.1900 0.0652  0.0060  0.0344  28  SER L OG  
3098 N N   . VAL C 29  ? 0.2018 0.4725 0.1816 0.0562  0.0044  0.0409  29  VAL L N   
3099 C CA  . VAL C 29  ? 0.1964 0.4380 0.1750 0.0556  0.0032  0.0420  29  VAL L CA  
3100 C C   . VAL C 29  ? 0.1949 0.4343 0.1762 0.0662  0.0040  0.0483  29  VAL L C   
3101 O O   . VAL C 29  ? 0.2048 0.4231 0.1860 0.0678  0.0041  0.0503  29  VAL L O   
3102 C CB  . VAL C 29  ? 0.1950 0.4142 0.1714 0.0534  0.0033  0.0418  29  VAL L CB  
3103 C CG1 . VAL C 29  ? 0.2069 0.4222 0.1767 0.0409  0.0027  0.0353  29  VAL L CG1 
3104 C CG2 . VAL C 29  ? 0.1980 0.4193 0.1771 0.0622  0.0052  0.0470  29  VAL L CG2 
3105 N N   . SER C 30  ? 0.2029 0.4640 0.1854 0.0723  0.0046  0.0509  30  SER L N   
3106 C CA  . SER C 30  ? 0.2053 0.4626 0.1869 0.0817  0.0059  0.0574  30  SER L CA  
3107 C C   . SER C 30  ? 0.1991 0.4355 0.1776 0.0882  0.0082  0.0629  30  SER L C   
3108 O O   . SER C 30  ? 0.1927 0.4324 0.1700 0.0929  0.0089  0.0642  30  SER L O   
3109 C CB  . SER C 30  ? 0.2355 0.4854 0.2181 0.0764  0.0047  0.0549  30  SER L CB  
3110 O OG  . SER C 30  ? 0.2798 0.5229 0.2601 0.0830  0.0067  0.0608  30  SER L OG  
3111 N N   . ASN C 31  ? 0.1840 0.4007 0.1606 0.0882  0.0095  0.0655  31  ASN L N   
3112 C CA  . ASN C 31  ? 0.1997 0.3948 0.1720 0.0917  0.0122  0.0696  31  ASN L CA  
3113 C C   . ASN C 31  ? 0.1930 0.3715 0.1688 0.0831  0.0112  0.0649  31  ASN L C   
3114 O O   . ASN C 31  ? 0.2054 0.3663 0.1780 0.0835  0.0137  0.0671  31  ASN L O   
3115 C CB  . ASN C 31  ? 0.2085 0.3922 0.1724 0.0974  0.0158  0.0761  31  ASN L CB  
3116 C CG  . ASN C 31  ? 0.2104 0.3925 0.1760 0.0908  0.0158  0.0741  31  ASN L CG  
3117 O OD1 . ASN C 31  ? 0.2032 0.3934 0.1761 0.0841  0.0125  0.0678  31  ASN L OD1 
3118 N ND2 . ASN C 31  ? 0.2280 0.3978 0.1848 0.0924  0.0196  0.0789  31  ASN L ND2 
3119 N N   . ASP C 32  ? 0.1859 0.3689 0.1657 0.0761  0.0078  0.0584  32  ASP L N   
3120 C CA  . ASP C 32  ? 0.1915 0.3599 0.1723 0.0702  0.0059  0.0533  32  ASP L CA  
3121 C C   . ASP C 32  ? 0.1908 0.3480 0.1708 0.0692  0.0061  0.0528  32  ASP L C   
3122 O O   . ASP C 32  ? 0.1871 0.3417 0.1659 0.0643  0.0037  0.0484  32  ASP L O   
3123 C CB  . ASP C 32  ? 0.1961 0.3701 0.1768 0.0649  0.0024  0.0471  32  ASP L CB  
3124 C CG  . ASP C 32  ? 0.2120 0.3951 0.1939 0.0657  0.0021  0.0467  32  ASP L CG  
3125 O OD1 . ASP C 32  ? 0.2128 0.3916 0.1956 0.0676  0.0038  0.0486  32  ASP L OD1 
3126 O OD2 . ASP C 32  ? 0.2369 0.4318 0.2182 0.0631  0.0003  0.0436  32  ASP L OD2 
3127 N N   . LEU C 33  ? 0.2023 0.3531 0.1810 0.0739  0.0091  0.0576  33  LEU L N   
3128 C CA  . LEU C 33  ? 0.2032 0.3459 0.1812 0.0744  0.0098  0.0579  33  LEU L CA  
3129 C C   . LEU C 33  ? 0.1947 0.3196 0.1712 0.0747  0.0123  0.0593  33  LEU L C   
3130 O O   . LEU C 33  ? 0.1912 0.3111 0.1637 0.0781  0.0157  0.0636  33  LEU L O   
3131 C CB  . LEU C 33  ? 0.2200 0.3745 0.1963 0.0813  0.0115  0.0620  33  LEU L CB  
3132 C CG  . LEU C 33  ? 0.2379 0.3931 0.2142 0.0817  0.0116  0.0610  33  LEU L CG  
3133 C CD1 . LEU C 33  ? 0.2652 0.4006 0.2391 0.0842  0.0139  0.0633  33  LEU L CD1 
3134 C CD2 . LEU C 33  ? 0.2363 0.3937 0.2142 0.0717  0.0087  0.0547  33  LEU L CD2 
3135 N N   . THR C 34  ? 0.1759 0.2910 0.1536 0.0706  0.0108  0.0553  34  THR L N   
3136 C CA  . THR C 34  ? 0.1864 0.2873 0.1633 0.0692  0.0129  0.0547  34  THR L CA  
3137 C C   . THR C 34  ? 0.1910 0.2832 0.1666 0.0704  0.0141  0.0557  34  THR L C   
3138 O O   . THR C 34  ? 0.1950 0.2915 0.1715 0.0695  0.0118  0.0541  34  THR L O   
3139 C CB  . THR C 34  ? 0.1815 0.2810 0.1605 0.0651  0.0098  0.0483  34  THR L CB  
3140 O OG1 . THR C 34  ? 0.1906 0.2998 0.1705 0.0648  0.0088  0.0473  34  THR L OG1 
3141 C CG2 . THR C 34  ? 0.1839 0.2746 0.1627 0.0629  0.0119  0.0462  34  THR L CG2 
3142 N N   . TRP C 35  ? 0.1966 0.2768 0.1688 0.0715  0.0182  0.0581  35  TRP L N   
3143 C CA  . TRP C 35  ? 0.2010 0.2718 0.1718 0.0725  0.0196  0.0584  35  TRP L CA  
3144 C C   . TRP C 35  ? 0.1998 0.2608 0.1715 0.0670  0.0202  0.0541  35  TRP L C   
3145 O O   . TRP C 35  ? 0.2165 0.2732 0.1859 0.0639  0.0230  0.0534  35  TRP L O   
3146 C CB  . TRP C 35  ? 0.2093 0.2726 0.1726 0.0794  0.0240  0.0642  35  TRP L CB  
3147 C CG  . TRP C 35  ? 0.2150 0.2921 0.1774 0.0870  0.0229  0.0676  35  TRP L CG  
3148 C CD1 . TRP C 35  ? 0.2193 0.3032 0.1779 0.0921  0.0237  0.0714  35  TRP L CD1 
3149 C CD2 . TRP C 35  ? 0.2117 0.3002 0.1765 0.0905  0.0211  0.0669  35  TRP L CD2 
3150 N NE1 . TRP C 35  ? 0.2199 0.3212 0.1793 0.0990  0.0220  0.0725  35  TRP L NE1 
3151 C CE2 . TRP C 35  ? 0.2185 0.3235 0.1816 0.0979  0.0207  0.0697  35  TRP L CE2 
3152 C CE3 . TRP C 35  ? 0.2134 0.3016 0.1812 0.0876  0.0200  0.0638  35  TRP L CE3 
3153 C CZ2 . TRP C 35  ? 0.2219 0.3461 0.1871 0.1017  0.0192  0.0683  35  TRP L CZ2 
3154 C CZ3 . TRP C 35  ? 0.2136 0.3183 0.1828 0.0909  0.0188  0.0631  35  TRP L CZ3 
3155 C CH2 . TRP C 35  ? 0.2154 0.3390 0.1835 0.0977  0.0185  0.0650  35  TRP L CH2 
3156 N N   . TYR C 36  ? 0.2006 0.2592 0.1745 0.0656  0.0179  0.0510  36  TYR L N   
3157 C CA  . TYR C 36  ? 0.1943 0.2461 0.1690 0.0617  0.0180  0.0464  36  TYR L CA  
3158 C C   . TYR C 36  ? 0.2153 0.2578 0.1881 0.0626  0.0204  0.0476  36  TYR L C   
3159 O O   . TYR C 36  ? 0.2227 0.2672 0.1951 0.0661  0.0197  0.0502  36  TYR L O   
3160 C CB  . TYR C 36  ? 0.1848 0.2406 0.1616 0.0604  0.0125  0.0410  36  TYR L CB  
3161 C CG  . TYR C 36  ? 0.1757 0.2396 0.1531 0.0605  0.0092  0.0384  36  TYR L CG  
3162 C CD1 . TYR C 36  ? 0.1819 0.2506 0.1582 0.0615  0.0066  0.0397  36  TYR L CD1 
3163 C CD2 . TYR C 36  ? 0.1809 0.2497 0.1598 0.0592  0.0090  0.0339  36  TYR L CD2 
3164 C CE1 . TYR C 36  ? 0.1747 0.2492 0.1503 0.0619  0.0035  0.0368  36  TYR L CE1 
3165 C CE2 . TYR C 36  ? 0.1756 0.2532 0.1549 0.0605  0.0059  0.0310  36  TYR L CE2 
3166 C CZ  . TYR C 36  ? 0.1814 0.2602 0.1587 0.0622  0.0031  0.0327  36  TYR L CZ  
3167 O OH  . TYR C 36  ? 0.1801 0.2660 0.1566 0.0638  0.0000  0.0294  36  TYR L OH  
3168 N N   . GLN C 37  ? 0.2252 0.2603 0.1971 0.0589  0.0228  0.0446  37  GLN L N   
3169 C CA  . GLN C 37  ? 0.2304 0.2557 0.2003 0.0585  0.0253  0.0442  37  GLN L CA  
3170 C C   . GLN C 37  ? 0.2219 0.2503 0.1954 0.0553  0.0218  0.0379  37  GLN L C   
3171 O O   . GLN C 37  ? 0.2203 0.2533 0.1952 0.0516  0.0217  0.0330  37  GLN L O   
3172 C CB  . GLN C 37  ? 0.2480 0.2607 0.2107 0.0558  0.0320  0.0456  37  GLN L CB  
3173 C CG  . GLN C 37  ? 0.2520 0.2527 0.2111 0.0545  0.0352  0.0444  37  GLN L CG  
3174 C CD  . GLN C 37  ? 0.2752 0.2615 0.2247 0.0485  0.0423  0.0440  37  GLN L CD  
3175 O OE1 . GLN C 37  ? 0.2886 0.2796 0.2388 0.0403  0.0438  0.0392  37  GLN L OE1 
3176 N NE2 . GLN C 37  ? 0.2779 0.2463 0.2161 0.0529  0.0470  0.0488  37  GLN L NE2 
3177 N N   . GLN C 38  ? 0.2317 0.2585 0.2057 0.0568  0.0193  0.0376  38  GLN L N   
3178 C CA  . GLN C 38  ? 0.2327 0.2599 0.2074 0.0553  0.0160  0.0322  38  GLN L CA  
3179 C C   . GLN C 38  ? 0.2575 0.2776 0.2315 0.0540  0.0191  0.0317  38  GLN L C   
3180 O O   . GLN C 38  ? 0.2329 0.2499 0.2058 0.0558  0.0188  0.0341  38  GLN L O   
3181 C CB  . GLN C 38  ? 0.2349 0.2635 0.2073 0.0571  0.0105  0.0317  38  GLN L CB  
3182 C CG  . GLN C 38  ? 0.2435 0.2701 0.2131 0.0577  0.0067  0.0262  38  GLN L CG  
3183 C CD  . GLN C 38  ? 0.2488 0.2706 0.2107 0.0596  0.0015  0.0254  38  GLN L CD  
3184 O OE1 . GLN C 38  ? 0.2708 0.2895 0.2295 0.0577  0.0014  0.0287  38  GLN L OE1 
3185 N NE2 . GLN C 38  ? 0.2474 0.2681 0.2043 0.0633  -0.0026 0.0204  38  GLN L NE2 
3186 N N   . LYS C 39  ? 0.2843 0.3037 0.2586 0.0502  0.0219  0.0275  39  LYS L N   
3187 C CA  . LYS C 39  ? 0.3107 0.3232 0.2838 0.0478  0.0250  0.0257  39  LYS L CA  
3188 C C   . LYS C 39  ? 0.3132 0.3300 0.2875 0.0491  0.0199  0.0216  39  LYS L C   
3189 O O   . LYS C 39  ? 0.3245 0.3477 0.2987 0.0514  0.0148  0.0189  39  LYS L O   
3190 C CB  . LYS C 39  ? 0.3270 0.3370 0.2979 0.0412  0.0308  0.0222  39  LYS L CB  
3191 C CG  . LYS C 39  ? 0.3628 0.3609 0.3269 0.0398  0.0369  0.0270  39  LYS L CG  
3192 C CD  . LYS C 39  ? 0.3941 0.3848 0.3517 0.0305  0.0440  0.0234  39  LYS L CD  
3193 C CE  . LYS C 39  ? 0.4161 0.3915 0.3630 0.0304  0.0495  0.0292  39  LYS L CE  
3194 N NZ  . LYS C 39  ? 0.4414 0.4028 0.3764 0.0195  0.0578  0.0264  39  LYS L NZ  
3195 N N   . PRO C 40  ? 0.3583 0.3698 0.3317 0.0488  0.0209  0.0213  40  PRO L N   
3196 C CA  . PRO C 40  ? 0.3511 0.3644 0.3231 0.0506  0.0160  0.0184  40  PRO L CA  
3197 C C   . PRO C 40  ? 0.3319 0.3542 0.3043 0.0507  0.0133  0.0113  40  PRO L C   
3198 O O   . PRO C 40  ? 0.3401 0.3681 0.3151 0.0466  0.0169  0.0072  40  PRO L O   
3199 C CB  . PRO C 40  ? 0.3723 0.3795 0.3438 0.0493  0.0188  0.0190  40  PRO L CB  
3200 C CG  . PRO C 40  ? 0.3910 0.3921 0.3625 0.0493  0.0243  0.0234  40  PRO L CG  
3201 C CD  . PRO C 40  ? 0.3894 0.3916 0.3610 0.0477  0.0265  0.0236  40  PRO L CD  
3202 N N   . GLY C 41  ? 0.3247 0.3483 0.2926 0.0557  0.0072  0.0097  41  GLY L N   
3203 C CA  . GLY C 41  ? 0.3462 0.3799 0.3121 0.0599  0.0030  0.0028  41  GLY L CA  
3204 C C   . GLY C 41  ? 0.3366 0.3819 0.3051 0.0611  0.0021  0.0000  41  GLY L C   
3205 O O   . GLY C 41  ? 0.3629 0.4205 0.3301 0.0657  -0.0013 -0.0067 41  GLY L O   
3206 N N   . GLN C 42  ? 0.3158 0.3595 0.2878 0.0574  0.0055  0.0042  42  GLN L N   
3207 C CA  . GLN C 42  ? 0.3001 0.3559 0.2752 0.0568  0.0059  0.0015  42  GLN L CA  
3208 C C   . GLN C 42  ? 0.2689 0.3203 0.2408 0.0613  0.0022  0.0055  42  GLN L C   
3209 O O   . GLN C 42  ? 0.2661 0.3052 0.2342 0.0624  0.0011  0.0109  42  GLN L O   
3210 C CB  . GLN C 42  ? 0.3316 0.3877 0.3107 0.0481  0.0134  0.0030  42  GLN L CB  
3211 C CG  . GLN C 42  ? 0.3748 0.4315 0.3549 0.0412  0.0186  -0.0007 42  GLN L CG  
3212 C CD  . GLN C 42  ? 0.4326 0.4852 0.4115 0.0320  0.0264  0.0003  42  GLN L CD  
3213 O OE1 . GLN C 42  ? 0.4490 0.5003 0.4270 0.0312  0.0279  0.0037  42  GLN L OE1 
3214 N NE2 . GLN C 42  ? 0.5202 0.5670 0.4967 0.0248  0.0321  -0.0019 42  GLN L NE2 
3215 N N   . SER C 43  ? 0.2407 0.3041 0.2140 0.0631  0.0007  0.0019  43  SER L N   
3216 C CA  . SER C 43  ? 0.2382 0.2992 0.2091 0.0664  -0.0019 0.0049  43  SER L CA  
3217 C C   . SER C 43  ? 0.2304 0.2871 0.2054 0.0604  0.0033  0.0118  43  SER L C   
3218 O O   . SER C 43  ? 0.2295 0.2871 0.2080 0.0545  0.0090  0.0124  43  SER L O   
3219 C CB  . SER C 43  ? 0.2461 0.3236 0.2176 0.0705  -0.0049 -0.0017 43  SER L CB  
3220 O OG  . SER C 43  ? 0.2611 0.3444 0.2280 0.0777  -0.0096 -0.0087 43  SER L OG  
3221 N N   . PRO C 44  ? 0.2264 0.2786 0.1993 0.0620  0.0019  0.0163  44  PRO L N   
3222 C CA  . PRO C 44  ? 0.2211 0.2730 0.1973 0.0586  0.0064  0.0221  44  PRO L CA  
3223 C C   . PRO C 44  ? 0.2209 0.2826 0.2004 0.0550  0.0100  0.0201  44  PRO L C   
3224 O O   . PRO C 44  ? 0.2234 0.2971 0.2041 0.0559  0.0076  0.0139  44  PRO L O   
3225 C CB  . PRO C 44  ? 0.2318 0.2821 0.2049 0.0612  0.0031  0.0250  44  PRO L CB  
3226 C CG  . PRO C 44  ? 0.2332 0.2756 0.1987 0.0643  -0.0021 0.0222  44  PRO L CG  
3227 C CD  . PRO C 44  ? 0.2293 0.2757 0.1946 0.0671  -0.0038 0.0159  44  PRO L CD  
3228 N N   . LYS C 45  ? 0.2202 0.2762 0.1994 0.0510  0.0159  0.0248  45  LYS L N   
3229 C CA  . LYS C 45  ? 0.2237 0.2837 0.2022 0.0452  0.0210  0.0241  45  LYS L CA  
3230 C C   . LYS C 45  ? 0.2068 0.2637 0.1831 0.0470  0.0226  0.0309  45  LYS L C   
3231 O O   . LYS C 45  ? 0.1970 0.2440 0.1706 0.0504  0.0239  0.0372  45  LYS L O   
3232 C CB  . LYS C 45  ? 0.2606 0.3099 0.2350 0.0390  0.0277  0.0244  45  LYS L CB  
3233 C CG  . LYS C 45  ? 0.2950 0.3432 0.2641 0.0306  0.0343  0.0237  45  LYS L CG  
3234 C CD  . LYS C 45  ? 0.3483 0.3813 0.3092 0.0230  0.0417  0.0235  45  LYS L CD  
3235 C CE  . LYS C 45  ? 0.4002 0.4253 0.3504 0.0135  0.0494  0.0243  45  LYS L CE  
3236 N NZ  . LYS C 45  ? 0.4463 0.4512 0.3846 0.0054  0.0572  0.0240  45  LYS L NZ  
3237 N N   . LEU C 46  ? 0.1994 0.2663 0.1765 0.0452  0.0226  0.0294  46  LEU L N   
3238 C CA  A LEU C 46  ? 0.2002 0.2669 0.1752 0.0473  0.0236  0.0353  46  LEU L CA  
3239 C CA  B LEU C 46  ? 0.2033 0.2693 0.1783 0.0477  0.0235  0.0357  46  LEU L CA  
3240 C C   . LEU C 46  ? 0.2176 0.2696 0.1837 0.0443  0.0309  0.0410  46  LEU L C   
3241 O O   . LEU C 46  ? 0.2262 0.2756 0.1880 0.0363  0.0358  0.0379  46  LEU L O   
3242 C CB  A LEU C 46  ? 0.1926 0.2750 0.1705 0.0454  0.0217  0.0306  46  LEU L CB  
3243 C CB  B LEU C 46  ? 0.1995 0.2808 0.1776 0.0474  0.0207  0.0320  46  LEU L CB  
3244 C CG  A LEU C 46  ? 0.1924 0.2775 0.1683 0.0464  0.0229  0.0355  46  LEU L CG  
3245 C CG  B LEU C 46  ? 0.2004 0.2840 0.1781 0.0515  0.0194  0.0375  46  LEU L CG  
3246 C CD1 A LEU C 46  ? 0.1852 0.2692 0.1623 0.0535  0.0191  0.0403  46  LEU L CD1 
3247 C CD1 B LEU C 46  ? 0.1983 0.2962 0.1798 0.0534  0.0143  0.0327  46  LEU L CD1 
3248 C CD2 A LEU C 46  ? 0.1873 0.2896 0.1665 0.0442  0.0210  0.0296  46  LEU L CD2 
3249 C CD2 B LEU C 46  ? 0.2118 0.2893 0.1828 0.0490  0.0255  0.0432  46  LEU L CD2 
3250 N N   . LEU C 47  ? 0.2242 0.2678 0.1861 0.0506  0.0319  0.0484  47  LEU L N   
3251 C CA  . LEU C 47  ? 0.2490 0.2748 0.1979 0.0506  0.0386  0.0544  47  LEU L CA  
3252 C C   . LEU C 47  ? 0.2504 0.2786 0.1944 0.0542  0.0394  0.0597  47  LEU L C   
3253 O O   . LEU C 47  ? 0.2710 0.2879 0.2035 0.0497  0.0451  0.0618  47  LEU L O   
3254 C CB  . LEU C 47  ? 0.2663 0.2795 0.2107 0.0579  0.0396  0.0588  47  LEU L CB  
3255 C CG  . LEU C 47  ? 0.2749 0.2815 0.2211 0.0547  0.0402  0.0548  47  LEU L CG  
3256 C CD1 . LEU C 47  ? 0.2932 0.2865 0.2323 0.0629  0.0420  0.0598  47  LEU L CD1 
3257 C CD2 . LEU C 47  ? 0.2884 0.2868 0.2293 0.0437  0.0454  0.0501  47  LEU L CD2 
3258 N N   . ILE C 48  ? 0.2326 0.2744 0.1834 0.0611  0.0344  0.0614  48  ILE L N   
3259 C CA  . ILE C 48  ? 0.2437 0.2896 0.1898 0.0667  0.0347  0.0670  48  ILE L CA  
3260 C C   . ILE C 48  ? 0.2277 0.2947 0.1850 0.0666  0.0288  0.0636  48  ILE L C   
3261 O O   . ILE C 48  ? 0.2154 0.2900 0.1807 0.0672  0.0242  0.0600  48  ILE L O   
3262 C CB  . ILE C 48  ? 0.2693 0.3094 0.2085 0.0778  0.0354  0.0734  48  ILE L CB  
3263 C CG1 . ILE C 48  ? 0.3101 0.3241 0.2332 0.0792  0.0419  0.0772  48  ILE L CG1 
3264 C CG2 . ILE C 48  ? 0.2643 0.3159 0.2014 0.0846  0.0342  0.0777  48  ILE L CG2 
3265 C CD1 . ILE C 48  ? 0.3397 0.3473 0.2538 0.0925  0.0425  0.0829  48  ILE L CD1 
3266 N N   . TYR C 49  ? 0.2217 0.2963 0.1778 0.0655  0.0293  0.0644  49  TYR L N   
3267 C CA  . TYR C 49  ? 0.2212 0.3144 0.1856 0.0663  0.0240  0.0617  49  TYR L CA  
3268 C C   . TYR C 49  ? 0.2086 0.3076 0.1680 0.0710  0.0253  0.0672  49  TYR L C   
3269 O O   . TYR C 49  ? 0.2279 0.3149 0.1760 0.0733  0.0302  0.0729  49  TYR L O   
3270 C CB  . TYR C 49  ? 0.2200 0.3217 0.1901 0.0598  0.0220  0.0544  49  TYR L CB  
3271 C CG  . TYR C 49  ? 0.2440 0.3439 0.2090 0.0535  0.0268  0.0538  49  TYR L CG  
3272 C CD1 . TYR C 49  ? 0.2716 0.3603 0.2317 0.0471  0.0313  0.0520  49  TYR L CD1 
3273 C CD2 . TYR C 49  ? 0.2700 0.3800 0.2340 0.0524  0.0271  0.0544  49  TYR L CD2 
3274 C CE1 . TYR C 49  ? 0.2996 0.3877 0.2534 0.0382  0.0365  0.0502  49  TYR L CE1 
3275 C CE2 . TYR C 49  ? 0.2956 0.4045 0.2533 0.0447  0.0321  0.0534  49  TYR L CE2 
3276 C CZ  . TYR C 49  ? 0.3150 0.4132 0.2674 0.0368  0.0370  0.0510  49  TYR L CZ  
3277 O OH  . TYR C 49  ? 0.3643 0.4627 0.3090 0.0268  0.0426  0.0493  49  TYR L OH  
3278 N N   . TYR C 50  ? 0.1998 0.3157 0.1656 0.0723  0.0211  0.0653  50  TYR L N   
3279 C CA  . TYR C 50  ? 0.2000 0.3264 0.1628 0.0779  0.0212  0.0699  50  TYR L CA  
3280 C C   . TYR C 50  ? 0.2106 0.3311 0.1656 0.0871  0.0234  0.0764  50  TYR L C   
3281 O O   . TYR C 50  ? 0.2247 0.3422 0.1695 0.0936  0.0262  0.0824  50  TYR L O   
3282 C CB  . TYR C 50  ? 0.2172 0.3427 0.1745 0.0749  0.0243  0.0715  50  TYR L CB  
3283 C CG  . TYR C 50  ? 0.2085 0.3432 0.1726 0.0674  0.0223  0.0646  50  TYR L CG  
3284 C CD1 . TYR C 50  ? 0.2011 0.3477 0.1747 0.0663  0.0167  0.0581  50  TYR L CD1 
3285 C CD2 . TYR C 50  ? 0.2200 0.3513 0.1788 0.0614  0.0263  0.0643  50  TYR L CD2 
3286 C CE1 . TYR C 50  ? 0.2024 0.3573 0.1804 0.0620  0.0146  0.0513  50  TYR L CE1 
3287 C CE2 . TYR C 50  ? 0.2129 0.3570 0.1780 0.0556  0.0244  0.0572  50  TYR L CE2 
3288 C CZ  . TYR C 50  ? 0.2063 0.3627 0.1813 0.0572  0.0182  0.0507  50  TYR L CZ  
3289 O OH  . TYR C 50  ? 0.2103 0.3790 0.1898 0.0538  0.0161  0.0431  50  TYR L OH  
3290 N N   . ALA C 51  ? 0.2095 0.3280 0.1674 0.0888  0.0222  0.0751  51  ALA L N   
3291 C CA  . ALA C 51  ? 0.2217 0.3393 0.1739 0.0986  0.0232  0.0794  51  ALA L CA  
3292 C C   . ALA C 51  ? 0.2494 0.3425 0.1871 0.1037  0.0286  0.0850  51  ALA L C   
3293 O O   . ALA C 51  ? 0.2628 0.3495 0.1968 0.1099  0.0294  0.0864  51  ALA L O   
3294 C CB  . ALA C 51  ? 0.2225 0.3613 0.1743 0.1063  0.0215  0.0816  51  ALA L CB  
3295 N N   . SER C 52  ? 0.2608 0.3397 0.1886 0.1010  0.0326  0.0879  52  SER L N   
3296 C CA  . SER C 52  ? 0.2913 0.3425 0.1995 0.1057  0.0386  0.0939  52  SER L CA  
3297 C C   . SER C 52  ? 0.3143 0.3453 0.2150 0.0932  0.0437  0.0926  52  SER L C   
3298 O O   . SER C 52  ? 0.3480 0.3515 0.2293 0.0948  0.0496  0.0971  52  SER L O   
3299 C CB  . SER C 52  ? 0.3037 0.3553 0.1984 0.1181  0.0396  0.1008  52  SER L CB  
3300 O OG  . SER C 52  ? 0.3065 0.3647 0.2011 0.1123  0.0400  0.1012  52  SER L OG  
3301 N N   . ASN C 53  ? 0.3036 0.3471 0.2164 0.0816  0.0420  0.0866  53  ASN L N   
3302 C CA  . ASN C 53  ? 0.3354 0.3671 0.2419 0.0685  0.0470  0.0838  53  ASN L CA  
3303 C C   . ASN C 53  ? 0.3131 0.3364 0.2234 0.0613  0.0482  0.0785  53  ASN L C   
3304 O O   . ASN C 53  ? 0.2990 0.3386 0.2258 0.0600  0.0429  0.0726  53  ASN L O   
3305 C CB  . ASN C 53  ? 0.3490 0.4024 0.2668 0.0609  0.0443  0.0785  53  ASN L CB  
3306 C CG  . ASN C 53  ? 0.4277 0.4880 0.3399 0.0654  0.0444  0.0833  53  ASN L CG  
3307 O OD1 . ASN C 53  ? 0.4944 0.5542 0.4010 0.0773  0.0434  0.0895  53  ASN L OD1 
3308 N ND2 . ASN C 53  ? 0.4496 0.5194 0.3632 0.0566  0.0455  0.0800  53  ASN L ND2 
3309 N N   . ARG C 54  ? 0.3286 0.3258 0.2223 0.0570  0.0550  0.0805  54  ARG L N   
3310 C CA  . ARG C 54  ? 0.3455 0.3361 0.2420 0.0477  0.0570  0.0744  54  ARG L CA  
3311 C C   . ARG C 54  ? 0.3237 0.3319 0.2302 0.0341  0.0567  0.0658  54  ARG L C   
3312 O O   . ARG C 54  ? 0.3203 0.3298 0.2197 0.0266  0.0603  0.0655  54  ARG L O   
3313 C CB  . ARG C 54  ? 0.3870 0.3435 0.2604 0.0445  0.0653  0.0780  54  ARG L CB  
3314 C CG  . ARG C 54  ? 0.4187 0.3600 0.2853 0.0584  0.0647  0.0833  54  ARG L CG  
3315 C CD  . ARG C 54  ? 0.4668 0.3723 0.3099 0.0546  0.0728  0.0853  54  ARG L CD  
3316 N NE  . ARG C 54  ? 0.5252 0.4051 0.3422 0.0527  0.0797  0.0910  54  ARG L NE  
3317 C CZ  . ARG C 54  ? 0.5754 0.4389 0.3745 0.0678  0.0805  0.0997  54  ARG L CZ  
3318 N NH1 . ARG C 54  ? 0.6114 0.4486 0.3838 0.0646  0.0872  0.1048  54  ARG L NH1 
3319 N NH2 . ARG C 54  ? 0.5638 0.4383 0.3704 0.0858  0.0746  0.1028  54  ARG L NH2 
3320 N N   . TYR C 55  ? 0.3035 0.3249 0.2244 0.0316  0.0528  0.0587  55  TYR L N   
3321 C CA  . TYR C 55  ? 0.3013 0.3408 0.2310 0.0206  0.0523  0.0488  55  TYR L CA  
3322 C C   . TYR C 55  ? 0.3212 0.3456 0.2365 0.0066  0.0611  0.0463  55  TYR L C   
3323 O O   . TYR C 55  ? 0.3333 0.3311 0.2339 0.0062  0.0665  0.0509  55  TYR L O   
3324 C CB  . TYR C 55  ? 0.2764 0.3307 0.2220 0.0249  0.0453  0.0429  55  TYR L CB  
3325 C CG  . TYR C 55  ? 0.2692 0.3452 0.2236 0.0179  0.0433  0.0323  55  TYR L CG  
3326 C CD1 . TYR C 55  ? 0.2656 0.3634 0.2277 0.0192  0.0389  0.0281  55  TYR L CD1 
3327 C CD2 . TYR C 55  ? 0.2916 0.3682 0.2463 0.0109  0.0455  0.0258  55  TYR L CD2 
3328 C CE1 . TYR C 55  ? 0.2626 0.3830 0.2319 0.0150  0.0367  0.0175  55  TYR L CE1 
3329 C CE2 . TYR C 55  ? 0.2859 0.3865 0.2481 0.0056  0.0436  0.0151  55  TYR L CE2 
3330 C CZ  . TYR C 55  ? 0.2744 0.3973 0.2437 0.0083  0.0391  0.0109  55  TYR L CZ  
3331 O OH  . TYR C 55  ? 0.2878 0.4367 0.2637 0.0053  0.0369  -0.0003 55  TYR L OH  
3332 N N   . THR C 56  ? 0.3472 0.3891 0.2649 -0.0052 0.0630  0.0386  56  THR L N   
3333 C CA  . THR C 56  ? 0.3891 0.4234 0.2939 -0.0226 0.0719  0.0334  56  THR L CA  
3334 C C   . THR C 56  ? 0.3768 0.3942 0.2770 -0.0253 0.0748  0.0319  56  THR L C   
3335 O O   . THR C 56  ? 0.3560 0.3894 0.2718 -0.0206 0.0690  0.0265  56  THR L O   
3336 C CB  . THR C 56  ? 0.4201 0.4887 0.3362 -0.0329 0.0707  0.0213  56  THR L CB  
3337 O OG1 . THR C 56  ? 0.4802 0.5672 0.4028 -0.0285 0.0667  0.0220  56  THR L OG1 
3338 C CG2 . THR C 56  ? 0.4575 0.5204 0.3583 -0.0538 0.0810  0.0156  56  THR L CG2 
3339 N N   . GLY C 57  ? 0.4093 0.3938 0.2868 -0.0327 0.0838  0.0363  57  GLY L N   
3340 C CA  . GLY C 57  ? 0.4248 0.3910 0.2940 -0.0390 0.0887  0.0337  57  GLY L CA  
3341 C C   . GLY C 57  ? 0.4311 0.3797 0.3014 -0.0227 0.0849  0.0408  57  GLY L C   
3342 O O   . GLY C 57  ? 0.4546 0.3857 0.3174 -0.0258 0.0886  0.0395  57  GLY L O   
3343 N N   . VAL C 58  ? 0.4007 0.3536 0.2786 -0.0064 0.0783  0.0479  58  VAL L N   
3344 C CA  . VAL C 58  ? 0.3979 0.3383 0.2767 0.0088  0.0748  0.0541  58  VAL L CA  
3345 C C   . VAL C 58  ? 0.4368 0.3382 0.2880 0.0115  0.0824  0.0619  58  VAL L C   
3346 O O   . VAL C 58  ? 0.4399 0.3274 0.2749 0.0113  0.0863  0.0673  58  VAL L O   
3347 C CB  . VAL C 58  ? 0.3700 0.3306 0.2650 0.0235  0.0658  0.0577  58  VAL L CB  
3348 C CG1 . VAL C 58  ? 0.3574 0.3070 0.2504 0.0383  0.0634  0.0640  58  VAL L CG1 
3349 C CG2 . VAL C 58  ? 0.3302 0.3223 0.2477 0.0218  0.0585  0.0497  58  VAL L CG2 
3350 N N   . PRO C 59  ? 0.4543 0.3345 0.2968 0.0150  0.0849  0.0630  59  PRO L N   
3351 C CA  . PRO C 59  ? 0.5066 0.3463 0.3194 0.0204  0.0919  0.0705  59  PRO L CA  
3352 C C   . PRO C 59  ? 0.5048 0.3391 0.3106 0.0402  0.0885  0.0804  59  PRO L C   
3353 O O   . PRO C 59  ? 0.4627 0.3237 0.2887 0.0522  0.0802  0.0816  59  PRO L O   
3354 C CB  . PRO C 59  ? 0.5166 0.3415 0.3262 0.0223  0.0933  0.0684  59  PRO L CB  
3355 C CG  . PRO C 59  ? 0.4840 0.3400 0.3193 0.0124  0.0891  0.0585  59  PRO L CG  
3356 C CD  . PRO C 59  ? 0.4520 0.3437 0.3097 0.0142  0.0816  0.0569  59  PRO L CD  
3357 N N   . ASP C 60  ? 0.5540 0.3522 0.3285 0.0427  0.0956  0.0871  60  ASP L N   
3358 C CA  . ASP C 60  ? 0.5950 0.3798 0.3534 0.0623  0.0944  0.0970  60  ASP L CA  
3359 C C   . ASP C 60  ? 0.5504 0.3441 0.3169 0.0837  0.0881  0.0999  60  ASP L C   
3360 O O   . ASP C 60  ? 0.5322 0.3314 0.2949 0.1009  0.0845  0.1062  60  ASP L O   
3361 C CB  . ASP C 60  ? 0.7062 0.4383 0.4226 0.0647  0.1038  0.1030  60  ASP L CB  
3362 C CG  . ASP C 60  ? 0.8098 0.5205 0.5043 0.0467  0.1122  0.1032  60  ASP L CG  
3363 O OD1 . ASP C 60  ? 0.8696 0.6108 0.5837 0.0340  0.1101  0.0987  60  ASP L OD1 
3364 O OD2 . ASP C 60  ? 0.9107 0.5741 0.5673 0.0462  0.1208  0.1078  60  ASP L OD2 
3365 N N   . ARG C 61  ? 0.5256 0.3167 0.2981 0.0833  0.0878  0.0958  61  ARG L N   
3366 C CA  . ARG C 61  ? 0.5080 0.3068 0.2858 0.1032  0.0826  0.0980  61  ARG L CA  
3367 C C   . ARG C 61  ? 0.4607 0.3059 0.2702 0.1089  0.0730  0.0961  61  ARG L C   
3368 O O   . ARG C 61  ? 0.4496 0.3080 0.2633 0.1258  0.0683  0.0982  61  ARG L O   
3369 C CB  . ARG C 61  ? 0.5033 0.2888 0.2799 0.0995  0.0849  0.0934  61  ARG L CB  
3370 C CG  . ARG C 61  ? 0.4731 0.2825 0.2756 0.0822  0.0827  0.0846  61  ARG L CG  
3371 C CD  . ARG C 61  ? 0.4773 0.2730 0.2767 0.0813  0.0849  0.0809  61  ARG L CD  
3372 N NE  . ARG C 61  ? 0.4498 0.2661 0.2708 0.0665  0.0830  0.0726  61  ARG L NE  
3373 C CZ  . ARG C 61  ? 0.4655 0.2766 0.2843 0.0473  0.0880  0.0667  61  ARG L CZ  
3374 N NH1 . ARG C 61  ? 0.5106 0.2957 0.3062 0.0380  0.0958  0.0682  61  ARG L NH1 
3375 N NH2 . ARG C 61  ? 0.4476 0.2807 0.2861 0.0371  0.0853  0.0588  61  ARG L NH2 
3376 N N   . PHE C 62  ? 0.4324 0.3021 0.2619 0.0955  0.0701  0.0917  62  PHE L N   
3377 C CA  . PHE C 62  ? 0.3912 0.3002 0.2474 0.0984  0.0617  0.0894  62  PHE L CA  
3378 C C   . PHE C 62  ? 0.3975 0.3160 0.2505 0.1046  0.0602  0.0942  62  PHE L C   
3379 O O   . PHE C 62  ? 0.3962 0.3053 0.2409 0.0953  0.0640  0.0949  62  PHE L O   
3380 C CB  . PHE C 62  ? 0.3691 0.2977 0.2463 0.0827  0.0590  0.0816  62  PHE L CB  
3381 C CG  . PHE C 62  ? 0.3672 0.2911 0.2497 0.0765  0.0597  0.0762  62  PHE L CG  
3382 C CD1 . PHE C 62  ? 0.3676 0.3031 0.2608 0.0838  0.0552  0.0750  62  PHE L CD1 
3383 C CD2 . PHE C 62  ? 0.3975 0.3051 0.2722 0.0628  0.0655  0.0722  62  PHE L CD2 
3384 C CE1 . PHE C 62  ? 0.3689 0.3005 0.2667 0.0780  0.0558  0.0701  62  PHE L CE1 
3385 C CE2 . PHE C 62  ? 0.4091 0.3137 0.2883 0.0572  0.0662  0.0669  62  PHE L CE2 
3386 C CZ  . PHE C 62  ? 0.3816 0.2976 0.2724 0.0653  0.0612  0.0662  62  PHE L CZ  
3387 N N   . THR C 63  ? 0.3894 0.3264 0.2472 0.1195  0.0554  0.0970  63  THR L N   
3388 C CA  . THR C 63  ? 0.3975 0.3505 0.2557 0.1259  0.0529  0.1006  63  THR L CA  
3389 C C   . THR C 63  ? 0.3599 0.3510 0.2416 0.1282  0.0455  0.0969  63  THR L C   
3390 O O   . THR C 63  ? 0.3393 0.3406 0.2314 0.1293  0.0428  0.0933  63  THR L O   
3391 C CB  . THR C 63  ? 0.4379 0.3732 0.2713 0.1437  0.0556  0.1084  63  THR L CB  
3392 O OG1 . THR C 63  ? 0.4304 0.3727 0.2631 0.1595  0.0530  0.1089  63  THR L OG1 
3393 C CG2 . THR C 63  ? 0.4890 0.3804 0.2931 0.1404  0.0638  0.1127  63  THR L CG2 
3394 N N   . GLY C 64  ? 0.3313 0.3419 0.2191 0.1284  0.0427  0.0977  64  GLY L N   
3395 C CA  . GLY C 64  ? 0.2976 0.3431 0.2034 0.1301  0.0365  0.0943  64  GLY L CA  
3396 C C   . GLY C 64  ? 0.3009 0.3604 0.2012 0.1402  0.0354  0.0985  64  GLY L C   
3397 O O   . GLY C 64  ? 0.3078 0.3506 0.1939 0.1415  0.0389  0.1032  64  GLY L O   
3398 N N   . SER C 65  ? 0.2852 0.3751 0.1955 0.1463  0.0309  0.0964  65  SER L N   
3399 C CA  . SER C 65  ? 0.3050 0.4154 0.2124 0.1559  0.0292  0.0990  65  SER L CA  
3400 C C   . SER C 65  ? 0.2759 0.4231 0.2019 0.1503  0.0242  0.0926  65  SER L C   
3401 O O   . SER C 65  ? 0.2624 0.4165 0.1990 0.1430  0.0224  0.0873  65  SER L O   
3402 C CB  . SER C 65  ? 0.3399 0.4465 0.2295 0.1766  0.0305  0.1046  65  SER L CB  
3403 O OG  . SER C 65  ? 0.3554 0.4796 0.2511 0.1832  0.0281  0.1009  65  SER L OG  
3404 N N   . GLY C 66  ? 0.2675 0.4361 0.1946 0.1539  0.0224  0.0932  66  GLY L N   
3405 C CA  . GLY C 66  ? 0.2488 0.4544 0.1893 0.1501  0.0184  0.0872  66  GLY L CA  
3406 C C   . GLY C 66  ? 0.2372 0.4515 0.1851 0.1392  0.0169  0.0849  66  GLY L C   
3407 O O   . GLY C 66  ? 0.2333 0.4264 0.1798 0.1318  0.0184  0.0863  66  GLY L O   
3408 N N   . TYR C 67  ? 0.2145 0.4614 0.1692 0.1383  0.0142  0.0807  67  TYR L N   
3409 C CA  . TYR C 67  ? 0.2070 0.4664 0.1689 0.1278  0.0125  0.0771  67  TYR L CA  
3410 C C   . TYR C 67  ? 0.2046 0.4980 0.1744 0.1223  0.0100  0.0697  67  TYR L C   
3411 O O   . TYR C 67  ? 0.2106 0.5279 0.1781 0.1330  0.0097  0.0700  67  TYR L O   
3412 C CB  . TYR C 67  ? 0.2110 0.4716 0.1649 0.1370  0.0135  0.0828  67  TYR L CB  
3413 C CG  . TYR C 67  ? 0.2039 0.4700 0.1637 0.1266  0.0123  0.0800  67  TYR L CG  
3414 C CD1 . TYR C 67  ? 0.2074 0.4498 0.1646 0.1213  0.0139  0.0823  67  TYR L CD1 
3415 C CD2 . TYR C 67  ? 0.1933 0.4887 0.1610 0.1206  0.0097  0.0738  67  TYR L CD2 
3416 C CE1 . TYR C 67  ? 0.2056 0.4542 0.1684 0.1124  0.0126  0.0789  67  TYR L CE1 
3417 C CE2 . TYR C 67  ? 0.2000 0.4983 0.1720 0.1112  0.0086  0.0706  67  TYR L CE2 
3418 C CZ  . TYR C 67  ? 0.1961 0.4714 0.1661 0.1079  0.0098  0.0732  67  TYR L CZ  
3419 O OH  . TYR C 67  ? 0.2057 0.4849 0.1796 0.1001  0.0085  0.0696  67  TYR L OH  
3420 N N   . GLY C 68  ? 0.2029 0.4973 0.1796 0.1065  0.0086  0.0632  68  GLY L N   
3421 C CA  . GLY C 68  ? 0.1928 0.5167 0.1740 0.0975  0.0073  0.0553  68  GLY L CA  
3422 C C   . GLY C 68  ? 0.1912 0.5071 0.1737 0.0884  0.0075  0.0511  68  GLY L C   
3423 O O   . GLY C 68  ? 0.1922 0.4811 0.1744 0.0792  0.0071  0.0500  68  GLY L O   
3424 N N   . THR C 69  ? 0.1901 0.5268 0.1730 0.0920  0.0079  0.0489  69  THR L N   
3425 C CA  . THR C 69  ? 0.1887 0.5193 0.1720 0.0809  0.0083  0.0441  69  THR L CA  
3426 C C   . THR C 69  ? 0.2055 0.5194 0.1873 0.0914  0.0093  0.0489  69  THR L C   
3427 O O   . THR C 69  ? 0.2104 0.5077 0.1921 0.0828  0.0096  0.0467  69  THR L O   
3428 C CB  . THR C 69  ? 0.1879 0.5558 0.1725 0.0725  0.0087  0.0359  69  THR L CB  
3429 O OG1 . THR C 69  ? 0.1783 0.5759 0.1639 0.0893  0.0087  0.0377  69  THR L OG1 
3430 C CG2 . THR C 69  ? 0.1810 0.5622 0.1649 0.0582  0.0084  0.0297  69  THR L CG2 
3431 N N   . ASP C 70  ? 0.2188 0.5361 0.1974 0.1096  0.0099  0.0549  70  ASP L N   
3432 C CA  . ASP C 70  ? 0.2409 0.5503 0.2161 0.1208  0.0110  0.0577  70  ASP L CA  
3433 C C   . ASP C 70  ? 0.2432 0.5153 0.2116 0.1298  0.0127  0.0658  70  ASP L C   
3434 O O   . ASP C 70  ? 0.2446 0.5117 0.2064 0.1406  0.0134  0.0714  70  ASP L O   
3435 C CB  . ASP C 70  ? 0.2769 0.6224 0.2501 0.1359  0.0106  0.0567  70  ASP L CB  
3436 C CG  . ASP C 70  ? 0.2968 0.6847 0.2763 0.1258  0.0097  0.0471  70  ASP L CG  
3437 O OD1 . ASP C 70  ? 0.3058 0.6914 0.2892 0.1060  0.0099  0.0415  70  ASP L OD1 
3438 O OD2 . ASP C 70  ? 0.3592 0.7836 0.3380 0.1379  0.0090  0.0450  70  ASP L OD2 
3439 N N   . PHE C 71  ? 0.2362 0.4819 0.2049 0.1239  0.0136  0.0660  71  PHE L N   
3440 C CA  . PHE C 71  ? 0.2370 0.4466 0.1995 0.1270  0.0159  0.0718  71  PHE L CA  
3441 C C   . PHE C 71  ? 0.2502 0.4449 0.2073 0.1345  0.0177  0.0736  71  PHE L C   
3442 O O   . PHE C 71  ? 0.2578 0.4621 0.2197 0.1304  0.0169  0.0692  71  PHE L O   
3443 C CB  . PHE C 71  ? 0.2205 0.4119 0.1880 0.1119  0.0152  0.0695  71  PHE L CB  
3444 C CG  . PHE C 71  ? 0.2070 0.4111 0.1782 0.1057  0.0134  0.0675  71  PHE L CG  
3445 C CD1 . PHE C 71  ? 0.2112 0.4063 0.1788 0.1089  0.0144  0.0716  71  PHE L CD1 
3446 C CD2 . PHE C 71  ? 0.1916 0.4150 0.1682 0.0954  0.0112  0.0611  71  PHE L CD2 
3447 C CE1 . PHE C 71  ? 0.1967 0.4042 0.1678 0.1035  0.0127  0.0694  71  PHE L CE1 
3448 C CE2 . PHE C 71  ? 0.1935 0.4268 0.1720 0.0897  0.0098  0.0589  71  PHE L CE2 
3449 C CZ  . PHE C 71  ? 0.1848 0.4107 0.1615 0.0944  0.0103  0.0630  71  PHE L CZ  
3450 N N   . THR C 72  ? 0.2647 0.4339 0.2104 0.1441  0.0206  0.0798  72  THR L N   
3451 C CA  . THR C 72  ? 0.2841 0.4339 0.2210 0.1526  0.0231  0.0821  72  THR L CA  
3452 C C   . THR C 72  ? 0.2958 0.4092 0.2275 0.1451  0.0264  0.0844  72  THR L C   
3453 O O   . THR C 72  ? 0.2869 0.3854 0.2112 0.1446  0.0284  0.0884  72  THR L O   
3454 C CB  . THR C 72  ? 0.3302 0.4826 0.2524 0.1736  0.0242  0.0870  72  THR L CB  
3455 O OG1 . THR C 72  ? 0.3232 0.5167 0.2525 0.1790  0.0209  0.0832  72  THR L OG1 
3456 C CG2 . THR C 72  ? 0.3616 0.4945 0.2727 0.1841  0.0266  0.0887  72  THR L CG2 
3457 N N   . PHE C 73  ? 0.2818 0.3820 0.2155 0.1401  0.0273  0.0821  73  PHE L N   
3458 C CA  . PHE C 73  ? 0.2932 0.3608 0.2207 0.1336  0.0310  0.0834  73  PHE L CA  
3459 C C   . PHE C 73  ? 0.3170 0.3658 0.2308 0.1449  0.0343  0.0860  73  PHE L C   
3460 O O   . PHE C 73  ? 0.3237 0.3868 0.2412 0.1510  0.0326  0.0836  73  PHE L O   
3461 C CB  . PHE C 73  ? 0.2883 0.3569 0.2290 0.1184  0.0291  0.0776  73  PHE L CB  
3462 C CG  . PHE C 73  ? 0.2971 0.3398 0.2340 0.1109  0.0324  0.0768  73  PHE L CG  
3463 C CD1 . PHE C 73  ? 0.3153 0.3479 0.2513 0.1022  0.0340  0.0765  73  PHE L CD1 
3464 C CD2 . PHE C 73  ? 0.3045 0.3360 0.2393 0.1116  0.0339  0.0754  73  PHE L CD2 
3465 C CE1 . PHE C 73  ? 0.3250 0.3389 0.2581 0.0938  0.0372  0.0742  73  PHE L CE1 
3466 C CE2 . PHE C 73  ? 0.3048 0.3164 0.2373 0.1030  0.0368  0.0734  73  PHE L CE2 
3467 C CZ  . PHE C 73  ? 0.3239 0.3273 0.2554 0.0941  0.0386  0.0726  73  PHE L CZ  
3468 N N   . THR C 74  ? 0.3371 0.3549 0.2340 0.1473  0.0392  0.0904  74  THR L N   
3469 C CA  . THR C 74  ? 0.3728 0.3652 0.2509 0.1588  0.0432  0.0935  74  THR L CA  
3470 C C   . THR C 74  ? 0.4010 0.3603 0.2711 0.1468  0.0485  0.0927  74  THR L C   
3471 O O   . THR C 74  ? 0.4016 0.3489 0.2687 0.1355  0.0511  0.0933  74  THR L O   
3472 C CB  . THR C 74  ? 0.4131 0.3956 0.2700 0.1766  0.0450  0.1002  74  THR L CB  
3473 O OG1 . THR C 74  ? 0.3952 0.4153 0.2624 0.1863  0.0398  0.0992  74  THR L OG1 
3474 C CG2 . THR C 74  ? 0.4428 0.3961 0.2771 0.1904  0.0490  0.1030  74  THR L CG2 
3475 N N   . ILE C 75  ? 0.3930 0.3402 0.2597 0.1484  0.0501  0.0907  75  ILE L N   
3476 C CA  . ILE C 75  ? 0.4283 0.3387 0.2793 0.1413  0.0566  0.0907  75  ILE L CA  
3477 C C   . ILE C 75  ? 0.4740 0.3579 0.2983 0.1593  0.0603  0.0958  75  ILE L C   
3478 O O   . ILE C 75  ? 0.4744 0.3692 0.3007 0.1722  0.0578  0.0946  75  ILE L O   
3479 C CB  . ILE C 75  ? 0.4092 0.3234 0.2742 0.1298  0.0559  0.0843  75  ILE L CB  
3480 C CG1 . ILE C 75  ? 0.3766 0.3230 0.2673 0.1195  0.0500  0.0796  75  ILE L CG1 
3481 C CG2 . ILE C 75  ? 0.4257 0.3084 0.2781 0.1173  0.0626  0.0826  75  ILE L CG2 
3482 C CD1 . ILE C 75  ? 0.3654 0.3139 0.2672 0.1096  0.0491  0.0737  75  ILE L CD1 
3483 N N   . SER C 76  ? 0.5097 0.3622 0.3094 0.1608  0.0658  0.1010  76  SER L N   
3484 C CA  . SER C 76  ? 0.5677 0.3879 0.3347 0.1799  0.0698  0.1071  76  SER L CA  
3485 C C   . SER C 76  ? 0.5874 0.3843 0.3433 0.1832  0.0730  0.1047  76  SER L C   
3486 O O   . SER C 76  ? 0.6142 0.4129 0.3609 0.2046  0.0709  0.1061  76  SER L O   
3487 C CB  . SER C 76  ? 0.6069 0.3926 0.3473 0.1761  0.0760  0.1126  76  SER L CB  
3488 O OG  . SER C 76  ? 0.6365 0.3940 0.3690 0.1549  0.0829  0.1097  76  SER L OG  
3489 N N   . THR C 77  ? 0.5671 0.3487 0.3262 0.1634  0.0771  0.1001  77  THR L N   
3490 C CA  . THR C 77  ? 0.5842 0.3365 0.3287 0.1626  0.0819  0.0975  77  THR L CA  
3491 C C   . THR C 77  ? 0.5491 0.3211 0.3204 0.1417  0.0806  0.0897  77  THR L C   
3492 O O   . THR C 77  ? 0.5339 0.2964 0.3052 0.1219  0.0847  0.0871  77  THR L O   
3493 C CB  . THR C 77  ? 0.6503 0.3468 0.3554 0.1599  0.0917  0.1010  77  THR L CB  
3494 O OG1 . THR C 77  ? 0.6779 0.3691 0.3848 0.1368  0.0957  0.0996  77  THR L OG1 
3495 C CG2 . THR C 77  ? 0.6905 0.3612 0.3633 0.1825  0.0932  0.1094  77  THR L CG2 
3496 N N   . VAL C 78  ? 0.5112 0.3147 0.3055 0.1460  0.0745  0.0860  78  VAL L N   
3497 C CA  . VAL C 78  ? 0.4851 0.3115 0.3058 0.1283  0.0718  0.0791  78  VAL L CA  
3498 C C   . VAL C 78  ? 0.5112 0.3096 0.3210 0.1156  0.0783  0.0749  78  VAL L C   
3499 O O   . VAL C 78  ? 0.5381 0.3065 0.3256 0.1241  0.0830  0.0762  78  VAL L O   
3500 C CB  . VAL C 78  ? 0.4611 0.3245 0.3051 0.1352  0.0644  0.0763  78  VAL L CB  
3501 C CG1 . VAL C 78  ? 0.4914 0.3464 0.3279 0.1460  0.0653  0.0748  78  VAL L CG1 
3502 C CG2 . VAL C 78  ? 0.4359 0.3239 0.3054 0.1183  0.0605  0.0705  78  VAL L CG2 
3503 N N   . GLN C 79  ? 0.5008 0.3095 0.3252 0.0962  0.0786  0.0693  79  GLN L N   
3504 C CA  . GLN C 79  ? 0.5075 0.2981 0.3257 0.0812  0.0844  0.0634  79  GLN L CA  
3505 C C   . GLN C 79  ? 0.4530 0.2723 0.2967 0.0764  0.0789  0.0572  79  GLN L C   
3506 O O   . GLN C 79  ? 0.4167 0.2674 0.2816 0.0790  0.0717  0.0571  79  GLN L O   
3507 C CB  . GLN C 79  ? 0.5372 0.3206 0.3509 0.0615  0.0895  0.0602  79  GLN L CB  
3508 C CG  . GLN C 79  ? 0.5885 0.3462 0.3781 0.0618  0.0949  0.0660  79  GLN L CG  
3509 C CD  . GLN C 79  ? 0.6600 0.3714 0.4150 0.0682  0.1027  0.0696  79  GLN L CD  
3510 O OE1 . GLN C 79  ? 0.7069 0.3920 0.4456 0.0547  0.1104  0.0652  79  GLN L OE1 
3511 N NE2 . GLN C 79  ? 0.7110 0.4119 0.4528 0.0895  0.1008  0.0772  79  GLN L NE2 
3512 N N   . ALA C 80  ? 0.4625 0.2687 0.3013 0.0697  0.0828  0.0523  80  ALA L N   
3513 C CA  . ALA C 80  ? 0.4412 0.2692 0.2997 0.0649  0.0787  0.0462  80  ALA L CA  
3514 C C   . ALA C 80  ? 0.4226 0.2815 0.3034 0.0551  0.0733  0.0427  80  ALA L C   
3515 O O   . ALA C 80  ? 0.4004 0.2850 0.2997 0.0589  0.0662  0.0417  80  ALA L O   
3516 C CB  . ALA C 80  ? 0.4510 0.2566 0.2971 0.0549  0.0856  0.0409  80  ALA L CB  
3517 N N   . GLU C 81  ? 0.4305 0.2867 0.3074 0.0440  0.0763  0.0414  81  GLU L N   
3518 C CA  . GLU C 81  ? 0.4196 0.3038 0.3148 0.0349  0.0717  0.0367  81  GLU L CA  
3519 C C   . GLU C 81  ? 0.4049 0.3088 0.3118 0.0439  0.0647  0.0413  81  GLU L C   
3520 O O   . GLU C 81  ? 0.3929 0.3187 0.3136 0.0389  0.0602  0.0377  81  GLU L O   
3521 C CB  . GLU C 81  ? 0.4525 0.3298 0.3390 0.0187  0.0781  0.0318  81  GLU L CB  
3522 C CG  . GLU C 81  ? 0.4899 0.3455 0.3574 0.0181  0.0837  0.0374  81  GLU L CG  
3523 C CD  . GLU C 81  ? 0.5515 0.3671 0.3908 0.0146  0.0934  0.0389  81  GLU L CD  
3524 O OE1 . GLU C 81  ? 0.5120 0.3132 0.3454 0.0204  0.0947  0.0387  81  GLU L OE1 
3525 O OE2 . GLU C 81  ? 0.5780 0.3738 0.3984 0.0063  0.1002  0.0404  81  GLU L OE2 
3526 N N   . ASP C 82  ? 0.3923 0.2905 0.2935 0.0573  0.0636  0.0483  82  ASP L N   
3527 C CA  . ASP C 82  ? 0.3678 0.2856 0.2789 0.0649  0.0576  0.0522  82  ASP L CA  
3528 C C   . ASP C 82  ? 0.3603 0.2995 0.2865 0.0700  0.0509  0.0510  82  ASP L C   
3529 O O   . ASP C 82  ? 0.3425 0.2995 0.2770 0.0745  0.0458  0.0530  82  ASP L O   
3530 C CB  . ASP C 82  ? 0.3902 0.2951 0.2869 0.0759  0.0599  0.0594  82  ASP L CB  
3531 C CG  . ASP C 82  ? 0.4027 0.2837 0.2811 0.0698  0.0669  0.0613  82  ASP L CG  
3532 O OD1 . ASP C 82  ? 0.4041 0.2876 0.2855 0.0556  0.0689  0.0567  82  ASP L OD1 
3533 O OD2 . ASP C 82  ? 0.4181 0.2777 0.2773 0.0794  0.0706  0.0671  82  ASP L OD2 
3534 N N   . LEU C 83  ? 0.3440 0.2825 0.2733 0.0680  0.0508  0.0472  83  LEU L N   
3535 C CA  . LEU C 83  ? 0.3323 0.2899 0.2739 0.0706  0.0448  0.0458  83  LEU L CA  
3536 C C   . LEU C 83  ? 0.2938 0.2678 0.2466 0.0641  0.0397  0.0429  83  LEU L C   
3537 O O   . LEU C 83  ? 0.2866 0.2596 0.2407 0.0561  0.0405  0.0388  83  LEU L O   
3538 C CB  . LEU C 83  ? 0.3640 0.3168 0.3058 0.0690  0.0460  0.0421  83  LEU L CB  
3539 C CG  . LEU C 83  ? 0.4036 0.3560 0.3492 0.0583  0.0465  0.0358  83  LEU L CG  
3540 C CD1 . LEU C 83  ? 0.4097 0.3802 0.3669 0.0557  0.0400  0.0328  83  LEU L CD1 
3541 C CD2 . LEU C 83  ? 0.4301 0.3695 0.3696 0.0581  0.0505  0.0335  83  LEU L CD2 
3542 N N   . ALA C 84  ? 0.2572 0.2457 0.2158 0.0675  0.0348  0.0446  84  ALA L N   
3543 C CA  . ALA C 84  ? 0.2534 0.2536 0.2184 0.0636  0.0301  0.0429  84  ALA L CA  
3544 C C   . ALA C 84  ? 0.2340 0.2471 0.2018 0.0671  0.0263  0.0450  84  ALA L C   
3545 O O   . ALA C 84  ? 0.2465 0.2626 0.2120 0.0732  0.0277  0.0480  84  ALA L O   
3546 C CB  . ALA C 84  ? 0.2533 0.2514 0.2162 0.0620  0.0319  0.0440  84  ALA L CB  
3547 N N   . VAL C 85  ? 0.2250 0.2454 0.1958 0.0635  0.0219  0.0432  85  VAL L N   
3548 C CA  . VAL C 85  ? 0.2242 0.2562 0.1957 0.0643  0.0191  0.0448  85  VAL L CA  
3549 C C   . VAL C 85  ? 0.2380 0.2727 0.2098 0.0656  0.0192  0.0467  85  VAL L C   
3550 O O   . VAL C 85  ? 0.2341 0.2651 0.2066 0.0628  0.0184  0.0444  85  VAL L O   
3551 C CB  . VAL C 85  ? 0.2357 0.2693 0.2058 0.0590  0.0148  0.0416  85  VAL L CB  
3552 C CG1 . VAL C 85  ? 0.2495 0.2940 0.2182 0.0572  0.0128  0.0424  85  VAL L CG1 
3553 C CG2 . VAL C 85  ? 0.2639 0.2941 0.2326 0.0573  0.0150  0.0399  85  VAL L CG2 
3554 N N   . TYR C 86  ? 0.2377 0.2806 0.2088 0.0703  0.0202  0.0502  86  TYR L N   
3555 C CA  . TYR C 86  ? 0.2434 0.2905 0.2143 0.0721  0.0203  0.0525  86  TYR L CA  
3556 C C   . TYR C 86  ? 0.2515 0.3120 0.2244 0.0692  0.0164  0.0511  86  TYR L C   
3557 O O   . TYR C 86  ? 0.2702 0.3395 0.2431 0.0681  0.0154  0.0502  86  TYR L O   
3558 C CB  . TYR C 86  ? 0.2463 0.2924 0.2124 0.0806  0.0240  0.0574  86  TYR L CB  
3559 C CG  . TYR C 86  ? 0.2471 0.2743 0.2070 0.0818  0.0287  0.0586  86  TYR L CG  
3560 C CD1 . TYR C 86  ? 0.2509 0.2703 0.2082 0.0839  0.0306  0.0579  86  TYR L CD1 
3561 C CD2 . TYR C 86  ? 0.2533 0.2697 0.2085 0.0793  0.0317  0.0596  86  TYR L CD2 
3562 C CE1 . TYR C 86  ? 0.2601 0.2600 0.2099 0.0832  0.0353  0.0581  86  TYR L CE1 
3563 C CE2 . TYR C 86  ? 0.2674 0.2647 0.2144 0.0775  0.0368  0.0598  86  TYR L CE2 
3564 C CZ  . TYR C 86  ? 0.2712 0.2592 0.2153 0.0790  0.0386  0.0587  86  TYR L CZ  
3565 O OH  . TYR C 86  ? 0.2861 0.2530 0.2196 0.0764  0.0444  0.0586  86  TYR L OH  
3566 N N   . PHE C 87  ? 0.2244 0.2866 0.1981 0.0669  0.0146  0.0503  87  PHE L N   
3567 C CA  . PHE C 87  ? 0.2287 0.3002 0.2019 0.0632  0.0112  0.0484  87  PHE L CA  
3568 C C   . PHE C 87  ? 0.2273 0.3072 0.2018 0.0660  0.0117  0.0507  87  PHE L C   
3569 O O   . PHE C 87  ? 0.2146 0.2886 0.1896 0.0676  0.0132  0.0517  87  PHE L O   
3570 C CB  . PHE C 87  ? 0.2343 0.2969 0.2046 0.0584  0.0076  0.0439  87  PHE L CB  
3571 C CG  . PHE C 87  ? 0.2455 0.2986 0.2120 0.0554  0.0064  0.0414  87  PHE L CG  
3572 C CD1 . PHE C 87  ? 0.2621 0.3152 0.2224 0.0500  0.0049  0.0397  87  PHE L CD1 
3573 C CD2 . PHE C 87  ? 0.2456 0.2898 0.2134 0.0568  0.0070  0.0401  87  PHE L CD2 
3574 C CE1 . PHE C 87  ? 0.2730 0.3155 0.2275 0.0468  0.0040  0.0377  87  PHE L CE1 
3575 C CE2 . PHE C 87  ? 0.2617 0.2976 0.2253 0.0546  0.0057  0.0378  87  PHE L CE2 
3576 C CZ  . PHE C 87  ? 0.2627 0.2969 0.2195 0.0500  0.0042  0.0370  87  PHE L CZ  
3577 N N   . CYS C 88  ? 0.2099 0.3038 0.1842 0.0651  0.0105  0.0506  88  CYS L N   
3578 C CA  . CYS C 88  ? 0.2111 0.3141 0.1863 0.0663  0.0100  0.0516  88  CYS L CA  
3579 C C   . CYS C 88  ? 0.1971 0.2978 0.1699 0.0595  0.0064  0.0470  88  CYS L C   
3580 O O   . CYS C 88  ? 0.1892 0.2837 0.1571 0.0538  0.0046  0.0435  88  CYS L O   
3581 C CB  . CYS C 88  ? 0.2196 0.3421 0.1955 0.0705  0.0110  0.0539  88  CYS L CB  
3582 S SG  . CYS C 88  ? 0.2408 0.3790 0.2152 0.0624  0.0094  0.0492  88  CYS L SG  
3583 N N   . GLN C 89  ? 0.1894 0.2933 0.1630 0.0604  0.0056  0.0468  89  GLN L N   
3584 C CA  . GLN C 89  ? 0.1978 0.2983 0.1673 0.0560  0.0022  0.0423  89  GLN L CA  
3585 C C   . GLN C 89  ? 0.1914 0.3060 0.1628 0.0569  0.0022  0.0431  89  GLN L C   
3586 O O   . GLN C 89  ? 0.1931 0.3124 0.1687 0.0615  0.0040  0.0464  89  GLN L O   
3587 C CB  . GLN C 89  ? 0.1980 0.2861 0.1668 0.0577  0.0005  0.0396  89  GLN L CB  
3588 C CG  . GLN C 89  ? 0.2213 0.3041 0.1834 0.0563  -0.0033 0.0346  89  GLN L CG  
3589 C CD  . GLN C 89  ? 0.2322 0.3166 0.1971 0.0605  -0.0045 0.0322  89  GLN L CD  
3590 O OE1 . GLN C 89  ? 0.2617 0.3439 0.2299 0.0626  -0.0038 0.0314  89  GLN L OE1 
3591 N NE2 . GLN C 89  ? 0.2492 0.3390 0.2123 0.0609  -0.0064 0.0300  89  GLN L NE2 
3592 N N   . GLN C 90  ? 0.1883 0.3080 0.1551 0.0516  0.0006  0.0400  90  GLN L N   
3593 C CA  . GLN C 90  ? 0.1935 0.3261 0.1619 0.0519  0.0002  0.0397  90  GLN L CA  
3594 C C   . GLN C 90  ? 0.1932 0.3149 0.1565 0.0508  -0.0028 0.0352  90  GLN L C   
3595 O O   . GLN C 90  ? 0.2041 0.3086 0.1582 0.0478  -0.0050 0.0312  90  GLN L O   
3596 C CB  . GLN C 90  ? 0.1980 0.3472 0.1641 0.0464  0.0008  0.0382  90  GLN L CB  
3597 C CG  . GLN C 90  ? 0.2123 0.3518 0.1672 0.0359  -0.0005 0.0323  90  GLN L CG  
3598 C CD  . GLN C 90  ? 0.2155 0.3474 0.1630 0.0327  -0.0027 0.0281  90  GLN L CD  
3599 O OE1 . GLN C 90  ? 0.2204 0.3642 0.1729 0.0362  -0.0030 0.0288  90  GLN L OE1 
3600 N NE2 . GLN C 90  ? 0.2210 0.3310 0.1541 0.0266  -0.0043 0.0235  90  GLN L NE2 
3601 N N   . ASP C 91  ? 0.1897 0.3204 0.1568 0.0538  -0.0030 0.0356  91  ASP L N   
3602 C CA  . ASP C 91  ? 0.2020 0.3264 0.1638 0.0536  -0.0062 0.0304  91  ASP L CA  
3603 C C   . ASP C 91  ? 0.2016 0.3414 0.1646 0.0523  -0.0061 0.0298  91  ASP L C   
3604 O O   . ASP C 91  ? 0.2032 0.3422 0.1645 0.0543  -0.0083 0.0263  91  ASP L O   
3605 C CB  . ASP C 91  ? 0.2053 0.3241 0.1698 0.0590  -0.0073 0.0290  91  ASP L CB  
3606 C CG  . ASP C 91  ? 0.2038 0.3365 0.1770 0.0618  -0.0049 0.0322  91  ASP L CG  
3607 O OD1 . ASP C 91  ? 0.1986 0.3368 0.1762 0.0624  -0.0013 0.0382  91  ASP L OD1 
3608 O OD2 . ASP C 91  ? 0.2179 0.3554 0.1915 0.0637  -0.0067 0.0285  91  ASP L OD2 
3609 N N   . TYR C 92  ? 0.1950 0.3502 0.1603 0.0493  -0.0041 0.0322  92  TYR L N   
3610 C CA  . TYR C 92  ? 0.1989 0.3698 0.1636 0.0466  -0.0042 0.0303  92  TYR L CA  
3611 C C   . TYR C 92  ? 0.2122 0.3704 0.1644 0.0392  -0.0065 0.0233  92  TYR L C   
3612 O O   . TYR C 92  ? 0.2255 0.3843 0.1748 0.0395  -0.0081 0.0199  92  TYR L O   
3613 C CB  . TYR C 92  ? 0.1927 0.3854 0.1619 0.0460  -0.0017 0.0336  92  TYR L CB  
3614 C CG  . TYR C 92  ? 0.2050 0.4184 0.1746 0.0435  -0.0017 0.0316  92  TYR L CG  
3615 C CD1 . TYR C 92  ? 0.1998 0.4265 0.1753 0.0503  -0.0012 0.0353  92  TYR L CD1 
3616 C CD2 . TYR C 92  ? 0.2191 0.4387 0.1818 0.0332  -0.0016 0.0258  92  TYR L CD2 
3617 C CE1 . TYR C 92  ? 0.2114 0.4590 0.1876 0.0484  -0.0012 0.0334  92  TYR L CE1 
3618 C CE2 . TYR C 92  ? 0.2363 0.4772 0.1995 0.0300  -0.0013 0.0232  92  TYR L CE2 
3619 C CZ  . TYR C 92  ? 0.2244 0.4797 0.1950 0.0382  -0.0014 0.0270  92  TYR L CZ  
3620 O OH  . TYR C 92  ? 0.2350 0.5136 0.2064 0.0356  -0.0011 0.0245  92  TYR L OH  
3621 N N   . GLY C 93  ? 0.2379 0.3835 0.1810 0.0324  -0.0061 0.0211  93  GLY L N   
3622 C CA  . GLY C 93  ? 0.2681 0.3954 0.1936 0.0234  -0.0071 0.0147  93  GLY L CA  
3623 C C   . GLY C 93  ? 0.2922 0.3896 0.2068 0.0277  -0.0100 0.0126  93  GLY L C   
3624 O O   . GLY C 93  ? 0.2972 0.3919 0.2193 0.0344  -0.0104 0.0159  93  GLY L O   
3625 N N   . SER C 94  ? 0.3071 0.3831 0.2036 0.0250  -0.0120 0.0070  94  SER L N   
3626 C CA  . SER C 94  ? 0.3370 0.3818 0.2178 0.0304  -0.0151 0.0043  94  SER L CA  
3627 C C   . SER C 94  ? 0.3522 0.3747 0.2127 0.0185  -0.0133 0.0022  94  SER L C   
3628 O O   . SER C 94  ? 0.3732 0.3953 0.2229 0.0066  -0.0110 -0.0010 94  SER L O   
3629 C CB  . SER C 94  ? 0.3698 0.4029 0.2402 0.0375  -0.0186 -0.0005 94  SER L CB  
3630 O OG  . SER C 94  ? 0.4054 0.4128 0.2625 0.0465  -0.0221 -0.0027 94  SER L OG  
3631 N N   . PRO C 95  ? 0.3272 0.3319 0.1810 0.0198  -0.0137 0.0036  95  PRO L N   
3632 C CA  . PRO C 95  ? 0.3131 0.3190 0.1786 0.0327  -0.0162 0.0064  95  PRO L CA  
3633 C C   . PRO C 95  ? 0.2805 0.3141 0.1704 0.0335  -0.0136 0.0121  95  PRO L C   
3634 O O   . PRO C 95  ? 0.2753 0.3233 0.1706 0.0249  -0.0102 0.0141  95  PRO L O   
3635 C CB  . PRO C 95  ? 0.3372 0.3121 0.1826 0.0314  -0.0171 0.0054  95  PRO L CB  
3636 C CG  . PRO C 95  ? 0.3448 0.3156 0.1789 0.0142  -0.0129 0.0048  95  PRO L CG  
3637 C CD  . PRO C 95  ? 0.3577 0.3400 0.1907 0.0074  -0.0115 0.0019  95  PRO L CD  
3638 N N   . PRO C 96  ? 0.2655 0.3067 0.1690 0.0440  -0.0150 0.0143  96  PRO L N   
3639 C CA  . PRO C 96  ? 0.2349 0.2919 0.1550 0.0448  -0.0123 0.0195  96  PRO L CA  
3640 C C   . PRO C 96  ? 0.2338 0.2795 0.1468 0.0385  -0.0108 0.0203  96  PRO L C   
3641 O O   . PRO C 96  ? 0.2369 0.2588 0.1335 0.0377  -0.0127 0.0175  96  PRO L O   
3642 C CB  . PRO C 96  ? 0.2431 0.3017 0.1716 0.0548  -0.0139 0.0196  96  PRO L CB  
3643 C CG  . PRO C 96  ? 0.2536 0.3072 0.1747 0.0604  -0.0176 0.0144  96  PRO L CG  
3644 C CD  . PRO C 96  ? 0.2722 0.3071 0.1737 0.0551  -0.0189 0.0110  96  PRO L CD  
3645 N N   . THR C 97  ? 0.2175 0.2804 0.1414 0.0351  -0.0075 0.0241  97  THR L N   
3646 C CA  . THR C 97  ? 0.2260 0.2845 0.1458 0.0288  -0.0056 0.0249  97  THR L CA  
3647 C C   . THR C 97  ? 0.2127 0.2853 0.1480 0.0342  -0.0034 0.0296  97  THR L C   
3648 O O   . THR C 97  ? 0.2167 0.3058 0.1643 0.0398  -0.0022 0.0328  97  THR L O   
3649 C CB  . THR C 97  ? 0.2419 0.3071 0.1532 0.0163  -0.0033 0.0224  97  THR L CB  
3650 O OG1 . THR C 97  ? 0.2292 0.3222 0.1535 0.0177  -0.0018 0.0241  97  THR L OG1 
3651 C CG2 . THR C 97  ? 0.2656 0.3079 0.1556 0.0093  -0.0048 0.0174  97  THR L CG2 
3652 N N   . PHE C 98  ? 0.2184 0.2826 0.1510 0.0323  -0.0027 0.0300  98  PHE L N   
3653 C CA  . PHE C 98  ? 0.2105 0.2820 0.1545 0.0377  -0.0008 0.0338  98  PHE L CA  
3654 C C   . PHE C 98  ? 0.2168 0.3010 0.1617 0.0324  0.0018  0.0344  98  PHE L C   
3655 O O   . PHE C 98  ? 0.2368 0.3155 0.1703 0.0224  0.0019  0.0310  98  PHE L O   
3656 C CB  . PHE C 98  ? 0.2147 0.2674 0.1549 0.0406  -0.0024 0.0328  98  PHE L CB  
3657 C CG  . PHE C 98  ? 0.2166 0.2623 0.1580 0.0475  -0.0049 0.0313  98  PHE L CG  
3658 C CD1 . PHE C 98  ? 0.2150 0.2678 0.1675 0.0531  -0.0035 0.0333  98  PHE L CD1 
3659 C CD2 . PHE C 98  ? 0.2323 0.2651 0.1618 0.0480  -0.0084 0.0274  98  PHE L CD2 
3660 C CE1 . PHE C 98  ? 0.2158 0.2669 0.1695 0.0580  -0.0054 0.0306  98  PHE L CE1 
3661 C CE2 . PHE C 98  ? 0.2365 0.2673 0.1672 0.0556  -0.0110 0.0249  98  PHE L CE2 
3662 C CZ  . PHE C 98  ? 0.2259 0.2684 0.1698 0.0599  -0.0095 0.0262  98  PHE L CZ  
3663 N N   . GLY C 99  ? 0.2167 0.3149 0.1722 0.0386  0.0040  0.0380  99  GLY L N   
3664 C CA  . GLY C 99  ? 0.2198 0.3295 0.1766 0.0365  0.0061  0.0381  99  GLY L CA  
3665 C C   . GLY C 99  ? 0.2437 0.3367 0.1954 0.0335  0.0059  0.0369  99  GLY L C   
3666 O O   . GLY C 99  ? 0.2429 0.3155 0.1910 0.0352  0.0040  0.0365  99  GLY L O   
3667 N N   . GLY C 100 ? 0.2399 0.3438 0.1910 0.0294  0.0077  0.0358  100 GLY L N   
3668 C CA  . GLY C 100 ? 0.2605 0.3512 0.2065 0.0257  0.0079  0.0346  100 GLY L CA  
3669 C C   . GLY C 100 ? 0.2663 0.3520 0.2203 0.0353  0.0086  0.0376  100 GLY L C   
3670 O O   . GLY C 100 ? 0.2975 0.3713 0.2479 0.0333  0.0085  0.0367  100 GLY L O   
3671 N N   . GLY C 101 ? 0.2585 0.3521 0.2211 0.0450  0.0098  0.0410  101 GLY L N   
3672 C CA  . GLY C 101 ? 0.2663 0.3512 0.2335 0.0530  0.0114  0.0436  101 GLY L CA  
3673 C C   . GLY C 101 ? 0.2535 0.3507 0.2237 0.0589  0.0139  0.0449  101 GLY L C   
3674 O O   . GLY C 101 ? 0.2695 0.3834 0.2388 0.0554  0.0142  0.0427  101 GLY L O   
3675 N N   . THR C 102 ? 0.2593 0.3483 0.2314 0.0674  0.0161  0.0479  102 THR L N   
3676 C CA  . THR C 102 ? 0.2593 0.3539 0.2315 0.0757  0.0186  0.0492  102 THR L CA  
3677 C C   . THR C 102 ? 0.2647 0.3388 0.2357 0.0764  0.0203  0.0494  102 THR L C   
3678 O O   . THR C 102 ? 0.2655 0.3246 0.2356 0.0776  0.0215  0.0510  102 THR L O   
3679 C CB  . THR C 102 ? 0.2530 0.3566 0.2239 0.0874  0.0203  0.0530  102 THR L CB  
3680 O OG1 . THR C 102 ? 0.2426 0.3688 0.2153 0.0860  0.0186  0.0519  102 THR L OG1 
3681 C CG2 . THR C 102 ? 0.2775 0.3828 0.2452 0.0981  0.0226  0.0539  102 THR L CG2 
3682 N N   . LYS C 103 ? 0.2560 0.3306 0.2270 0.0747  0.0206  0.0471  103 LYS L N   
3683 C CA  . LYS C 103 ? 0.2781 0.3355 0.2480 0.0752  0.0224  0.0466  103 LYS L CA  
3684 C C   . LYS C 103 ? 0.2916 0.3444 0.2578 0.0863  0.0261  0.0492  103 LYS L C   
3685 O O   . LYS C 103 ? 0.3207 0.3877 0.2861 0.0931  0.0265  0.0491  103 LYS L O   
3686 C CB  . LYS C 103 ? 0.3082 0.3671 0.2783 0.0686  0.0211  0.0430  103 LYS L CB  
3687 C CG  . LYS C 103 ? 0.3384 0.3810 0.3079 0.0682  0.0226  0.0418  103 LYS L CG  
3688 C CD  . LYS C 103 ? 0.3752 0.4179 0.3439 0.0617  0.0211  0.0385  103 LYS L CD  
3689 C CE  . LYS C 103 ? 0.4085 0.4369 0.3771 0.0618  0.0227  0.0369  103 LYS L CE  
3690 N NZ  . LYS C 103 ? 0.4550 0.4842 0.4223 0.0572  0.0217  0.0341  103 LYS L NZ  
3691 N N   . VAL C 104 ? 0.3030 0.3364 0.2651 0.0881  0.0290  0.0509  104 VAL L N   
3692 C CA  . VAL C 104 ? 0.3111 0.3315 0.2642 0.0983  0.0333  0.0536  104 VAL L CA  
3693 C C   . VAL C 104 ? 0.3254 0.3305 0.2764 0.0951  0.0357  0.0509  104 VAL L C   
3694 O O   . VAL C 104 ? 0.3168 0.3102 0.2687 0.0865  0.0366  0.0490  104 VAL L O   
3695 C CB  . VAL C 104 ? 0.3236 0.3301 0.2692 0.1012  0.0360  0.0575  104 VAL L CB  
3696 C CG1 . VAL C 104 ? 0.3378 0.3227 0.2689 0.1105  0.0411  0.0601  104 VAL L CG1 
3697 C CG2 . VAL C 104 ? 0.3194 0.3428 0.2668 0.1058  0.0336  0.0602  104 VAL L CG2 
3698 N N   . GLU C 105 ? 0.3584 0.3655 0.3060 0.1027  0.0369  0.0504  105 GLU L N   
3699 C CA  . GLU C 105 ? 0.3872 0.3831 0.3327 0.1010  0.0391  0.0474  105 GLU L CA  
3700 C C   . GLU C 105 ? 0.3734 0.3496 0.3046 0.1124  0.0440  0.0495  105 GLU L C   
3701 O O   . GLU C 105 ? 0.3926 0.3724 0.3167 0.1251  0.0442  0.0530  105 GLU L O   
3702 C CB  . GLU C 105 ? 0.4124 0.4282 0.3646 0.1007  0.0363  0.0442  105 GLU L CB  
3703 C CG  . GLU C 105 ? 0.4329 0.4670 0.3939 0.0915  0.0318  0.0428  105 GLU L CG  
3704 C CD  . GLU C 105 ? 0.4919 0.5413 0.4567 0.0871  0.0300  0.0392  105 GLU L CD  
3705 O OE1 . GLU C 105 ? 0.5559 0.6275 0.5220 0.0903  0.0289  0.0384  105 GLU L OE1 
3706 O OE2 . GLU C 105 ? 0.5213 0.5616 0.4870 0.0806  0.0300  0.0367  105 GLU L OE2 
3707 N N   . ILE C 106 ? 0.3844 0.3385 0.3091 0.1080  0.0480  0.0476  106 ILE L N   
3708 C CA  . ILE C 106 ? 0.4081 0.3344 0.3140 0.1166  0.0538  0.0495  106 ILE L CA  
3709 C C   . ILE C 106 ? 0.4170 0.3443 0.3199 0.1248  0.0543  0.0469  106 ILE L C   
3710 O O   . ILE C 106 ? 0.3810 0.3182 0.2942 0.1170  0.0528  0.0425  106 ILE L O   
3711 C CB  . ILE C 106 ? 0.4292 0.3289 0.3266 0.1050  0.0590  0.0482  106 ILE L CB  
3712 C CG1 . ILE C 106 ? 0.4380 0.3395 0.3389 0.0961  0.0586  0.0497  106 ILE L CG1 
3713 C CG2 . ILE C 106 ? 0.4587 0.3253 0.3325 0.1130  0.0656  0.0500  106 ILE L CG2 
3714 C CD1 . ILE C 106 ? 0.4599 0.3561 0.3504 0.1061  0.0593  0.0558  106 ILE L CD1 
3715 N N   . LYS C 107 ? 0.4564 0.3740 0.3442 0.1415  0.0564  0.0495  107 LYS L N   
3716 C CA  . LYS C 107 ? 0.4658 0.3809 0.3463 0.1531  0.0575  0.0471  107 LYS L CA  
3717 C C   . LYS C 107 ? 0.4907 0.3632 0.3490 0.1537  0.0645  0.0475  107 LYS L C   
3718 O O   . LYS C 107 ? 0.5242 0.3725 0.3664 0.1561  0.0680  0.0518  107 LYS L O   
3719 C CB  . LYS C 107 ? 0.4899 0.4224 0.3651 0.1736  0.0550  0.0491  107 LYS L CB  
3720 C CG  . LYS C 107 ? 0.5542 0.4885 0.4209 0.1892  0.0556  0.0461  107 LYS L CG  
3721 C CD  . LYS C 107 ? 0.6058 0.5648 0.4687 0.2102  0.0524  0.0474  107 LYS L CD  
3722 C CE  . LYS C 107 ? 0.6433 0.6350 0.5136 0.2196  0.0495  0.0418  107 LYS L CE  
3723 N NZ  . LYS C 107 ? 0.6998 0.6681 0.5482 0.2392  0.0526  0.0410  107 LYS L NZ  
3724 N N   . ARG C 108 ? 0.4537 0.3168 0.3104 0.1498  0.0669  0.0429  108 ARG L N   
3725 C CA  . ARG C 108 ? 0.4753 0.2966 0.3093 0.1481  0.0743  0.0421  108 ARG L CA  
3726 C C   . ARG C 108 ? 0.4719 0.2900 0.2994 0.1590  0.0752  0.0383  108 ARG L C   
3727 O O   . ARG C 108 ? 0.4485 0.3001 0.2913 0.1661  0.0699  0.0364  108 ARG L O   
3728 C CB  . ARG C 108 ? 0.4683 0.2800 0.3079 0.1254  0.0774  0.0386  108 ARG L CB  
3729 C CG  . ARG C 108 ? 0.4370 0.2772 0.3004 0.1138  0.0732  0.0332  108 ARG L CG  
3730 C CD  . ARG C 108 ? 0.4454 0.2680 0.3050 0.0973  0.0783  0.0278  108 ARG L CD  
3731 N NE  . ARG C 108 ? 0.4819 0.2766 0.3225 0.1018  0.0841  0.0253  108 ARG L NE  
3732 C CZ  . ARG C 108 ? 0.5053 0.2765 0.3347 0.0887  0.0907  0.0205  108 ARG L CZ  
3733 N NH1 . ARG C 108 ? 0.5049 0.2796 0.3406 0.0705  0.0923  0.0174  108 ARG L NH1 
3734 N NH2 . ARG C 108 ? 0.5316 0.2764 0.3423 0.0936  0.0959  0.0179  108 ARG L NH2 
3735 N N   . THR C 109 ? 0.4889 0.2691 0.2950 0.1576  0.0820  0.0365  109 THR L N   
3736 C CA  . THR C 109 ? 0.4962 0.2683 0.2932 0.1678  0.0836  0.0324  109 THR L CA  
3737 C C   . THR C 109 ? 0.4562 0.2578 0.2785 0.1543  0.0803  0.0265  109 THR L C   
3738 O O   . THR C 109 ? 0.4256 0.2371 0.2633 0.1353  0.0795  0.0251  109 THR L O   
3739 C CB  . THR C 109 ? 0.5450 0.2640 0.3094 0.1675  0.0925  0.0316  109 THR L CB  
3740 O OG1 . THR C 109 ? 0.5325 0.2422 0.3021 0.1420  0.0965  0.0286  109 THR L OG1 
3741 C CG2 . THR C 109 ? 0.5847 0.2694 0.3178 0.1845  0.0959  0.0378  109 THR L CG2 
3742 N N   . VAL C 110 ? 0.4547 0.2666 0.2779 0.1646  0.0790  0.0228  110 VAL L N   
3743 C CA  . VAL C 110 ? 0.4256 0.2592 0.2678 0.1524  0.0770  0.0168  110 VAL L CA  
3744 C C   . VAL C 110 ? 0.4339 0.2419 0.2708 0.1338  0.0827  0.0130  110 VAL L C   
3745 O O   . VAL C 110 ? 0.4597 0.2276 0.2715 0.1354  0.0897  0.0127  110 VAL L O   
3746 C CB  . VAL C 110 ? 0.4350 0.2805 0.2752 0.1675  0.0757  0.0131  110 VAL L CB  
3747 C CG1 . VAL C 110 ? 0.4167 0.2768 0.2715 0.1545  0.0750  0.0070  110 VAL L CG1 
3748 C CG2 . VAL C 110 ? 0.4254 0.3081 0.2760 0.1818  0.0695  0.0151  110 VAL L CG2 
3749 N N   . ALA C 111 ? 0.3971 0.2273 0.2550 0.1168  0.0798  0.0100  111 ALA L N   
3750 C CA  . ALA C 111 ? 0.4004 0.2183 0.2582 0.0988  0.0840  0.0045  111 ALA L CA  
3751 C C   . ALA C 111 ? 0.3777 0.2242 0.2547 0.0926  0.0797  -0.0001 111 ALA L C   
3752 O O   . ALA C 111 ? 0.3396 0.2164 0.2354 0.0901  0.0732  0.0015  111 ALA L O   
3753 C CB  . ALA C 111 ? 0.3931 0.2082 0.2541 0.0843  0.0850  0.0056  111 ALA L CB  
3754 N N   . ALA C 112 ? 0.3891 0.2243 0.2597 0.0896  0.0836  -0.0058 112 ALA L N   
3755 C CA  . ALA C 112 ? 0.3767 0.2362 0.2630 0.0836  0.0802  -0.0106 112 ALA L CA  
3756 C C   . ALA C 112 ? 0.3572 0.2296 0.2567 0.0663  0.0784  -0.0131 112 ALA L C   
3757 O O   . ALA C 112 ? 0.3797 0.2363 0.2723 0.0562  0.0828  -0.0148 112 ALA L O   
3758 C CB  . ALA C 112 ? 0.3974 0.2398 0.2718 0.0854  0.0852  -0.0163 112 ALA L CB  
3759 N N   . PRO C 113 ? 0.3343 0.2349 0.2507 0.0622  0.0725  -0.0142 113 PRO L N   
3760 C CA  . PRO C 113 ? 0.3211 0.2337 0.2474 0.0486  0.0706  -0.0176 113 PRO L CA  
3761 C C   . PRO C 113 ? 0.3328 0.2377 0.2548 0.0389  0.0754  -0.0256 113 PRO L C   
3762 O O   . PRO C 113 ? 0.3564 0.2553 0.2733 0.0427  0.0778  -0.0284 113 PRO L O   
3763 C CB  . PRO C 113 ? 0.2967 0.2365 0.2367 0.0499  0.0632  -0.0161 113 PRO L CB  
3764 C CG  . PRO C 113 ? 0.3029 0.2459 0.2407 0.0599  0.0632  -0.0155 113 PRO L CG  
3765 C CD  . PRO C 113 ? 0.3202 0.2423 0.2448 0.0703  0.0678  -0.0131 113 PRO L CD  
3766 N N   . SER C 114 ? 0.3389 0.2461 0.2628 0.0267  0.0767  -0.0297 114 SER L N   
3767 C CA  A SER C 114 ? 0.3413 0.2553 0.2672 0.0157  0.0789  -0.0384 114 SER L CA  
3768 C CA  B SER C 114 ? 0.3401 0.2542 0.2660 0.0157  0.0788  -0.0384 114 SER L CA  
3769 C C   . SER C 114 ? 0.3192 0.2621 0.2601 0.0163  0.0708  -0.0385 114 SER L C   
3770 O O   . SER C 114 ? 0.3125 0.2673 0.2603 0.0180  0.0654  -0.0344 114 SER L O   
3771 C CB  A SER C 114 ? 0.3556 0.2633 0.2760 0.0024  0.0840  -0.0437 114 SER L CB  
3772 C CB  B SER C 114 ? 0.3519 0.2601 0.2726 0.0024  0.0839  -0.0438 114 SER L CB  
3773 O OG  A SER C 114 ? 0.3859 0.2637 0.2897 0.0023  0.0909  -0.0414 114 SER L OG  
3774 O OG  B SER C 114 ? 0.3391 0.2599 0.2672 0.0014  0.0797  -0.0405 114 SER L OG  
3775 N N   . VAL C 115 ? 0.3066 0.2579 0.2500 0.0150  0.0704  -0.0430 115 VAL L N   
3776 C CA  . VAL C 115 ? 0.2988 0.2729 0.2522 0.0170  0.0629  -0.0420 115 VAL L CA  
3777 C C   . VAL C 115 ? 0.3089 0.2972 0.2656 0.0085  0.0624  -0.0499 115 VAL L C   
3778 O O   . VAL C 115 ? 0.3312 0.3145 0.2837 0.0020  0.0681  -0.0571 115 VAL L O   
3779 C CB  . VAL C 115 ? 0.2951 0.2717 0.2488 0.0239  0.0616  -0.0401 115 VAL L CB  
3780 C CG1 . VAL C 115 ? 0.2861 0.2821 0.2463 0.0246  0.0546  -0.0384 115 VAL L CG1 
3781 C CG2 . VAL C 115 ? 0.3053 0.2719 0.2554 0.0333  0.0623  -0.0338 115 VAL L CG2 
3782 N N   . PHE C 116 ? 0.2787 0.2845 0.2413 0.0097  0.0556  -0.0488 116 PHE L N   
3783 C CA  . PHE C 116 ? 0.2795 0.3033 0.2449 0.0047  0.0537  -0.0562 116 PHE L CA  
3784 C C   . PHE C 116 ? 0.2727 0.3089 0.2398 0.0110  0.0458  -0.0529 116 PHE L C   
3785 O O   . PHE C 116 ? 0.2630 0.2965 0.2296 0.0166  0.0411  -0.0456 116 PHE L O   
3786 C CB  . PHE C 116 ? 0.2771 0.3088 0.2438 0.0001  0.0537  -0.0598 116 PHE L CB  
3787 C CG  . PHE C 116 ? 0.2952 0.3120 0.2571 -0.0077 0.0618  -0.0623 116 PHE L CG  
3788 C CD1 . PHE C 116 ? 0.3183 0.3361 0.2765 -0.0194 0.0687  -0.0722 116 PHE L CD1 
3789 C CD2 . PHE C 116 ? 0.2950 0.2945 0.2537 -0.0041 0.0631  -0.0550 116 PHE L CD2 
3790 C CE1 . PHE C 116 ? 0.3255 0.3250 0.2750 -0.0284 0.0770  -0.0745 116 PHE L CE1 
3791 C CE2 . PHE C 116 ? 0.3180 0.3002 0.2687 -0.0113 0.0708  -0.0568 116 PHE L CE2 
3792 C CZ  . PHE C 116 ? 0.3347 0.3157 0.2799 -0.0240 0.0778  -0.0665 116 PHE L CZ  
3793 N N   . ILE C 117 ? 0.2723 0.3217 0.2397 0.0093  0.0444  -0.0587 117 ILE L N   
3794 C CA  . ILE C 117 ? 0.2632 0.3217 0.2280 0.0154  0.0369  -0.0558 117 ILE L CA  
3795 C C   . ILE C 117 ? 0.2699 0.3471 0.2345 0.0160  0.0333  -0.0625 117 ILE L C   
3796 O O   . ILE C 117 ? 0.2725 0.3609 0.2404 0.0094  0.0375  -0.0717 117 ILE L O   
3797 C CB  . ILE C 117 ? 0.2608 0.3182 0.2239 0.0155  0.0375  -0.0553 117 ILE L CB  
3798 C CG1 . ILE C 117 ? 0.2592 0.3206 0.2157 0.0207  0.0304  -0.0508 117 ILE L CG1 
3799 C CG2 . ILE C 117 ? 0.2700 0.3353 0.2353 0.0095  0.0422  -0.0647 117 ILE L CG2 
3800 C CD1 . ILE C 117 ? 0.2646 0.3242 0.2181 0.0202  0.0306  -0.0487 117 ILE L CD1 
3801 N N   . PHE C 118 ? 0.2636 0.3441 0.2228 0.0239  0.0260  -0.0585 118 PHE L N   
3802 C CA  . PHE C 118 ? 0.2681 0.3677 0.2247 0.0287  0.0211  -0.0645 118 PHE L CA  
3803 C C   . PHE C 118 ? 0.2781 0.3778 0.2239 0.0368  0.0145  -0.0616 118 PHE L C   
3804 O O   . PHE C 118 ? 0.2753 0.3593 0.2121 0.0416  0.0107  -0.0531 118 PHE L O   
3805 C CB  . PHE C 118 ? 0.2615 0.3619 0.2173 0.0334  0.0177  -0.0625 118 PHE L CB  
3806 C CG  . PHE C 118 ? 0.2576 0.3577 0.2216 0.0255  0.0238  -0.0652 118 PHE L CG  
3807 C CD1 . PHE C 118 ? 0.2576 0.3768 0.2268 0.0184  0.0277  -0.0759 118 PHE L CD1 
3808 C CD2 . PHE C 118 ? 0.2586 0.3397 0.2237 0.0240  0.0262  -0.0576 118 PHE L CD2 
3809 C CE1 . PHE C 118 ? 0.2668 0.3833 0.2402 0.0094  0.0339  -0.0784 118 PHE L CE1 
3810 C CE2 . PHE C 118 ? 0.2706 0.3491 0.2404 0.0172  0.0318  -0.0596 118 PHE L CE2 
3811 C CZ  . PHE C 118 ? 0.2704 0.3652 0.2434 0.0094  0.0358  -0.0699 118 PHE L CZ  
3812 N N   . PRO C 119 ? 0.2812 0.3975 0.2256 0.0379  0.0134  -0.0686 119 PRO L N   
3813 C CA  . PRO C 119 ? 0.2919 0.4067 0.2226 0.0469  0.0068  -0.0656 119 PRO L CA  
3814 C C   . PRO C 119 ? 0.2918 0.4087 0.2117 0.0592  -0.0005 -0.0644 119 PRO L C   
3815 O O   . PRO C 119 ? 0.2791 0.4069 0.2053 0.0603  -0.0005 -0.0684 119 PRO L O   
3816 C CB  . PRO C 119 ? 0.2981 0.4349 0.2311 0.0458  0.0075  -0.0751 119 PRO L CB  
3817 C CG  . PRO C 119 ? 0.3036 0.4490 0.2517 0.0332  0.0159  -0.0826 119 PRO L CG  
3818 C CD  . PRO C 119 ? 0.2970 0.4333 0.2506 0.0301  0.0185  -0.0798 119 PRO L CD  
3819 N N   . PRO C 120 ? 0.3134 0.4183 0.2147 0.0690  -0.0068 -0.0591 120 PRO L N   
3820 C CA  . PRO C 120 ? 0.3321 0.4370 0.2185 0.0836  -0.0144 -0.0586 120 PRO L CA  
3821 C C   . PRO C 120 ? 0.3352 0.4735 0.2259 0.0906  -0.0169 -0.0702 120 PRO L C   
3822 O O   . PRO C 120 ? 0.3158 0.4709 0.2125 0.0863  -0.0146 -0.0765 120 PRO L O   
3823 C CB  . PRO C 120 ? 0.3590 0.4415 0.2211 0.0909  -0.0193 -0.0513 120 PRO L CB  
3824 C CG  . PRO C 120 ? 0.3530 0.4356 0.2202 0.0805  -0.0147 -0.0513 120 PRO L CG  
3825 C CD  . PRO C 120 ? 0.3320 0.4208 0.2226 0.0666  -0.0069 -0.0532 120 PRO L CD  
3826 N N   . SER C 121 ? 0.3488 0.4984 0.2376 0.1004  -0.0211 -0.0735 121 SER L N   
3827 C CA  . SER C 121 ? 0.3693 0.5551 0.2593 0.1101  -0.0248 -0.0853 121 SER L CA  
3828 C C   . SER C 121 ? 0.3885 0.5740 0.2576 0.1256  -0.0319 -0.0850 121 SER L C   
3829 O O   . SER C 121 ? 0.4208 0.5736 0.2677 0.1336  -0.0361 -0.0749 121 SER L O   
3830 C CB  . SER C 121 ? 0.3608 0.5591 0.2513 0.1191  -0.0285 -0.0888 121 SER L CB  
3831 O OG  . SER C 121 ? 0.3742 0.5457 0.2425 0.1345  -0.0356 -0.0800 121 SER L OG  
3832 N N   . ASP C 122 ? 0.4211 0.6437 0.2942 0.1313  -0.0338 -0.0968 122 ASP L N   
3833 C CA  . ASP C 122 ? 0.4541 0.6817 0.3056 0.1501  -0.0416 -0.0980 122 ASP L CA  
3834 C C   . ASP C 122 ? 0.4704 0.6861 0.2995 0.1721  -0.0505 -0.0945 122 ASP L C   
3835 O O   . ASP C 122 ? 0.4952 0.6847 0.2955 0.1873  -0.0567 -0.0873 122 ASP L O   
3836 C CB  . ASP C 122 ? 0.4616 0.7362 0.3252 0.1494  -0.0408 -0.1126 122 ASP L CB  
3837 C CG  . ASP C 122 ? 0.4831 0.7592 0.3609 0.1300  -0.0328 -0.1142 122 ASP L CG  
3838 O OD1 . ASP C 122 ? 0.4897 0.7315 0.3608 0.1238  -0.0307 -0.1036 122 ASP L OD1 
3839 O OD2 . ASP C 122 ? 0.5214 0.8342 0.4159 0.1210  -0.0286 -0.1269 122 ASP L OD2 
3840 N N   . GLU C 123 ? 0.4684 0.6979 0.3083 0.1726  -0.0503 -0.0984 123 GLU L N   
3841 C CA  . GLU C 123 ? 0.5064 0.7239 0.3262 0.1932  -0.0582 -0.0954 123 GLU L CA  
3842 C C   . GLU C 123 ? 0.4952 0.6560 0.2914 0.1946  -0.0596 -0.0798 123 GLU L C   
3843 O O   . GLU C 123 ? 0.5086 0.6470 0.2735 0.2144  -0.0671 -0.0752 123 GLU L O   
3844 C CB  . GLU C 123 ? 0.5347 0.7743 0.3723 0.1896  -0.0565 -0.1016 123 GLU L CB  
3845 C CG  . GLU C 123 ? 0.5826 0.8222 0.4001 0.2145  -0.0657 -0.1025 123 GLU L CG  
3846 C CD  . GLU C 123 ? 0.6233 0.8760 0.4545 0.2116  -0.0644 -0.1059 123 GLU L CD  
3847 O OE1 . GLU C 123 ? 0.6320 0.9049 0.4905 0.1905  -0.0563 -0.1108 123 GLU L OE1 
3848 O OE2 . GLU C 123 ? 0.6786 0.9177 0.4910 0.2302  -0.0712 -0.1032 123 GLU L OE2 
3849 N N   . GLN C 124 ? 0.4390 0.5767 0.2473 0.1742  -0.0523 -0.0721 124 GLN L N   
3850 C CA  . GLN C 124 ? 0.4463 0.5344 0.2325 0.1730  -0.0529 -0.0585 124 GLN L CA  
3851 C C   . GLN C 124 ? 0.4763 0.5435 0.2391 0.1767  -0.0549 -0.0535 124 GLN L C   
3852 O O   . GLN C 124 ? 0.4997 0.5293 0.2298 0.1870  -0.0594 -0.0453 124 GLN L O   
3853 C CB  . GLN C 124 ? 0.4134 0.4876 0.2188 0.1512  -0.0449 -0.0526 124 GLN L CB  
3854 C CG  . GLN C 124 ? 0.4224 0.4511 0.2058 0.1483  -0.0451 -0.0403 124 GLN L CG  
3855 C CD  . GLN C 124 ? 0.3938 0.4140 0.1965 0.1282  -0.0374 -0.0355 124 GLN L CD  
3856 O OE1 . GLN C 124 ? 0.3723 0.4129 0.2004 0.1153  -0.0314 -0.0395 124 GLN L OE1 
3857 N NE2 . GLN C 124 ? 0.3901 0.3797 0.1788 0.1263  -0.0378 -0.0273 124 GLN L NE2 
3858 N N   . LEU C 125 ? 0.4809 0.5685 0.2575 0.1678  -0.0513 -0.0581 125 LEU L N   
3859 C CA  . LEU C 125 ? 0.5452 0.6131 0.3013 0.1684  -0.0522 -0.0530 125 LEU L CA  
3860 C C   . LEU C 125 ? 0.6151 0.6747 0.3367 0.1939  -0.0616 -0.0531 125 LEU L C   
3861 O O   . LEU C 125 ? 0.6333 0.6521 0.3218 0.1985  -0.0640 -0.0437 125 LEU L O   
3862 C CB  . LEU C 125 ? 0.5356 0.6334 0.3147 0.1562  -0.0470 -0.0601 125 LEU L CB  
3863 C CG  . LEU C 125 ? 0.5239 0.6175 0.3266 0.1327  -0.0379 -0.0575 125 LEU L CG  
3864 C CD1 . LEU C 125 ? 0.5207 0.6403 0.3411 0.1228  -0.0333 -0.0648 125 LEU L CD1 
3865 C CD2 . LEU C 125 ? 0.5435 0.5959 0.3291 0.1250  -0.0363 -0.0453 125 LEU L CD2 
3866 N N   . LYS C 126 ? 0.6615 0.7560 0.3882 0.2102  -0.0666 -0.0633 126 LYS L N   
3867 C CA  . LYS C 126 ? 0.7468 0.8379 0.4405 0.2393  -0.0766 -0.0649 126 LYS L CA  
3868 C C   . LYS C 126 ? 0.7653 0.7997 0.4211 0.2484  -0.0802 -0.0526 126 LYS L C   
3869 O O   . LYS C 126 ? 0.8146 0.8218 0.4329 0.2643  -0.0856 -0.0479 126 LYS L O   
3870 C CB  . LYS C 126 ? 0.7825 0.9166 0.4886 0.2544  -0.0811 -0.0769 126 LYS L CB  
3871 C CG  . LYS C 126 ? 0.8130 1.0052 0.5423 0.2546  -0.0806 -0.0913 126 LYS L CG  
3872 C CD  . LYS C 126 ? 0.8548 1.0913 0.5931 0.2696  -0.0852 -0.1038 126 LYS L CD  
3873 C CE  . LYS C 126 ? 0.8848 1.1818 0.6467 0.2660  -0.0836 -0.1194 126 LYS L CE  
3874 N NZ  . LYS C 126 ? 0.9400 1.2848 0.7101 0.2800  -0.0880 -0.1329 126 LYS L NZ  
3875 N N   . SER C 127 ? 0.7353 0.7512 0.3994 0.2372  -0.0767 -0.0475 127 SER L N   
3876 C CA  . SER C 127 ? 0.7507 0.7166 0.3814 0.2447  -0.0797 -0.0378 127 SER L CA  
3877 C C   . SER C 127 ? 0.7572 0.6763 0.3697 0.2270  -0.0746 -0.0260 127 SER L C   
3878 O O   . SER C 127 ? 0.8159 0.6901 0.3979 0.2298  -0.0760 -0.0179 127 SER L O   
3879 C CB  . SER C 127 ? 0.7364 0.7098 0.3852 0.2416  -0.0785 -0.0394 127 SER L CB  
3880 O OG  . SER C 127 ? 0.7096 0.6836 0.3876 0.2147  -0.0698 -0.0362 127 SER L OG  
3881 N N   . GLY C 128 ? 0.7016 0.6302 0.3307 0.2088  -0.0688 -0.0254 128 GLY L N   
3882 C CA  . GLY C 128 ? 0.6978 0.5861 0.3059 0.1936  -0.0646 -0.0155 128 GLY L CA  
3883 C C   . GLY C 128 ? 0.6560 0.5430 0.2903 0.1670  -0.0560 -0.0120 128 GLY L C   
3884 O O   . GLY C 128 ? 0.6509 0.5102 0.2711 0.1520  -0.0518 -0.0049 128 GLY L O   
3885 N N   . THR C 129 ? 0.6142 0.5296 0.2836 0.1611  -0.0533 -0.0168 129 THR L N   
3886 C CA  . THR C 129 ? 0.5632 0.4776 0.2562 0.1386  -0.0456 -0.0135 129 THR L CA  
3887 C C   . THR C 129 ? 0.5136 0.4709 0.2484 0.1291  -0.0408 -0.0213 129 THR L C   
3888 O O   . THR C 129 ? 0.5068 0.4949 0.2544 0.1394  -0.0435 -0.0298 129 THR L O   
3889 C CB  . THR C 129 ? 0.5700 0.4662 0.2589 0.1387  -0.0460 -0.0097 129 THR L CB  
3890 O OG1 . THR C 129 ? 0.6060 0.4568 0.2525 0.1440  -0.0491 -0.0021 129 THR L OG1 
3891 C CG2 . THR C 129 ? 0.5486 0.4479 0.2619 0.1179  -0.0387 -0.0070 129 THR L CG2 
3892 N N   . ALA C 130 ? 0.4661 0.4244 0.2189 0.1098  -0.0337 -0.0190 130 ALA L N   
3893 C CA  . ALA C 130 ? 0.4122 0.4026 0.2012 0.0991  -0.0280 -0.0252 130 ALA L CA  
3894 C C   . ALA C 130 ? 0.3897 0.3743 0.1943 0.0871  -0.0230 -0.0215 130 ALA L C   
3895 O O   . ALA C 130 ? 0.3898 0.3546 0.1864 0.0768  -0.0202 -0.0150 130 ALA L O   
3896 C CB  . ALA C 130 ? 0.4143 0.4124 0.2079 0.0907  -0.0245 -0.0266 130 ALA L CB  
3897 N N   . SER C 131 ? 0.3557 0.3581 0.1803 0.0884  -0.0221 -0.0259 131 SER L N   
3898 C CA  . SER C 131 ? 0.3290 0.3310 0.1717 0.0777  -0.0169 -0.0235 131 SER L CA  
3899 C C   . SER C 131 ? 0.3107 0.3363 0.1799 0.0688  -0.0108 -0.0295 131 SER L C   
3900 O O   . SER C 131 ? 0.3020 0.3499 0.1823 0.0721  -0.0108 -0.0375 131 SER L O   
3901 C CB  . SER C 131 ? 0.3265 0.3273 0.1693 0.0849  -0.0198 -0.0235 131 SER L CB  
3902 O OG  . SER C 131 ? 0.3499 0.3241 0.1653 0.0928  -0.0250 -0.0177 131 SER L OG  
3903 N N   . VAL C 132 ? 0.3008 0.3217 0.1788 0.0576  -0.0054 -0.0264 132 VAL L N   
3904 C CA  . VAL C 132 ? 0.2773 0.3143 0.1767 0.0496  0.0009  -0.0315 132 VAL L CA  
3905 C C   . VAL C 132 ? 0.2668 0.2999 0.1776 0.0452  0.0045  -0.0287 132 VAL L C   
3906 O O   . VAL C 132 ? 0.2693 0.2882 0.1738 0.0426  0.0044  -0.0220 132 VAL L O   
3907 C CB  . VAL C 132 ? 0.2775 0.3135 0.1768 0.0426  0.0042  -0.0308 132 VAL L CB  
3908 C CG1 . VAL C 132 ? 0.2624 0.3144 0.1793 0.0376  0.0097  -0.0379 132 VAL L CG1 
3909 C CG2 . VAL C 132 ? 0.2959 0.3262 0.1763 0.0465  0.0000  -0.0296 132 VAL L CG2 
3910 N N   . VAL C 133 ? 0.2552 0.3001 0.1807 0.0433  0.0080  -0.0339 133 VAL L N   
3911 C CA  . VAL C 133 ? 0.2440 0.2836 0.1777 0.0407  0.0109  -0.0310 133 VAL L CA  
3912 C C   . VAL C 133 ? 0.2426 0.2845 0.1886 0.0337  0.0182  -0.0335 133 VAL L C   
3913 O O   . VAL C 133 ? 0.2328 0.2847 0.1844 0.0306  0.0214  -0.0405 133 VAL L O   
3914 C CB  . VAL C 133 ? 0.2417 0.2890 0.1774 0.0452  0.0086  -0.0342 133 VAL L CB  
3915 C CG1 . VAL C 133 ? 0.2362 0.2783 0.1803 0.0416  0.0123  -0.0315 133 VAL L CG1 
3916 C CG2 . VAL C 133 ? 0.2575 0.2989 0.1777 0.0548  0.0010  -0.0315 133 VAL L CG2 
3917 N N   . CYS C 134 ? 0.2382 0.2706 0.1865 0.0317  0.0208  -0.0281 134 CYS L N   
3918 C CA  . CYS C 134 ? 0.2385 0.2687 0.1949 0.0280  0.0274  -0.0294 134 CYS L CA  
3919 C C   . CYS C 134 ? 0.2361 0.2604 0.1961 0.0285  0.0292  -0.0267 134 CYS L C   
3920 O O   . CYS C 134 ? 0.2371 0.2570 0.1943 0.0311  0.0260  -0.0210 134 CYS L O   
3921 C CB  . CYS C 134 ? 0.2491 0.2765 0.2041 0.0273  0.0287  -0.0260 134 CYS L CB  
3922 S SG  . CYS C 134 ? 0.2647 0.2880 0.2260 0.0265  0.0363  -0.0284 134 CYS L SG  
3923 N N   . LEU C 135 ? 0.2319 0.2552 0.1964 0.0254  0.0343  -0.0311 135 LEU L N   
3924 C CA  . LEU C 135 ? 0.2306 0.2472 0.1968 0.0250  0.0367  -0.0291 135 LEU L CA  
3925 C C   . LEU C 135 ? 0.2461 0.2500 0.2118 0.0248  0.0430  -0.0275 135 LEU L C   
3926 O O   . LEU C 135 ? 0.2465 0.2469 0.2109 0.0217  0.0478  -0.0325 135 LEU L O   
3927 C CB  . LEU C 135 ? 0.2326 0.2570 0.2007 0.0205  0.0382  -0.0359 135 LEU L CB  
3928 C CG  . LEU C 135 ? 0.2431 0.2597 0.2115 0.0172  0.0426  -0.0355 135 LEU L CG  
3929 C CD1 . LEU C 135 ? 0.2441 0.2574 0.2127 0.0226  0.0387  -0.0282 135 LEU L CD1 
3930 C CD2 . LEU C 135 ? 0.2575 0.2854 0.2271 0.0098  0.0452  -0.0443 135 LEU L CD2 
3931 N N   . LEU C 136 ? 0.2409 0.2377 0.2060 0.0289  0.0429  -0.0213 136 LEU L N   
3932 C CA  . LEU C 136 ? 0.2496 0.2330 0.2115 0.0318  0.0484  -0.0192 136 LEU L CA  
3933 C C   . LEU C 136 ? 0.2590 0.2344 0.2193 0.0300  0.0506  -0.0181 136 LEU L C   
3934 O O   . LEU C 136 ? 0.2436 0.2236 0.2063 0.0320  0.0466  -0.0139 136 LEU L O   
3935 C CB  . LEU C 136 ? 0.2395 0.2254 0.2016 0.0386  0.0461  -0.0132 136 LEU L CB  
3936 C CG  . LEU C 136 ? 0.2381 0.2319 0.2006 0.0402  0.0453  -0.0144 136 LEU L CG  
3937 C CD1 . LEU C 136 ? 0.2329 0.2370 0.1967 0.0355  0.0408  -0.0164 136 LEU L CD1 
3938 C CD2 . LEU C 136 ? 0.2428 0.2426 0.2053 0.0462  0.0439  -0.0096 136 LEU L CD2 
3939 N N   . ASN C 137 ? 0.2755 0.2389 0.2303 0.0248  0.0571  -0.0225 137 ASN L N   
3940 C CA  . ASN C 137 ? 0.2895 0.2458 0.2410 0.0198  0.0602  -0.0230 137 ASN L CA  
3941 C C   . ASN C 137 ? 0.3048 0.2383 0.2459 0.0240  0.0656  -0.0186 137 ASN L C   
3942 O O   . ASN C 137 ? 0.3156 0.2331 0.2477 0.0259  0.0706  -0.0200 137 ASN L O   
3943 C CB  . ASN C 137 ? 0.3214 0.2819 0.2718 0.0085  0.0640  -0.0320 137 ASN L CB  
3944 C CG  . ASN C 137 ? 0.3586 0.3278 0.3113 0.0033  0.0631  -0.0336 137 ASN L CG  
3945 O OD1 . ASN C 137 ? 0.3784 0.3587 0.3373 0.0089  0.0567  -0.0295 137 ASN L OD1 
3946 N ND2 . ASN C 137 ? 0.4067 0.3690 0.3526 -0.0074 0.0700  -0.0393 137 ASN L ND2 
3947 N N   . ASN C 138 ? 0.3064 0.2383 0.2476 0.0269  0.0641  -0.0133 138 ASN L N   
3948 C CA  . ASN C 138 ? 0.3362 0.2465 0.2657 0.0300  0.0691  -0.0092 138 ASN L CA  
3949 C C   . ASN C 138 ? 0.3366 0.2342 0.2583 0.0420  0.0706  -0.0052 138 ASN L C   
3950 O O   . ASN C 138 ? 0.3625 0.2367 0.2696 0.0422  0.0772  -0.0072 138 ASN L O   
3951 C CB  . ASN C 138 ? 0.3817 0.2753 0.2998 0.0180  0.0770  -0.0148 138 ASN L CB  
3952 C CG  . ASN C 138 ? 0.4105 0.3216 0.3364 0.0075  0.0753  -0.0190 138 ASN L CG  
3953 O OD1 . ASN C 138 ? 0.3901 0.3228 0.3285 0.0105  0.0682  -0.0178 138 ASN L OD1 
3954 N ND2 . ASN C 138 ? 0.4857 0.3870 0.4022 -0.0048 0.0822  -0.0243 138 ASN L ND2 
3955 N N   . PHE C 139 ? 0.3050 0.2175 0.2344 0.0515  0.0649  -0.0006 139 PHE L N   
3956 C CA  . PHE C 139 ? 0.3160 0.2246 0.2398 0.0642  0.0654  0.0019  139 PHE L CA  
3957 C C   . PHE C 139 ? 0.3144 0.2288 0.2386 0.0740  0.0625  0.0085  139 PHE L C   
3958 O O   . PHE C 139 ? 0.3013 0.2246 0.2322 0.0701  0.0594  0.0110  139 PHE L O   
3959 C CB  . PHE C 139 ? 0.3037 0.2295 0.2357 0.0649  0.0623  -0.0010 139 PHE L CB  
3960 C CG  . PHE C 139 ? 0.2793 0.2295 0.2244 0.0621  0.0553  0.0006  139 PHE L CG  
3961 C CD1 . PHE C 139 ? 0.2713 0.2359 0.2197 0.0696  0.0518  0.0045  139 PHE L CD1 
3962 C CD2 . PHE C 139 ? 0.2661 0.2245 0.2179 0.0523  0.0526  -0.0020 139 PHE L CD2 
3963 C CE1 . PHE C 139 ? 0.2726 0.2555 0.2291 0.0651  0.0463  0.0058  139 PHE L CE1 
3964 C CE2 . PHE C 139 ? 0.2589 0.2340 0.2179 0.0506  0.0464  -0.0002 139 PHE L CE2 
3965 C CZ  . PHE C 139 ? 0.2489 0.2347 0.2095 0.0558  0.0436  0.0037  139 PHE L CZ  
3966 N N   . TYR C 140 ? 0.3214 0.2311 0.2376 0.0873  0.0638  0.0105  140 TYR L N   
3967 C CA  . TYR C 140 ? 0.3352 0.2533 0.2503 0.0992  0.0613  0.0159  140 TYR L CA  
3968 C C   . TYR C 140 ? 0.3445 0.2696 0.2550 0.1138  0.0611  0.0152  140 TYR L C   
3969 O O   . TYR C 140 ? 0.3553 0.2599 0.2526 0.1195  0.0656  0.0128  140 TYR L O   
3970 C CB  . TYR C 140 ? 0.3559 0.2512 0.2580 0.1021  0.0649  0.0201  140 TYR L CB  
3971 C CG  . TYR C 140 ? 0.3607 0.2705 0.2649 0.1127  0.0612  0.0253  140 TYR L CG  
3972 C CD1 . TYR C 140 ? 0.3817 0.2936 0.2772 0.1301  0.0613  0.0269  140 TYR L CD1 
3973 C CD2 . TYR C 140 ? 0.3550 0.2807 0.2706 0.1059  0.0572  0.0277  140 TYR L CD2 
3974 C CE1 . TYR C 140 ? 0.3839 0.3150 0.2825 0.1398  0.0577  0.0306  140 TYR L CE1 
3975 C CE2 . TYR C 140 ? 0.3555 0.2983 0.2742 0.1144  0.0538  0.0316  140 TYR L CE2 
3976 C CZ  . TYR C 140 ? 0.3718 0.3188 0.2826 0.1309  0.0541  0.0328  140 TYR L CZ  
3977 O OH  . TYR C 140 ? 0.3956 0.3634 0.3096 0.1392  0.0507  0.0355  140 TYR L OH  
3978 N N   . PRO C 141 ? 0.3431 0.2969 0.2625 0.1201  0.0563  0.0165  141 PRO L N   
3979 C CA  . PRO C 141 ? 0.3336 0.3086 0.2654 0.1130  0.0515  0.0190  141 PRO L CA  
3980 C C   . PRO C 141 ? 0.3243 0.3137 0.2686 0.0984  0.0482  0.0163  141 PRO L C   
3981 O O   . PRO C 141 ? 0.3012 0.2862 0.2460 0.0935  0.0495  0.0124  141 PRO L O   
3982 C CB  . PRO C 141 ? 0.3368 0.3364 0.2697 0.1256  0.0490  0.0199  141 PRO L CB  
3983 C CG  . PRO C 141 ? 0.3451 0.3493 0.2745 0.1335  0.0504  0.0155  141 PRO L CG  
3984 C CD  . PRO C 141 ? 0.3537 0.3222 0.2701 0.1346  0.0557  0.0147  141 PRO L CD  
3985 N N   . ARG C 142 ? 0.3322 0.3370 0.2844 0.0919  0.0441  0.0182  142 ARG L N   
3986 C CA  . ARG C 142 ? 0.3610 0.3731 0.3203 0.0788  0.0408  0.0163  142 ARG L CA  
3987 C C   . ARG C 142 ? 0.3354 0.3637 0.2973 0.0767  0.0396  0.0129  142 ARG L C   
3988 O O   . ARG C 142 ? 0.3623 0.3889 0.3259 0.0678  0.0383  0.0107  142 ARG L O   
3989 C CB  . ARG C 142 ? 0.4172 0.4371 0.3801 0.0736  0.0371  0.0193  142 ARG L CB  
3990 C CG  . ARG C 142 ? 0.4767 0.5120 0.4425 0.0650  0.0333  0.0183  142 ARG L CG  
3991 C CD  . ARG C 142 ? 0.5533 0.5969 0.5197 0.0640  0.0310  0.0214  142 ARG L CD  
3992 N NE  . ARG C 142 ? 0.6002 0.6322 0.5664 0.0582  0.0289  0.0227  142 ARG L NE  
3993 C CZ  . ARG C 142 ? 0.6523 0.6816 0.6160 0.0498  0.0258  0.0217  142 ARG L CZ  
3994 N NH1 . ARG C 142 ? 0.6190 0.6545 0.5797 0.0442  0.0248  0.0197  142 ARG L NH1 
3995 N NH2 . ARG C 142 ? 0.7355 0.7553 0.6982 0.0476  0.0237  0.0225  142 ARG L NH2 
3996 N N   . GLU C 143 ? 0.3296 0.3742 0.2909 0.0847  0.0400  0.0120  143 GLU L N   
3997 C CA  . GLU C 143 ? 0.3361 0.4003 0.2998 0.0815  0.0391  0.0081  143 GLU L CA  
3998 C C   . GLU C 143 ? 0.3260 0.3781 0.2880 0.0810  0.0414  0.0046  143 GLU L C   
3999 O O   . GLU C 143 ? 0.3052 0.3414 0.2619 0.0900  0.0449  0.0039  143 GLU L O   
4000 C CB  . GLU C 143 ? 0.3644 0.4518 0.3277 0.0923  0.0394  0.0066  143 GLU L CB  
4001 C CG  . GLU C 143 ? 0.4266 0.5307 0.3922 0.0910  0.0371  0.0091  143 GLU L CG  
4002 C CD  . GLU C 143 ? 0.4493 0.5382 0.4127 0.0969  0.0373  0.0140  143 GLU L CD  
4003 O OE1 . GLU C 143 ? 0.4329 0.5080 0.3903 0.1099  0.0397  0.0153  143 GLU L OE1 
4004 O OE2 . GLU C 143 ? 0.5315 0.6208 0.4973 0.0880  0.0351  0.0165  143 GLU L OE2 
4005 N N   . ALA C 144 ? 0.3076 0.3653 0.2719 0.0706  0.0398  0.0024  144 ALA L N   
4006 C CA  . ALA C 144 ? 0.3179 0.3673 0.2813 0.0682  0.0415  -0.0014 144 ALA L CA  
4007 C C   . ALA C 144 ? 0.3224 0.3871 0.2870 0.0587  0.0392  -0.0036 144 ALA L C   
4008 O O   . ALA C 144 ? 0.3385 0.4084 0.3023 0.0505  0.0363  -0.0014 144 ALA L O   
4009 C CB  . ALA C 144 ? 0.3068 0.3350 0.2695 0.0634  0.0421  -0.0010 144 ALA L CB  
4010 N N   . LYS C 145 ? 0.3298 0.3992 0.2942 0.0591  0.0407  -0.0078 145 LYS L N   
4011 C CA  . LYS C 145 ? 0.3247 0.4050 0.2881 0.0486  0.0389  -0.0097 145 LYS L CA  
4012 C C   . LYS C 145 ? 0.3094 0.3740 0.2718 0.0442  0.0390  -0.0114 145 LYS L C   
4013 O O   . LYS C 145 ? 0.2890 0.3461 0.2523 0.0498  0.0420  -0.0146 145 LYS L O   
4014 C CB  . LYS C 145 ? 0.3516 0.4549 0.3158 0.0511  0.0402  -0.0138 145 LYS L CB  
4015 C CG  . LYS C 145 ? 0.3905 0.5066 0.3514 0.0381  0.0387  -0.0153 145 LYS L CG  
4016 C CD  . LYS C 145 ? 0.4429 0.5877 0.4049 0.0387  0.0401  -0.0201 145 LYS L CD  
4017 C CE  . LYS C 145 ? 0.4858 0.6335 0.4502 0.0473  0.0424  -0.0250 145 LYS L CE  
4018 N NZ  . LYS C 145 ? 0.5382 0.7175 0.5033 0.0462  0.0433  -0.0303 145 LYS L NZ  
4019 N N   . VAL C 146 ? 0.2835 0.3428 0.2423 0.0354  0.0358  -0.0096 146 VAL L N   
4020 C CA  . VAL C 146 ? 0.2857 0.3348 0.2426 0.0317  0.0350  -0.0117 146 VAL L CA  
4021 C C   . VAL C 146 ? 0.2837 0.3400 0.2342 0.0239  0.0330  -0.0125 146 VAL L C   
4022 O O   . VAL C 146 ? 0.2801 0.3368 0.2236 0.0180  0.0306  -0.0093 146 VAL L O   
4023 C CB  . VAL C 146 ? 0.2910 0.3269 0.2467 0.0310  0.0326  -0.0093 146 VAL L CB  
4024 C CG1 . VAL C 146 ? 0.3211 0.3516 0.2748 0.0285  0.0313  -0.0123 146 VAL L CG1 
4025 C CG2 . VAL C 146 ? 0.3004 0.3295 0.2610 0.0372  0.0353  -0.0085 146 VAL L CG2 
4026 N N   . GLN C 147 ? 0.2728 0.3339 0.2242 0.0236  0.0347  -0.0167 147 GLN L N   
4027 C CA  . GLN C 147 ? 0.2858 0.3545 0.2301 0.0159  0.0335  -0.0177 147 GLN L CA  
4028 C C   . GLN C 147 ? 0.2675 0.3275 0.2089 0.0148  0.0322  -0.0198 147 GLN L C   
4029 O O   . GLN C 147 ? 0.2739 0.3328 0.2221 0.0193  0.0346  -0.0238 147 GLN L O   
4030 C CB  . GLN C 147 ? 0.3157 0.4024 0.2637 0.0170  0.0366  -0.0218 147 GLN L CB  
4031 C CG  . GLN C 147 ? 0.3705 0.4722 0.3213 0.0193  0.0377  -0.0211 147 GLN L CG  
4032 C CD  . GLN C 147 ? 0.4075 0.5333 0.3584 0.0167  0.0394  -0.0253 147 GLN L CD  
4033 O OE1 . GLN C 147 ? 0.5338 0.6663 0.4880 0.0210  0.0414  -0.0300 147 GLN L OE1 
4034 N NE2 . GLN C 147 ? 0.4505 0.5913 0.3970 0.0089  0.0390  -0.0245 147 GLN L NE2 
4035 N N   . TRP C 148 ? 0.2532 0.3070 0.1831 0.0092  0.0289  -0.0176 148 TRP L N   
4036 C CA  . TRP C 148 ? 0.2593 0.3086 0.1841 0.0089  0.0271  -0.0200 148 TRP L CA  
4037 C C   . TRP C 148 ? 0.2669 0.3266 0.1887 0.0041  0.0287  -0.0229 148 TRP L C   
4038 O O   . TRP C 148 ? 0.2732 0.3377 0.1877 -0.0024 0.0290  -0.0211 148 TRP L O   
4039 C CB  . TRP C 148 ? 0.2624 0.2974 0.1722 0.0076  0.0223  -0.0160 148 TRP L CB  
4040 C CG  . TRP C 148 ? 0.2610 0.2881 0.1745 0.0135  0.0203  -0.0147 148 TRP L CG  
4041 C CD1 . TRP C 148 ? 0.2582 0.2783 0.1696 0.0138  0.0192  -0.0105 148 TRP L CD1 
4042 C CD2 . TRP C 148 ? 0.2582 0.2863 0.1785 0.0191  0.0198  -0.0186 148 TRP L CD2 
4043 N NE1 . TRP C 148 ? 0.2603 0.2771 0.1775 0.0199  0.0179  -0.0113 148 TRP L NE1 
4044 C CE2 . TRP C 148 ? 0.2536 0.2756 0.1755 0.0227  0.0181  -0.0165 148 TRP L CE2 
4045 C CE3 . TRP C 148 ? 0.2554 0.2907 0.1797 0.0205  0.0206  -0.0243 148 TRP L CE3 
4046 C CZ2 . TRP C 148 ? 0.2459 0.2703 0.1734 0.0272  0.0174  -0.0202 148 TRP L CZ2 
4047 C CZ3 . TRP C 148 ? 0.2533 0.2912 0.1830 0.0244  0.0200  -0.0282 148 TRP L CZ3 
4048 C CH2 . TRP C 148 ? 0.2441 0.2774 0.1756 0.0274  0.0186  -0.0264 148 TRP L CH2 
4049 N N   . LYS C 149 ? 0.2839 0.3472 0.2098 0.0062  0.0296  -0.0276 149 LYS L N   
4050 C CA  . LYS C 149 ? 0.3108 0.3835 0.2328 0.0018  0.0307  -0.0306 149 LYS L CA  
4051 C C   . LYS C 149 ? 0.3127 0.3801 0.2283 0.0029  0.0279  -0.0324 149 LYS L C   
4052 O O   . LYS C 149 ? 0.3080 0.3738 0.2306 0.0079  0.0278  -0.0353 149 LYS L O   
4053 C CB  . LYS C 149 ? 0.3376 0.4229 0.2722 0.0050  0.0352  -0.0363 149 LYS L CB  
4054 C CG  . LYS C 149 ? 0.3762 0.4700 0.3165 0.0071  0.0377  -0.0355 149 LYS L CG  
4055 C CD  . LYS C 149 ? 0.4001 0.5031 0.3499 0.0138  0.0420  -0.0412 149 LYS L CD  
4056 C CE  . LYS C 149 ? 0.4387 0.5518 0.3920 0.0184  0.0435  -0.0403 149 LYS L CE  
4057 N NZ  . LYS C 149 ? 0.4719 0.5986 0.4298 0.0252  0.0469  -0.0460 149 LYS L NZ  
4058 N N   . VAL C 150 ? 0.3182 0.3834 0.2191 -0.0020 0.0258  -0.0307 150 VAL L N   
4059 C CA  . VAL C 150 ? 0.3226 0.3829 0.2132 0.0001  0.0224  -0.0317 150 VAL L CA  
4060 C C   . VAL C 150 ? 0.3221 0.3940 0.2115 -0.0046 0.0246  -0.0353 150 VAL L C   
4061 O O   . VAL C 150 ? 0.3331 0.4058 0.2133 -0.0123 0.0256  -0.0328 150 VAL L O   
4062 C CB  . VAL C 150 ? 0.3433 0.3848 0.2119 -0.0005 0.0179  -0.0252 150 VAL L CB  
4063 C CG1 . VAL C 150 ? 0.3683 0.4042 0.2220 0.0037  0.0140  -0.0259 150 VAL L CG1 
4064 C CG2 . VAL C 150 ? 0.3405 0.3727 0.2121 0.0046  0.0160  -0.0223 150 VAL L CG2 
4065 N N   . ASP C 151 ? 0.3198 0.4018 0.2187 -0.0013 0.0258  -0.0417 151 ASP L N   
4066 C CA  . ASP C 151 ? 0.3402 0.4354 0.2410 -0.0053 0.0285  -0.0462 151 ASP L CA  
4067 C C   . ASP C 151 ? 0.3400 0.4445 0.2474 -0.0095 0.0325  -0.0464 151 ASP L C   
4068 O O   . ASP C 151 ? 0.3376 0.4504 0.2383 -0.0161 0.0336  -0.0468 151 ASP L O   
4069 C CB  . ASP C 151 ? 0.3663 0.4565 0.2473 -0.0084 0.0252  -0.0437 151 ASP L CB  
4070 C CG  . ASP C 151 ? 0.3787 0.4683 0.2565 -0.0014 0.0217  -0.0465 151 ASP L CG  
4071 O OD1 . ASP C 151 ? 0.3547 0.4543 0.2483 0.0024  0.0234  -0.0528 151 ASP L OD1 
4072 O OD2 . ASP C 151 ? 0.4231 0.5021 0.2805 0.0000  0.0174  -0.0427 151 ASP L OD2 
4073 N N   . ASN C 152 ? 0.3355 0.4400 0.2551 -0.0053 0.0346  -0.0468 152 ASN L N   
4074 C CA  . ASN C 152 ? 0.3317 0.4473 0.2592 -0.0052 0.0382  -0.0479 152 ASN L CA  
4075 C C   . ASN C 152 ? 0.3278 0.4458 0.2457 -0.0125 0.0372  -0.0429 152 ASN L C   
4076 O O   . ASN C 152 ? 0.3294 0.4629 0.2531 -0.0129 0.0399  -0.0449 152 ASN L O   
4077 C CB  . ASN C 152 ? 0.3514 0.4828 0.2846 -0.0050 0.0416  -0.0547 152 ASN L CB  
4078 C CG  . ASN C 152 ? 0.3518 0.4935 0.2944 0.0004  0.0451  -0.0574 152 ASN L CG  
4079 O OD1 . ASN C 152 ? 0.3986 0.5318 0.3470 0.0071  0.0459  -0.0563 152 ASN L OD1 
4080 N ND2 . ASN C 152 ? 0.4004 0.5610 0.3427 -0.0022 0.0467  -0.0605 152 ASN L ND2 
4081 N N   . ALA C 153 ? 0.3115 0.4159 0.2136 -0.0182 0.0339  -0.0374 153 ALA L N   
4082 C CA  . ALA C 153 ? 0.3138 0.4173 0.2038 -0.0275 0.0338  -0.0331 153 ALA L CA  
4083 C C   . ALA C 153 ? 0.3072 0.4010 0.2003 -0.0239 0.0326  -0.0290 153 ALA L C   
4084 O O   . ALA C 153 ? 0.3119 0.3881 0.2018 -0.0186 0.0295  -0.0260 153 ALA L O   
4085 C CB  . ALA C 153 ? 0.3313 0.4202 0.1978 -0.0360 0.0315  -0.0293 153 ALA L CB  
4086 N N   . LEU C 154 ? 0.3025 0.4098 0.2019 -0.0258 0.0349  -0.0294 154 LEU L N   
4087 C CA  . LEU C 154 ? 0.3081 0.4088 0.2105 -0.0229 0.0341  -0.0258 154 LEU L CA  
4088 C C   . LEU C 154 ? 0.3149 0.3958 0.1971 -0.0313 0.0314  -0.0199 154 LEU L C   
4089 O O   . LEU C 154 ? 0.3250 0.4060 0.1907 -0.0439 0.0323  -0.0191 154 LEU L O   
4090 C CB  . LEU C 154 ? 0.3240 0.4475 0.2360 -0.0227 0.0371  -0.0283 154 LEU L CB  
4091 C CG  . LEU C 154 ? 0.3565 0.4765 0.2693 -0.0220 0.0363  -0.0246 154 LEU L CG  
4092 C CD1 . LEU C 154 ? 0.3754 0.4802 0.2975 -0.0102 0.0349  -0.0224 154 LEU L CD1 
4093 C CD2 . LEU C 154 ? 0.3756 0.5243 0.2961 -0.0221 0.0392  -0.0283 154 LEU L CD2 
4094 N N   . GLN C 155 ? 0.3066 0.3695 0.1880 -0.0249 0.0285  -0.0163 155 GLN L N   
4095 C CA  . GLN C 155 ? 0.3218 0.3610 0.1819 -0.0296 0.0254  -0.0109 155 GLN L CA  
4096 C C   . GLN C 155 ? 0.3206 0.3605 0.1786 -0.0353 0.0264  -0.0084 155 GLN L C   
4097 O O   . GLN C 155 ? 0.2906 0.3453 0.1664 -0.0301 0.0279  -0.0099 155 GLN L O   
4098 C CB  . GLN C 155 ? 0.3264 0.3491 0.1867 -0.0185 0.0213  -0.0093 155 GLN L CB  
4099 C CG  . GLN C 155 ? 0.3285 0.3540 0.1924 -0.0125 0.0203  -0.0129 155 GLN L CG  
4100 C CD  . GLN C 155 ? 0.3585 0.3736 0.1997 -0.0190 0.0190  -0.0113 155 GLN L CD  
4101 O OE1 . GLN C 155 ? 0.3767 0.3694 0.1961 -0.0186 0.0156  -0.0071 155 GLN L OE1 
4102 N NE2 . GLN C 155 ? 0.3591 0.3887 0.2026 -0.0251 0.0219  -0.0146 155 GLN L NE2 
4103 N N   . SER C 156 ? 0.3504 0.3712 0.1847 -0.0449 0.0254  -0.0045 156 SER L N   
4104 C CA  . SER C 156 ? 0.3671 0.3832 0.1955 -0.0509 0.0259  -0.0019 156 SER L CA  
4105 C C   . SER C 156 ? 0.3826 0.3637 0.1829 -0.0538 0.0229  0.0030  156 SER L C   
4106 O O   . SER C 156 ? 0.4011 0.3635 0.1784 -0.0583 0.0220  0.0046  156 SER L O   
4107 C CB  . SER C 156 ? 0.3888 0.4265 0.2153 -0.0659 0.0305  -0.0048 156 SER L CB  
4108 O OG  . SER C 156 ? 0.4378 0.4681 0.2432 -0.0786 0.0320  -0.0050 156 SER L OG  
4109 N N   . GLY C 157 ? 0.3969 0.3691 0.1977 -0.0506 0.0214  0.0055  157 GLY L N   
4110 C CA  . GLY C 157 ? 0.4345 0.3731 0.2068 -0.0538 0.0190  0.0100  157 GLY L CA  
4111 C C   . GLY C 157 ? 0.4400 0.3577 0.2064 -0.0381 0.0135  0.0121  157 GLY L C   
4112 O O   . GLY C 157 ? 0.4701 0.3593 0.2129 -0.0373 0.0110  0.0156  157 GLY L O   
4113 N N   . ASN C 158 ? 0.3908 0.3231 0.1774 -0.0260 0.0119  0.0095  158 ASN L N   
4114 C CA  . ASN C 158 ? 0.3920 0.3092 0.1713 -0.0117 0.0067  0.0101  158 ASN L CA  
4115 C C   . ASN C 158 ? 0.3514 0.2840 0.1572 0.0003  0.0052  0.0078  158 ASN L C   
4116 O O   . ASN C 158 ? 0.3343 0.2690 0.1440 0.0115  0.0021  0.0054  158 ASN L O   
4117 C CB  . ASN C 158 ? 0.3924 0.3100 0.1645 -0.0098 0.0058  0.0084  158 ASN L CB  
4118 C CG  . ASN C 158 ? 0.3758 0.3225 0.1719 -0.0136 0.0098  0.0039  158 ASN L CG  
4119 O OD1 . ASN C 158 ? 0.3672 0.3331 0.1853 -0.0153 0.0128  0.0020  158 ASN L OD1 
4120 N ND2 . ASN C 158 ? 0.3864 0.3355 0.1772 -0.0132 0.0095  0.0020  158 ASN L ND2 
4121 N N   . SER C 159 ? 0.3283 0.2757 0.1530 -0.0026 0.0082  0.0073  159 SER L N   
4122 C CA  . SER C 159 ? 0.3196 0.2788 0.1666 0.0071  0.0076  0.0055  159 SER L CA  
4123 C C   . SER C 159 ? 0.3230 0.2779 0.1712 0.0061  0.0076  0.0082  159 SER L C   
4124 O O   . SER C 159 ? 0.3239 0.2749 0.1625 -0.0037 0.0094  0.0105  159 SER L O   
4125 C CB  . SER C 159 ? 0.3032 0.2857 0.1744 0.0079  0.0115  0.0014  159 SER L CB  
4126 O OG  . SER C 159 ? 0.2930 0.2876 0.1699 -0.0001 0.0155  0.0015  159 SER L OG  
4127 N N   . GLN C 160 ? 0.3098 0.2668 0.1691 0.0155  0.0057  0.0074  160 GLN L N   
4128 C CA  . GLN C 160 ? 0.3192 0.2755 0.1836 0.0159  0.0058  0.0096  160 GLN L CA  
4129 C C   . GLN C 160 ? 0.2876 0.2599 0.1760 0.0223  0.0076  0.0071  160 GLN L C   
4130 O O   . GLN C 160 ? 0.2690 0.2468 0.1646 0.0279  0.0071  0.0035  160 GLN L O   
4131 C CB  . GLN C 160 ? 0.3575 0.2929 0.2034 0.0208  0.0012  0.0118  160 GLN L CB  
4132 C CG  . GLN C 160 ? 0.4319 0.3434 0.2480 0.0144  -0.0002 0.0148  160 GLN L CG  
4133 C CD  . GLN C 160 ? 0.4916 0.3791 0.2870 0.0199  -0.0043 0.0171  160 GLN L CD  
4134 O OE1 . GLN C 160 ? 0.5477 0.4226 0.3299 0.0311  -0.0090 0.0165  160 GLN L OE1 
4135 N NE2 . GLN C 160 ? 0.5367 0.4187 0.3282 0.0125  -0.0027 0.0193  160 GLN L NE2 
4136 N N   . GLU C 161 ? 0.2724 0.2519 0.1708 0.0204  0.0101  0.0086  161 GLU L N   
4137 C CA  . GLU C 161 ? 0.2690 0.2597 0.1864 0.0256  0.0126  0.0071  161 GLU L CA  
4138 C C   . GLU C 161 ? 0.2618 0.2471 0.1794 0.0292  0.0106  0.0090  161 GLU L C   
4139 O O   . GLU C 161 ? 0.2431 0.2202 0.1499 0.0262  0.0087  0.0120  161 GLU L O   
4140 C CB  . GLU C 161 ? 0.2689 0.2719 0.1953 0.0228  0.0168  0.0076  161 GLU L CB  
4141 C CG  . GLU C 161 ? 0.2983 0.3102 0.2280 0.0211  0.0194  0.0048  161 GLU L CG  
4142 C CD  . GLU C 161 ? 0.2888 0.3148 0.2282 0.0225  0.0234  0.0042  161 GLU L CD  
4143 O OE1 . GLU C 161 ? 0.3065 0.3367 0.2494 0.0243  0.0240  0.0065  161 GLU L OE1 
4144 O OE2 . GLU C 161 ? 0.3187 0.3524 0.2608 0.0224  0.0256  0.0012  161 GLU L OE2 
4145 N N   . SER C 162 ? 0.2478 0.2375 0.1765 0.0342  0.0115  0.0070  162 SER L N   
4146 C CA  . SER C 162 ? 0.2463 0.2350 0.1787 0.0372  0.0107  0.0084  162 SER L CA  
4147 C C   . SER C 162 ? 0.2302 0.2262 0.1764 0.0386  0.0153  0.0075  162 SER L C   
4148 O O   . SER C 162 ? 0.2201 0.2194 0.1716 0.0386  0.0181  0.0041  162 SER L O   
4149 C CB  . SER C 162 ? 0.2683 0.2528 0.1947 0.0421  0.0065  0.0060  162 SER L CB  
4150 O OG  . SER C 162 ? 0.2759 0.2609 0.2056 0.0449  0.0056  0.0066  162 SER L OG  
4151 N N   . VAL C 163 ? 0.2225 0.2191 0.1724 0.0396  0.0164  0.0104  163 VAL L N   
4152 C CA  . VAL C 163 ? 0.2312 0.2303 0.1900 0.0417  0.0210  0.0105  163 VAL L CA  
4153 C C   . VAL C 163 ? 0.2418 0.2391 0.2025 0.0433  0.0203  0.0109  163 VAL L C   
4154 O O   . VAL C 163 ? 0.2356 0.2319 0.1926 0.0437  0.0167  0.0132  163 VAL L O   
4155 C CB  . VAL C 163 ? 0.2383 0.2422 0.1987 0.0427  0.0235  0.0136  163 VAL L CB  
4156 C CG1 . VAL C 163 ? 0.2456 0.2473 0.2104 0.0473  0.0282  0.0140  163 VAL L CG1 
4157 C CG2 . VAL C 163 ? 0.2573 0.2668 0.2154 0.0404  0.0238  0.0125  163 VAL L CG2 
4158 N N   . THR C 164 ? 0.2355 0.2319 0.2004 0.0431  0.0237  0.0080  164 THR L N   
4159 C CA  . THR C 164 ? 0.2441 0.2405 0.2111 0.0433  0.0243  0.0079  164 THR L CA  
4160 C C   . THR C 164 ? 0.2516 0.2455 0.2192 0.0456  0.0258  0.0132  164 THR L C   
4161 O O   . THR C 164 ? 0.2480 0.2410 0.2152 0.0479  0.0279  0.0161  164 THR L O   
4162 C CB  . THR C 164 ? 0.2622 0.2577 0.2312 0.0397  0.0290  0.0030  164 THR L CB  
4163 O OG1 . THR C 164 ? 0.2662 0.2532 0.2339 0.0394  0.0346  0.0037  164 THR L OG1 
4164 C CG2 . THR C 164 ? 0.2792 0.2826 0.2484 0.0378  0.0269  -0.0033 164 THR L CG2 
4165 N N   . GLU C 165 ? 0.2829 0.2777 0.2512 0.0460  0.0247  0.0141  165 GLU L N   
4166 C CA  . GLU C 165 ? 0.3208 0.3131 0.2895 0.0483  0.0272  0.0185  165 GLU L CA  
4167 C C   . GLU C 165 ? 0.2940 0.2771 0.2608 0.0480  0.0337  0.0179  165 GLU L C   
4168 O O   . GLU C 165 ? 0.2978 0.2781 0.2641 0.0435  0.0362  0.0131  165 GLU L O   
4169 C CB  . GLU C 165 ? 0.3671 0.3624 0.3366 0.0481  0.0249  0.0189  165 GLU L CB  
4170 C CG  . GLU C 165 ? 0.4589 0.4581 0.4263 0.0493  0.0191  0.0205  165 GLU L CG  
4171 C CD  . GLU C 165 ? 0.5559 0.5573 0.5224 0.0508  0.0188  0.0253  165 GLU L CD  
4172 O OE1 . GLU C 165 ? 0.6248 0.6271 0.5933 0.0535  0.0222  0.0284  165 GLU L OE1 
4173 O OE2 . GLU C 165 ? 0.6836 0.6860 0.6457 0.0491  0.0153  0.0257  165 GLU L OE2 
4174 N N   . GLN C 166 ? 0.3004 0.2787 0.2645 0.0528  0.0362  0.0223  166 GLN L N   
4175 C CA  . GLN C 166 ? 0.3156 0.2788 0.2725 0.0542  0.0428  0.0228  166 GLN L CA  
4176 C C   . GLN C 166 ? 0.3133 0.2693 0.2673 0.0467  0.0463  0.0196  166 GLN L C   
4177 O O   . GLN C 166 ? 0.2943 0.2570 0.2514 0.0441  0.0443  0.0196  166 GLN L O   
4178 C CB  . GLN C 166 ? 0.3274 0.2879 0.2801 0.0629  0.0437  0.0286  166 GLN L CB  
4179 C CG  . GLN C 166 ? 0.3634 0.3042 0.3041 0.0674  0.0501  0.0296  166 GLN L CG  
4180 C CD  . GLN C 166 ? 0.4000 0.3419 0.3358 0.0798  0.0500  0.0347  166 GLN L CD  
4181 O OE1 . GLN C 166 ? 0.4217 0.3766 0.3622 0.0826  0.0465  0.0379  166 GLN L OE1 
4182 N NE2 . GLN C 166 ? 0.3825 0.3133 0.3089 0.0881  0.0533  0.0349  166 GLN L NE2 
4183 N N   . ASP C 167 ? 0.3223 0.2649 0.2693 0.0424  0.0522  0.0162  167 ASP L N   
4184 C CA  . ASP C 167 ? 0.3456 0.2824 0.2880 0.0323  0.0568  0.0118  167 ASP L CA  
4185 C C   . ASP C 167 ? 0.3719 0.2939 0.3042 0.0333  0.0610  0.0165  167 ASP L C   
4186 O O   . ASP C 167 ? 0.3642 0.2712 0.2874 0.0418  0.0632  0.0219  167 ASP L O   
4187 C CB  . ASP C 167 ? 0.3787 0.3047 0.3145 0.0255  0.0625  0.0062  167 ASP L CB  
4188 C CG  . ASP C 167 ? 0.4146 0.3389 0.3456 0.0123  0.0677  0.0000  167 ASP L CG  
4189 O OD1 . ASP C 167 ? 0.4402 0.3849 0.3804 0.0068  0.0647  -0.0062 167 ASP L OD1 
4190 O OD2 . ASP C 167 ? 0.4168 0.3188 0.3329 0.0078  0.0751  0.0010  167 ASP L OD2 
4191 N N   . SER C 168 ? 0.3620 0.2906 0.2958 0.0262  0.0614  0.0145  168 SER L N   
4192 C CA  . SER C 168 ? 0.3944 0.3108 0.3186 0.0259  0.0650  0.0188  168 SER L CA  
4193 C C   . SER C 168 ? 0.4300 0.3172 0.3344 0.0197  0.0746  0.0182  168 SER L C   
4194 O O   . SER C 168 ? 0.5053 0.3745 0.3964 0.0226  0.0782  0.0236  168 SER L O   
4195 C CB  . SER C 168 ? 0.3933 0.3276 0.3251 0.0190  0.0627  0.0155  168 SER L CB  
4196 O OG  . SER C 168 ? 0.3834 0.3223 0.3137 0.0057  0.0668  0.0069  168 SER L OG  
4197 N N   A LYS C 169 ? 0.4312 0.3112 0.3310 0.0118  0.0789  0.0120  169 LYS L N   
4198 N N   B LYS C 169 ? 0.4530 0.3351 0.3536 0.0102  0.0789  0.0114  169 LYS L N   
4199 C CA  A LYS C 169 ? 0.4505 0.3017 0.3291 0.0009  0.0892  0.0089  169 LYS L CA  
4200 C CA  B LYS C 169 ? 0.4894 0.3400 0.3678 0.0020  0.0890  0.0097  169 LYS L CA  
4201 C C   A LYS C 169 ? 0.4634 0.2891 0.3285 0.0078  0.0929  0.0105  169 LYS L C   
4202 C C   B LYS C 169 ? 0.5048 0.3318 0.3714 0.0156  0.0903  0.0152  169 LYS L C   
4203 O O   A LYS C 169 ? 0.4572 0.2489 0.2981 0.0041  0.1014  0.0112  169 LYS L O   
4204 O O   B LYS C 169 ? 0.5009 0.3046 0.3510 0.0239  0.0932  0.0219  169 LYS L O   
4205 C CB  A LYS C 169 ? 0.4620 0.3284 0.3452 -0.0167 0.0920  -0.0016 169 LYS L CB  
4206 C CB  B LYS C 169 ? 0.5138 0.3713 0.3931 -0.0140 0.0930  -0.0008 169 LYS L CB  
4207 C CG  A LYS C 169 ? 0.4610 0.3432 0.3476 -0.0265 0.0923  -0.0044 169 LYS L CG  
4208 C CG  B LYS C 169 ? 0.5252 0.4067 0.4126 -0.0277 0.0930  -0.0078 169 LYS L CG  
4209 C CD  A LYS C 169 ? 0.4838 0.3758 0.3676 -0.0460 0.0982  -0.0157 169 LYS L CD  
4210 C CD  B LYS C 169 ? 0.5545 0.4404 0.4377 -0.0453 0.0992  -0.0190 169 LYS L CD  
4211 C CE  A LYS C 169 ? 0.4807 0.4041 0.3827 -0.0464 0.0925  -0.0237 169 LYS L CE  
4212 C CE  B LYS C 169 ? 0.5544 0.4796 0.4540 -0.0535 0.0953  -0.0280 169 LYS L CE  
4213 N NZ  A LYS C 169 ? 0.4668 0.4237 0.3882 -0.0387 0.0828  -0.0241 169 LYS L NZ  
4214 N NZ  B LYS C 169 ? 0.5633 0.4994 0.4662 -0.0530 0.0930  -0.0253 169 LYS L NZ  
4215 N N   A ASP C 170 ? 0.4375 0.2763 0.3148 0.0178  0.0872  0.0109  170 ASP L N   
4216 N N   B ASP C 170 ? 0.4748 0.3101 0.3498 0.0191  0.0876  0.0122  170 ASP L N   
4217 C CA  A ASP C 170 ? 0.4583 0.2747 0.3227 0.0275  0.0901  0.0130  170 ASP L CA  
4218 C CA  B ASP C 170 ? 0.4829 0.2962 0.3451 0.0288  0.0905  0.0140  170 ASP L CA  
4219 C C   A ASP C 170 ? 0.4433 0.2742 0.3183 0.0453  0.0828  0.0186  170 ASP L C   
4220 C C   B ASP C 170 ? 0.4582 0.2869 0.3315 0.0464  0.0831  0.0194  170 ASP L C   
4221 O O   A ASP C 170 ? 0.4590 0.2794 0.3271 0.0536  0.0840  0.0187  170 ASP L O   
4222 O O   B ASP C 170 ? 0.4781 0.2948 0.3432 0.0559  0.0844  0.0201  170 ASP L O   
4223 C CB  A ASP C 170 ? 0.4732 0.2870 0.3366 0.0178  0.0937  0.0049  170 ASP L CB  
4224 C CB  B ASP C 170 ? 0.4901 0.3041 0.3537 0.0193  0.0932  0.0058  170 ASP L CB  
4225 C CG  A ASP C 170 ? 0.4417 0.2888 0.3284 0.0184  0.0861  0.0012  170 ASP L CG  
4226 C CG  B ASP C 170 ? 0.4540 0.3044 0.3425 0.0185  0.0851  0.0023  170 ASP L CG  
4227 O OD1 A ASP C 170 ? 0.4160 0.2848 0.3175 0.0261  0.0784  0.0052  170 ASP L OD1 
4228 O OD1 B ASP C 170 ? 0.4476 0.3081 0.3410 0.0067  0.0864  -0.0055 170 ASP L OD1 
4229 O OD2 A ASP C 170 ? 0.4503 0.2997 0.3381 0.0109  0.0882  -0.0055 170 ASP L OD2 
4230 O OD2 B ASP C 170 ? 0.4272 0.2950 0.3283 0.0293  0.0778  0.0072  170 ASP L OD2 
4231 N N   . SER C 171 ? 0.4196 0.2745 0.3098 0.0497  0.0759  0.0222  171 SER L N   
4232 C CA  . SER C 171 ? 0.3995 0.2720 0.2995 0.0636  0.0692  0.0270  171 SER L CA  
4233 C C   . SER C 171 ? 0.3813 0.2676 0.2908 0.0664  0.0659  0.0238  171 SER L C   
4234 O O   . SER C 171 ? 0.3727 0.2700 0.2856 0.0777  0.0624  0.0267  171 SER L O   
4235 C CB  . SER C 171 ? 0.4440 0.2996 0.3285 0.0779  0.0714  0.0334  171 SER L CB  
4236 O OG  . SER C 171 ? 0.4575 0.2922 0.3274 0.0738  0.0764  0.0360  171 SER L OG  
4237 N N   . THR C 172 ? 0.3513 0.2414 0.2660 0.0559  0.0666  0.0177  172 THR L N   
4238 C CA  . THR C 172 ? 0.3345 0.2372 0.2575 0.0571  0.0637  0.0144  172 THR L CA  
4239 C C   . THR C 172 ? 0.3116 0.2404 0.2508 0.0533  0.0564  0.0134  172 THR L C   
4240 O O   . THR C 172 ? 0.2844 0.2202 0.2281 0.0492  0.0541  0.0141  172 THR L O   
4241 C CB  . THR C 172 ? 0.3464 0.2371 0.2634 0.0491  0.0687  0.0079  172 THR L CB  
4242 O OG1 . THR C 172 ? 0.3364 0.2350 0.2589 0.0360  0.0690  0.0027  172 THR L OG1 
4243 C CG2 . THR C 172 ? 0.3806 0.2393 0.2768 0.0515  0.0768  0.0082  172 THR L CG2 
4244 N N   . TYR C 173 ? 0.2954 0.2359 0.2406 0.0555  0.0532  0.0120  173 TYR L N   
4245 C CA  . TYR C 173 ? 0.2807 0.2400 0.2362 0.0516  0.0471  0.0105  173 TYR L CA  
4246 C C   . TYR C 173 ? 0.2661 0.2264 0.2229 0.0450  0.0480  0.0042  173 TYR L C   
4247 O O   . TYR C 173 ? 0.2594 0.2083 0.2103 0.0448  0.0531  0.0014  173 TYR L O   
4248 C CB  . TYR C 173 ? 0.2909 0.2625 0.2495 0.0575  0.0433  0.0134  173 TYR L CB  
4249 C CG  . TYR C 173 ? 0.3217 0.2972 0.2798 0.0636  0.0421  0.0187  173 TYR L CG  
4250 C CD1 . TYR C 173 ? 0.3566 0.3250 0.3081 0.0730  0.0455  0.0212  173 TYR L CD1 
4251 C CD2 . TYR C 173 ? 0.3211 0.3055 0.2834 0.0609  0.0378  0.0208  173 TYR L CD2 
4252 C CE1 . TYR C 173 ? 0.3770 0.3506 0.3275 0.0796  0.0444  0.0256  173 TYR L CE1 
4253 C CE2 . TYR C 173 ? 0.3457 0.3344 0.3076 0.0659  0.0371  0.0251  173 TYR L CE2 
4254 C CZ  . TYR C 173 ? 0.3788 0.3637 0.3355 0.0752  0.0403  0.0275  173 TYR L CZ  
4255 O OH  . TYR C 173 ? 0.4045 0.3957 0.3600 0.0817  0.0395  0.0314  173 TYR L OH  
4256 N N   . SER C 174 ? 0.2409 0.2137 0.2034 0.0409  0.0432  0.0019  174 SER L N   
4257 C CA  . SER C 174 ? 0.2352 0.2139 0.1993 0.0370  0.0423  -0.0034 174 SER L CA  
4258 C C   . SER C 174 ? 0.2292 0.2184 0.1954 0.0391  0.0360  -0.0015 174 SER L C   
4259 O O   . SER C 174 ? 0.2148 0.2072 0.1812 0.0411  0.0321  0.0025  174 SER L O   
4260 C CB  . SER C 174 ? 0.2405 0.2227 0.2055 0.0302  0.0435  -0.0096 174 SER L CB  
4261 O OG  . SER C 174 ? 0.2547 0.2241 0.2143 0.0257  0.0506  -0.0119 174 SER L OG  
4262 N N   . LEU C 175 ? 0.2276 0.2209 0.1936 0.0377  0.0352  -0.0044 175 LEU L N   
4263 C CA  . LEU C 175 ? 0.2245 0.2241 0.1886 0.0383  0.0301  -0.0024 175 LEU L CA  
4264 C C   . LEU C 175 ? 0.2267 0.2307 0.1893 0.0359  0.0281  -0.0072 175 LEU L C   
4265 O O   . LEU C 175 ? 0.2225 0.2269 0.1869 0.0339  0.0317  -0.0119 175 LEU L O   
4266 C CB  . LEU C 175 ? 0.2341 0.2355 0.1979 0.0405  0.0318  0.0001  175 LEU L CB  
4267 C CG  . LEU C 175 ? 0.2459 0.2541 0.2060 0.0383  0.0284  0.0015  175 LEU L CG  
4268 C CD1 . LEU C 175 ? 0.2569 0.2723 0.2179 0.0406  0.0301  0.0037  175 LEU L CD1 
4269 C CD2 . LEU C 175 ? 0.2491 0.2596 0.2074 0.0357  0.0282  -0.0023 175 LEU L CD2 
4270 N N   . SER C 176 ? 0.2259 0.2317 0.1832 0.0366  0.0227  -0.0061 176 SER L N   
4271 C CA  . SER C 176 ? 0.2405 0.2499 0.1932 0.0364  0.0199  -0.0098 176 SER L CA  
4272 C C   . SER C 176 ? 0.2554 0.2617 0.2005 0.0350  0.0180  -0.0062 176 SER L C   
4273 O O   . SER C 176 ? 0.2521 0.2539 0.1923 0.0344  0.0162  -0.0016 176 SER L O   
4274 C CB  . SER C 176 ? 0.2602 0.2720 0.2082 0.0399  0.0150  -0.0119 176 SER L CB  
4275 O OG  . SER C 176 ? 0.2837 0.2876 0.2236 0.0424  0.0108  -0.0068 176 SER L OG  
4276 N N   . SER C 177 ? 0.2424 0.2517 0.1852 0.0335  0.0182  -0.0089 177 SER L N   
4277 C CA  . SER C 177 ? 0.2528 0.2589 0.1848 0.0308  0.0159  -0.0064 177 SER L CA  
4278 C C   . SER C 177 ? 0.2581 0.2632 0.1815 0.0332  0.0122  -0.0094 177 SER L C   
4279 O O   . SER C 177 ? 0.2679 0.2817 0.1982 0.0341  0.0139  -0.0149 177 SER L O   
4280 C CB  . SER C 177 ? 0.2535 0.2655 0.1893 0.0273  0.0196  -0.0066 177 SER L CB  
4281 O OG  . SER C 177 ? 0.2650 0.2752 0.1892 0.0228  0.0179  -0.0052 177 SER L OG  
4282 N N   . THR C 178 ? 0.2583 0.2527 0.1656 0.0346  0.0076  -0.0063 178 THR L N   
4283 C CA  . THR C 178 ? 0.2688 0.2602 0.1638 0.0396  0.0032  -0.0085 178 THR L CA  
4284 C C   . THR C 178 ? 0.2794 0.2606 0.1580 0.0351  0.0025  -0.0056 178 THR L C   
4285 O O   . THR C 178 ? 0.2866 0.2540 0.1521 0.0306  0.0019  -0.0006 178 THR L O   
4286 C CB  . THR C 178 ? 0.2877 0.2705 0.1721 0.0474  -0.0018 -0.0074 178 THR L CB  
4287 O OG1 . THR C 178 ? 0.2761 0.2703 0.1770 0.0490  0.0000  -0.0102 178 THR L OG1 
4288 C CG2 . THR C 178 ? 0.3024 0.2834 0.1726 0.0558  -0.0068 -0.0102 178 THR L CG2 
4289 N N   . LEU C 179 ? 0.2808 0.2687 0.1590 0.0350  0.0028  -0.0090 179 LEU L N   
4290 C CA  . LEU C 179 ? 0.2976 0.2768 0.1586 0.0307  0.0021  -0.0070 179 LEU L CA  
4291 C C   . LEU C 179 ? 0.3258 0.2914 0.1649 0.0395  -0.0038 -0.0064 179 LEU L C   
4292 O O   . LEU C 179 ? 0.3247 0.3021 0.1701 0.0480  -0.0059 -0.0114 179 LEU L O   
4293 C CB  . LEU C 179 ? 0.2917 0.2869 0.1648 0.0273  0.0057  -0.0115 179 LEU L CB  
4294 C CG  . LEU C 179 ? 0.3162 0.3057 0.1734 0.0225  0.0054  -0.0103 179 LEU L CG  
4295 C CD1 . LEU C 179 ? 0.3293 0.3116 0.1782 0.0119  0.0079  -0.0058 179 LEU L CD1 
4296 C CD2 . LEU C 179 ? 0.3121 0.3194 0.1829 0.0211  0.0084  -0.0160 179 LEU L CD2 
4297 N N   . THR C 180 ? 0.3512 0.2929 0.1640 0.0380  -0.0062 -0.0011 180 THR L N   
4298 C CA  . THR C 180 ? 0.4000 0.3238 0.1869 0.0492  -0.0122 -0.0001 180 THR L CA  
4299 C C   . THR C 180 ? 0.4302 0.3401 0.1943 0.0451  -0.0124 0.0020  180 THR L C   
4300 O O   . THR C 180 ? 0.4348 0.3303 0.1866 0.0327  -0.0094 0.0062  180 THR L O   
4301 C CB  . THR C 180 ? 0.4315 0.3333 0.2016 0.0535  -0.0153 0.0039  180 THR L CB  
4302 O OG1 . THR C 180 ? 0.4081 0.3268 0.2021 0.0565  -0.0147 0.0013  180 THR L OG1 
4303 C CG2 . THR C 180 ? 0.4803 0.3618 0.2208 0.0679  -0.0218 0.0046  180 THR L CG2 
4304 N N   . LEU C 181 ? 0.4397 0.3570 0.1998 0.0544  -0.0154 -0.0015 181 LEU L N   
4305 C CA  . LEU C 181 ? 0.4976 0.4011 0.2334 0.0530  -0.0164 0.0003  181 LEU L CA  
4306 C C   . LEU C 181 ? 0.5264 0.4142 0.2351 0.0707  -0.0235 0.0006  181 LEU L C   
4307 O O   . LEU C 181 ? 0.5341 0.4369 0.2533 0.0839  -0.0272 -0.0037 181 LEU L O   
4308 C CB  . LEU C 181 ? 0.4946 0.4256 0.2523 0.0484  -0.0131 -0.0049 181 LEU L CB  
4309 C CG  . LEU C 181 ? 0.4927 0.4422 0.2780 0.0350  -0.0065 -0.0065 181 LEU L CG  
4310 C CD1 . LEU C 181 ? 0.5009 0.4735 0.3031 0.0321  -0.0036 -0.0121 181 LEU L CD1 
4311 C CD2 . LEU C 181 ? 0.5207 0.4541 0.2922 0.0211  -0.0032 -0.0010 181 LEU L CD2 
4312 N N   . SER C 182 ? 0.5659 0.4261 0.2401 0.0711  -0.0252 0.0050  182 SER L N   
4313 C CA  . SER C 182 ? 0.5887 0.4376 0.2364 0.0902  -0.0320 0.0045  182 SER L CA  
4314 C C   . SER C 182 ? 0.5741 0.4610 0.2458 0.0968  -0.0329 -0.0034 182 SER L C   
4315 O O   . SER C 182 ? 0.5483 0.4579 0.2457 0.0835  -0.0275 -0.0063 182 SER L O   
4316 C CB  . SER C 182 ? 0.6369 0.4452 0.2401 0.0871  -0.0325 0.0113  182 SER L CB  
4317 O OG  . SER C 182 ? 0.6272 0.4461 0.2369 0.0731  -0.0279 0.0109  182 SER L OG  
4318 N N   . LYS C 183 ? 0.5875 0.4834 0.2512 0.1169  -0.0394 -0.0076 183 LYS L N   
4319 C CA  . LYS C 183 ? 0.5934 0.5250 0.2747 0.1227  -0.0404 -0.0158 183 LYS L CA  
4320 C C   . LYS C 183 ? 0.5943 0.5203 0.2671 0.1120  -0.0372 -0.0135 183 LYS L C   
4321 O O   . LYS C 183 ? 0.5668 0.5230 0.2674 0.1035  -0.0332 -0.0194 183 LYS L O   
4322 C CB  . LYS C 183 ? 0.6465 0.5841 0.3099 0.1472  -0.0486 -0.0199 183 LYS L CB  
4323 C CG  . LYS C 183 ? 0.6496 0.6239 0.3277 0.1517  -0.0494 -0.0284 183 LYS L CG  
4324 C CD  . LYS C 183 ? 0.6778 0.6807 0.3596 0.1716  -0.0555 -0.0370 183 LYS L CD  
4325 C CE  . LYS C 183 ? 0.7440 0.7232 0.3832 0.1950  -0.0639 -0.0338 183 LYS L CE  
4326 N NZ  . LYS C 183 ? 0.7991 0.8064 0.4371 0.2054  -0.0670 -0.0408 183 LYS L NZ  
4327 N N   . ALA C 184 ? 0.6337 0.5207 0.2682 0.1110  -0.0383 -0.0055 184 ALA L N   
4328 C CA  . ALA C 184 ? 0.6644 0.5426 0.2844 0.1012  -0.0356 -0.0029 184 ALA L CA  
4329 C C   . ALA C 184 ? 0.6376 0.5355 0.2891 0.0789  -0.0275 -0.0045 184 ALA L C   
4330 O O   . ALA C 184 ? 0.6153 0.5404 0.2858 0.0748  -0.0252 -0.0099 184 ALA L O   
4331 C CB  . ALA C 184 ? 0.7194 0.5469 0.2907 0.1005  -0.0368 0.0064  184 ALA L CB  
4332 N N   . ASP C 185 ? 0.6174 0.5040 0.2747 0.0664  -0.0235 -0.0008 185 ASP L N   
4333 C CA  . ASP C 185 ? 0.5922 0.4967 0.2775 0.0473  -0.0162 -0.0021 185 ASP L CA  
4334 C C   . ASP C 185 ? 0.5506 0.4944 0.2767 0.0496  -0.0146 -0.0104 185 ASP L C   
4335 O O   . ASP C 185 ? 0.5313 0.4947 0.2755 0.0401  -0.0101 -0.0140 185 ASP L O   
4336 C CB  . ASP C 185 ? 0.6111 0.4992 0.2946 0.0368  -0.0133 0.0025  185 ASP L CB  
4337 C CG  . ASP C 185 ? 0.6504 0.5011 0.2941 0.0273  -0.0124 0.0097  185 ASP L CG  
4338 O OD1 . ASP C 185 ? 0.7270 0.5643 0.3457 0.0299  -0.0140 0.0112  185 ASP L OD1 
4339 O OD2 . ASP C 185 ? 0.6672 0.5032 0.3047 0.0164  -0.0095 0.0132  185 ASP L OD2 
4340 N N   . TYR C 186 ? 0.5181 0.4725 0.2556 0.0618  -0.0179 -0.0139 186 TYR L N   
4341 C CA  . TYR C 186 ? 0.4861 0.4752 0.2593 0.0619  -0.0155 -0.0223 186 TYR L CA  
4342 C C   . TYR C 186 ? 0.4995 0.5090 0.2778 0.0633  -0.0152 -0.0283 186 TYR L C   
4343 O O   . TYR C 186 ? 0.4652 0.4975 0.2691 0.0550  -0.0102 -0.0341 186 TYR L O   
4344 C CB  . TYR C 186 ? 0.4531 0.4497 0.2330 0.0741  -0.0193 -0.0253 186 TYR L CB  
4345 C CG  . TYR C 186 ? 0.4210 0.4506 0.2330 0.0727  -0.0162 -0.0344 186 TYR L CG  
4346 C CD1 . TYR C 186 ? 0.3930 0.4301 0.2290 0.0611  -0.0100 -0.0353 186 TYR L CD1 
4347 C CD2 . TYR C 186 ? 0.4186 0.4715 0.2345 0.0829  -0.0194 -0.0424 186 TYR L CD2 
4348 C CE1 . TYR C 186 ? 0.3751 0.4370 0.2359 0.0585  -0.0064 -0.0435 186 TYR L CE1 
4349 C CE2 . TYR C 186 ? 0.3902 0.4724 0.2330 0.0786  -0.0156 -0.0516 186 TYR L CE2 
4350 C CZ  . TYR C 186 ? 0.3691 0.4530 0.2330 0.0661  -0.0089 -0.0518 186 TYR L CZ  
4351 O OH  . TYR C 186 ? 0.3391 0.4466 0.2245 0.0615  -0.0048 -0.0607 186 TYR L OH  
4352 N N   . GLU C 187 ? 0.5418 0.5421 0.2943 0.0741  -0.0205 -0.0272 187 GLU L N   
4353 C CA  . GLU C 187 ? 0.5597 0.5827 0.3160 0.0785  -0.0215 -0.0339 187 GLU L CA  
4354 C C   . GLU C 187 ? 0.5709 0.5912 0.3245 0.0656  -0.0172 -0.0321 187 GLU L C   
4355 O O   . GLU C 187 ? 0.5480 0.5909 0.3109 0.0665  -0.0166 -0.0387 187 GLU L O   
4356 C CB  . GLU C 187 ? 0.6024 0.6209 0.3329 0.0979  -0.0294 -0.0344 187 GLU L CB  
4357 C CG  . GLU C 187 ? 0.6112 0.6529 0.3567 0.1099  -0.0326 -0.0415 187 GLU L CG  
4358 C CD  . GLU C 187 ? 0.6522 0.6931 0.3730 0.1323  -0.0411 -0.0429 187 GLU L CD  
4359 O OE1 . GLU C 187 ? 0.6881 0.7022 0.3745 0.1402  -0.0450 -0.0367 187 GLU L OE1 
4360 O OE2 . GLU C 187 ? 0.6606 0.7278 0.3957 0.1414  -0.0435 -0.0506 187 GLU L OE2 
4361 N N   . LYS C 188 ? 0.5727 0.5708 0.3163 0.0533  -0.0139 -0.0250 188 LYS L N   
4362 C CA  . LYS C 188 ? 0.5955 0.5941 0.3369 0.0395  -0.0092 -0.0239 188 LYS L CA  
4363 C C   . LYS C 188 ? 0.5468 0.5725 0.3237 0.0293  -0.0029 -0.0301 188 LYS L C   
4364 O O   . LYS C 188 ? 0.5101 0.5420 0.2896 0.0188  0.0010  -0.0308 188 LYS L O   
4365 C CB  . LYS C 188 ? 0.6527 0.6203 0.3692 0.0288  -0.0076 -0.0151 188 LYS L CB  
4366 C CG  . LYS C 188 ? 0.7287 0.6605 0.4017 0.0360  -0.0125 -0.0081 188 LYS L CG  
4367 C CD  . LYS C 188 ? 0.7983 0.7027 0.4438 0.0197  -0.0088 -0.0012 188 LYS L CD  
4368 C CE  . LYS C 188 ? 0.8547 0.7293 0.4824 0.0149  -0.0084 0.0049  188 LYS L CE  
4369 N NZ  . LYS C 188 ? 0.9174 0.7477 0.4950 0.0168  -0.0110 0.0123  188 LYS L NZ  
4370 N N   . HIS C 189 ? 0.4856 0.5251 0.2872 0.0317  -0.0016 -0.0342 189 HIS L N   
4371 C CA  . HIS C 189 ? 0.4614 0.5167 0.2903 0.0222  0.0047  -0.0381 189 HIS L CA  
4372 C C   . HIS C 189 ? 0.4325 0.5096 0.2843 0.0267  0.0059  -0.0467 189 HIS L C   
4373 O O   . HIS C 189 ? 0.4584 0.5382 0.3080 0.0360  0.0019  -0.0487 189 HIS L O   
4374 C CB  . HIS C 189 ? 0.4648 0.5073 0.2957 0.0165  0.0067  -0.0325 189 HIS L CB  
4375 C CG  . HIS C 189 ? 0.5080 0.5314 0.3160 0.0084  0.0068  -0.0255 189 HIS L CG  
4376 N ND1 . HIS C 189 ? 0.5377 0.5682 0.3461 -0.0026 0.0110  -0.0260 189 HIS L ND1 
4377 C CD2 . HIS C 189 ? 0.5627 0.5601 0.3455 0.0086  0.0038  -0.0184 189 HIS L CD2 
4378 C CE1 . HIS C 189 ? 0.5756 0.5866 0.3599 -0.0105 0.0109  -0.0198 189 HIS L CE1 
4379 N NE2 . HIS C 189 ? 0.5960 0.5841 0.3629 -0.0039 0.0066  -0.0148 189 HIS L NE2 
4380 N N   . LYS C 190 ? 0.4284 0.5196 0.2999 0.0199  0.0116  -0.0520 190 LYS L N   
4381 C CA  . LYS C 190 ? 0.4485 0.5585 0.3392 0.0209  0.0144  -0.0614 190 LYS L CA  
4382 C C   . LYS C 190 ? 0.4061 0.5139 0.3129 0.0184  0.0185  -0.0621 190 LYS L C   
4383 O O   . LYS C 190 ? 0.3845 0.4979 0.2981 0.0217  0.0180  -0.0660 190 LYS L O   
4384 C CB  . LYS C 190 ? 0.5126 0.6364 0.4097 0.0156  0.0182  -0.0675 190 LYS L CB  
4385 C CG  . LYS C 190 ? 0.5870 0.7284 0.5002 0.0142  0.0220  -0.0781 190 LYS L CG  
4386 C CD  . LYS C 190 ? 0.6669 0.8232 0.5800 0.0117  0.0232  -0.0845 190 LYS L CD  
4387 C CE  . LYS C 190 ? 0.7393 0.9148 0.6627 0.0110  0.0254  -0.0958 190 LYS L CE  
4388 N NZ  . LYS C 190 ? 0.7817 0.9566 0.7197 0.0035  0.0331  -0.1017 190 LYS L NZ  
4389 N N   . VAL C 191 ? 0.3663 0.4678 0.2782 0.0130  0.0224  -0.0590 191 VAL L N   
4390 C CA  . VAL C 191 ? 0.3474 0.4470 0.2739 0.0115  0.0271  -0.0605 191 VAL L CA  
4391 C C   . VAL C 191 ? 0.3244 0.4104 0.2468 0.0130  0.0250  -0.0525 191 VAL L C   
4392 O O   . VAL C 191 ? 0.3064 0.3855 0.2193 0.0105  0.0237  -0.0464 191 VAL L O   
4393 C CB  . VAL C 191 ? 0.3508 0.4543 0.2858 0.0073  0.0328  -0.0636 191 VAL L CB  
4394 C CG1 . VAL C 191 ? 0.3462 0.4439 0.2919 0.0079  0.0374  -0.0652 191 VAL L CG1 
4395 C CG2 . VAL C 191 ? 0.3604 0.4764 0.2977 0.0051  0.0349  -0.0714 191 VAL L CG2 
4396 N N   . TYR C 192 ? 0.3085 0.3920 0.2372 0.0157  0.0251  -0.0533 192 TYR L N   
4397 C CA  . TYR C 192 ? 0.2996 0.3716 0.2266 0.0176  0.0235  -0.0469 192 TYR L CA  
4398 C C   . TYR C 192 ? 0.2956 0.3665 0.2359 0.0161  0.0291  -0.0489 192 TYR L C   
4399 O O   . TYR C 192 ? 0.3102 0.3847 0.2584 0.0155  0.0323  -0.0549 192 TYR L O   
4400 C CB  . TYR C 192 ? 0.3023 0.3722 0.2223 0.0236  0.0182  -0.0461 192 TYR L CB  
4401 C CG  . TYR C 192 ? 0.3062 0.3699 0.2074 0.0270  0.0125  -0.0423 192 TYR L CG  
4402 C CD1 . TYR C 192 ? 0.3129 0.3595 0.1995 0.0272  0.0096  -0.0342 192 TYR L CD1 
4403 C CD2 . TYR C 192 ? 0.3095 0.3828 0.2053 0.0294  0.0106  -0.0467 192 TYR L CD2 
4404 C CE1 . TYR C 192 ? 0.3338 0.3690 0.1982 0.0294  0.0053  -0.0304 192 TYR L CE1 
4405 C CE2 . TYR C 192 ? 0.3309 0.3951 0.2057 0.0332  0.0057  -0.0427 192 TYR L CE2 
4406 C CZ  . TYR C 192 ? 0.3419 0.3849 0.1998 0.0332  0.0032  -0.0343 192 TYR L CZ  
4407 O OH  . TYR C 192 ? 0.3783 0.4066 0.2107 0.0363  -0.0010 -0.0300 192 TYR L OH  
4408 N N   . ALA C 193 ? 0.2854 0.3508 0.2264 0.0153  0.0306  -0.0440 193 ALA L N   
4409 C CA  . ALA C 193 ? 0.2862 0.3484 0.2364 0.0161  0.0356  -0.0450 193 ALA L CA  
4410 C C   . ALA C 193 ? 0.2717 0.3266 0.2213 0.0180  0.0344  -0.0383 193 ALA L C   
4411 O O   . ALA C 193 ? 0.2726 0.3273 0.2154 0.0165  0.0316  -0.0334 193 ALA L O   
4412 C CB  . ALA C 193 ? 0.2945 0.3625 0.2472 0.0153  0.0394  -0.0478 193 ALA L CB  
4413 N N   . CYS C 194 ? 0.2682 0.3170 0.2236 0.0203  0.0373  -0.0390 194 CYS L N   
4414 C CA  . CYS C 194 ? 0.2716 0.3143 0.2281 0.0229  0.0373  -0.0335 194 CYS L CA  
4415 C C   . CYS C 194 ? 0.2715 0.3126 0.2317 0.0264  0.0424  -0.0348 194 CYS L C   
4416 O O   . CYS C 194 ? 0.2807 0.3153 0.2425 0.0271  0.0466  -0.0394 194 CYS L O   
4417 C CB  . CYS C 194 ? 0.2793 0.3155 0.2374 0.0236  0.0366  -0.0333 194 CYS L CB  
4418 S SG  . CYS C 194 ? 0.3260 0.3552 0.2849 0.0269  0.0362  -0.0266 194 CYS L SG  
4419 N N   . GLU C 195 ? 0.2642 0.3116 0.2240 0.0286  0.0421  -0.0317 195 GLU L N   
4420 C CA  . GLU C 195 ? 0.2804 0.3279 0.2421 0.0354  0.0462  -0.0330 195 GLU L CA  
4421 C C   . GLU C 195 ? 0.2704 0.3146 0.2325 0.0403  0.0460  -0.0281 195 GLU L C   
4422 O O   . GLU C 195 ? 0.2607 0.3135 0.2222 0.0379  0.0427  -0.0240 195 GLU L O   
4423 C CB  . GLU C 195 ? 0.3039 0.3674 0.2653 0.0356  0.0464  -0.0352 195 GLU L CB  
4424 C CG  . GLU C 195 ? 0.3452 0.4118 0.3072 0.0455  0.0499  -0.0370 195 GLU L CG  
4425 C CD  . GLU C 195 ? 0.3871 0.4770 0.3497 0.0460  0.0489  -0.0378 195 GLU L CD  
4426 O OE1 . GLU C 195 ? 0.4092 0.5104 0.3718 0.0436  0.0464  -0.0339 195 GLU L OE1 
4427 O OE2 . GLU C 195 ? 0.4138 0.5117 0.3764 0.0475  0.0507  -0.0428 195 GLU L OE2 
4428 N N   . VAL C 196 ? 0.2677 0.2989 0.2289 0.0467  0.0498  -0.0287 196 VAL L N   
4429 C CA  . VAL C 196 ? 0.2709 0.2958 0.2314 0.0518  0.0498  -0.0240 196 VAL L CA  
4430 C C   . VAL C 196 ? 0.2738 0.2995 0.2311 0.0633  0.0527  -0.0245 196 VAL L C   
4431 O O   . VAL C 196 ? 0.2840 0.2978 0.2361 0.0686  0.0571  -0.0286 196 VAL L O   
4432 C CB  . VAL C 196 ? 0.2783 0.2850 0.2371 0.0493  0.0517  -0.0239 196 VAL L CB  
4433 C CG1 . VAL C 196 ? 0.2779 0.2751 0.2342 0.0553  0.0528  -0.0195 196 VAL L CG1 
4434 C CG2 . VAL C 196 ? 0.2831 0.2942 0.2448 0.0408  0.0477  -0.0236 196 VAL L CG2 
4435 N N   . THR C 197 ? 0.2671 0.3066 0.2260 0.0676  0.0504  -0.0210 197 THR L N   
4436 C CA  . THR C 197 ? 0.2802 0.3254 0.2358 0.0812  0.0522  -0.0214 197 THR L CA  
4437 C C   . THR C 197 ? 0.2792 0.3144 0.2325 0.0864  0.0521  -0.0163 197 THR L C   
4438 O O   . THR C 197 ? 0.2770 0.3184 0.2347 0.0795  0.0489  -0.0125 197 THR L O   
4439 C CB  . THR C 197 ? 0.2768 0.3528 0.2364 0.0815  0.0498  -0.0230 197 THR L CB  
4440 O OG1 . THR C 197 ? 0.2768 0.3613 0.2377 0.0761  0.0501  -0.0277 197 THR L OG1 
4441 C CG2 . THR C 197 ? 0.2954 0.3833 0.2519 0.0974  0.0509  -0.0244 197 THR L CG2 
4442 N N   . HIS C 198 ? 0.2901 0.3074 0.2345 0.0981  0.0557  -0.0161 198 HIS L N   
4443 C CA  . HIS C 198 ? 0.2944 0.2994 0.2344 0.1035  0.0561  -0.0110 198 HIS L CA  
4444 C C   . HIS C 198 ? 0.3203 0.3125 0.2471 0.1215  0.0595  -0.0115 198 HIS L C   
4445 O O   . HIS C 198 ? 0.3273 0.3043 0.2454 0.1261  0.0632  -0.0156 198 HIS L O   
4446 C CB  . HIS C 198 ? 0.2923 0.2744 0.2308 0.0933  0.0576  -0.0093 198 HIS L CB  
4447 C CG  . HIS C 198 ? 0.2930 0.2649 0.2279 0.0969  0.0578  -0.0041 198 HIS L CG  
4448 N ND1 . HIS C 198 ? 0.3120 0.2587 0.2324 0.1067  0.0623  -0.0028 198 HIS L ND1 
4449 C CD2 . HIS C 198 ? 0.2756 0.2577 0.2171 0.0926  0.0542  0.0000  198 HIS L CD2 
4450 C CE1 . HIS C 198 ? 0.3171 0.2608 0.2366 0.1083  0.0614  0.0021  198 HIS L CE1 
4451 N NE2 . HIS C 198 ? 0.2933 0.2604 0.2269 0.0999  0.0561  0.0038  198 HIS L NE2 
4452 N N   . GLN C 199 ? 0.3327 0.3304 0.2568 0.1317  0.0581  -0.0075 199 GLN L N   
4453 C CA  . GLN C 199 ? 0.3732 0.3586 0.2820 0.1521  0.0605  -0.0068 199 GLN L CA  
4454 C C   . GLN C 199 ? 0.3924 0.3345 0.2826 0.1555  0.0667  -0.0074 199 GLN L C   
4455 O O   . GLN C 199 ? 0.4133 0.3413 0.2868 0.1733  0.0693  -0.0090 199 GLN L O   
4456 C CB  . GLN C 199 ? 0.4092 0.3952 0.3169 0.1564  0.0589  -0.0009 199 GLN L CB  
4457 C CG  . GLN C 199 ? 0.4597 0.4733 0.3671 0.1728  0.0561  -0.0011 199 GLN L CG  
4458 C CD  . GLN C 199 ? 0.4470 0.4709 0.3608 0.1686  0.0533  0.0040  199 GLN L CD  
4459 O OE1 . GLN C 199 ? 0.4819 0.4908 0.3843 0.1806  0.0544  0.0078  199 GLN L OE1 
4460 N NE2 . GLN C 199 ? 0.4280 0.4732 0.3576 0.1514  0.0500  0.0040  199 GLN L NE2 
4461 N N   . GLY C 200 ? 0.3751 0.2959 0.2653 0.1400  0.0690  -0.0063 200 GLY L N   
4462 C CA  . GLY C 200 ? 0.4111 0.2897 0.2819 0.1387  0.0758  -0.0070 200 GLY L CA  
4463 C C   . GLY C 200 ? 0.4177 0.2857 0.2846 0.1331  0.0795  -0.0138 200 GLY L C   
4464 O O   . GLY C 200 ? 0.4442 0.2768 0.2928 0.1315  0.0858  -0.0156 200 GLY L O   
4465 N N   . LEU C 201 ? 0.3953 0.2928 0.2780 0.1291  0.0758  -0.0175 201 LEU L N   
4466 C CA  . LEU C 201 ? 0.4143 0.3073 0.2956 0.1240  0.0785  -0.0242 201 LEU L CA  
4467 C C   . LEU C 201 ? 0.4359 0.3348 0.3097 0.1418  0.0787  -0.0275 201 LEU L C   
4468 O O   . LEU C 201 ? 0.4290 0.3599 0.3125 0.1506  0.0738  -0.0266 201 LEU L O   
4469 C CB  . LEU C 201 ? 0.3881 0.3099 0.2900 0.1086  0.0742  -0.0261 201 LEU L CB  
4470 C CG  . LEU C 201 ? 0.3783 0.2975 0.2877 0.0921  0.0735  -0.0245 201 LEU L CG  
4471 C CD1 . LEU C 201 ? 0.3478 0.2958 0.2744 0.0815  0.0682  -0.0255 201 LEU L CD1 
4472 C CD2 . LEU C 201 ? 0.4072 0.2974 0.3054 0.0826  0.0800  -0.0286 201 LEU L CD2 
4473 N N   . SER C 202 ? 0.4622 0.3349 0.3202 0.1450  0.0841  -0.0325 202 SER L N   
4474 C CA  . SER C 202 ? 0.4855 0.3627 0.3345 0.1636  0.0843  -0.0367 202 SER L CA  
4475 C C   . SER C 202 ? 0.4742 0.3945 0.3444 0.1587  0.0795  -0.0405 202 SER L C   
4476 O O   . SER C 202 ? 0.4786 0.4203 0.3490 0.1736  0.0773  -0.0432 202 SER L O   
4477 C CB  . SER C 202 ? 0.5113 0.3462 0.3366 0.1659  0.0917  -0.0414 202 SER L CB  
4478 O OG  . SER C 202 ? 0.5426 0.3355 0.3439 0.1714  0.0965  -0.0373 202 SER L OG  
4479 N N   . SER C 203 ? 0.4613 0.3924 0.3465 0.1386  0.0784  -0.0417 203 SER L N   
4480 C CA  . SER C 203 ? 0.4486 0.4172 0.3517 0.1312  0.0740  -0.0446 203 SER L CA  
4481 C C   . SER C 203 ? 0.4168 0.3918 0.3333 0.1109  0.0717  -0.0423 203 SER L C   
4482 O O   . SER C 203 ? 0.4002 0.3527 0.3126 0.1030  0.0741  -0.0405 203 SER L O   
4483 C CB  . SER C 203 ? 0.4901 0.4589 0.3892 0.1339  0.0765  -0.0520 203 SER L CB  
4484 O OG  . SER C 203 ? 0.5419 0.4863 0.4366 0.1208  0.0807  -0.0552 203 SER L OG  
4485 N N   . PRO C 204 ? 0.4005 0.4061 0.3312 0.1025  0.0671  -0.0423 204 PRO L N   
4486 C CA  . PRO C 204 ? 0.3793 0.3899 0.3197 0.0864  0.0642  -0.0396 204 PRO L CA  
4487 C C   . PRO C 204 ? 0.3829 0.3760 0.3211 0.0759  0.0673  -0.0435 204 PRO L C   
4488 O O   . PRO C 204 ? 0.3867 0.3753 0.3207 0.0772  0.0704  -0.0493 204 PRO L O   
4489 C CB  . PRO C 204 ? 0.3660 0.4079 0.3159 0.0808  0.0599  -0.0404 204 PRO L CB  
4490 C CG  . PRO C 204 ? 0.3794 0.4394 0.3276 0.0943  0.0597  -0.0420 204 PRO L CG  
4491 C CD  . PRO C 204 ? 0.4092 0.4457 0.3453 0.1080  0.0645  -0.0451 204 PRO L CD  
4492 N N   . VAL C 205 ? 0.3672 0.3534 0.3083 0.0663  0.0663  -0.0411 205 VAL L N   
4493 C CA  . VAL C 205 ? 0.3762 0.3519 0.3168 0.0547  0.0687  -0.0453 205 VAL L CA  
4494 C C   . VAL C 205 ? 0.3460 0.3429 0.2966 0.0457  0.0634  -0.0452 205 VAL L C   
4495 O O   . VAL C 205 ? 0.3274 0.3358 0.2831 0.0449  0.0583  -0.0397 205 VAL L O   
4496 C CB  . VAL C 205 ? 0.3996 0.3553 0.3348 0.0514  0.0714  -0.0433 205 VAL L CB  
4497 C CG1 . VAL C 205 ? 0.4077 0.3620 0.3450 0.0381  0.0728  -0.0481 205 VAL L CG1 
4498 C CG2 . VAL C 205 ? 0.4353 0.3636 0.3552 0.0600  0.0776  -0.0438 205 VAL L CG2 
4499 N N   . THR C 206 ? 0.3323 0.3336 0.2839 0.0398  0.0644  -0.0510 206 THR L N   
4500 C CA  . THR C 206 ? 0.3266 0.3446 0.2842 0.0321  0.0596  -0.0514 206 THR L CA  
4501 C C   . THR C 206 ? 0.3430 0.3568 0.3006 0.0239  0.0611  -0.0562 206 THR L C   
4502 O O   . THR C 206 ? 0.3524 0.3550 0.3055 0.0212  0.0669  -0.0625 206 THR L O   
4503 C CB  . THR C 206 ? 0.3290 0.3610 0.2878 0.0320  0.0588  -0.0546 206 THR L CB  
4504 O OG1 . THR C 206 ? 0.3200 0.3590 0.2789 0.0392  0.0576  -0.0508 206 THR L OG1 
4505 C CG2 . THR C 206 ? 0.3186 0.3640 0.2798 0.0250  0.0540  -0.0547 206 THR L CG2 
4506 N N   . LYS C 207 ? 0.3194 0.3417 0.2803 0.0203  0.0562  -0.0539 207 LYS L N   
4507 C CA  . LYS C 207 ? 0.3271 0.3547 0.2891 0.0133  0.0563  -0.0598 207 LYS L CA  
4508 C C   . LYS C 207 ? 0.3184 0.3626 0.2816 0.0129  0.0503  -0.0596 207 LYS L C   
4509 O O   . LYS C 207 ? 0.2905 0.3379 0.2524 0.0162  0.0453  -0.0531 207 LYS L O   
4510 C CB  . LYS C 207 ? 0.3369 0.3608 0.2995 0.0112  0.0559  -0.0585 207 LYS L CB  
4511 C CG  . LYS C 207 ? 0.3620 0.3666 0.3202 0.0107  0.0621  -0.0584 207 LYS L CG  
4512 C CD  . LYS C 207 ? 0.3987 0.3931 0.3513 0.0037  0.0697  -0.0668 207 LYS L CD  
4513 C CE  . LYS C 207 ? 0.4410 0.4099 0.3842 0.0045  0.0761  -0.0652 207 LYS L CE  
4514 N NZ  . LYS C 207 ? 0.4776 0.4295 0.4102 -0.0027 0.0845  -0.0732 207 LYS L NZ  
4515 N N   . SER C 208 ? 0.3203 0.3739 0.2839 0.0087  0.0513  -0.0668 208 SER L N   
4516 C CA  . SER C 208 ? 0.3350 0.4023 0.2969 0.0095  0.0457  -0.0664 208 SER L CA  
4517 C C   . SER C 208 ? 0.3345 0.4152 0.2973 0.0058  0.0452  -0.0744 208 SER L C   
4518 O O   . SER C 208 ? 0.3309 0.4110 0.2961 0.0002  0.0504  -0.0814 208 SER L O   
4519 C CB  . SER C 208 ? 0.3607 0.4307 0.3215 0.0100  0.0466  -0.0666 208 SER L CB  
4520 O OG  . SER C 208 ? 0.3844 0.4554 0.3469 0.0061  0.0521  -0.0750 208 SER L OG  
4521 N N   . PHE C 209 ? 0.3413 0.4330 0.3001 0.0089  0.0391  -0.0733 209 PHE L N   
4522 C CA  . PHE C 209 ? 0.3363 0.4460 0.2948 0.0076  0.0376  -0.0814 209 PHE L CA  
4523 C C   . PHE C 209 ? 0.3551 0.4708 0.3068 0.0110  0.0332  -0.0794 209 PHE L C   
4524 O O   . PHE C 209 ? 0.3343 0.4404 0.2802 0.0136  0.0306  -0.0715 209 PHE L O   
4525 C CB  . PHE C 209 ? 0.3265 0.4453 0.2843 0.0108  0.0336  -0.0828 209 PHE L CB  
4526 C CG  . PHE C 209 ? 0.3141 0.4273 0.2632 0.0197  0.0259  -0.0742 209 PHE L CG  
4527 C CD1 . PHE C 209 ? 0.3082 0.4069 0.2569 0.0216  0.0252  -0.0668 209 PHE L CD1 
4528 C CD2 . PHE C 209 ? 0.3091 0.4293 0.2480 0.0263  0.0197  -0.0734 209 PHE L CD2 
4529 C CE1 . PHE C 209 ? 0.2991 0.3898 0.2376 0.0286  0.0188  -0.0592 209 PHE L CE1 
4530 C CE2 . PHE C 209 ? 0.3094 0.4186 0.2357 0.0343  0.0132  -0.0654 209 PHE L CE2 
4531 C CZ  . PHE C 209 ? 0.3046 0.3983 0.2307 0.0347  0.0130  -0.0584 209 PHE L CZ  
4532 N N   . ASN C 210 ? 0.3783 0.5108 0.3299 0.0098  0.0328  -0.0873 210 ASN L N   
4533 C CA  . ASN C 210 ? 0.4151 0.5555 0.3583 0.0134  0.0284  -0.0866 210 ASN L CA  
4534 C C   . ASN C 210 ? 0.4249 0.5769 0.3600 0.0216  0.0213  -0.0875 210 ASN L C   
4535 O O   . ASN C 210 ? 0.4645 0.6323 0.4056 0.0207  0.0222  -0.0955 210 ASN L O   
4536 C CB  . ASN C 210 ? 0.4587 0.6119 0.4071 0.0073  0.0330  -0.0959 210 ASN L CB  
4537 C CG  . ASN C 210 ? 0.4981 0.6404 0.4490 0.0033  0.0378  -0.0939 210 ASN L CG  
4538 O OD1 . ASN C 210 ? 0.5766 0.7249 0.5246 0.0026  0.0374  -0.0950 210 ASN L OD1 
4539 N ND2 . ASN C 210 ? 0.5276 0.6549 0.4828 0.0019  0.0416  -0.0906 210 ASN L ND2 
4540 N N   . ARG C 211 ? 0.4316 0.5754 0.3517 0.0294  0.0148  -0.0800 211 ARG L N   
4541 C CA  . ARG C 211 ? 0.4463 0.5955 0.3546 0.0409  0.0074  -0.0795 211 ARG L CA  
4542 C C   . ARG C 211 ? 0.4491 0.6234 0.3557 0.0448  0.0053  -0.0887 211 ARG L C   
4543 O O   . ARG C 211 ? 0.4537 0.6340 0.3649 0.0382  0.0090  -0.0923 211 ARG L O   
4544 C CB  . ARG C 211 ? 0.4614 0.5879 0.3490 0.0474  0.0018  -0.0685 211 ARG L CB  
4545 C CG  . ARG C 211 ? 0.5023 0.6303 0.3722 0.0618  -0.0061 -0.0679 211 ARG L CG  
4546 C CD  . ARG C 211 ? 0.5399 0.6399 0.3843 0.0668  -0.0105 -0.0573 211 ARG L CD  
4547 N NE  . ARG C 211 ? 0.5961 0.6917 0.4329 0.0610  -0.0089 -0.0555 211 ARG L NE  
4548 C CZ  . ARG C 211 ? 0.6072 0.7133 0.4344 0.0665  -0.0116 -0.0590 211 ARG L CZ  
4549 N NH1 . ARG C 211 ? 0.6270 0.7504 0.4507 0.0791  -0.0165 -0.0650 211 ARG L NH1 
4550 N NH2 . ARG C 211 ? 0.6725 0.7737 0.4931 0.0597  -0.0095 -0.0569 211 ARG L NH2 
# 
