Ticket #1547: 4ume_assembly.cif

data_4UME
#
_coordinate_server_result.query_type      assembly 
_coordinate_server_result.datetime_utc    '2018-12-16 20:48:22' 
_coordinate_server_result.is_empty        no 
_coordinate_server_result.has_error       no 
_coordinate_server_result.api_version     1.4.8 
_coordinate_server_result.core_version    3.2.1 
#
loop_
_coordinate_server_query_params.name
_coordinate_server_query_params.value
id 1 
atomSitesOnly 0 
modelId . 
format mmCIF 
encoding cif 
lowPrecisionCoords false 
#
_entry.id    4UME 
#
loop_
_entity.id
_entity.type
_entity.src_method
_entity.pdbx_description
_entity.formula_weight
_entity.pdbx_number_of_molecules
_entity.details
_entity.pdbx_mutation
_entity.pdbx_fragment
_entity.pdbx_ec
1 polymer man '3-DEOXY-D-MANNO-OCTULOSONATE 8-PHOSPHATE PHOSPHATASE KDSC' ? ? . ? ? 3.1.3.45 
2 non-polymer man '3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID' ? ? . ? ? ? 
3 non-polymer syn 'MAGNESIUM ION' ? ? . ? ? ? 
4 water nat water ? ? . ? ? ? 
#
_exptl.entry_id    4UME 
_exptl.method      'X-ray diffraction' 
#
_cell.entry_id            4UME 
_cell.length_a            86.61 
_cell.length_b            86.61 
_cell.length_c            41.4 
_cell.angle_alpha         90 
_cell.angle_beta          90 
_cell.angle_gamma         90 
_cell.Z_PDB               8 
_cell.pdbx_unique_axis    ? 
#
_symmetry.entry_id                          4UME 
_symmetry.space_group_name_H-M              'I 4' 
_symmetry.pdbx_full_space_group_name_H-M    ? 
_symmetry.cell_setting                      ? 
_symmetry.Int_Tables_number                 79 
_symmetry.space_group_name_Hall             . 
#
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 1 MET A 21 . LYS A 29 . MET A 1 LYS A 9 1 ? 9 
HELX_P HELX_P2 2 TYR A 60 . SER A 73 . TYR A 40 SER A 53 1 ? 14 
HELX_P HELX_P3 3 SER A 85 . GLY A 96 . SER A 65 GLY A 76 1 ? 12 
HELX_P HELX_P4 4 ASP A 106 . GLY A 119 . ASP A 86 GLY A 99 1 ? 14 
HELX_P HELX_P5 5 GLU A 121 . SER A 123 . GLU A 101 SER A 103 5 ? 3 
HELX_P HELX_P6 6 ASP A 131 . PRO A 133 . ASP A 111 PRO A 113 5 ? 3 
HELX_P HELX_P7 7 ASP A 134 . ALA A 141 . ASP A 114 ALA A 121 1 ? 8 
HELX_P HELX_P8 8 CYS A 151 . VAL A 157 . CYS A 131 VAL A 137 1 ? 7 
HELX_P HELX_P9 9 GLY A 169 . GLN A 182 . GLY A 149 GLN A 162 1 ? 14 
HELX_P HELX_P10 10 ASN A 184 . THR A 191 . ASN A 164 THR A 171 1 ? 8 
HELX_P HELX_P11 11 MET A-2 21 . LYS A-2 29 . MET A-2 1 LYS A-2 9 1 ? 9 
HELX_P HELX_P12 12 TYR A-2 60 . SER A-2 73 . TYR A-2 40 SER A-2 53 1 ? 14 
HELX_P HELX_P13 13 SER A-2 85 . GLY A-2 96 . SER A-2 65 GLY A-2 76 1 ? 12 
HELX_P HELX_P14 14 ASP A-2 106 . GLY A-2 119 . ASP A-2 86 GLY A-2 99 1 ? 14 
HELX_P HELX_P15 15 GLU A-2 121 . SER A-2 123 . GLU A-2 101 SER A-2 103 5 ? 3 
HELX_P HELX_P16 16 ASP A-2 131 . PRO A-2 133 . ASP A-2 111 PRO A-2 113 5 ? 3 
HELX_P HELX_P17 17 ASP A-2 134 . ALA A-2 141 . ASP A-2 114 ALA A-2 121 1 ? 8 
HELX_P HELX_P18 18 CYS A-2 151 . VAL A-2 157 . CYS A-2 131 VAL A-2 137 1 ? 7 
HELX_P HELX_P19 19 GLY A-2 169 . GLN A-2 182 . GLY A-2 149 GLN A-2 162 1 ? 14 
HELX_P HELX_P20 20 ASN A-2 184 . THR A-2 191 . ASN A-2 164 THR A-2 171 1 ? 8 
HELX_P HELX_P21 21 MET A-3 21 . LYS A-3 29 . MET A-3 1 LYS A-3 9 1 ? 9 
HELX_P HELX_P22 22 TYR A-3 60 . SER A-3 73 . TYR A-3 40 SER A-3 53 1 ? 14 
HELX_P HELX_P23 23 SER A-3 85 . GLY A-3 96 . SER A-3 65 GLY A-3 76 1 ? 12 
HELX_P HELX_P24 24 ASP A-3 106 . GLY A-3 119 . ASP A-3 86 GLY A-3 99 1 ? 14 
HELX_P HELX_P25 25 GLU A-3 121 . SER A-3 123 . GLU A-3 101 SER A-3 103 5 ? 3 
HELX_P HELX_P26 26 ASP A-3 131 . PRO A-3 133 . ASP A-3 111 PRO A-3 113 5 ? 3 
HELX_P HELX_P27 27 ASP A-3 134 . ALA A-3 141 . ASP A-3 114 ALA A-3 121 1 ? 8 
HELX_P HELX_P28 28 CYS A-3 151 . VAL A-3 157 . CYS A-3 131 VAL A-3 137 1 ? 7 
HELX_P HELX_P29 29 GLY A-3 169 . GLN A-3 182 . GLY A-3 149 GLN A-3 162 1 ? 14 
HELX_P HELX_P30 30 ASN A-3 184 . THR A-3 191 . ASN A-3 164 THR A-3 171 1 ? 8 
HELX_P HELX_P31 31 MET A-4 21 . LYS A-4 29 . MET A-4 1 LYS A-4 9 1 ? 9 
HELX_P HELX_P32 32 TYR A-4 60 . SER A-4 73 . TYR A-4 40 SER A-4 53 1 ? 14 
HELX_P HELX_P33 33 SER A-4 85 . GLY A-4 96 . SER A-4 65 GLY A-4 76 1 ? 12 
HELX_P HELX_P34 34 ASP A-4 106 . GLY A-4 119 . ASP A-4 86 GLY A-4 99 1 ? 14 
HELX_P HELX_P35 35 GLU A-4 121 . SER A-4 123 . GLU A-4 101 SER A-4 103 5 ? 3 
HELX_P HELX_P36 36 ASP A-4 131 . PRO A-4 133 . ASP A-4 111 PRO A-4 113 5 ? 3 
HELX_P HELX_P37 37 ASP A-4 134 . ALA A-4 141 . ASP A-4 114 ALA A-4 121 1 ? 8 
HELX_P HELX_P38 38 CYS A-4 151 . VAL A-4 157 . CYS A-4 131 VAL A-4 137 1 ? 7 
HELX_P HELX_P39 39 GLY A-4 169 . GLN A-4 182 . GLY A-4 149 GLN A-4 162 1 ? 14 
HELX_P HELX_P40 40 ASN A-4 184 . THR A-4 191 . ASN A-4 164 THR A-4 171 1 ? 8 
#
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.symmetry
_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
AA 3 LEU A 33 . MET A 36 . ? LEU A 13 MET A 16 
AA 2 ILE A 76 . ILE A 80 . ? ILE A 56 ILE A 60 
AA 1 HIS A 99 . ILE A 101 . ? HIS A 79 ILE A 81 
AA 4 CYS A 125 . ILE A 128 . ? CYS A 105 ILE A 108 
AA 5 PHE A 143 . SER A 146 . ? PHE A 123 SER A 126 
AA 3 LEU A-2 33 . MET A-2 36 . ? LEU A-2 13 MET A-2 16 
AA 2 ILE A-2 76 . ILE A-2 80 . ? ILE A-2 56 ILE A-2 60 
AA 1 HIS A-2 99 . ILE A-2 101 . ? HIS A-2 79 ILE A-2 81 
AA 4 CYS A-2 125 . ILE A-2 128 . ? CYS A-2 105 ILE A-2 108 
AA 5 PHE A-2 143 . SER A-2 146 . ? PHE A-2 123 SER A-2 126 
AA 3 LEU A-3 33 . MET A-3 36 . ? LEU A-3 13 MET A-3 16 
AA 2 ILE A-3 76 . ILE A-3 80 . ? ILE A-3 56 ILE A-3 60 
AA 1 HIS A-3 99 . ILE A-3 101 . ? HIS A-3 79 ILE A-3 81 
AA 4 CYS A-3 125 . ILE A-3 128 . ? CYS A-3 105 ILE A-3 108 
AA 5 PHE A-3 143 . SER A-3 146 . ? PHE A-3 123 SER A-3 126 
AA 3 LEU A-4 33 . MET A-4 36 . ? LEU A-4 13 MET A-4 16 
AA 2 ILE A-4 76 . ILE A-4 80 . ? ILE A-4 56 ILE A-4 60 
AA 1 HIS A-4 99 . ILE A-4 101 . ? HIS A-4 79 ILE A-4 81 
AA 4 CYS A-4 125 . ILE A-4 128 . ? CYS A-4 105 ILE A-4 108 
AA 5 PHE A-4 143 . SER A-4 146 . ? PHE A-4 123 SER A-4 126 
#
_entity_poly.entity_id                       1 
_entity_poly.type                            polypeptide(L) 
_entity_poly.nstd_linkage                    no 
_entity_poly.nstd_monomer                    no 
_entity_poly.pdbx_seq_one_letter_code        
;MGSSHHHHHHSSENLYFQGHMNEIYQKAKHIKLFAMDVDGILSDGQIIYNSEGTETKAFYVQDGLGLQALKQSGIILAII
TGRSSAMVDRRAKELGISHIIQGQDDKLTALVGLTKKLGIELSHCAYIGDDLPDLKAVREAGFGISVPNGCEQTRAVSDY
ITTKTGGNGAVREVCELILKAQNNFDAFIATFQ
; 

_entity_poly.pdbx_seq_one_letter_code_can    
;MGSSHHHHHHSSENLYFQGHMNEIYQKAKHIKLFAMDVDGILSDGQIIYNSEGTETKAFYVQDGLGLQALKQSGIILAII
TGRSSAMVDRRAKELGISHIIQGQDDKLTALVGLTKKLGIELSHCAYIGDDLPDLKAVREAGFGISVPNGCEQTRAVSDY
ITTKTGGNGAVREVCELILKAQNNFDAFIATFQ
; 

_entity_poly.pdbx_strand_id                  A,A-2,A-3,A-4 
#
loop_
_struct_asym.id
_struct_asym.pdbx_blank_PDB_chainid_flag
_struct_asym.pdbx_modified
_struct_asym.entity_id
_struct_asym.details
A N Y 1 'Might not contain all original atoms depending on the query used' 
A-2 N Y 1 'Added by the Coordinate Server' 
A-3 N Y 1 'Added by the Coordinate Server' 
A-4 N Y 1 'Added by the Coordinate Server' 
B N Y 2 'Might not contain all original atoms depending on the query used' 
B-2 N Y 2 'Added by the Coordinate Server' 
B-3 N Y 2 'Added by the Coordinate Server' 
B-4 N Y 2 'Added by the Coordinate Server' 
C N Y 3 'Might not contain all original atoms depending on the query used' 
D N Y 3 'Might not contain all original atoms depending on the query used' 
E N Y 3 'Might not contain all original atoms depending on the query used' 
F N Y 3 'Might not contain all original atoms depending on the query used' 
C-2 N Y 3 'Added by the Coordinate Server' 
D-2 N Y 3 'Added by the Coordinate Server' 
E-2 N Y 3 'Added by the Coordinate Server' 
F-2 N Y 3 'Added by the Coordinate Server' 
C-3 N Y 3 'Added by the Coordinate Server' 
D-3 N Y 3 'Added by the Coordinate Server' 
E-3 N Y 3 'Added by the Coordinate Server' 
F-3 N Y 3 'Added by the Coordinate Server' 
C-4 N Y 3 'Added by the Coordinate Server' 
D-4 N Y 3 'Added by the Coordinate Server' 
E-4 N Y 3 'Added by the Coordinate Server' 
F-4 N Y 3 'Added by the Coordinate Server' 
G N Y 4 'Might not contain all original atoms depending on the query used' 
G-2 N Y 4 'Added by the Coordinate Server' 
G-3 N Y 4 'Added by the Coordinate Server' 
G-4 N Y 4 'Added by the Coordinate Server' 
#
loop_
_struct_conn.id
_struct_conn.conn_type_id
_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_asym_id
_struct_conn.pdbx_ptnr3_label_comp_id
_struct_conn.pdbx_ptnr3_label_seq_id
_struct_conn.pdbx_ptnr3_label_alt_id
_struct_conn.pdbx_ptnr3_label_atom_id
_struct_conn.pdbx_ptnr3_PDB_ins_code
_struct_conn.details
_struct_conn.pdbx_dist_value
_struct_conn.pdbx_value_order
metalc1 metalc ? C MG . MG ? ? ? 1_555 A ASP 39 O ? ? A MG 1175 A ASP 19 1_555 ? ? ? ? ? ? ? 2.170 ? 
metalc2 metalc ? C MG . MG ? ? ? 1_555 G HOH . O ? ? A MG 1175 A HOH 2006 1_555 ? ? ? ? ? ? ? 2.083 ? 
metalc3 metalc ? C MG . MG ? ? ? 1_555 A ASP 37 OD2 ? ? A MG 1175 A ASP 17 1_555 ? ? ? ? ? ? ? 1.959 ? 
metalc4 metalc ? C MG . MG ? ? ? 1_555 A ASP 130 OD1 ? ? A MG 1175 A ASP 110 1_555 ? ? ? ? ? ? ? 2.017 ? 
metalc5 metalc ? C MG . MG ? ? ? 1_555 G HOH . O ? ? A MG 1175 A HOH 2007 1_555 ? ? ? ? ? ? ? 2.051 ? 
metalc6 metalc ? C MG . MG ? ? ? 1_555 G HOH . O ? ? A MG 1175 A HOH 2009 1_555 ? ? ? ? ? ? ? 2.074 ? 
metalc7 metalc ? D MG . MG ? ? ? 1_555 G HOH . O ? ? A MG 1176 A HOH 2085 4_555 ? ? ? ? ? ? ? 2.316 ? 
metalc8 metalc ? D MG . MG ? ? ? 1_555 G HOH . O ? ? A MG 1176 A HOH 2085 3_555 ? ? ? ? ? ? ? 2.316 ? 
metalc9 metalc ? D MG . MG ? ? ? 1_555 G HOH . O ? ? A MG 1176 A HOH 2086 1_555 ? ? ? ? ? ? ? 2.497 ? 
metalc10 metalc ? D MG . MG ? ? ? 1_555 G HOH . O ? ? A MG 1176 A HOH 2086 3_555 ? ? ? ? ? ? ? 2.497 ? 
metalc11 metalc ? D MG . MG ? ? ? 1_555 G HOH . O ? ? A MG 1176 A HOH 2086 4_555 ? ? ? ? ? ? ? 2.497 ? 
metalc12 metalc ? D MG . MG ? ? ? 1_555 G HOH . O ? ? A MG 1176 A HOH 2085 2_555 ? ? ? ? ? ? ? 2.316 ? 
metalc13 metalc ? D MG . MG ? ? ? 1_555 G HOH . O ? ? A MG 1176 A HOH 2086 2_555 ? ? ? ? ? ? ? 2.497 ? 
metalc14 metalc ? D MG . MG ? ? ? 1_555 G HOH . O ? ? A MG 1176 A HOH 2085 1_555 ? ? ? ? ? ? ? 2.316 ? 
metalc15 metalc ? E MG . MG ? ? ? 1_555 G HOH . O ? ? A MG 1177 A HOH 2084 3_555 ? ? ? ? ? ? ? 2.820 ? 
metalc16 metalc ? E MG . MG ? ? ? 1_555 G HOH . O ? ? A MG 1177 A HOH 2084 4_555 ? ? ? ? ? ? ? 2.820 ? 
metalc17 metalc ? E MG . MG ? ? ? 1_555 G HOH . O ? ? A MG 1177 A HOH 2084 2_555 ? ? ? ? ? ? ? 2.820 ? 
metalc18 metalc ? E MG . MG ? ? ? 1_555 G HOH . O ? ? A MG 1177 A HOH 2084 1_555 ? ? ? ? ? ? ? 2.820 ? 
#
_struct_conn_type.id           metalc 
_struct_conn_type.criteria     ? 
_struct_conn_type.reference    ? 
#
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.pdbx_stereo_config
_chem_comp_bond.pdbx_ordinal
_chem_comp_bond.pdbx_aromatic_flag
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.value_order
ALA N 1 N N CA SING 
ALA N 2 N N H SING 
ALA N 3 N N H2 SING 
ALA N 4 N CA C SING 
ALA N 5 N CA CB SING 
ALA N 6 N CA HA SING 
ALA N 7 N C O DOUB 
ALA N 8 N C OXT SING 
ALA N 9 N CB HB1 SING 
ALA N 10 N CB HB2 SING 
ALA N 11 N CB HB3 SING 
ALA N 12 N OXT HXT SING 
ARG N 1 N N CA SING 
ARG N 2 N N H SING 
ARG N 3 N N H2 SING 
ARG N 4 N CA C SING 
ARG N 5 N CA CB SING 
ARG N 6 N CA HA SING 
ARG N 7 N C O DOUB 
ARG N 8 N C OXT SING 
ARG N 9 N CB CG SING 
ARG N 10 N CB HB2 SING 
ARG N 11 N CB HB3 SING 
ARG N 12 N CG CD SING 
ARG N 13 N CG HG2 SING 
ARG N 14 N CG HG3 SING 
ARG N 15 N CD NE SING 
ARG N 16 N CD HD2 SING 
ARG N 17 N CD HD3 SING 
ARG N 18 N NE CZ SING 
ARG N 19 N NE HE SING 
ARG N 20 N CZ NH1 SING 
ARG N 21 N CZ NH2 DOUB 
ARG N 22 N NH1 HH11 SING 
ARG N 23 N NH1 HH12 SING 
ARG N 24 N NH2 HH21 SING 
ARG N 25 N NH2 HH22 SING 
ARG N 26 N OXT HXT SING 
ASN N 1 N N CA SING 
ASN N 2 N N H SING 
ASN N 3 N N H2 SING 
ASN N 4 N CA C SING 
ASN N 5 N CA CB SING 
ASN N 6 N CA HA SING 
ASN N 7 N C O DOUB 
ASN N 8 N C OXT SING 
ASN N 9 N CB CG SING 
ASN N 10 N CB HB2 SING 
ASN N 11 N CB HB3 SING 
ASN N 12 N CG OD1 DOUB 
ASN N 13 N CG ND2 SING 
ASN N 14 N ND2 HD21 SING 
ASN N 15 N ND2 HD22 SING 
ASN N 16 N OXT HXT SING 
ASP N 1 N N CA SING 
ASP N 2 N N H SING 
ASP N 3 N N H2 SING 
ASP N 4 N CA C SING 
ASP N 5 N CA CB SING 
ASP N 6 N CA HA SING 
ASP N 7 N C O DOUB 
ASP N 8 N C OXT SING 
ASP N 9 N CB CG SING 
ASP N 10 N CB HB2 SING 
ASP N 11 N CB HB3 SING 
ASP N 12 N CG OD1 DOUB 
ASP N 13 N CG OD2 SING 
ASP N 14 N OD2 HD2 SING 
ASP N 15 N OXT HXT SING 
CYS N 1 N N CA SING 
CYS N 2 N N H SING 
CYS N 3 N N H2 SING 
CYS N 4 N CA C SING 
CYS N 5 N CA CB SING 
CYS N 6 N CA HA SING 
CYS N 7 N C O DOUB 
CYS N 8 N C OXT SING 
CYS N 9 N CB SG SING 
CYS N 10 N CB HB2 SING 
CYS N 11 N CB HB3 SING 
CYS N 12 N SG HG SING 
CYS N 13 N OXT HXT SING 
GLN N 1 N N CA SING 
GLN N 2 N N H SING 
GLN N 3 N N H2 SING 
GLN N 4 N CA C SING 
GLN N 5 N CA CB SING 
GLN N 6 N CA HA SING 
GLN N 7 N C O DOUB 
GLN N 8 N C OXT SING 
GLN N 9 N CB CG SING 
GLN N 10 N CB HB2 SING 
GLN N 11 N CB HB3 SING 
GLN N 12 N CG CD SING 
GLN N 13 N CG HG2 SING 
GLN N 14 N CG HG3 SING 
GLN N 15 N CD OE1 DOUB 
GLN N 16 N CD NE2 SING 
GLN N 17 N NE2 HE21 SING 
GLN N 18 N NE2 HE22 SING 
GLN N 19 N OXT HXT SING 
GLU N 1 N N CA SING 
GLU N 2 N N H SING 
GLU N 3 N N H2 SING 
GLU N 4 N CA C SING 
GLU N 5 N CA CB SING 
GLU N 6 N CA HA SING 
GLU N 7 N C O DOUB 
GLU N 8 N C OXT SING 
GLU N 9 N CB CG SING 
GLU N 10 N CB HB2 SING 
GLU N 11 N CB HB3 SING 
GLU N 12 N CG CD SING 
GLU N 13 N CG HG2 SING 
GLU N 14 N CG HG3 SING 
GLU N 15 N CD OE1 DOUB 
GLU N 16 N CD OE2 SING 
GLU N 17 N OE2 HE2 SING 
GLU N 18 N OXT HXT SING 
GLY N 1 N N CA SING 
GLY N 2 N N H SING 
GLY N 3 N N H2 SING 
GLY N 4 N CA C SING 
GLY N 5 N CA HA2 SING 
GLY N 6 N CA HA3 SING 
GLY N 7 N C O DOUB 
GLY N 8 N C OXT SING 
GLY N 9 N OXT HXT SING 
HIS N 1 N N CA SING 
HIS N 2 N N H SING 
HIS N 3 N N H2 SING 
HIS N 4 N CA C SING 
HIS N 5 N CA CB SING 
HIS N 6 N CA HA SING 
HIS N 7 N C O DOUB 
HIS N 8 N C OXT SING 
HIS N 9 N CB CG SING 
HIS N 10 N CB HB2 SING 
HIS N 11 N CB HB3 SING 
HIS N 12 Y CG ND1 SING 
HIS N 13 Y CG CD2 DOUB 
HIS N 14 Y ND1 CE1 DOUB 
HIS N 15 N ND1 HD1 SING 
HIS N 16 Y CD2 NE2 SING 
HIS N 17 N CD2 HD2 SING 
HIS N 18 Y CE1 NE2 SING 
HIS N 19 N CE1 HE1 SING 
HIS N 20 N NE2 HE2 SING 
HIS N 21 N OXT HXT SING 
HOH N 1 N O H1 SING 
HOH N 2 N O H2 SING 
ILE N 1 N N CA SING 
ILE N 2 N N H SING 
ILE N 3 N N H2 SING 
ILE N 4 N CA C SING 
ILE N 5 N CA CB SING 
ILE N 6 N CA HA SING 
ILE N 7 N C O DOUB 
ILE N 8 N C OXT SING 
ILE N 9 N CB CG1 SING 
ILE N 10 N CB CG2 SING 
ILE N 11 N CB HB SING 
ILE N 12 N CG1 CD1 SING 
ILE N 13 N CG1 HG12 SING 
ILE N 14 N CG1 HG13 SING 
ILE N 15 N CG2 HG21 SING 
ILE N 16 N CG2 HG22 SING 
ILE N 17 N CG2 HG23 SING 
ILE N 18 N CD1 HD11 SING 
ILE N 19 N CD1 HD12 SING 
ILE N 20 N CD1 HD13 SING 
ILE N 21 N OXT HXT SING 
KDO N 1 N C1 O1A DOUB 
KDO N 2 N C1 O1B SING 
KDO N 3 N C1 C2 SING 
KDO N 4 N O1B H1B SING 
KDO N 5 N C2 O2 SING 
KDO N 6 N C2 C3 SING 
KDO N 7 N C2 O6 SING 
KDO N 8 N O2 HO2 SING 
KDO N 9 N C3 C4 SING 
KDO N 10 N C3 H31 SING 
KDO N 11 N C3 H32 SING 
KDO N 12 N C4 O4 SING 
KDO N 13 N C4 C5 SING 
KDO N 14 N C4 H4 SING 
KDO N 15 N O4 HO4 SING 
KDO N 16 N C5 O5 SING 
KDO N 17 N C5 C6 SING 
KDO N 18 N C5 H5 SING 
KDO N 19 N O5 HO5 SING 
KDO N 20 N C6 O6 SING 
KDO N 21 N C6 C7 SING 
KDO N 22 N C6 H6 SING 
KDO N 23 N C7 O7 SING 
KDO N 24 N C7 C8 SING 
KDO N 25 N C7 H7 SING 
KDO N 26 N O7 HO7 SING 
KDO N 27 N C8 O8 SING 
KDO N 28 N C8 H81 SING 
KDO N 29 N C8 H82 SING 
KDO N 30 N O8 HO8 SING 
LEU N 1 N N CA SING 
LEU N 2 N N H SING 
LEU N 3 N N H2 SING 
LEU N 4 N CA C SING 
LEU N 5 N CA CB SING 
LEU N 6 N CA HA SING 
LEU N 7 N C O DOUB 
LEU N 8 N C OXT SING 
LEU N 9 N CB CG SING 
LEU N 10 N CB HB2 SING 
LEU N 11 N CB HB3 SING 
LEU N 12 N CG CD1 SING 
LEU N 13 N CG CD2 SING 
LEU N 14 N CG HG SING 
LEU N 15 N CD1 HD11 SING 
LEU N 16 N CD1 HD12 SING 
LEU N 17 N CD1 HD13 SING 
LEU N 18 N CD2 HD21 SING 
LEU N 19 N CD2 HD22 SING 
LEU N 20 N CD2 HD23 SING 
LEU N 21 N OXT HXT SING 
LYS N 1 N N CA SING 
LYS N 2 N N H SING 
LYS N 3 N N H2 SING 
LYS N 4 N CA C SING 
LYS N 5 N CA CB SING 
LYS N 6 N CA HA SING 
LYS N 7 N C O DOUB 
LYS N 8 N C OXT SING 
LYS N 9 N CB CG SING 
LYS N 10 N CB HB2 SING 
LYS N 11 N CB HB3 SING 
LYS N 12 N CG CD SING 
LYS N 13 N CG HG2 SING 
LYS N 14 N CG HG3 SING 
LYS N 15 N CD CE SING 
LYS N 16 N CD HD2 SING 
LYS N 17 N CD HD3 SING 
LYS N 18 N CE NZ SING 
LYS N 19 N CE HE2 SING 
LYS N 20 N CE HE3 SING 
LYS N 21 N NZ HZ1 SING 
LYS N 22 N NZ HZ2 SING 
LYS N 23 N NZ HZ3 SING 
LYS N 24 N OXT HXT SING 
MET N 1 N N CA SING 
MET N 2 N N H SING 
MET N 3 N N H2 SING 
MET N 4 N CA C SING 
MET N 5 N CA CB SING 
MET N 6 N CA HA SING 
MET N 7 N C O DOUB 
MET N 8 N C OXT SING 
MET N 9 N CB CG SING 
MET N 10 N CB HB2 SING 
MET N 11 N CB HB3 SING 
MET N 12 N CG SD SING 
MET N 13 N CG HG2 SING 
MET N 14 N CG HG3 SING 
MET N 15 N SD CE SING 
MET N 16 N CE HE1 SING 
MET N 17 N CE HE2 SING 
MET N 18 N CE HE3 SING 
MET N 19 N OXT HXT SING 
PHE N 1 N N CA SING 
PHE N 2 N N H SING 
PHE N 3 N N H2 SING 
PHE N 4 N CA C SING 
PHE N 5 N CA CB SING 
PHE N 6 N CA HA SING 
PHE N 7 N C O DOUB 
PHE N 8 N C OXT SING 
PHE N 9 N CB CG SING 
PHE N 10 N CB HB2 SING 
PHE N 11 N CB HB3 SING 
PHE N 12 Y CG CD1 DOUB 
PHE N 13 Y CG CD2 SING 
PHE N 14 Y CD1 CE1 SING 
PHE N 15 N CD1 HD1 SING 
PHE N 16 Y CD2 CE2 DOUB 
PHE N 17 N CD2 HD2 SING 
PHE N 18 Y CE1 CZ DOUB 
PHE N 19 N CE1 HE1 SING 
PHE N 20 Y CE2 CZ SING 
PHE N 21 N CE2 HE2 SING 
PHE N 22 N CZ HZ SING 
PHE N 23 N OXT HXT SING 
PRO N 1 N N CA SING 
PRO N 2 N N CD SING 
PRO N 3 N N H SING 
PRO N 4 N CA C SING 
PRO N 5 N CA CB SING 
PRO N 6 N CA HA SING 
PRO N 7 N C O DOUB 
PRO N 8 N C OXT SING 
PRO N 9 N CB CG SING 
PRO N 10 N CB HB2 SING 
PRO N 11 N CB HB3 SING 
PRO N 12 N CG CD SING 
PRO N 13 N CG HG2 SING 
PRO N 14 N CG HG3 SING 
PRO N 15 N CD HD2 SING 
PRO N 16 N CD HD3 SING 
PRO N 17 N OXT HXT SING 
SER N 1 N N CA SING 
SER N 2 N N H SING 
SER N 3 N N H2 SING 
SER N 4 N CA C SING 
SER N 5 N CA CB SING 
SER N 6 N CA HA SING 
SER N 7 N C O DOUB 
SER N 8 N C OXT SING 
SER N 9 N CB OG SING 
SER N 10 N CB HB2 SING 
SER N 11 N CB HB3 SING 
SER N 12 N OG HG SING 
SER N 13 N OXT HXT SING 
THR N 1 N N CA SING 
THR N 2 N N H SING 
THR N 3 N N H2 SING 
THR N 4 N CA C SING 
THR N 5 N CA CB SING 
THR N 6 N CA HA SING 
THR N 7 N C O DOUB 
THR N 8 N C OXT SING 
THR N 9 N CB OG1 SING 
THR N 10 N CB CG2 SING 
THR N 11 N CB HB SING 
THR N 12 N OG1 HG1 SING 
THR N 13 N CG2 HG21 SING 
THR N 14 N CG2 HG22 SING 
THR N 15 N CG2 HG23 SING 
THR N 16 N OXT HXT SING 
TYR N 1 N N CA SING 
TYR N 2 N N H SING 
TYR N 3 N N H2 SING 
TYR N 4 N CA C SING 
TYR N 5 N CA CB SING 
TYR N 6 N CA HA SING 
TYR N 7 N C O DOUB 
TYR N 8 N C OXT SING 
TYR N 9 N CB CG SING 
TYR N 10 N CB HB2 SING 
TYR N 11 N CB HB3 SING 
TYR N 12 Y CG CD1 DOUB 
TYR N 13 Y CG CD2 SING 
TYR N 14 Y CD1 CE1 SING 
TYR N 15 N CD1 HD1 SING 
TYR N 16 Y CD2 CE2 DOUB 
TYR N 17 N CD2 HD2 SING 
TYR N 18 Y CE1 CZ DOUB 
TYR N 19 N CE1 HE1 SING 
TYR N 20 Y CE2 CZ SING 
TYR N 21 N CE2 HE2 SING 
TYR N 22 N CZ OH SING 
TYR N 23 N OH HH SING 
TYR N 24 N OXT HXT SING 
VAL N 1 N N CA SING 
VAL N 2 N N H SING 
VAL N 3 N N H2 SING 
VAL N 4 N CA C SING 
VAL N 5 N CA CB SING 
VAL N 6 N CA HA SING 
VAL N 7 N C O DOUB 
VAL N 8 N C OXT SING 
VAL N 9 N CB CG1 SING 
VAL N 10 N CB CG2 SING 
VAL N 11 N CB HB SING 
VAL N 12 N CG1 HG11 SING 
VAL N 13 N CG1 HG12 SING 
VAL N 14 N CG1 HG13 SING 
VAL N 15 N CG2 HG21 SING 
VAL N 16 N CG2 HG22 SING 
VAL N 17 N CG2 HG23 SING 
VAL N 18 N OXT HXT SING 
#
_atom_sites.entry_id                     4UME 
_atom_sites.fract_transf_matrix[1][1]    0.011546 
_atom_sites.fract_transf_matrix[1][2]    0 
_atom_sites.fract_transf_matrix[1][3]    0 
_atom_sites.fract_transf_vector[1]       0 
_atom_sites.fract_transf_matrix[2][1]    0 
_atom_sites.fract_transf_matrix[2][2]    0.011546 
_atom_sites.fract_transf_matrix[2][3]    0 
_atom_sites.fract_transf_vector[2]       0 
_atom_sites.fract_transf_matrix[3][1]    0 
_atom_sites.fract_transf_matrix[3][2]    0 
_atom_sites.fract_transf_matrix[3][3]    0.024155 
_atom_sites.fract_transf_vector[3]       0 
#
loop_
_pdbx_nonpoly_scheme.asym_id
_pdbx_nonpoly_scheme.entity_id
_pdbx_nonpoly_scheme.mon_id
_pdbx_nonpoly_scheme.ndb_seq_num
_pdbx_nonpoly_scheme.pdb_seq_num
_pdbx_nonpoly_scheme.auth_seq_num
_pdbx_nonpoly_scheme.pdb_mon_id
_pdbx_nonpoly_scheme.auth_mon_id
_pdbx_nonpoly_scheme.pdb_strand_id
_pdbx_nonpoly_scheme.pdb_ins_code
B 2 KDO 1 1174 1174 KDO KDO A . 
C 3 MG 1 1175 1175 MG MG A . 
D 3 MG 1 1176 1176 MG MG A . 
E 3 MG 1 1177 1177 MG MG A . 
F 3 MG 1 1178 1178 MG MG A . 
G 4 HOH 1 2001 2001 HOH HOH A . 
G 4 HOH 2 2002 2002 HOH HOH A . 
G 4 HOH 3 2003 2003 HOH HOH A . 
G 4 HOH 4 2004 2004 HOH HOH A . 
G 4 HOH 5 2005 2005 HOH HOH A . 
G 4 HOH 6 2006 2006 HOH HOH A . 
G 4 HOH 7 2007 2007 HOH HOH A . 
G 4 HOH 8 2008 2008 HOH HOH A . 
G 4 HOH 9 2009 2009 HOH HOH A . 
G 4 HOH 10 2010 2010 HOH HOH A . 
G 4 HOH 11 2011 2011 HOH HOH A . 
G 4 HOH 12 2012 2012 HOH HOH A . 
G 4 HOH 13 2013 2013 HOH HOH A . 
G 4 HOH 14 2014 2014 HOH HOH A . 
G 4 HOH 15 2015 2015 HOH HOH A . 
G 4 HOH 16 2016 2016 HOH HOH A . 
G 4 HOH 17 2017 2017 HOH HOH A . 
G 4 HOH 18 2018 2018 HOH HOH A . 
G 4 HOH 19 2019 2019 HOH HOH A . 
G 4 HOH 20 2020 2020 HOH HOH A . 
G 4 HOH 21 2021 2021 HOH HOH A . 
G 4 HOH 22 2022 2022 HOH HOH A . 
G 4 HOH 23 2023 2023 HOH HOH A . 
G 4 HOH 24 2024 2024 HOH HOH A . 
G 4 HOH 25 2025 2025 HOH HOH A . 
G 4 HOH 26 2026 2026 HOH HOH A . 
G 4 HOH 27 2027 2027 HOH HOH A . 
G 4 HOH 28 2028 2028 HOH HOH A . 
G 4 HOH 29 2029 2029 HOH HOH A . 
G 4 HOH 30 2030 2030 HOH HOH A . 
G 4 HOH 31 2031 2031 HOH HOH A . 
G 4 HOH 32 2032 2032 HOH HOH A . 
G 4 HOH 33 2033 2033 HOH HOH A . 
G 4 HOH 34 2034 2034 HOH HOH A . 
G 4 HOH 35 2035 2035 HOH HOH A . 
G 4 HOH 36 2036 2036 HOH HOH A . 
G 4 HOH 37 2037 2037 HOH HOH A . 
G 4 HOH 38 2038 2038 HOH HOH A . 
G 4 HOH 39 2039 2039 HOH HOH A . 
G 4 HOH 40 2040 2040 HOH HOH A . 
G 4 HOH 41 2041 2041 HOH HOH A . 
G 4 HOH 42 2042 2042 HOH HOH A . 
G 4 HOH 43 2043 2043 HOH HOH A . 
G 4 HOH 44 2044 2044 HOH HOH A . 
G 4 HOH 45 2045 2045 HOH HOH A . 
G 4 HOH 46 2046 2046 HOH HOH A . 
G 4 HOH 47 2047 2047 HOH HOH A . 
G 4 HOH 48 2048 2048 HOH HOH A . 
G 4 HOH 49 2049 2049 HOH HOH A . 
G 4 HOH 50 2050 2050 HOH HOH A . 
G 4 HOH 51 2051 2051 HOH HOH A . 
G 4 HOH 52 2052 2052 HOH HOH A . 
G 4 HOH 53 2053 2053 HOH HOH A . 
G 4 HOH 54 2054 2054 HOH HOH A . 
G 4 HOH 55 2055 2055 HOH HOH A . 
G 4 HOH 56 2056 2056 HOH HOH A . 
G 4 HOH 57 2057 2057 HOH HOH A . 
G 4 HOH 58 2058 2058 HOH HOH A . 
G 4 HOH 59 2059 2059 HOH HOH A . 
G 4 HOH 60 2060 2060 HOH HOH A . 
G 4 HOH 61 2061 2061 HOH HOH A . 
G 4 HOH 62 2062 2062 HOH HOH A . 
G 4 HOH 63 2063 2063 HOH HOH A . 
G 4 HOH 64 2064 2064 HOH HOH A . 
G 4 HOH 65 2065 2065 HOH HOH A . 
G 4 HOH 66 2066 2066 HOH HOH A . 
G 4 HOH 67 2067 2067 HOH HOH A . 
G 4 HOH 68 2068 2068 HOH HOH A . 
G 4 HOH 69 2069 2069 HOH HOH A . 
G 4 HOH 70 2070 2070 HOH HOH A . 
G 4 HOH 71 2071 2071 HOH HOH A . 
G 4 HOH 72 2072 2072 HOH HOH A . 
G 4 HOH 73 2073 2073 HOH HOH A . 
G 4 HOH 74 2074 2074 HOH HOH A . 
G 4 HOH 75 2075 2075 HOH HOH A . 
G 4 HOH 76 2076 2076 HOH HOH A . 
G 4 HOH 77 2077 2077 HOH HOH A . 
G 4 HOH 78 2078 2078 HOH HOH A . 
G 4 HOH 79 2079 2079 HOH HOH A . 
G 4 HOH 80 2080 2080 HOH HOH A . 
G 4 HOH 81 2081 2081 HOH HOH A . 
G 4 HOH 82 2082 2082 HOH HOH A . 
G 4 HOH 83 2083 2083 HOH HOH A . 
G 4 HOH 84 2084 2084 HOH HOH A . 
G 4 HOH 85 2085 2085 HOH HOH A . 
G 4 HOH 86 2086 2086 HOH HOH A . 
#
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_atom_id
_atom_site.auth_comp_id
_atom_site.auth_asym_id
_atom_site.auth_seq_id
_atom_site.pdbx_PDB_model_num
ATOM 1 N N . HIS A 1 20 . 22.583 10.104 21.041 1 48.34 ? N HIS A 0 1 
ATOM 2 C CA . HIS A 1 20 . 22.545 11.566 20.738 1 49.45 ? CA HIS A 0 1 
ATOM 3 C C . HIS A 1 20 . 23.043 11.876 19.326 1 46.41 ? C HIS A 0 1 
ATOM 4 O O . HIS A 1 20 . 24.013 11.283 18.851 1 45.94 ? O HIS A 0 1 
ATOM 5 C CB . HIS A 1 20 . 23.348 12.363 21.773 1 52.97 ? CB HIS A 0 1 
ATOM 6 C CG . HIS A 1 20 . 23.221 13.85 21.62 1 57.04 ? CG HIS A 0 1 
ATOM 7 N ND1 . HIS A 1 20 . 23.991 14.578 20.736 1 57.4 ? ND1 HIS A 0 1 
ATOM 8 C CD2 . HIS A 1 20 . 22.406 14.743 22.23 1 58.45 ? CD2 HIS A 0 1 
ATOM 9 C CE1 . HIS A 1 20 . 23.662 15.855 20.815 1 57.94 ? CE1 HIS A 0 1 
ATOM 10 N NE2 . HIS A 1 20 . 22.705 15.983 21.717 1 58.53 ? NE2 HIS A 0 1 
ATOM 11 N N . MET A 1 21 . 22.389 12.842 18.689 1 43.8 ? N MET A 1 1 
ATOM 12 C CA . MET A 1 21 . 22.533 13.091 17.256 1 42.39 ? CA MET A 1 1 
ATOM 13 C C . MET A 1 21 . 23.865 13.675 16.785 1 39.99 ? C MET A 1 1 
ATOM 14 O O . MET A 1 21 . 24.257 13.447 15.639 1 38.36 ? O MET A 1 1 
ATOM 15 C CB . MET A 1 21 . 21.376 13.956 16.754 1 44.52 ? CB MET A 1 1 
ATOM 16 C CG . MET A 1 21 . 20.911 13.616 15.345 1 47.55 ? CG MET A 1 1 
ATOM 17 S SD . MET A 1 21 . 19.825 12.177 15.271 1 50 ? SD MET A 1 1 
ATOM 18 C CE . MET A 1 21 . 20.983 10.855 14.925 1 49.59 ? CE MET A 1 1 
ATOM 19 N N . ASN A 1 22 . 24.55 14.436 17.644 1 38.82 ? N ASN A 2 1 
ATOM 20 C CA . ASN A 1 22 . 25.84 15.035 17.268 1 36.62 ? CA ASN A 2 1 
ATOM 21 C C . ASN A 1 22 . 26.865 13.997 16.82 1 35.42 ? C ASN A 2 1 
ATOM 22 O O . ASN A 1 22 . 27.692 14.267 15.942 1 33.97 ? O ASN A 2 1 
ATOM 23 C CB . ASN A 1 22 . 26.427 15.908 18.381 1 36.59 ? CB ASN A 2 1 
ATOM 24 C CG . ASN A 1 22 . 27.68 16.652 17.932 1 36.28 ? CG ASN A 2 1 
ATOM 25 O OD1 . ASN A 1 22 . 27.716 17.231 16.848 1 35.62 ? OD1 ASN A 2 1 
ATOM 26 N ND2 . ASN A 1 22 . 28.712 16.629 18.758 1 35.55 ? ND2 ASN A 2 1 
ATOM 27 N N . GLU A 1 23 . 26.79 12.811 17.419 1 35.48 ? N GLU A 3 1 
ATOM 28 C CA . GLU A 1 23 . 27.619 11.677 17.018 1 36.55 ? CA GLU A 3 1 
ATOM 29 C C . GLU A 1 23 . 27.421 11.352 15.538 1 34.33 ? C GLU A 3 1 
ATOM 30 O O . GLU A 1 23 . 28.368 11.007 14.84 1 34 ? O GLU A 3 1 
ATOM 31 C CB . GLU A 1 23 . 27.302 10.446 17.866 1 37.94 ? CB GLU A 3 1 
ATOM 32 C CG . GLU A 1 23 . 27.483 10.661 19.358 1 40.69 ? CG GLU A 3 1 
ATOM 33 C CD . GLU A 1 23 . 27.796 9.378 20.106 1 42.48 ? CD GLU A 3 1 
ATOM 34 O OE1 . GLU A 1 23 . 26.98 8.429 20.039 1 43.46 ? OE1 GLU A 3 1 
ATOM 35 O OE2 . GLU A 1 23 . 28.867 9.321 20.755 1 40.81 ? OE2 GLU A 3 1 
ATOM 36 N N . ILE A 1 24 . 26.189 11.489 15.066 1 32.57 ? N ILE A 4 1 
ATOM 37 C CA . ILE A 1 24 . 25.869 11.204 13.672 1 32.59 ? CA ILE A 4 1 
ATOM 38 C C . ILE A 1 24 . 26.257 12.382 12.766 1 32.45 ? C ILE A 4 1 
ATOM 39 O O . ILE A 1 24 . 26.824 12.181 11.682 1 31.49 ? O ILE A 4 1 
ATOM 40 C CB . ILE A 1 24 . 24.394 10.75 13.517 1 32.86 ? CB ILE A 4 1 
ATOM 41 C CG1 . ILE A 1 24 . 24.255 9.255 13.828 1 34.21 ? CG1 ILE A 4 1 
ATOM 42 C CG2 . ILE A 1 24 . 23.893 10.942 12.099 1 34.2 ? CG2 ILE A 4 1 
ATOM 43 C CD1 . ILE A 1 24 . 24.244 8.88 15.296 1 33.68 ? CD1 ILE A 4 1 
ATOM 44 N N . TYR A 1 25 . 25.974 13.605 13.225 1 32.58 ? N TYR A 5 1 
ATOM 45 C CA . TYR A 1 25 . 26.395 14.826 12.524 1 31.73 ? CA TYR A 5 1 
ATOM 46 C C . TYR A 1 25 . 27.909 14.867 12.315 1 30.44 ? C TYR A 5 1 
ATOM 47 O O . TYR A 1 25 . 28.391 15.382 11.302 1 29.2 ? O TYR A 5 1 
ATOM 48 C CB . TYR A 1 25 . 25.951 16.088 13.28 1 34.8 ? CB TYR A 5 1 
ATOM 49 C CG . TYR A 1 25 . 24.453 16.267 13.435 1 36.87 ? CG TYR A 5 1 
ATOM 50 C CD1 . TYR A 1 25 . 23.6 16.184 12.332 1 38.24 ? CD1 TYR A 5 1 
ATOM 51 C CD2 . TYR A 1 25 . 23.888 16.531 14.686 1 37.76 ? CD2 TYR A 5 1 
ATOM 52 C CE1 . TYR A 1 25 . 22.231 16.35 12.468 1 38.85 ? CE1 TYR A 5 1 
ATOM 53 C CE2 . TYR A 1 25 . 22.52 16.703 14.832 1 39.31 ? CE2 TYR A 5 1 
ATOM 54 C CZ . TYR A 1 25 . 21.695 16.605 13.715 1 39.98 ? CZ TYR A 5 1 
ATOM 55 O OH . TYR A 1 25 . 20.332 16.765 13.84 1 41.2 ? OH TYR A 5 1 
ATOM 56 N N . GLN A 1 26 . 28.653 14.323 13.279 1 29.41 ? N GLN A 6 1 
ATOM 57 C CA . GLN A 1 26 . 30.104 14.195 13.163 1 28.7 ? CA GLN A 6 1 
ATOM 58 C C . GLN A 1 26 . 30.487 13.365 11.942 1 28.69 ? C GLN A 6 1 
ATOM 59 O O . GLN A 1 26 . 31.451 13.691 11.248 1 29.35 ? O GLN A 6 1 
ATOM 60 C CB . GLN A 1 26 . 30.712 13.607 14.447 1 29.35 ? CB GLN A 6 1 
ATOM 61 C CG . GLN A 1 26 . 30.847 14.623 15.581 1 30.2 ? CG GLN A 6 1 
ATOM 62 C CD . GLN A 1 26 . 31.078 13.991 16.945 1 31.73 ? CD GLN A 6 1 
ATOM 63 O OE1 . GLN A 1 26 . 30.915 12.78 17.125 1 32.26 ? OE1 GLN A 6 1 
ATOM 64 N NE2 . GLN A 1 26 . 31.458 14.816 17.918 1 31.27 ? NE2 GLN A 6 1 
ATOM 65 N N . LYS A 1 27 . 29.707 12.32 11.665 1 27.82 ? N LYS A 7 1 
ATOM 66 C CA . LYS A 1 27 . 29.954 11.452 10.513 1 27.26 ? CA LYS A 7 1 
ATOM 67 C C . LYS A 1 27 . 29.513 12.048 9.171 1 26.8 ? C LYS A 7 1 
ATOM 68 O O . LYS A 1 27 . 30.218 11.901 8.175 1 26.55 ? O LYS A 7 1 
ATOM 69 C CB . LYS A 1 27 . 29.325 10.072 10.733 1 28.56 ? CB LYS A 7 1 
ATOM 70 C CG . LYS A 1 27 . 30.146 9.18 11.649 1 29.48 ? CG LYS A 7 1 
ATOM 71 C CD . LYS A 1 27 . 29.329 8.024 12.201 1 31.72 ? CD LYS A 7 1 
ATOM 72 C CE . LYS A 1 27 . 30.156 7.186 13.173 1 32.67 ? CE LYS A 7 1 
ATOM 73 N NZ . LYS A 1 27 . 29.378 6.056 13.763 1 33.56 ? NZ LYS A 7 1 
ATOM 74 N N . ALA A 1 28 . 28.359 12.717 9.15 1 25.43 ? N ALA A 8 1 
ATOM 75 C CA . ALA A 1 28 . 27.823 13.331 7.932 1 24.75 ? CA ALA A 8 1 
ATOM 76 C C . ALA A 1 28 . 28.527 14.643 7.557 1 25.42 ? C ALA A 8 1 
ATOM 77 O O . ALA A 1 28 . 28.409 15.129 6.421 1 23.42 ? O ALA A 8 1 
ATOM 78 C CB . ALA A 1 28 . 26.324 13.549 8.072 1 24.5 ? CB ALA A 8 1 
ATOM 79 N N . LYS A 1 29 . 29.272 15.187 8.523 1 26.88 ? N LYS A 9 1 
ATOM 80 C CA . LYS A 1 29 . 29.95 16.487 8.439 1 27.79 ? CA LYS A 9 1 
ATOM 81 C C . LYS A 1 29 . 30.69 16.761 7.125 1 27.72 ? C LYS A 9 1 
ATOM 82 O O . LYS A 1 29 . 30.615 17.873 6.594 1 27.16 ? O LYS A 9 1 
ATOM 83 C CB . LYS A 1 29 . 30.946 16.614 9.604 1 30.33 ? CB LYS A 9 1 
ATOM 84 C CG . LYS A 1 29 . 31.21 18.032 10.088 1 32.08 ? CG LYS A 9 1 
ATOM 85 C CD . LYS A 1 29 . 30.548 18.304 11.435 1 33.34 ? CD LYS A 9 1 
ATOM 86 C CE . LYS A 1 29 . 29.135 18.856 11.271 1 33.82 ? CE LYS A 9 1 
ATOM 87 N NZ . LYS A 1 29 . 28.367 19.043 12.536 1 31.73 ? NZ LYS A 9 1 
ATOM 88 N N . HIS A 1 30 . 31.401 15.752 6.619 1 26.59 ? N HIS A 10 1 
ATOM 89 C CA . HIS A 1 30 . 32.302 15.918 5.474 1 26.79 ? CA HIS A 10 1 
ATOM 90 C C . HIS A 1 30 . 31.887 15.14 4.214 1 25.03 ? C HIS A 10 1 
ATOM 91 O O . HIS A 1 30 . 32.718 14.878 3.329 1 24.31 ? O HIS A 10 1 
ATOM 92 C CB . HIS A 1 30 . 33.751 15.564 5.877 1 29.44 ? CB HIS A 10 1 
ATOM 93 C CG . HIS A 1 30 . 34.347 16.506 6.881 1 31 ? CG HIS A 10 1 
ATOM 94 N ND1 . HIS A 1 30 . 34.536 17.848 6.623 1 31.33 ? ND1 HIS A 10 1 
ATOM 95 C CD2 . HIS A 1 30 . 34.787 16.301 8.147 1 31.72 ? CD2 HIS A 10 1 
ATOM 96 C CE1 . HIS A 1 30 . 35.064 18.428 7.686 1 32.04 ? CE1 HIS A 10 1 
ATOM 97 N NE2 . HIS A 1 30 . 35.229 17.512 8.624 1 31.32 ? NE2 HIS A 10 1 
ATOM 98 N N . ILE A 1 31 . 30.604 14.784 4.127 1 22.28 ? N ILE A 11 1 
ATOM 99 C CA . ILE A 1 31 . 30.087 14.047 2.973 1 19.31 ? CA ILE A 11 1 
ATOM 100 C C . ILE A 1 31 . 30.115 14.924 1.729 1 18.66 ? C ILE A 11 1 
ATOM 101 O O . ILE A 1 31 . 29.688 16.07 1.764 1 18.14 ? O ILE A 11 1 
ATOM 102 C CB . ILE A 1 31 . 28.65 13.546 3.213 1 18.94 ? CB ILE A 11 1 
ATOM 103 C CG1 . ILE A 1 31 . 28.575 12.629 4.448 1 18.66 ? CG1 ILE A 11 1 
ATOM 104 C CG2 . ILE A 1 31 . 28.088 12.891 1.953 1 18.45 ? CG2 ILE A 11 1 
ATOM 105 C CD1 . ILE A 1 31 . 29.638 11.541 4.54 1 18.49 ? CD1 ILE A 11 1 
ATOM 106 N N . LYS A 1 32 . 30.639 14.375 0.643 1 17.82 ? N LYS A 12 1 
ATOM 107 C CA . LYS A 1 32 . 30.69 15.068 -0.639 1 17.54 ? CA LYS A 12 1 
ATOM 108 C C . LYS A 1 32 . 29.826 14.344 -1.648 1 16.42 ? C LYS A 12 1 
ATOM 109 O O . LYS A 1 32 . 29.444 14.902 -2.681 1 15.79 ? O LYS A 12 1 
ATOM 110 C CB . LYS A 1 32 . 32.125 15.115 -1.16 1 18.45 ? CB LYS A 12 1 
ATOM 111 C CG . LYS A 1 32 . 33.017 16.122 -0.452 1 19.81 ? CG LYS A 12 1 
ATOM 112 C CD . LYS A 1 32 . 34.483 15.755 -0.634 1 20.77 ? CD LYS A 12 1 
ATOM 113 C CE . LYS A 1 32 . 35.382 16.722 0.116 1 21.62 ? CE LYS A 12 1 
ATOM 114 N NZ . LYS A 1 32 . 35.56 17.995 -0.641 1 22.79 ? NZ LYS A 12 1 
ATOM 115 N N . LEU A 1 33 . 29.521 13.091 -1.34 1 15.68 ? N LEU A 13 1 
ATOM 116 C CA . LEU A 1 33 . 28.759 12.253 -2.248 1 15.06 ? CA LEU A 13 1 
ATOM 117 C C . LEU A 1 33 . 27.784 11.404 -1.474 1 14.26 ? C LEU A 13 1 
ATOM 118 O O . LEU A 1 33 . 28.151 10.768 -0.483 1 14.01 ? O LEU A 13 1 
ATOM 119 C CB . LEU A 1 33 . 29.682 11.345 -3.08 1 15.36 ? CB LEU A 13 1 
ATOM 120 C CG . LEU A 1 33 . 28.987 10.445 -4.119 1 15.27 ? CG LEU A 13 1 
ATOM 121 C CD1 . LEU A 1 33 . 29.855 10.215 -5.337 1 15.93 ? CD1 LEU A 13 1 
ATOM 122 C CD2 . LEU A 1 33 . 28.582 9.111 -3.523 1 15.65 ? CD2 LEU A 13 1 
ATOM 123 N N . PHE A 1 34 . 26.548 11.381 -1.962 1 13.55 ? N PHE A 14 1 
ATOM 124 C CA . PHE A 1 34 . 25.509 10.542 -1.395 1 13.45 ? CA PHE A 14 1 
ATOM 125 C C . PHE A 1 34 . 25.073 9.545 -2.453 1 13.27 ? C PHE A 14 1 
ATOM 126 O O . PHE A 1 34 . 24.557 9.929 -3.532 1 12.88 ? O PHE A 14 1 
ATOM 127 C CB . PHE A 1 34 . 24.342 11.403 -0.874 1 13.07 ? CB PHE A 14 1 
ATOM 128 C CG . PHE A 1 34 . 23.207 10.617 -0.268 1 13.24 ? CG PHE A 14 1 
ATOM 129 C CD1 . PHE A 1 34 . 23.446 9.538 0.588 1 13.53 ? CD1 PHE A 14 1 
ATOM 130 C CD2 . PHE A 1 34 . 21.887 10.987 -0.516 1 13.04 ? CD2 PHE A 14 1 
ATOM 131 C CE1 . PHE A 1 34 . 22.391 8.829 1.154 1 13.44 ? CE1 PHE A 14 1 
ATOM 132 C CE2 . PHE A 1 34 . 20.832 10.289 0.051 1 13.33 ? CE2 PHE A 14 1 
ATOM 133 C CZ . PHE A 1 34 . 21.081 9.208 0.883 1 13.4 ? CZ PHE A 14 1 
ATOM 134 N N . ALA A 1 35 . 25.308 8.269 -2.145 1 13.05 ? N ALA A 15 1 
ATOM 135 C CA . ALA A 1 35 . 24.936 7.157 -3.02 1 13.33 ? CA ALA A 15 1 
ATOM 136 C C . ALA A 1 35 . 23.809 6.328 -2.419 1 13.72 ? C ALA A 15 1 
ATOM 137 O O . ALA A 1 35 . 23.741 6.112 -1.193 1 13.4 ? O ALA A 15 1 
ATOM 138 C CB . ALA A 1 35 . 26.137 6.281 -3.317 1 13.07 ? CB ALA A 15 1 
ATOM 139 N N . MET A 1 36 . 22.918 5.864 -3.291 1 13.91 ? N MET A 16 1 
ATOM 140 C CA . MET A 1 36 . 21.719 5.184 -2.823 1 14.22 ? CA MET A 16 1 
ATOM 141 C C . MET A 1 36 . 21.479 3.891 -3.563 1 13.81 ? C MET A 16 1 
ATOM 142 O O . MET A 1 36 . 21.633 3.808 -4.783 1 13.75 ? O MET A 16 1 
ATOM 143 C CB . MET A 1 36 . 20.479 6.067 -2.99 1 15.07 ? CB MET A 16 1 
ATOM 144 C CG . MET A 1 36 . 20.45 7.365 -2.193 1 15.82 ? CG MET A 16 1 
ATOM 145 S SD . MET A 1 36 . 19.387 8.567 -3.028 1 16.38 ? SD MET A 16 1 
ATOM 146 C CE . MET A 1 36 . 20.52 9.234 -4.257 1 15.94 ? CE MET A 16 1 
ATOM 147 N N . ASP A 1 37 . 21.08 2.885 -2.807 1 13.77 ? N ASP A 17 1 
ATOM 148 C CA . ASP A 1 37 . 20.418 1.729 -3.374 1 13.6 ? CA ASP A 17 1 
ATOM 149 C C . ASP A 1 37 . 19 2.157 -3.763 1 13.13 ? C ASP A 17 1 
ATOM 150 O O . ASP A 1 37 . 18.481 3.121 -3.208 1 12.82 ? O ASP A 17 1 
ATOM 151 C CB . ASP A 1 37 . 20.376 0.623 -2.334 1 13.99 ? CB ASP A 17 1 
ATOM 152 C CG . ASP A 1 37 . 19.67 -0.604 -2.828 1 14.53 ? CG ASP A 17 1 
ATOM 153 O OD1 . ASP A 1 37 . 19.888 -1.005 -4 1 14.23 ? OD1 ASP A 17 1 
ATOM 154 O OD2 . ASP A 1 37 . 18.882 -1.158 -2.029 1 15.16 ? OD2 ASP A 17 1 
ATOM 155 N N . VAL A 1 38 . 18.38 1.466 -4.724 1 13.2 ? N VAL A 18 1 
ATOM 156 C CA . VAL A 1 38 . 17.015 1.81 -5.148 1 13.06 ? CA VAL A 18 1 
ATOM 157 C C . VAL A 1 38 . 15.956 0.985 -4.413 1 13.37 ? C VAL A 18 1 
ATOM 158 O O . VAL A 1 38 . 15.213 1.536 -3.594 1 13.15 ? O VAL A 18 1 
ATOM 159 C CB . VAL A 1 38 . 16.805 1.719 -6.675 1 12.96 ? CB VAL A 18 1 
ATOM 160 C CG1 . VAL A 1 38 . 15.34 1.943 -7.03 1 12.62 ? CG1 VAL A 18 1 
ATOM 161 C CG2 . VAL A 1 38 . 17.674 2.739 -7.386 1 12.87 ? CG2 VAL A 18 1 
ATOM 162 N N . ASP A 1 39 . 15.905 -0.323 -4.684 1 13.54 ? N ASP A 19 1 
ATOM 163 C CA . ASP A 1 39 . 14.829 -1.163 -4.16 1 13.96 ? CA ASP A 19 1 
ATOM 164 C C . ASP A 1 39 . 14.91 -1.335 -2.658 1 13.29 ? C ASP A 19 1 
ATOM 165 O O . ASP A 1 39 . 15.897 -1.835 -2.143 1 13.13 ? O ASP A 19 1 
ATOM 166 C CB . ASP A 1 39 . 14.819 -2.514 -4.855 1 14.64 ? CB ASP A 19 1 
ATOM 167 C CG . ASP A 1 39 . 14.724 -2.382 -6.345 1 15.7 ? CG ASP A 19 1 
ATOM 168 O OD1 . ASP A 1 39 . 13.663 -1.915 -6.832 1 16.7 ? OD1 ASP A 19 1 
ATOM 169 O OD2 . ASP A 1 39 . 15.713 -2.727 -7.034 1 16.23 ? OD2 ASP A 19 1 
ATOM 170 N N . GLY A 1 40 . 13.867 -0.903 -1.962 1 12.97 ? N GLY A 20 1 
ATOM 171 C CA . GLY A 1 40 . 13.822 -0.969 -0.507 1 12.66 ? CA GLY A 20 1 
ATOM 172 C C . GLY A 1 40 . 14.286 0.308 0.182 1 12.81 ? C GLY A 20 1 
ATOM 173 O O . GLY A 1 40 . 14.17 0.437 1.413 1 12.52 ? O GLY A 20 1 
ATOM 174 N N . ILE A 1 41 . 14.829 1.238 -0.609 1 12.55 ? N ILE A 21 1 
ATOM 175 C CA . ILE A 1 41 . 15.341 2.522 -0.112 1 12.77 ? CA ILE A 21 1 
ATOM 176 C C . ILE A 1 41 . 14.561 3.67 -0.795 1 13.32 ? C ILE A 21 1 
ATOM 177 O O . ILE A 1 41 . 13.781 4.392 -0.153 1 13.31 ? O ILE A 21 1 
ATOM 178 C CB . ILE A 1 41 . 16.88 2.662 -0.363 1 12.7 ? CB ILE A 21 1 
ATOM 179 C CG1 . ILE A 1 41 . 17.674 1.583 0.375 1 12.18 ? CG1 ILE A 21 1 
ATOM 180 C CG2 . ILE A 1 41 . 17.399 4.043 0.034 1 12.39 ? CG2 ILE A 21 1 
ATOM 181 C CD1 . ILE A 1 41 . 17.504 1.598 1.88 1 12.06 ? CD1 ILE A 21 1 
ATOM 182 N N . LEU A 1 42 . 14.764 3.813 -2.101 1 13 ? N LEU A 22 1 
ATOM 183 C CA . LEU A 1 42 . 14.015 4.767 -2.891 1 13.22 ? CA LEU A 22 1 
ATOM 184 C C . LEU A 1 42 . 12.599 4.274 -3.194 1 14.15 ? C LEU A 22 1 
ATOM 185 O O . LEU A 1 42 . 11.702 5.081 -3.423 1 14.6 ? O LEU A 22 1 
ATOM 186 C CB . LEU A 1 42 . 14.774 5.094 -4.171 1 12.5 ? CB LEU A 22 1 
ATOM 187 C CG . LEU A 1 42 . 15.964 6.04 -3.957 1 12.24 ? CG LEU A 22 1 
ATOM 188 C CD1 . LEU A 1 42 . 16.789 6.181 -5.224 1 12.28 ? CD1 LEU A 22 1 
ATOM 189 C CD2 . LEU A 1 42 . 15.526 7.412 -3.461 1 12.07 ? CD2 LEU A 22 1 
ATOM 190 N N . SER A 1 43 . 12.403 2.953 -3.215 1 15 ? N SER A 23 1 
ATOM 191 C CA . SER A 1 43 . 11.057 2.365 -3.287 1 15.51 ? CA SER A 23 1 
ATOM 192 C C . SER A 1 43 . 10.824 1.607 -1.998 1 15.8 ? C SER A 23 1 
ATOM 193 O O . SER A 1 43 . 11.748 1.477 -1.194 1 16.03 ? O SER A 23 1 
ATOM 194 C CB . SER A 1 43 . 10.92 1.423 -4.485 1 15.48 ? CB SER A 23 1 
ATOM 195 O OG . SER A 1 43 . 11.733 0.267 -4.33 1 16.16 ? OG SER A 23 1 
ATOM 196 N N . ASP A 1 44 . 9.613 1.084 -1.806 1 16.28 ? N ASP A 24 1 
ATOM 197 C CA . ASP A 1 44 . 9.316 0.236 -0.637 1 15.96 ? CA ASP A 24 1 
ATOM 198 C C . ASP A 1 44 . 9.598 -1.25 -0.869 1 15.36 ? C ASP A 24 1 
ATOM 199 O O . ASP A 1 44 . 9.205 -2.095 -0.058 1 15.54 ? O ASP A 24 1 
ATOM 200 C CB . ASP A 1 44 . 7.875 0.436 -0.158 1 16.63 ? CB ASP A 24 1 
ATOM 201 C CG . ASP A 1 44 . 6.848 -0.128 -1.125 1 17.53 ? CG ASP A 24 1 
ATOM 202 O OD1 . ASP A 1 44 . 7.193 -0.424 -2.298 1 17.63 ? OD1 ASP A 24 1 
ATOM 203 O OD2 . ASP A 1 44 . 5.684 -0.279 -0.696 1 18.16 ? OD2 ASP A 24 1 
ATOM 204 N N . GLY A 1 45 . 10.285 -1.567 -1.965 1 14.56 ? N GLY A 25 1 
ATOM 205 C CA . GLY A 1 45 . 10.74 -2.934 -2.221 1 13.96 ? CA GLY A 25 1 
ATOM 206 C C . GLY A 1 45 . 9.823 -3.731 -3.135 1 13.86 ? C GLY A 25 1 
ATOM 207 O O . GLY A 1 45 . 10.134 -4.854 -3.52 1 13.94 ? O GLY A 25 1 
ATOM 208 N N . GLN A 1 46 . 8.683 -3.162 -3.491 1 13.74 ? N GLN A 26 1 
ATOM 209 C CA . GLN A 1 46 . 7.81 -3.84 -4.426 1 13.8 ? CA GLN A 26 1 
ATOM 210 C C . GLN A 1 46 . 8.447 -3.922 -5.8 1 13.48 ? C GLN A 26 1 
ATOM 211 O O . GLN A 1 46 . 8.986 -2.937 -6.292 1 12.96 ? O GLN A 26 1 
ATOM 212 C CB . GLN A 1 46 . 6.426 -3.192 -4.474 1 14.55 ? CB GLN A 26 1 
ATOM 213 C CG . GLN A 1 46 . 5.558 -3.604 -3.3 1 15.53 ? CG GLN A 26 1 
ATOM 214 C CD . GLN A 1 46 . 4.209 -2.923 -3.306 1 16.79 ? CD GLN A 26 1 
ATOM 215 O OE1 . GLN A 1 46 . 3.47 -2.991 -4.281 1 17.39 ? OE1 GLN A 26 1 
ATOM 216 N NE2 . GLN A 1 46 . 3.876 -2.264 -2.207 1 17.7 ? NE2 GLN A 26 1 
ATOM 217 N N . ILE A 1 47 . 8.426 -5.126 -6.372 1 13.66 ? N ILE A 27 1 
ATOM 218 C CA . ILE A 1 47 . 8.789 -5.369 -7.773 1 13.9 ? CA ILE A 27 1 
ATOM 219 C C . ILE A 1 47 . 7.502 -5.781 -8.498 1 13.96 ? C ILE A 27 1 
ATOM 220 O O . ILE A 1 47 . 6.871 -6.803 -8.16 1 13.85 ? O ILE A 27 1 
ATOM 221 C CB . ILE A 1 47 . 9.847 -6.5 -7.932 1 13.92 ? CB ILE A 27 1 
ATOM 222 C CG1 . ILE A 1 47 . 11.048 -6.33 -6.972 1 13.73 ? CG1 ILE A 27 1 
ATOM 223 C CG2 . ILE A 1 47 . 10.282 -6.64 -9.39 1 13.82 ? CG2 ILE A 27 1 
ATOM 224 C CD1 . ILE A 1 47 . 11.904 -5.107 -7.213 1 13.61 ? CD1 ILE A 27 1 
ATOM 225 N N . ILE A 1 48 . 7.122 -4.979 -9.492 1 14.18 ? N ILE A 28 1 
ATOM 226 C CA . ILE A 1 48 . 5.775 -5 -10.048 1 13.98 ? CA ILE A 28 1 
ATOM 227 C C . ILE A 1 48 . 5.803 -5.279 -11.557 1 14.34 ? C ILE A 28 1 
ATOM 228 O O . ILE A 1 48 . 6.411 -4.535 -12.324 1 14.2 ? O ILE A 28 1 
ATOM 229 C CB . ILE A 1 48 . 5.067 -3.654 -9.778 1 13.96 ? CB ILE A 28 1 
ATOM 230 C CG1 . ILE A 1 48 . 5.102 -3.271 -8.287 1 13.75 ? CG1 ILE A 28 1 
ATOM 231 C CG2 . ILE A 1 48 . 3.629 -3.672 -10.278 1 13.87 ? CG2 ILE A 28 1 
ATOM 232 C CD1 . ILE A 1 48 . 4.895 -1.788 -8.041 1 12.91 ? CD1 ILE A 28 1 
ATOM 233 N N . TYR A 1 49 . 5.126 -6.35 -11.967 1 14.66 ? N TYR A 29 1 
ATOM 234 C CA . TYR A 1 49 . 5.05 -6.756 -13.376 1 14.52 ? CA TYR A 29 1 
ATOM 235 C C . TYR A 1 49 . 3.606 -6.781 -13.854 1 15.21 ? C TYR A 29 1 
ATOM 236 O O . TYR A 1 49 . 2.686 -7.004 -13.061 1 15.22 ? O TYR A 29 1 
ATOM 237 C CB . TYR A 1 49 . 5.64 -8.159 -13.575 1 14.22 ? CB TYR A 29 1 
ATOM 238 C CG . TYR A 1 49 . 7.107 -8.304 -13.247 1 13.91 ? CG TYR A 29 1 
ATOM 239 C CD1 . TYR A 1 49 . 8.021 -7.318 -13.617 1 14.34 ? CD1 TYR A 29 1 
ATOM 240 C CD2 . TYR A 1 49 . 7.589 -9.437 -12.597 1 13.73 ? CD2 TYR A 29 1 
ATOM 241 C CE1 . TYR A 1 49 . 9.369 -7.442 -13.325 1 14.14 ? CE1 TYR A 29 1 
ATOM 242 C CE2 . TYR A 1 49 . 8.943 -9.574 -12.303 1 13.66 ? CE2 TYR A 29 1 
ATOM 243 C CZ . TYR A 1 49 . 9.825 -8.57 -12.675 1 13.83 ? CZ TYR A 29 1 
ATOM 244 O OH . TYR A 1 49 . 11.172 -8.659 -12.409 1 13.82 ? OH TYR A 29 1 
ATOM 245 N N . ASN A 1 50 . 3.399 -6.566 -15.152 1 15.48 ? N ASN A 30 1 
ATOM 246 C CA . ASN A 1 50 . 2.067 -6.726 -15.705 1 15.71 ? CA ASN A 30 1 
ATOM 247 C C . ASN A 1 50 . 2 -7.658 -16.916 1 15.84 ? C ASN A 30 1 
ATOM 248 O O . ASN A 1 50 . 3.037 -8.084 -17.441 1 16.41 ? O ASN A 30 1 
ATOM 249 C CB . ASN A 1 50 . 1.364 -5.372 -15.916 1 15.37 ? CB ASN A 30 1 
ATOM 250 C CG . ASN A 1 50 . 1.771 -4.67 -17.196 1 15.88 ? CG ASN A 30 1 
ATOM 251 O OD1 . ASN A 1 50 . 2.163 -5.296 -18.186 1 15.52 ? OD1 ASN A 30 1 
ATOM 252 N ND2 . ASN A 1 50 . 1.625 -3.347 -17.195 1 15.99 ? ND2 ASN A 30 1 
ATOM 253 N N . SER A 1 51 . 0.779 -7.953 -17.359 1 16.07 ? N SER A 31 1 
ATOM 254 C CA . SER A 1 51 . 0.537 -9.006 -18.348 1 16.82 ? CA SER A 31 1 
ATOM 255 C C . SER A 1 51 . 0.99 -8.654 -19.752 1 17.87 ? C SER A 31 1 
ATOM 256 O O . SER A 1 51 . 0.955 -9.501 -20.633 1 17.94 ? O SER A 31 1 
ATOM 257 C CB . SER A 1 51 . -0.939 -9.422 -18.369 1 16.29 ? CB SER A 31 1 
ATOM 258 O OG . SER A 1 51 . -1.785 -8.357 -18.771 1 15.66 ? OG SER A 31 1 
ATOM 259 N N . GLU A 1 52 . 1.411 -7.407 -19.95 1 20.05 ? N GLU A 32 1 
ATOM 260 C CA . GLU A 1 52 . 1.959 -6.947 -21.231 1 21.43 ? CA GLU A 32 1 
ATOM 261 C C . GLU A 1 52 . 3.483 -6.931 -21.209 1 20.94 ? C GLU A 32 1 
ATOM 262 O O . GLU A 1 52 . 4.115 -6.474 -22.159 1 20.78 ? O GLU A 32 1 
ATOM 263 C CB . GLU A 1 52 . 1.426 -5.55 -21.575 1 23.92 ? CB GLU A 32 1 
ATOM 264 C CG . GLU A 1 52 . -0.057 -5.52 -21.931 1 27.66 ? CG GLU A 32 1 
ATOM 265 C CD . GLU A 1 52 . -0.51 -4.186 -22.505 1 30.86 ? CD GLU A 32 1 
ATOM 266 O OE1 . GLU A 1 52 . -0.353 -3.143 -21.832 1 32.19 ? OE1 GLU A 32 1 
ATOM 267 O OE2 . GLU A 1 52 . -1.041 -4.183 -23.637 1 33.9 ? OE2 GLU A 32 1 
ATOM 268 N N . GLY A 1 53 . 4.069 -7.429 -20.12 1 20.41 ? N GLY A 33 1 
ATOM 269 C CA . GLY A 1 53 . 5.527 -7.487 -19.974 1 18.51 ? CA GLY A 33 1 
ATOM 270 C C . GLY A 1 53 . 6.128 -6.218 -19.383 1 17.72 ? C GLY A 33 1 
ATOM 271 O O . GLY A 1 53 . 7.344 -6.03 -19.401 1 17.2 ? O GLY A 33 1 
ATOM 272 N N . THR A 1 54 . 5.278 -5.355 -18.845 1 16.94 ? N THR A 34 1 
ATOM 273 C CA . THR A 1 54 . 5.704 -4.042 -18.367 1 16.76 ? CA THR A 34 1 
ATOM 274 C C . THR A 1 54 . 6.026 -4.062 -16.871 1 16.02 ? C THR A 34 1 
ATOM 275 O O . THR A 1 54 . 5.303 -4.688 -16.088 1 15.53 ? O THR A 34 1 
ATOM 276 C CB . THR A 1 54 . 4.622 -2.998 -18.687 1 17 ? CB THR A 34 1 
ATOM 277 O OG1 . THR A 1 54 . 4.455 -2.917 -20.106 1 18.34 ? OG1 THR A 34 1 
ATOM 278 C CG2 . THR A 1 54 . 5.001 -1.641 -18.173 1 17.36 ? CG2 THR A 34 1 
ATOM 279 N N . GLU A 1 55 . 7.103 -3.376 -16.485 1 15.18 ? N GLU A 35 1 
ATOM 280 C CA . GLU A 1 55 . 7.53 -3.304 -15.077 1 14.56 ? CA GLU A 35 1 
ATOM 281 C C . GLU A 1 55 . 7.24 -1.936 -14.487 1 13.96 ? C GLU A 35 1 
ATOM 282 O O . GLU A 1 55 . 7.333 -0.928 -15.184 1 13.87 ? O GLU A 35 1 
ATOM 283 C CB . GLU A 1 55 . 9.035 -3.609 -14.918 1 14.67 ? CB GLU A 35 1 
ATOM 284 C CG . GLU A 1 55 . 9.508 -3.556 -13.46 1 15.31 ? CG GLU A 35 1 
ATOM 285 C CD . GLU A 1 55 . 10.968 -3.939 -13.241 1 15.89 ? CD GLU A 35 1 
ATOM 286 O OE1 . GLU A 1 55 . 11.701 -4.153 -14.227 1 16.64 ? OE1 GLU A 35 1 
ATOM 287 O OE2 . GLU A 1 55 . 11.386 -4.039 -12.065 1 16.37 ? OE2 GLU A 35 1 
ATOM 288 N N . THR A 1 56 . 6.929 -1.914 -13.194 1 13.21 ? N THR A 36 1 
ATOM 289 C CA . THR A 1 56 . 6.56 -0.695 -12.494 1 12.8 ? CA THR A 36 1 
ATOM 290 C C . THR A 1 56 . 7.377 -0.558 -11.201 1 12.78 ? C THR A 36 1 
ATOM 291 O O . THR A 1 56 . 7.691 -1.561 -10.537 1 13.06 ? O THR A 36 1 
ATOM 292 C CB . THR A 1 56 . 5.032 -0.675 -12.232 1 12.69 ? CB THR A 36 1 
ATOM 293 O OG1 . THR A 1 56 . 4.339 -0.562 -13.486 1 12.08 ? OG1 THR A 36 1 
ATOM 294 C CG2 . THR A 1 56 . 4.592 0.477 -11.308 1 12.34 ? CG2 THR A 36 1 
ATOM 295 N N . LYS A 1 57 . 7.739 0.679 -10.864 1 12.32 ? N LYS A 37 1 
ATOM 296 C CA . LYS A 1 57 . 8.36 0.975 -9.576 1 12.51 ? CA LYS A 37 1 
ATOM 297 C C . LYS A 1 57 . 7.803 2.292 -9.02 1 12.24 ? C LYS A 37 1 
ATOM 298 O O . LYS A 1 57 . 7.551 3.248 -9.77 1 12.04 ? O LYS A 37 1 
ATOM 299 C CB . LYS A 1 57 . 9.89 1.034 -9.691 1 12.69 ? CB LYS A 37 1 
ATOM 300 C CG . LYS A 1 57 . 10.616 0.516 -8.454 1 13.12 ? CG LYS A 37 1 
ATOM 301 C CD . LYS A 1 57 . 12.13 0.646 -8.583 1 13.42 ? CD LYS A 37 1 
ATOM 302 C CE . LYS A 1 57 . 12.684 -0.192 -9.736 1 13.51 ? CE LYS A 37 1 
ATOM 303 N NZ . LYS A 1 57 . 12.569 -1.649 -9.468 1 13.62 ? NZ LYS A 37 1 
ATOM 304 N N . ALA A 1 58 . 7.597 2.327 -7.709 1 11.72 ? N ALA A 38 1 
ATOM 305 C CA . ALA A 1 58 . 7.023 3.494 -7.058 1 11.68 ? CA ALA A 38 1 
ATOM 306 C C . ALA A 1 58 . 8.066 4.208 -6.201 1 11.97 ? C ALA A 38 1 
ATOM 307 O O . ALA A 1 58 . 8.783 3.581 -5.416 1 11.94 ? O ALA A 38 1 
ATOM 308 C CB . ALA A 1 58 . 5.827 3.087 -6.211 1 11.78 ? CB ALA A 38 1 
ATOM 309 N N . PHE A 1 59 . 8.139 5.526 -6.358 1 12.23 ? N PHE A 39 1 
ATOM 310 C CA . PHE A 1 59 . 9.038 6.364 -5.571 1 12.42 ? CA PHE A 39 1 
ATOM 311 C C . PHE A 1 59 . 8.218 7.274 -4.646 1 12.63 ? C PHE A 39 1 
ATOM 312 O O . PHE A 1 59 . 6.995 7.303 -4.743 1 12.86 ? O PHE A 39 1 
ATOM 313 C CB . PHE A 1 59 . 9.952 7.183 -6.498 1 12.17 ? CB PHE A 39 1 
ATOM 314 C CG . PHE A 1 59 . 10.763 6.348 -7.456 1 12.08 ? CG PHE A 39 1 
ATOM 315 C CD1 . PHE A 1 59 . 11.981 5.778 -7.06 1 12.27 ? CD1 PHE A 39 1 
ATOM 316 C CD2 . PHE A 1 59 . 10.322 6.136 -8.761 1 12.15 ? CD2 PHE A 39 1 
ATOM 317 C CE1 . PHE A 1 59 . 12.727 5.002 -7.944 1 12.03 ? CE1 PHE A 39 1 
ATOM 318 C CE2 . PHE A 1 59 . 11.066 5.368 -9.655 1 11.99 ? CE2 PHE A 39 1 
ATOM 319 C CZ . PHE A 1 59 . 12.265 4.798 -9.243 1 12.29 ? CZ PHE A 39 1 
ATOM 320 N N . TYR A 1 60 . 8.892 8.012 -3.76 1 12.96 ? N TYR A 40 1 
ATOM 321 C CA . TYR A 1 60 . 8.231 8.918 -2.825 1 13.11 ? CA TYR A 40 1 
ATOM 322 C C . TYR A 1 60 . 8.568 10.374 -3.094 1 13.31 ? C TYR A 40 1 
ATOM 323 O O . TYR A 1 60 . 9.745 10.749 -3.163 1 12.95 ? O TYR A 40 1 
ATOM 324 C CB . TYR A 1 60 . 8.637 8.568 -1.406 1 13.32 ? CB TYR A 40 1 
ATOM 325 C CG . TYR A 1 60 . 7.86 9.251 -0.311 1 13.32 ? CG TYR A 40 1 
ATOM 326 C CD1 . TYR A 1 60 . 6.463 9.298 -0.326 1 13.57 ? CD1 TYR A 40 1 
ATOM 327 C CD2 . TYR A 1 60 . 8.523 9.794 0.78 1 13.67 ? CD2 TYR A 40 1 
ATOM 328 C CE1 . TYR A 1 60 . 5.752 9.895 0.711 1 13.81 ? CE1 TYR A 40 1 
ATOM 329 C CE2 . TYR A 1 60 . 7.826 10.39 1.825 1 13.85 ? CE2 TYR A 40 1 
ATOM 330 C CZ . TYR A 1 60 . 6.444 10.437 1.789 1 14.18 ? CZ TYR A 40 1 
ATOM 331 O OH . TYR A 1 60 . 5.768 11.029 2.84 1 14.5 ? OH TYR A 40 1 
ATOM 332 N N . VAL A 1 61 . 7.516 11.185 -3.208 1 13.63 ? N VAL A 41 1 
ATOM 333 C CA . VAL A 1 61 . 7.603 12.621 -3.555 1 13.92 ? CA VAL A 41 1 
ATOM 334 C C . VAL A 1 61 . 8.479 13.479 -2.601 1 14.26 ? C VAL A 41 1 
ATOM 335 O O . VAL A 1 61 . 9.21 14.367 -3.049 1 14.57 ? O VAL A 41 1 
ATOM 336 C CB . VAL A 1 61 . 6.178 13.236 -3.734 1 13.31 ? CB VAL A 41 1 
ATOM 337 C CG1 . VAL A 1 61 . 5.46 13.415 -2.4 1 13.13 ? CG1 VAL A 41 1 
ATOM 338 C CG2 . VAL A 1 61 . 6.25 14.56 -4.47 1 13.58 ? CG2 VAL A 41 1 
ATOM 339 N N . GLN A 1 62 . 8.421 13.205 -1.303 1 14.41 ? N GLN A 42 1 
ATOM 340 C CA . GLN A 1 62 . 9.225 13.968 -0.337 1 15.2 ? CA GLN A 42 1 
ATOM 341 C C . GLN A 1 62 . 10.719 13.638 -0.406 1 14.9 ? C GLN A 42 1 
ATOM 342 O O . GLN A 1 62 . 11.559 14.459 -0.026 1 15.14 ? O GLN A 42 1 
ATOM 343 C CB . GLN A 1 62 . 8.699 13.775 1.073 1 15.38 ? CB GLN A 42 1 
ATOM 344 C CG . GLN A 1 62 . 7.249 14.19 1.23 1 16.73 ? CG GLN A 42 1 
ATOM 345 C CD . GLN A 1 62 . 6.878 14.446 2.672 1 17.67 ? CD GLN A 42 1 
ATOM 346 O OE1 . GLN A 1 62 . 7.713 14.299 3.567 1 18.87 ? OE1 GLN A 42 1 
ATOM 347 N NE2 . GLN A 1 62 . 5.618 14.829 2.913 1 17.95 ? NE2 GLN A 42 1 
ATOM 348 N N . ASP A 1 63 . 11.043 12.445 -0.904 1 14.54 ? N ASP A 43 1 
ATOM 349 C CA . ASP A 1 63 . 12.439 12.059 -1.143 1 14.12 ? CA ASP A 43 1 
ATOM 350 C C . ASP A 1 63 . 13.054 12.913 -2.229 1 14.45 ? C ASP A 43 1 
ATOM 351 O O . ASP A 1 63 . 14.209 13.34 -2.115 1 15.18 ? O ASP A 43 1 
ATOM 352 C CB . ASP A 1 63 . 12.544 10.575 -1.496 1 13.46 ? CB ASP A 43 1 
ATOM 353 C CG . ASP A 1 63 . 12.211 9.681 -0.32 1 13.42 ? CG ASP A 43 1 
ATOM 354 O OD1 . ASP A 1 63 . 12.369 10.134 0.843 1 13.27 ? OD1 ASP A 43 1 
ATOM 355 O OD2 . ASP A 1 63 . 11.814 8.526 -0.55 1 12.83 ? OD2 ASP A 43 1 
ATOM 356 N N . GLY A 1 64 . 12.272 13.189 -3.266 1 14.57 ? N GLY A 44 1 
ATOM 357 C CA . GLY A 1 64 . 12.741 13.991 -4.394 1 15.16 ? CA GLY A 44 1 
ATOM 358 C C . GLY A 1 64 . 13.173 15.383 -3.974 1 15.39 ? C GLY A 44 1 
ATOM 359 O O . GLY A 1 64 . 14.196 15.899 -4.429 1 15.57 ? O GLY A 44 1 
ATOM 360 N N . LEU A 1 65 . 12.389 15.988 -3.092 1 14.9 ? N LEU A 45 1 
ATOM 361 C CA . LEU A 1 65 . 12.642 17.347 -2.682 1 14.95 ? CA LEU A 45 1 
ATOM 362 C C . LEU A 1 65 . 13.844 17.39 -1.738 1 14.55 ? C LEU A 45 1 
ATOM 363 O O . LEU A 1 65 . 14.654 18.317 -1.794 1 14.46 ? O LEU A 45 1 
ATOM 364 C CB . LEU A 1 65 . 11.376 17.951 -2.072 1 14.9 ? CB LEU A 45 1 
ATOM 365 C CG . LEU A 1 65 . 11.201 19.466 -1.905 1 15.72 ? CG LEU A 45 1 
ATOM 366 C CD1 . LEU A 1 65 . 11.282 19.861 -0.435 1 15.61 ? CD1 LEU A 45 1 
ATOM 367 C CD2 . LEU A 1 65 . 12.135 20.314 -2.78 1 15.59 ? CD2 LEU A 45 1 
ATOM 368 N N . GLY A 1 66 . 13.968 16.37 -0.894 1 14.54 ? N GLY A 46 1 
ATOM 369 C CA . GLY A 1 66 . 15.107 16.26 0.011 1 15.24 ? CA GLY A 46 1 
ATOM 370 C C . GLY A 1 66 . 16.403 16.031 -0.74 1 15.57 ? C GLY A 46 1 
ATOM 371 O O . GLY A 1 66 . 17.463 16.479 -0.308 1 14.92 ? O GLY A 46 1 
ATOM 372 N N . LEU A 1 67 . 16.306 15.339 -1.876 1 16.24 ? N LEU A 47 1 
ATOM 373 C CA . LEU A 1 67 . 17.478 15.028 -2.683 1 16.57 ? CA LEU A 47 1 
ATOM 374 C C . LEU A 1 67 . 17.937 16.277 -3.42 1 16.96 ? C LEU A 47 1 
ATOM 375 O O . LEU A 1 67 . 19.133 16.524 -3.535 1 16.39 ? O LEU A 47 1 
ATOM 376 C CB . LEU A 1 67 . 17.222 13.858 -3.645 1 16.71 ? CB LEU A 47 1 
ATOM 377 C CG . LEU A 1 67 . 17.307 12.449 -3.019 1 17.09 ? CG LEU A 47 1 
ATOM 378 C CD1 . LEU A 1 67 . 16.725 11.379 -3.933 1 17.08 ? CD1 LEU A 47 1 
ATOM 379 C CD2 . LEU A 1 67 . 18.729 12.085 -2.62 1 17.07 ? CD2 LEU A 47 1 
ATOM 380 N N . GLN A 1 68 . 16.989 17.076 -3.894 1 17.46 ? N GLN A 48 1 
ATOM 381 C CA . GLN A 1 68 . 17.344 18.337 -4.531 1 18.32 ? CA GLN A 48 1 
ATOM 382 C C . GLN A 1 68 . 18.002 19.306 -3.546 1 17.41 ? C GLN A 48 1 
ATOM 383 O O . GLN A 1 68 . 18.984 19.95 -3.895 1 17.03 ? O GLN A 48 1 
ATOM 384 C CB . GLN A 1 68 . 16.143 18.965 -5.237 1 20.46 ? CB GLN A 48 1 
ATOM 385 C CG . GLN A 1 68 . 15.909 18.406 -6.635 1 23.55 ? CG GLN A 48 1 
ATOM 386 C CD . GLN A 1 68 . 14.478 18.592 -7.105 1 26.39 ? CD GLN A 48 1 
ATOM 387 O OE1 . GLN A 1 68 . 13.59 18.922 -6.314 1 28.63 ? OE1 GLN A 48 1 
ATOM 388 N NE2 . GLN A 1 68 . 14.241 18.365 -8.386 1 26.87 ? NE2 GLN A 48 1 
ATOM 389 N N . ALA A 1 69 . 17.484 19.37 -2.321 1 16.77 ? N ALA A 49 1 
ATOM 390 C CA . ALA A 1 69 . 18.095 20.152 -1.246 1 16.78 ? CA ALA A 49 1 
ATOM 391 C C . ALA A 1 69 . 19.557 19.765 -1.033 1 16.51 ? C ALA A 49 1 
ATOM 392 O O . ALA A 1 69 . 20.452 20.607 -1.147 1 16.17 ? O ALA A 49 1 
ATOM 393 C CB . ALA A 1 69 . 17.311 19.991 0.037 1 16.84 ? CB ALA A 49 1 
ATOM 394 N N . LEU A 1 70 . 19.798 18.493 -0.733 1 16.84 ? N LEU A 50 1 
ATOM 395 C CA . LEU A 1 70 . 21.157 17.965 -0.637 1 16.75 ? CA LEU A 50 1 
ATOM 396 C C . LEU A 1 70 . 21.979 18.373 -1.844 1 16.99 ? C LEU A 50 1 
ATOM 397 O O . LEU A 1 70 . 23.03 18.993 -1.699 1 16.65 ? O LEU A 50 1 
ATOM 398 C CB . LEU A 1 70 . 21.149 16.438 -0.571 1 16.75 ? CB LEU A 50 1 
ATOM 399 C CG . LEU A 1 70 . 21.49 15.702 0.715 1 16.49 ? CG LEU A 50 1 
ATOM 400 C CD1 . LEU A 1 70 . 22.265 14.452 0.322 1 16.57 ? CD1 LEU A 50 1 
ATOM 401 C CD2 . LEU A 1 70 . 22.298 16.546 1.688 1 15.91 ? CD2 LEU A 50 1 
ATOM 402 N N . LYS A 1 71 . 21.478 18.025 -3.028 1 17.72 ? N LYS A 51 1 
ATOM 403 C CA . LYS A 1 71 . 22.155 18.298 -4.297 1 18.88 ? CA LYS A 51 1 
ATOM 404 C C . LYS A 1 71 . 22.5 19.782 -4.435 1 19.43 ? C LYS A 51 1 
ATOM 405 O O . LYS A 1 71 . 23.607 20.134 -4.826 1 18.88 ? O LYS A 51 1 
ATOM 406 C CB . LYS A 1 71 . 21.283 17.822 -5.456 1 19.27 ? CB LYS A 51 1 
ATOM 407 C CG . LYS A 1 71 . 21.901 17.951 -6.845 1 20.27 ? CG LYS A 51 1 
ATOM 408 C CD . LYS A 1 71 . 21.488 19.239 -7.528 1 20.75 ? CD LYS A 51 1 
ATOM 409 C CE . LYS A 1 71 . 20.081 19.151 -8.109 1 20.99 ? CE LYS A 51 1 
ATOM 410 N NZ . LYS A 1 71 . 19.94 20.172 -9.186 1 20.05 ? NZ LYS A 51 1 
ATOM 411 N N . GLN A 1 72 . 21.545 20.637 -4.083 1 21.18 ? N GLN A 52 1 
ATOM 412 C CA . GLN A 1 72 . 21.718 22.091 -4.113 1 22.4 ? CA GLN A 52 1 
ATOM 413 C C . GLN A 1 72 . 22.866 22.574 -3.243 1 22.13 ? C GLN A 52 1 
ATOM 414 O O . GLN A 1 72 . 23.506 23.58 -3.558 1 21.46 ? O GLN A 52 1 
ATOM 415 C CB . GLN A 1 72 . 20.462 22.783 -3.601 1 24.02 ? CB GLN A 52 1 
ATOM 416 C CG . GLN A 1 72 . 19.314 22.843 -4.576 1 27.35 ? CG GLN A 52 1 
ATOM 417 C CD . GLN A 1 72 . 18.22 23.764 -4.084 1 29.94 ? CD GLN A 52 1 
ATOM 418 O OE1 . GLN A 1 72 . 18.386 24.46 -3.073 1 32.19 ? OE1 GLN A 52 1 
ATOM 419 N NE2 . GLN A 1 72 . 17.093 23.777 -4.79 1 30.54 ? NE2 GLN A 52 1 
ATOM 420 N N . SER A 1 73 . 23.086 21.889 -2.122 1 21.56 ? N SER A 53 1 
ATOM 421 C CA . SER A 1 73 . 24.124 22.292 -1.182 1 20.55 ? CA SER A 53 1 
ATOM 422 C C . SER A 1 73 . 25.49 21.829 -1.658 1 20.46 ? C SER A 53 1 
ATOM 423 O O . SER A 1 73 . 26.48 22.011 -0.963 1 21.04 ? O SER A 53 1 
ATOM 424 C CB . SER A 1 73 . 23.834 21.759 0.219 1 20.26 ? CB SER A 53 1 
ATOM 425 O OG . SER A 1 73 . 24.093 20.375 0.287 1 20.5 ? OG SER A 53 1 
ATOM 426 N N . GLY A 1 74 . 25.534 21.235 -2.847 1 20.43 ? N GLY A 54 1 
ATOM 427 C CA . GLY A 1 74 . 26.786 20.819 -3.461 1 20.23 ? CA GLY A 54 1 
ATOM 428 C C . GLY A 1 74 . 27.211 19.398 -3.144 1 20.15 ? C GLY A 54 1 
ATOM 429 O O . GLY A 1 74 . 28.392 19.104 -3.09 1 20.96 ? O GLY A 54 1 
ATOM 430 N N . ILE A 1 75 . 26.251 18.513 -2.922 1 19.8 ? N ILE A 55 1 
ATOM 431 C CA . ILE A 1 75 . 26.563 17.102 -2.764 1 18.63 ? CA ILE A 55 1 
ATOM 432 C C . ILE A 1 75 . 26.183 16.375 -4.054 1 18.4 ? C ILE A 55 1 
ATOM 433 O O . ILE A 1 75 . 25.161 16.672 -4.673 1 18.17 ? O ILE A 55 1 
ATOM 434 C CB . ILE A 1 75 . 25.933 16.516 -1.478 1 18.7 ? CB ILE A 55 1 
ATOM 435 C CG1 . ILE A 1 75 . 26.663 17.101 -0.255 1 18.5 ? CG1 ILE A 55 1 
ATOM 436 C CG2 . ILE A 1 75 . 25.993 14.989 -1.461 1 18.24 ? CG2 ILE A 55 1 
ATOM 437 C CD1 . ILE A 1 75 . 25.95 16.927 1.068 1 18.61 ? CD1 ILE A 55 1 
ATOM 438 N N . ILE A 1 76 . 27.061 15.478 -4.486 1 18.04 ? N ILE A 56 1 
ATOM 439 C CA . ILE A 1 76 . 26.846 14.677 -5.686 1 17.63 ? CA ILE A 56 1 
ATOM 440 C C . ILE A 1 76 . 25.985 13.466 -5.336 1 16.99 ? C ILE A 56 1 
ATOM 441 O O . ILE A 1 76 . 26.198 12.808 -4.309 1 16.43 ? O ILE A 56 1 
ATOM 442 C CB . ILE A 1 76 . 28.195 14.225 -6.292 1 17.96 ? CB ILE A 56 1 
ATOM 443 C CG1 . ILE A 1 76 . 29.052 15.458 -6.623 1 18.29 ? CG1 ILE A 56 1 
ATOM 444 C CG2 . ILE A 1 76 . 27.982 13.352 -7.53 1 17.55 ? CG2 ILE A 56 1 
ATOM 445 C CD1 . ILE A 1 76 . 30.545 15.219 -6.533 1 19.03 ? CD1 ILE A 56 1 
ATOM 446 N N . LEU A 1 77 . 25.009 13.194 -6.198 1 16.23 ? N LEU A 57 1 
ATOM 447 C CA . LEU A 1 77 . 24.054 12.122 -5.98 1 15.68 ? CA LEU A 57 1 
ATOM 448 C C . LEU A 1 77 . 24.273 10.979 -6.97 1 15.42 ? C LEU A 57 1 
ATOM 449 O O . LEU A 1 77 . 24.468 11.205 -8.167 1 14.95 ? O LEU A 57 1 
ATOM 450 C CB . LEU A 1 77 . 22.622 12.658 -6.086 1 15.58 ? CB LEU A 57 1 
ATOM 451 C CG . LEU A 1 77 . 22.166 13.84 -5.221 1 15.36 ? CG LEU A 57 1 
ATOM 452 C CD1 . LEU A 1 77 . 20.689 14.106 -5.481 1 15.71 ? CD1 LEU A 57 1 
ATOM 453 C CD2 . LEU A 1 77 . 22.398 13.629 -3.733 1 15.55 ? CD2 LEU A 57 1 
ATOM 454 N N . ALA A 1 78 . 24.233 9.756 -6.448 1 15.14 ? N ALA A 58 1 
ATOM 455 C CA . ALA A 1 78 . 24.483 8.551 -7.232 1 14.83 ? CA ALA A 58 1 
ATOM 456 C C . ALA A 1 78 . 23.524 7.441 -6.849 1 14.71 ? C ALA A 58 1 
ATOM 457 O O . ALA A 1 78 . 23.048 7.37 -5.704 1 14.64 ? O ALA A 58 1 
ATOM 458 C CB . ALA A 1 78 . 25.915 8.077 -7.051 1 14.86 ? CB ALA A 58 1 
ATOM 459 N N . ILE A 1 79 . 23.241 6.586 -7.825 1 14.09 ? N ILE A 59 1 
ATOM 460 C CA . ILE A 1 79 . 22.482 5.377 -7.603 1 13.69 ? CA ILE A 59 1 
ATOM 461 C C . ILE A 1 79 . 23.373 4.163 -7.883 1 14.01 ? C ILE A 59 1 
ATOM 462 O O . ILE A 1 79 . 24.131 4.139 -8.859 1 13.75 ? O ILE A 59 1 
ATOM 463 C CB . ILE A 1 79 . 21.2 5.362 -8.468 1 13.4 ? CB ILE A 59 1 
ATOM 464 C CG1 . ILE A 1 79 . 20.059 6.094 -7.735 1 13.06 ? CG1 ILE A 59 1 
ATOM 465 C CG2 . ILE A 1 79 . 20.778 3.94 -8.798 1 12.97 ? CG2 ILE A 59 1 
ATOM 466 C CD1 . ILE A 1 79 . 18.824 6.34 -8.581 1 13.35 ? CD1 ILE A 59 1 
ATOM 467 N N . ILE A 1 80 . 23.312 3.176 -6.989 1 14.04 ? N ILE A 60 1 
ATOM 468 C CA . ILE A 1 80 . 23.959 1.889 -7.217 1 14.07 ? CA ILE A 60 1 
ATOM 469 C C . ILE A 1 80 . 22.944 0.794 -6.904 1 14.34 ? C ILE A 60 1 
ATOM 470 O O . ILE A 1 80 . 22.569 0.587 -5.747 1 14.12 ? O ILE A 60 1 
ATOM 471 C CB . ILE A 1 80 . 25.276 1.711 -6.41 1 14.01 ? CB ILE A 60 1 
ATOM 472 C CG1 . ILE A 1 80 . 26.148 2.978 -6.475 1 14.14 ? CG1 ILE A 60 1 
ATOM 473 C CG2 . ILE A 1 80 . 26.059 0.514 -6.95 1 14.07 ? CG2 ILE A 60 1 
ATOM 474 C CD1 . ILE A 1 80 . 27.459 2.885 -5.721 1 14.39 ? CD1 ILE A 60 1 
ATOM 475 N N . THR A 1 81 . 22.474 0.117 -7.942 1 14.77 ? N THR A 61 1 
ATOM 476 C CA . THR A 1 81 . 21.397 -0.848 -7.767 1 15.62 ? CA THR A 61 1 
ATOM 477 C C . THR A 1 81 . 21.686 -2.145 -8.5 1 15.96 ? C THR A 61 1 
ATOM 478 O O . THR A 1 81 . 22.301 -2.15 -9.574 1 15.86 ? O THR A 61 1 
ATOM 479 C CB . THR A 1 81 . 20.001 -0.287 -8.157 1 15.79 ? CB THR A 61 1 
ATOM 480 O OG1 . THR A 1 81 . 19.014 -1.318 -8.016 1 16.99 ? OG1 THR A 61 1 
ATOM 481 C CG2 . THR A 1 81 . 19.965 0.214 -9.599 1 16.03 ? CG2 THR A 61 1 
ATOM 482 N N . GLY A 1 82 . 21.253 -3.24 -7.887 1 16.22 ? N GLY A 62 1 
ATOM 483 C CA . GLY A 1 82 . 21.466 -4.567 -8.42 1 16.82 ? CA GLY A 62 1 
ATOM 484 C C . GLY A 1 82 . 20.626 -4.829 -9.642 1 17.26 ? C GLY A 62 1 
ATOM 485 O O . GLY A 1 82 . 21.039 -5.574 -10.521 1 18.49 ? O GLY A 62 1 
ATOM 486 N N . ARG A 1 83 . 19.447 -4.219 -9.707 1 17.83 ? N ARG A 63 1 
ATOM 487 C CA . ARG A 1 83 . 18.565 -4.401 -10.853 1 18.36 ? CA ARG A 63 1 
ATOM 488 C C . ARG A 1 83 . 18.801 -3.313 -11.886 1 19.33 ? C ARG A 63 1 
ATOM 489 O O . ARG A 1 83 . 19.71 -2.502 -11.739 1 20.52 ? O ARG A 63 1 
ATOM 490 C CB . ARG A 1 83 . 17.1 -4.458 -10.411 1 17.96 ? CB ARG A 63 1 
ATOM 491 C CG . ARG A 1 83 . 16.74 -5.759 -9.696 1 17.91 ? CG ARG A 63 1 
ATOM 492 C CD . ARG A 1 83 . 15.329 -5.741 -9.123 1 18.01 ? CD ARG A 63 1 
ATOM 493 N NE . ARG A 1 83 . 14.323 -5.688 -10.185 1 17.34 ? NE ARG A 63 1 
ATOM 494 C CZ . ARG A 1 83 . 13.854 -6.751 -10.826 1 16.87 ? CZ ARG A 63 1 
ATOM 495 N NH1 . ARG A 1 83 . 14.27 -7.969 -10.504 1 16.57 ? NH1 ARG A 63 1 
ATOM 496 N NH2 . ARG A 1 83 . 12.952 -6.592 -11.781 1 16.23 ? NH2 ARG A 63 1 
ATOM 497 N N . SER A 1 84 . 17.991 -3.296 -12.938 1 19.47 ? N SER A 64 1 
ATOM 498 C CA . SER A 1 84 . 18.162 -2.312 -14.003 1 19.07 ? CA SER A 64 1 
ATOM 499 C C . SER A 1 84 . 16.846 -1.999 -14.722 1 18.38 ? C SER A 64 1 
ATOM 500 O O . SER A 1 84 . 16.167 -2.913 -15.185 1 18.82 ? O SER A 64 1 
ATOM 501 C CB . SER A 1 84 . 19.194 -2.829 -15.002 1 19.47 ? CB SER A 64 1 
ATOM 502 O OG . SER A 1 84 . 19.211 -2.004 -16.139 1 20.11 ? OG SER A 64 1 
ATOM 503 N N . SER A 1 85 . 16.498 -0.713 -14.832 1 17.75 ? N SER A 65 1 
ATOM 504 C CA . SER A 1 85 . 15.238 -0.299 -15.477 1 17.13 ? CA SER A 65 1 
ATOM 505 C C . SER A 1 85 . 15.229 1.153 -15.972 1 16.95 ? C SER A 65 1 
ATOM 506 O O . SER A 1 85 . 15.99 1.994 -15.48 1 16.64 ? O SER A 65 1 
ATOM 507 C CB . SER A 1 85 . 14.044 -0.529 -14.537 1 16.56 ? CB SER A 65 1 
ATOM 508 O OG . SER A 1 85 . 14.014 0.428 -13.48 1 15.94 ? OG SER A 65 1 
ATOM 509 N N . ALA A 1 86 . 14.353 1.443 -16.939 1 16.55 ? N ALA A 66 1 
ATOM 510 C CA . ALA A 1 86 . 14.139 2.824 -17.397 1 16.96 ? CA ALA A 66 1 
ATOM 511 C C . ALA A 1 86 . 13.502 3.688 -16.297 1 17.43 ? C ALA A 66 1 
ATOM 512 O O . ALA A 1 86 . 13.663 4.904 -16.296 1 17.65 ? O ALA A 66 1 
ATOM 513 C CB . ALA A 1 86 . 13.292 2.864 -18.659 1 16.4 ? CB ALA A 66 1 
ATOM 514 N N . MET A 1 87 . 12.795 3.066 -15.358 1 17.5 ? N MET A 67 1 
ATOM 515 C CA . MET A 1 87 . 12.182 3.835 -14.277 1 18.4 ? CA MET A 67 1 
ATOM 516 C C . MET A 1 87 . 13.235 4.519 -13.427 1 18.15 ? C MET A 67 1 
ATOM 517 O O . MET A 1 87 . 13.099 5.695 -13.095 1 18.63 ? O MET A 67 1 
ATOM 518 C CB . MET A 1 87 . 11.268 2.969 -13.41 1 18.33 ? CB MET A 67 1 
ATOM 519 C CG . MET A 1 87 . 10.105 2.369 -14.171 1 19.02 ? CG MET A 67 1 
ATOM 520 S SD . MET A 1 87 . 10.539 0.836 -14.998 1 19.97 ? SD MET A 67 1 
ATOM 521 C CE . MET A 1 87 . 10.467 -0.263 -13.586 1 18.94 ? CE MET A 67 1 
ATOM 522 N N . VAL A 1 88 . 14.283 3.777 -13.082 1 18.83 ? N VAL A 68 1 
ATOM 523 C CA . VAL A 1 88 . 15.382 4.312 -12.286 1 19.55 ? CA VAL A 68 1 
ATOM 524 C C . VAL A 1 88 . 16.055 5.487 -12.991 1 20.71 ? C VAL A 68 1 
ATOM 525 O O . VAL A 1 88 . 16.286 6.533 -12.368 1 20.54 ? O VAL A 68 1 
ATOM 526 C CB . VAL A 1 88 . 16.425 3.225 -11.964 1 19.61 ? CB VAL A 68 1 
ATOM 527 C CG1 . VAL A 1 88 . 17.696 3.843 -11.397 1 19.41 ? CG1 VAL A 68 1 
ATOM 528 C CG2 . VAL A 1 88 . 15.837 2.192 -11.007 1 19.06 ? CG2 VAL A 68 1 
ATOM 529 N N . ASP A 1 89 . 16.357 5.302 -14.281 1 21.17 ? N ASP A 69 1 
ATOM 530 C CA . ASP A 1 89 . 16.987 6.331 -15.107 1 22.32 ? CA ASP A 69 1 
ATOM 531 C C . ASP A 1 89 . 16.158 7.612 -15.146 1 21.73 ? C ASP A 69 1 
ATOM 532 O O . ASP A 1 89 . 16.695 8.716 -14.982 1 21.9 ? O ASP A 69 1 
ATOM 533 C CB . ASP A 1 89 . 17.217 5.817 -16.535 1 23.24 ? CB ASP A 69 1 
ATOM 534 C CG . ASP A 1 89 . 18.498 5.011 -16.667 1 24.4 ? CG ASP A 69 1 
ATOM 535 O OD1 . ASP A 1 89 . 19.607 5.599 -16.613 1 24.83 ? OD1 ASP A 69 1 
ATOM 536 O OD2 . ASP A 1 89 . 18.401 3.777 -16.823 1 25.73 ? OD2 ASP A 69 1 
ATOM 537 N N . ARG A 1 90 . 14.852 7.45 -15.35 1 20.4 ? N ARG A 70 1 
ATOM 538 C CA . ARG A 1 90 . 13.928 8.571 -15.388 1 19.78 ? CA ARG A 70 1 
ATOM 539 C C . ARG A 1 90 . 13.858 9.295 -14.038 1 18.52 ? C ARG A 70 1 
ATOM 540 O O . ARG A 1 90 . 13.973 10.52 -13.995 1 18.15 ? O ARG A 70 1 
ATOM 541 C CB . ARG A 1 90 . 12.538 8.119 -15.862 1 20.63 ? CB ARG A 70 1 
ATOM 542 C CG . ARG A 1 90 . 11.482 9.216 -15.888 1 21.38 ? CG ARG A 70 1 
ATOM 543 C CD . ARG A 1 90 . 10.099 8.656 -16.206 1 22.58 ? CD ARG A 70 1 
ATOM 544 N NE . ARG A 1 90 . 9.097 9.717 -16.302 1 23.77 ? NE ARG A 70 1 
ATOM 545 C CZ . ARG A 1 90 . 7.851 9.574 -16.763 1 24.7 ? CZ ARG A 70 1 
ATOM 546 N NH1 . ARG A 1 90 . 7.394 8.391 -17.187 1 24.1 ? NH1 ARG A 70 1 
ATOM 547 N NH2 . ARG A 1 90 . 7.054 10.636 -16.796 1 23.65 ? NH2 ARG A 70 1 
ATOM 548 N N . ARG A 1 91 . 13.688 8.551 -12.945 1 17.53 ? N ARG A 71 1 
ATOM 549 C CA . ARG A 1 91 . 13.63 9.168 -11.632 1 16.72 ? CA ARG A 71 1 
ATOM 550 C C . ARG A 1 91 . 14.938 9.883 -11.324 1 17.14 ? C ARG A 71 1 
ATOM 551 O O . ARG A 1 91 . 14.935 11.01 -10.824 1 16.74 ? O ARG A 71 1 
ATOM 552 C CB . ARG A 1 91 . 13.3 8.144 -10.551 1 16.24 ? CB ARG A 71 1 
ATOM 553 C CG . ARG A 1 91 . 13.113 8.73 -9.158 1 16.1 ? CG ARG A 71 1 
ATOM 554 C CD . ARG A 1 91 . 11.906 9.662 -9.054 1 16.25 ? CD ARG A 71 1 
ATOM 555 N NE . ARG A 1 91 . 11.66 10.115 -7.676 1 16.08 ? NE ARG A 71 1 
ATOM 556 C CZ . ARG A 1 91 . 10.889 11.146 -7.323 1 16.47 ? CZ ARG A 71 1 
ATOM 557 N NH1 . ARG A 1 91 . 10.261 11.881 -8.237 1 16.45 ? NH1 ARG A 71 1 
ATOM 558 N NH2 . ARG A 1 91 . 10.747 11.449 -6.036 1 16.48 ? NH2 ARG A 71 1 
ATOM 559 N N . ALA A 1 92 . 16.056 9.235 -11.647 1 17.78 ? N ALA A 72 1 
ATOM 560 C CA . ALA A 1 92 . 17.372 9.821 -11.422 1 18.13 ? CA ALA A 72 1 
ATOM 561 C C . ALA A 1 92 . 17.54 11.123 -12.213 1 18.69 ? C ALA A 72 1 
ATOM 562 O O . ALA A 1 92 . 17.955 12.137 -11.658 1 18.36 ? O ALA A 72 1 
ATOM 563 C CB . ALA A 1 92 . 18.466 8.825 -11.776 1 17.69 ? CB ALA A 72 1 
ATOM 564 N N . LYS A 1 93 . 17.197 11.09 -13.5 1 19.88 ? N LYS A 73 1 
ATOM 565 C CA . LYS A 1 93 . 17.299 12.269 -14.364 1 20.32 ? CA LYS A 73 1 
ATOM 566 C C . LYS A 1 93 . 16.535 13.497 -13.863 1 20 ? C LYS A 73 1 
ATOM 567 O O . LYS A 1 93 . 17.071 14.604 -13.885 1 20.82 ? O LYS A 73 1 
ATOM 568 C CB . LYS A 1 93 . 16.9 11.919 -15.799 1 22.04 ? CB LYS A 73 1 
ATOM 569 C CG . LYS A 1 93 . 18.036 11.25 -16.561 1 24.21 ? CG LYS A 73 1 
ATOM 570 C CD . LYS A 1 93 . 17.585 10.635 -17.873 1 26.69 ? CD LYS A 73 1 
ATOM 571 C CE . LYS A 1 93 . 18.723 9.833 -18.49 1 28.37 ? CE LYS A 73 1 
ATOM 572 N NZ . LYS A 1 93 . 18.466 9.522 -19.92 1 30.02 ? NZ LYS A 73 1 
ATOM 573 N N . GLU A 1 94 . 15.306 13.315 -13.385 1 18.9 ? N GLU A 74 1 
ATOM 574 C CA . GLU A 1 94 . 14.499 14.471 -12.933 1 17.97 ? CA GLU A 74 1 
ATOM 575 C C . GLU A 1 94 . 14.983 15.087 -11.615 1 17 ? C GLU A 74 1 
ATOM 576 O O . GLU A 1 94 . 14.722 16.26 -11.34 1 16.98 ? O GLU A 74 1 
ATOM 577 C CB . GLU A 1 94 . 13.009 14.107 -12.842 1 18.21 ? CB GLU A 74 1 
ATOM 578 C CG . GLU A 1 94 . 12.657 13.251 -11.637 1 17.42 ? CG GLU A 74 1 
ATOM 579 C CD . GLU A 1 94 . 11.204 12.847 -11.59 1 17.32 ? CD GLU A 74 1 
ATOM 580 O OE1 . GLU A 1 94 . 10.347 13.614 -12.059 1 17.27 ? OE1 GLU A 74 1 
ATOM 581 O OE2 . GLU A 1 94 . 10.918 11.76 -11.047 1 17.13 ? OE2 GLU A 74 1 
ATOM 582 N N . LEU A 1 95 . 15.677 14.302 -10.796 1 16.3 ? N LEU A 75 1 
ATOM 583 C CA . LEU A 1 95 . 16.194 14.807 -9.521 1 15.89 ? CA LEU A 75 1 
ATOM 584 C C . LEU A 1 95 . 17.66 15.233 -9.615 1 15.82 ? C LEU A 75 1 
ATOM 585 O O . LEU A 1 95 . 18.213 15.795 -8.666 1 15.61 ? O LEU A 75 1 
ATOM 586 C CB . LEU A 1 95 . 16.004 13.762 -8.407 1 15.63 ? CB LEU A 75 1 
ATOM 587 C CG . LEU A 1 95 . 14.556 13.334 -8.13 1 15.53 ? CG LEU A 75 1 
ATOM 588 C CD1 . LEU A 1 95 . 14.503 12.212 -7.104 1 15.56 ? CD1 LEU A 75 1 
ATOM 589 C CD2 . LEU A 1 95 . 13.712 14.516 -7.67 1 15.59 ? CD2 LEU A 75 1 
ATOM 590 N N . GLY A 1 96 . 18.289 14.955 -10.757 1 15.49 ? N GLY A 76 1 
ATOM 591 C CA . GLY A 1 96 . 19.71 15.222 -10.925 1 15.56 ? CA GLY A 76 1 
ATOM 592 C C . GLY A 1 96 . 20.585 14.309 -10.074 1 15.67 ? C GLY A 76 1 
ATOM 593 O O . GLY A 1 96 . 21.601 14.749 -9.514 1 15.34 ? O GLY A 76 1 
ATOM 594 N N . ILE A 1 97 . 20.179 13.044 -9.952 1 15.16 ? N ILE A 77 1 
ATOM 595 C CA . ILE A 1 97 . 21.087 11.995 -9.499 1 15.1 ? CA ILE A 77 1 
ATOM 596 C C . ILE A 1 97 . 21.961 11.718 -10.71 1 15.34 ? C ILE A 77 1 
ATOM 597 O O . ILE A 1 97 . 21.467 11.237 -11.731 1 15.63 ? O ILE A 77 1 
ATOM 598 C CB . ILE A 1 97 . 20.345 10.72 -9.079 1 14.89 ? CB ILE A 77 1 
ATOM 599 C CG1 . ILE A 1 97 . 19.56 10.962 -7.783 1 14.5 ? CG1 ILE A 77 1 
ATOM 600 C CG2 . ILE A 1 97 . 21.327 9.564 -8.918 1 14.81 ? CG2 ILE A 77 1 
ATOM 601 C CD1 . ILE A 1 97 . 18.462 9.955 -7.541 1 14.32 ? CD1 ILE A 77 1 
ATOM 602 N N . SER A 1 98 . 23.245 12.05 -10.606 1 15.42 ? N SER A 78 1 
ATOM 603 C CA . SER A 1 98 . 24.08 12.216 -11.799 1 15.5 ? CA SER A 78 1 
ATOM 604 C C . SER A 1 98 . 24.933 11.015 -12.198 1 15.45 ? C SER A 78 1 
ATOM 605 O O . SER A 1 98 . 25.437 10.968 -13.334 1 15.25 ? O SER A 78 1 
ATOM 606 C CB . SER A 1 98 . 24.962 13.459 -11.655 1 15.58 ? CB SER A 78 1 
ATOM 607 O OG . SER A 1 98 . 25.591 13.494 -10.382 1 16.15 ? OG SER A 78 1 
ATOM 608 N N . HIS A 1 99 . 25.12 10.07 -11.274 1 15.26 ? N HIS A 79 1 
ATOM 609 C CA . HIS A 1 99 . 25.838 8.83 -11.576 1 15.57 ? CA HIS A 79 1 
ATOM 610 C C . HIS A 1 99 . 24.913 7.659 -11.313 1 16.2 ? C HIS A 79 1 
ATOM 611 O O . HIS A 1 99 . 24.524 7.392 -10.163 1 16.09 ? O HIS A 79 1 
ATOM 612 C CB . HIS A 1 99 . 27.149 8.712 -10.778 1 15.49 ? CB HIS A 79 1 
ATOM 613 C CG . HIS A 1 99 . 28.14 9.789 -11.096 1 15.79 ? CG HIS A 79 1 
ATOM 614 N ND1 . HIS A 1 99 . 28.149 11.009 -10.449 1 16.42 ? ND1 HIS A 79 1 
ATOM 615 C CD2 . HIS A 1 99 . 29.13 9.849 -12.019 1 15.66 ? CD2 HIS A 79 1 
ATOM 616 C CE1 . HIS A 1 99 . 29.107 11.768 -10.955 1 15.81 ? CE1 HIS A 79 1 
ATOM 617 N NE2 . HIS A 1 99 . 29.719 11.086 -11.904 1 15.36 ? NE2 HIS A 79 1 
ATOM 618 N N . ILE A 1 100 . 24.526 6.981 -12.389 1 16.22 ? N ILE A 80 1 
ATOM 619 C CA . ILE A 1 100 . 23.525 5.947 -12.263 1 16.88 ? CA ILE A 80 1 
ATOM 620 C C . ILE A 1 100 . 24.112 4.584 -12.587 1 17 ? C ILE A 80 1 
ATOM 621 O O . ILE A 1 100 . 24.273 4.223 -13.75 1 17.44 ? O ILE A 80 1 
ATOM 622 C CB . ILE A 1 100 . 22.275 6.25 -13.109 1 16.45 ? CB ILE A 80 1 
ATOM 623 C CG1 . ILE A 1 100 . 21.857 7.717 -12.934 1 16.28 ? CG1 ILE A 80 1 
ATOM 624 C CG2 . ILE A 1 100 . 21.138 5.315 -12.72 1 16.62 ? CG2 ILE A 80 1 
ATOM 625 C CD1 . ILE A 1 100 . 21.344 8.36 -14.204 1 16.11 ? CD1 ILE A 80 1 
ATOM 626 N N . ILE A 1 101 . 24.438 3.833 -11.542 1 16.48 ? N ILE A 81 1 
ATOM 627 C CA . ILE A 1 101 . 24.999 2.513 -11.74 1 16.23 ? CA ILE A 81 1 
ATOM 628 C C . ILE A 1 101 . 23.92 1.478 -11.449 1 16.13 ? C ILE A 81 1 
ATOM 629 O O . ILE A 1 101 . 23.401 1.399 -10.328 1 15.79 ? O ILE A 81 1 
ATOM 630 C CB . ILE A 1 101 . 26.27 2.292 -10.9 1 16.21 ? CB ILE A 81 1 
ATOM 631 C CG1 . ILE A 1 101 . 27.293 3.399 -11.192 1 16.1 ? CG1 ILE A 81 1 
ATOM 632 C CG2 . ILE A 1 101 . 26.85 0.914 -11.188 1 15.89 ? CG2 ILE A 81 1 
ATOM 633 C CD1 . ILE A 1 101 . 28.551 3.338 -10.342 1 15.74 ? CD1 ILE A 81 1 
ATOM 634 N N . GLN A 1 102 . 23.573 0.721 -12.49 1 16.1 ? N GLN A 82 1 
ATOM 635 C CA . GLN A 1 102 . 22.511 -0.288 -12.451 1 16.51 ? CA GLN A 82 1 
ATOM 636 C C . GLN A 1 102 . 23.074 -1.638 -12.87 1 16.72 ? C GLN A 82 1 
ATOM 637 O O . GLN A 1 102 . 24.136 -1.703 -13.492 1 16.02 ? O GLN A 82 1 
ATOM 638 C CB . GLN A 1 102 . 21.369 0.089 -13.403 1 16.49 ? CB GLN A 82 1 
ATOM 639 C CG . GLN A 1 102 . 20.656 1.39 -13.074 1 16.03 ? CG GLN A 82 1 
ATOM 640 C CD . GLN A 1 102 . 19.279 1.492 -13.718 1 16.37 ? CD GLN A 82 1 
ATOM 641 O OE1 . GLN A 1 102 . 18.322 0.867 -13.265 1 16.2 ? OE1 GLN A 82 1 
ATOM 642 N NE2 . GLN A 1 102 . 19.169 2.31 -14.754 1 15.74 ? NE2 GLN A 82 1 
ATOM 643 N N . GLY A 1 103 . 22.354 -2.712 -12.544 1 16.7 ? N GLY A 83 1 
ATOM 644 C CA . GLY A 1 103 . 22.817 -4.058 -12.847 1 16.68 ? CA GLY A 83 1 
ATOM 645 C C . GLY A 1 103 . 24.108 -4.382 -12.111 1 17.66 ? C GLY A 83 1 
ATOM 646 O O . GLY A 1 103 . 24.918 -5.186 -12.588 1 17.17 ? O GLY A 83 1 
ATOM 647 N N . GLN A 1 104 . 24.3 -3.745 -10.953 1 17.8 ? N GLN A 84 1 
ATOM 648 C CA . GLN A 1 104 . 25.503 -3.919 -10.148 1 18.62 ? CA GLN A 84 1 
ATOM 649 C C . GLN A 1 104 . 25.158 -4.166 -8.682 1 18.69 ? C GLN A 84 1 
ATOM 650 O O . GLN A 1 104 . 24.662 -3.263 -7.993 1 18.14 ? O GLN A 84 1 
ATOM 651 C CB . GLN A 1 104 . 26.407 -2.684 -10.286 1 19.67 ? CB GLN A 84 1 
ATOM 652 C CG . GLN A 1 104 . 27.618 -2.631 -9.355 1 20.38 ? CG GLN A 84 1 
ATOM 653 C CD . GLN A 1 104 . 28.608 -3.763 -9.592 1 20.97 ? CD GLN A 84 1 
ATOM 654 O OE1 . GLN A 1 104 . 28.373 -4.913 -9.198 1 20.68 ? OE1 GLN A 84 1 
ATOM 655 N NE2 . GLN A 1 104 . 29.73 -3.439 -10.235 1 20.37 ? NE2 GLN A 84 1 
ATOM 656 N N . ASP A 1 105 . 25.43 -5.383 -8.213 1 19.17 ? N ASP A 85 1 
ATOM 657 C CA . ASP A 1 105 . 25.208 -5.748 -6.809 1 19.67 ? CA ASP A 85 1 
ATOM 658 C C . ASP A 1 105 . 26.461 -5.621 -5.925 1 19.34 ? C ASP A 85 1 
ATOM 659 O O . ASP A 1 105 . 26.352 -5.597 -4.702 1 19.07 ? O ASP A 85 1 
ATOM 660 C CB . ASP A 1 105 . 24.583 -7.153 -6.689 1 21.59 ? CB ASP A 85 1 
ATOM 661 C CG . ASP A 1 105 . 23.055 -7.113 -6.501 1 23.09 ? CG ASP A 85 1 
ATOM 662 O OD1 . ASP A 1 105 . 22.552 -6.249 -5.755 1 24.65 ? OD1 ASP A 85 1 
ATOM 663 O OD2 . ASP A 1 105 . 22.348 -7.953 -7.091 1 25.05 ? OD2 ASP A 85 1 
ATOM 664 N N . ASP A 1 106 . 27.64 -5.532 -6.544 1 18.8 ? N ASP A 86 1 
ATOM 665 C CA . ASP A 1 106 . 28.889 -5.279 -5.818 1 18.66 ? CA ASP A 86 1 
ATOM 666 C C . ASP A 1 106 . 29.004 -3.78 -5.532 1 17.49 ? C ASP A 86 1 
ATOM 667 O O . ASP A 1 106 . 29.721 -3.049 -6.218 1 16.96 ? O ASP A 86 1 
ATOM 668 C CB . ASP A 1 106 . 30.092 -5.809 -6.623 1 20.16 ? CB ASP A 86 1 
ATOM 669 C CG . ASP A 1 106 . 31.403 -5.843 -5.817 1 21.4 ? CG ASP A 86 1 
ATOM 670 O OD1 . ASP A 1 106 . 31.424 -5.556 -4.591 1 22.53 ? OD1 ASP A 86 1 
ATOM 671 O OD2 . ASP A 1 106 . 32.443 -6.156 -6.437 1 22.1 ? OD2 ASP A 86 1 
ATOM 672 N N . LYS A 1 107 . 28.273 -3.343 -4.509 1 16.78 ? N LYS A 87 1 
ATOM 673 C CA . LYS A 1 107 . 28.072 -1.927 -4.214 1 16.54 ? CA LYS A 87 1 
ATOM 674 C C . LYS A 1 107 . 29.349 -1.197 -3.793 1 16.69 ? C LYS A 87 1 
ATOM 675 O O . LYS A 1 107 . 29.607 -0.103 -4.274 1 16.07 ? O LYS A 87 1 
ATOM 676 C CB . LYS A 1 107 . 26.968 -1.733 -3.149 1 16.58 ? CB LYS A 87 1 
ATOM 677 C CG . LYS A 1 107 . 25.617 -2.41 -3.442 1 15.91 ? CG LYS A 87 1 
ATOM 678 C CD . LYS A 1 107 . 24.933 -1.869 -4.688 1 15.22 ? CD LYS A 87 1 
ATOM 679 C CE . LYS A 1 107 . 23.534 -2.448 -4.879 1 14.69 ? CE LYS A 87 1 
ATOM 680 N NZ . LYS A 1 107 . 22.499 -1.741 -4.086 1 13.84 ? NZ LYS A 87 1 
ATOM 681 N N . LEU A 1 108 . 30.139 -1.793 -2.893 1 16.92 ? N LEU A 88 1 
ATOM 682 C CA . LEU A 1 108 . 31.4 -1.172 -2.447 1 16.45 ? CA LEU A 88 1 
ATOM 683 C C . LEU A 1 108 . 32.357 -0.947 -3.622 1 16.66 ? C LEU A 88 1 
ATOM 684 O O . LEU A 1 108 . 32.931 0.133 -3.773 1 16.6 ? O LEU A 88 1 
ATOM 685 C CB . LEU A 1 108 . 32.081 -2.025 -1.379 1 16.74 ? CB LEU A 88 1 
ATOM 686 C CG . LEU A 1 108 . 32.752 -1.358 -0.161 1 17.27 ? CG LEU A 88 1 
ATOM 687 C CD1 . LEU A 1 108 . 33.85 -2.257 0.405 1 16.93 ? CD1 LEU A 88 1 
ATOM 688 C CD2 . LEU A 1 108 . 33.289 0.024 -0.462 1 17.03 ? CD2 LEU A 88 1 
ATOM 689 N N . THR A 1 109 . 32.518 -1.965 -4.462 1 16.29 ? N THR A 89 1 
ATOM 690 C CA . THR A 1 109 . 33.372 -1.836 -5.635 1 16.15 ? CA THR A 89 1 
ATOM 691 C C . THR A 1 109 . 32.889 -0.667 -6.467 1 15.69 ? C THR A 89 1 
ATOM 692 O O . THR A 1 109 . 33.684 0.187 -6.84 1 14.92 ? O THR A 89 1 
ATOM 693 C CB . THR A 1 109 . 33.378 -3.114 -6.486 1 16.43 ? CB THR A 89 1 
ATOM 694 O OG1 . THR A 1 109 . 33.931 -4.186 -5.716 1 16.78 ? OG1 THR A 89 1 
ATOM 695 C CG2 . THR A 1 109 . 34.202 -2.924 -7.778 1 16.59 ? CG2 THR A 89 1 
ATOM 696 N N . ALA A 1 110 . 31.583 -0.62 -6.73 1 15.88 ? N ALA A 90 1 
ATOM 697 C CA . ALA A 1 110 . 31.006 0.467 -7.522 1 16.26 ? CA ALA A 90 1 
ATOM 698 C C . ALA A 1 110 . 31.244 1.845 -6.866 1 16.62 ? C ALA A 90 1 
ATOM 699 O O . ALA A 1 110 . 31.618 2.809 -7.542 1 16.81 ? O ALA A 90 1 
ATOM 700 C CB . ALA A 1 110 . 29.528 0.218 -7.763 1 16.71 ? CB ALA A 90 1 
ATOM 701 N N . LEU A 1 111 . 31.07 1.912 -5.547 1 16.29 ? N LEU A 91 1 
ATOM 702 C CA . LEU A 1 111 . 31.301 3.138 -4.798 1 16.4 ? CA LEU A 91 1 
ATOM 703 C C . LEU A 1 111 . 32.763 3.592 -4.913 1 17.38 ? C LEU A 91 1 
ATOM 704 O O . LEU A 1 111 . 33.046 4.731 -5.318 1 17.67 ? O LEU A 91 1 
ATOM 705 C CB . LEU A 1 111 . 30.869 2.951 -3.345 1 15.98 ? CB LEU A 91 1 
ATOM 706 C CG . LEU A 1 111 . 30.938 4.13 -2.368 1 15.93 ? CG LEU A 91 1 
ATOM 707 C CD1 . LEU A 1 111 . 30.199 5.357 -2.887 1 15.96 ? CD1 LEU A 91 1 
ATOM 708 C CD2 . LEU A 1 111 . 30.395 3.715 -1.015 1 15.67 ? CD2 LEU A 91 1 
ATOM 709 N N . VAL A 1 112 . 33.681 2.683 -4.588 1 17.31 ? N VAL A 92 1 
ATOM 710 C CA . VAL A 1 112 . 35.115 2.909 -4.753 1 17.06 ? CA VAL A 92 1 
ATOM 711 C C . VAL A 1 112 . 35.471 3.406 -6.173 1 17.59 ? C VAL A 92 1 
ATOM 712 O O . VAL A 1 112 . 36.262 4.33 -6.324 1 18.66 ? O VAL A 92 1 
ATOM 713 C CB . VAL A 1 112 . 35.912 1.639 -4.353 1 16.66 ? CB VAL A 92 1 
ATOM 714 C CG1 . VAL A 1 112 . 37.349 1.689 -4.853 1 16.45 ? CG1 VAL A 92 1 
ATOM 715 C CG2 . VAL A 1 112 . 35.884 1.456 -2.839 1 16.28 ? CG2 VAL A 92 1 
ATOM 716 N N . GLY A 1 113 . 34.887 2.797 -7.203 1 17.61 ? N GLY A 93 1 
ATOM 717 C CA . GLY A 1 113 . 35.058 3.247 -8.586 1 17.97 ? CA GLY A 93 1 
ATOM 718 C C . GLY A 1 113 . 34.645 4.695 -8.793 1 18.52 ? C GLY A 93 1 
ATOM 719 O O . GLY A 1 113 . 35.346 5.449 -9.458 1 18.59 ? O GLY A 93 1 
ATOM 720 N N . LEU A 1 114 . 33.507 5.086 -8.219 1 19.3 ? N LEU A 94 1 
ATOM 721 C CA . LEU A 1 114 . 33.053 6.477 -8.254 1 20.52 ? CA LEU A 94 1 
ATOM 722 C C . LEU A 1 114 . 34.012 7.423 -7.531 1 20.68 ? C LEU A 94 1 
ATOM 723 O O . LEU A 1 114 . 34.277 8.535 -7.987 1 20.38 ? O LEU A 94 1 
ATOM 724 C CB . LEU A 1 114 . 31.656 6.605 -7.631 1 21.02 ? CB LEU A 94 1 
ATOM 725 C CG . LEU A 1 114 . 30.444 6.44 -8.545 1 21.73 ? CG LEU A 94 1 
ATOM 726 C CD1 . LEU A 1 114 . 29.188 6.717 -7.743 1 21.48 ? CD1 LEU A 94 1 
ATOM 727 C CD2 . LEU A 1 114 . 30.515 7.336 -9.78 1 21.35 ? CD2 LEU A 94 1 
ATOM 728 N N . THR A 1 115 . 34.517 6.952 -6.399 1 22.1 ? N THR A 95 1 
ATOM 729 C CA . THR A 1 115 . 35.433 7.69 -5.554 1 23.61 ? CA THR A 95 1 
ATOM 730 C C . THR A 1 115 . 36.682 8.055 -6.36 1 24.5 ? C THR A 95 1 
ATOM 731 O O . THR A 1 115 . 37.218 9.157 -6.243 1 25.41 ? O THR A 95 1 
ATOM 732 C CB . THR A 1 115 . 35.744 6.843 -4.3 1 24.5 ? CB THR A 95 1 
ATOM 733 O OG1 . THR A 1 115 . 35.521 7.616 -3.117 1 27.66 ? OG1 THR A 95 1 
ATOM 734 C CG2 . THR A 1 115 . 37.144 6.277 -4.308 1 23.73 ? CG2 THR A 95 1 
ATOM 735 N N . LYS A 1 116 . 37.098 7.133 -7.22 1 25.75 ? N LYS A 96 1 
ATOM 736 C CA . LYS A 1 116 . 38.261 7.31 -8.07 1 26.71 ? CA LYS A 96 1 
ATOM 737 C C . LYS A 1 116 . 38.021 8.268 -9.236 1 26.25 ? C LYS A 96 1 
ATOM 738 O O . LYS A 1 116 . 38.904 9.047 -9.574 1 26.25 ? O LYS A 96 1 
ATOM 739 C CB . LYS A 1 116 . 38.753 5.953 -8.59 1 27.77 ? CB LYS A 96 1 
ATOM 740 C CG . LYS A 1 116 . 39.338 5.052 -7.513 1 29.03 ? CG LYS A 96 1 
ATOM 741 C CD . LYS A 1 116 . 39.857 3.766 -8.13 1 31.43 ? CD LYS A 96 1 
ATOM 742 C CE . LYS A 1 116 . 40.32 2.78 -7.069 1 34.11 ? CE LYS A 96 1 
ATOM 743 N NZ . LYS A 1 116 . 40.782 1.505 -7.693 1 35.29 ? NZ LYS A 96 1 
ATOM 744 N N . LYS A 1 117 . 36.844 8.225 -9.855 1 26.62 ? N LYS A 97 1 
ATOM 745 C CA . LYS A 1 117 . 36.612 9.096 -11.013 1 27.8 ? CA LYS A 97 1 
ATOM 746 C C . LYS A 1 117 . 36.227 10.538 -10.641 1 27.53 ? C LYS A 97 1 
ATOM 747 O O . LYS A 1 117 . 36.21 11.435 -11.497 1 26.52 ? O LYS A 97 1 
ATOM 748 C CB . LYS A 1 117 . 35.653 8.451 -12.031 1 29.12 ? CB LYS A 97 1 
ATOM 749 C CG . LYS A 1 117 . 34.179 8.757 -11.871 1 30.7 ? CG LYS A 97 1 
ATOM 750 C CD . LYS A 1 117 . 33.402 8.14 -13.027 1 32.61 ? CD LYS A 97 1 
ATOM 751 C CE . LYS A 1 117 . 32.133 8.928 -13.319 1 33.52 ? CE LYS A 97 1 
ATOM 752 N NZ . LYS A 1 117 . 31.434 8.484 -14.558 1 34.78 ? NZ LYS A 97 1 
ATOM 753 N N . LEU A 1 118 . 35.929 10.751 -9.359 1 27.51 ? N LEU A 98 1 
ATOM 754 C CA . LEU A 1 118 . 35.598 12.076 -8.863 1 27.89 ? CA LEU A 98 1 
ATOM 755 C C . LEU A 1 118 . 36.71 12.659 -8.009 1 28.46 ? C LEU A 98 1 
ATOM 756 O O . LEU A 1 118 . 36.679 13.843 -7.688 1 28.14 ? O LEU A 98 1 
ATOM 757 C CB . LEU A 1 118 . 34.29 12.064 -8.063 1 27.73 ? CB LEU A 98 1 
ATOM 758 C CG . LEU A 1 118 . 33.026 11.491 -8.705 1 28.2 ? CG LEU A 98 1 
ATOM 759 C CD1 . LEU A 1 118 . 31.842 11.663 -7.771 1 28.06 ? CD1 LEU A 98 1 
ATOM 760 C CD2 . LEU A 1 118 . 32.731 12.122 -10.054 1 28.69 ? CD2 LEU A 98 1 
ATOM 761 N N . GLY A 1 119 . 37.681 11.827 -7.637 1 29.03 ? N GLY A 99 1 
ATOM 762 C CA . GLY A 1 119 . 38.778 12.264 -6.778 1 30.77 ? CA GLY A 99 1 
ATOM 763 C C . GLY A 1 119 . 38.276 12.543 -5.373 1 32.8 ? C GLY A 99 1 
ATOM 764 O O . GLY A 1 119 . 38.424 13.648 -4.853 1 34.03 ? O GLY A 99 1 
ATOM 765 N N . ILE A 1 120 . 37.693 11.518 -4.761 1 32.92 ? N ILE A 100 1 
ATOM 766 C CA . ILE A 1 120 . 36.98 11.644 -3.5 1 31.96 ? CA ILE A 100 1 
ATOM 767 C C . ILE A 1 120 . 37.312 10.425 -2.642 1 31.43 ? C ILE A 100 1 
ATOM 768 O O . ILE A 1 120 . 37.532 9.34 -3.165 1 31.3 ? O ILE A 100 1 
ATOM 769 C CB . ILE A 1 120 . 35.461 11.806 -3.784 1 32.3 ? CB ILE A 100 1 
ATOM 770 C CG1 . ILE A 1 120 . 35.101 13.29 -3.8 1 32.81 ? CG1 ILE A 100 1 
ATOM 771 C CG2 . ILE A 1 120 . 34.582 11.071 -2.786 1 33.71 ? CG2 ILE A 100 1 
ATOM 772 C CD1 . ILE A 1 120 . 33.907 13.625 -4.665 1 34 ? CD1 ILE A 100 1 
ATOM 773 N N . GLU A 1 121 . 37.379 10.61 -1.331 1 30.37 ? N GLU A 101 1 
ATOM 774 C CA . GLU A 1 121 . 37.623 9.492 -0.44 1 30.68 ? CA GLU A 101 1 
ATOM 775 C C . GLU A 1 121 . 36.306 8.87 -0.008 1 28.71 ? C GLU A 101 1 
ATOM 776 O O . GLU A 1 121 . 35.28 9.545 0.02 1 27.7 ? O GLU A 101 1 
ATOM 777 C CB . GLU A 1 121 . 38.405 9.944 0.793 1 33.65 ? CB GLU A 101 1 
ATOM 778 C CG . GLU A 1 121 . 39.748 10.599 0.513 1 36.59 ? CG GLU A 101 1 
ATOM 779 C CD . GLU A 1 121 . 40.252 11.378 1.712 1 40.07 ? CD GLU A 101 1 
ATOM 780 O OE1 . GLU A 1 121 . 40.321 10.791 2.822 1 41.68 ? OE1 GLU A 101 1 
ATOM 781 O OE2 . GLU A 1 121 . 40.57 12.579 1.553 1 41.16 ? OE2 GLU A 101 1 
ATOM 782 N N . LEU A 1 122 . 36.357 7.58 0.33 1 28.09 ? N LEU A 102 1 
ATOM 783 C CA . LEU A 1 122 . 35.233 6.859 0.945 1 26.46 ? CA LEU A 102 1 
ATOM 784 C C . LEU A 1 122 . 34.66 7.529 2.19 1 25.23 ? C LEU A 102 1 
ATOM 785 O O . LEU A 1 122 . 33.442 7.521 2.404 1 24.02 ? O LEU A 102 1 
ATOM 786 C CB . LEU A 1 122 . 35.643 5.43 1.313 1 25.91 ? CB LEU A 102 1 
ATOM 787 C CG . LEU A 1 122 . 35.182 4.292 0.41 1 26.5 ? CG LEU A 102 1 
ATOM 788 C CD1 . LEU A 1 122 . 35.472 2.957 1.087 1 26.35 ? CD1 LEU A 102 1 
ATOM 789 C CD2 . LEU A 1 122 . 33.701 4.405 0.069 1 25.16 ? CD2 LEU A 102 1 
ATOM 790 N N . SER A 1 123 . 35.546 8.077 3.022 1 24.71 ? N SER A 103 1 
ATOM 791 C CA . SER A 1 123 . 35.136 8.813 4.212 1 24.28 ? CA SER A 103 1 
ATOM 792 C C . SER A 1 123 . 34.23 9.991 3.846 1 23.75 ? C SER A 103 1 
ATOM 793 O O . SER A 1 123 . 33.441 10.453 4.67 1 23.83 ? O SER A 103 1 
ATOM 794 C CB . SER A 1 123 . 36.358 9.283 5.005 1 25.39 ? CB SER A 103 1 
ATOM 795 O OG . SER A 1 123 . 37.298 9.949 4.171 1 25.63 ? OG SER A 103 1 
ATOM 796 N N . HIS A 1 124 . 34.329 10.448 2.599 1 23.78 ? N HIS A 104 1 
ATOM 797 C CA . HIS A 1 124 . 33.468 11.518 2.091 1 23.95 ? CA HIS A 104 1 
ATOM 798 C C . HIS A 1 124 . 32.225 11.011 1.346 1 22.23 ? C HIS A 104 1 
ATOM 799 O O . HIS A 1 124 . 31.482 11.799 0.754 1 20.57 ? O HIS A 104 1 
ATOM 800 C CB . HIS A 1 124 . 34.274 12.493 1.219 1 26.83 ? CB HIS A 104 1 
ATOM 801 C CG . HIS A 1 124 . 35.392 13.17 1.957 1 30.15 ? CG HIS A 104 1 
ATOM 802 N ND1 . HIS A 1 124 . 36.595 13.488 1.361 1 31.63 ? ND1 HIS A 104 1 
ATOM 803 C CD2 . HIS A 1 124 . 35.499 13.555 3.253 1 30.02 ? CD2 HIS A 104 1 
ATOM 804 C CE1 . HIS A 1 124 . 37.383 14.06 2.255 1 33.55 ? CE1 HIS A 104 1 
ATOM 805 N NE2 . HIS A 1 124 . 36.742 14.112 3.41 1 32.09 ? NE2 HIS A 104 1 
ATOM 806 N N . CYS A 1 125 . 32.015 9.696 1.377 1 20.24 ? N CYS A 105 1 
ATOM 807 C CA . CYS A 1 125 . 30.827 9.095 0.789 1 19.06 ? CA CYS A 105 1 
ATOM 808 C C . CYS A 1 125 . 29.829 8.681 1.859 1 17.46 ? C CYS A 105 1 
ATOM 809 O O . CYS A 1 125 . 30.201 8.116 2.888 1 17.08 ? O CYS A 105 1 
ATOM 810 C CB . CYS A 1 125 . 31.198 7.895 -0.071 1 19.1 ? CB CYS A 105 1 
ATOM 811 S SG . CYS A 1 125 . 32.2 8.356 -1.494 1 21.6 ? SG CYS A 105 1 
ATOM 812 N N . ALA A 1 126 . 28.563 8.993 1.613 1 16.01 ? N ALA A 106 1 
ATOM 813 C CA . ALA A 1 126 . 27.48 8.46 2.414 1 15.1 ? CA ALA A 106 1 
ATOM 814 C C . ALA A 1 126 . 26.792 7.417 1.55 1 14.64 ? C ALA A 106 1 
ATOM 815 O O . ALA A 1 126 . 26.674 7.591 0.328 1 13.74 ? O ALA A 106 1 
ATOM 816 C CB . ALA A 1 126 . 26.516 9.56 2.83 1 14.83 ? CB ALA A 106 1 
ATOM 817 N N . TYR A 1 127 . 26.363 6.323 2.175 1 14.19 ? N TYR A 107 1 
ATOM 818 C CA . TYR A 1 127 . 25.669 5.258 1.448 1 14.08 ? CA TYR A 107 1 
ATOM 819 C C . TYR A 1 127 . 24.518 4.696 2.271 1 14.03 ? C TYR A 107 1 
ATOM 820 O O . TYR A 1 127 . 24.654 4.467 3.482 1 13.38 ? O TYR A 107 1 
ATOM 821 C CB . TYR A 1 127 . 26.631 4.12 1.017 1 13.7 ? CB TYR A 107 1 
ATOM 822 C CG . TYR A 1 127 . 25.966 3.076 0.118 1 13.33 ? CG TYR A 107 1 
ATOM 823 C CD1 . TYR A 1 127 . 25.895 3.263 -1.258 1 13.24 ? CD1 TYR A 107 1 
ATOM 824 C CD2 . TYR A 1 127 . 25.383 1.925 0.657 1 13.15 ? CD2 TYR A 107 1 
ATOM 825 C CE1 . TYR A 1 127 . 25.266 2.338 -2.079 1 13.28 ? CE1 TYR A 107 1 
ATOM 826 C CE2 . TYR A 1 127 . 24.752 0.996 -0.153 1 12.98 ? CE2 TYR A 107 1 
ATOM 827 C CZ . TYR A 1 127 . 24.703 1.203 -1.518 1 12.96 ? CZ TYR A 107 1 
ATOM 828 O OH . TYR A 1 127 . 24.069 0.291 -2.338 1 12.95 ? OH TYR A 107 1 
ATOM 829 N N . ILE A 1 128 . 23.405 4.459 1.578 1 13.62 ? N ILE A 108 1 
ATOM 830 C CA . ILE A 1 128 . 22.213 3.874 2.168 1 13.4 ? CA ILE A 108 1 
ATOM 831 C C . ILE A 1 128 . 21.719 2.646 1.386 1 13.46 ? C ILE A 108 1 
ATOM 832 O O . ILE A 1 128 . 21.561 2.682 0.148 1 12.85 ? O ILE A 108 1 
ATOM 833 C CB . ILE A 1 128 . 21.088 4.924 2.318 1 13.2 ? CB ILE A 108 1 
ATOM 834 C CG1 . ILE A 1 128 . 19.855 4.302 2.988 1 13.18 ? CG1 ILE A 108 1 
ATOM 835 C CG2 . ILE A 1 128 . 20.753 5.552 0.963 1 12.96 ? CG2 ILE A 108 1 
ATOM 836 C CD1 . ILE A 1 128 . 18.843 5.315 3.499 1 13.27 ? CD1 ILE A 108 1 
ATOM 837 N N . GLY A 1 129 . 21.475 1.566 2.131 1 13.43 ? N GLY A 109 1 
ATOM 838 C CA . GLY A 1 129 . 20.99 0.307 1.555 1 13.68 ? CA GLY A 109 1 
ATOM 839 C C . GLY A 1 129 . 20.199 -0.517 2.551 1 13.92 ? C GLY A 109 1 
ATOM 840 O O . GLY A 1 129 . 20.332 -0.34 3.776 1 13.7 ? O GLY A 109 1 
ATOM 841 N N . ASP A 1 130 . 19.389 -1.432 2.028 1 14.3 ? N ASP A 110 1 
ATOM 842 C CA . ASP A 1 130 . 18.475 -2.229 2.854 1 15.09 ? CA ASP A 110 1 
ATOM 843 C C . ASP A 1 130 . 18.862 -3.706 3.028 1 15.55 ? C ASP A 110 1 
ATOM 844 O O . ASP A 1 130 . 18.336 -4.365 3.923 1 16.37 ? O ASP A 110 1 
ATOM 845 C CB . ASP A 1 130 . 17.042 -2.152 2.304 1 14.94 ? CB ASP A 110 1 
ATOM 846 C CG . ASP A 1 130 . 16.884 -2.908 0.979 1 15.16 ? CG ASP A 110 1 
ATOM 847 O OD1 . ASP A 1 130 . 17.685 -2.648 0.05 1 14.79 ? OD1 ASP A 110 1 
ATOM 848 O OD2 . ASP A 1 130 . 15.978 -3.768 0.876 1 14.6 ? OD2 ASP A 110 1 
ATOM 849 N N . ASP A 1 131 . 19.748 -4.239 2.186 1 15.6 ? N ASP A 111 1 
ATOM 850 C CA . ASP A 1 131 . 19.958 -5.693 2.154 1 15.57 ? CA ASP A 111 1 
ATOM 851 C C . ASP A 1 131 . 21.437 -6.107 2.088 1 15.87 ? C ASP A 111 1 
ATOM 852 O O . ASP A 1 131 . 22.341 -5.282 2.231 1 16.4 ? O ASP A 111 1 
ATOM 853 C CB . ASP A 1 131 . 19.148 -6.335 1.001 1 15.26 ? CB ASP A 111 1 
ATOM 854 C CG . ASP A 1 131 . 18.572 -7.712 1.37 1 15.54 ? CG ASP A 111 1 
ATOM 855 O OD1 . ASP A 1 131 . 19.11 -8.352 2.298 1 16.1 ? OD1 ASP A 111 1 
ATOM 856 O OD2 . ASP A 1 131 . 17.589 -8.167 0.736 1 14.83 ? OD2 ASP A 111 1 
ATOM 857 N N . LEU A 1 132 . 21.671 -7.395 1.871 1 15.47 ? N LEU A 112 1 
ATOM 858 C CA . LEU A 1 132 . 23.021 -7.956 1.922 1 15.2 ? CA LEU A 112 1 
ATOM 859 C C . LEU A 1 132 . 24.058 -7.4 0.935 1 14.69 ? C LEU A 112 1 
ATOM 860 O O . LEU A 1 132 . 25.196 -7.191 1.344 1 15.12 ? O LEU A 112 1 
ATOM 861 C CB . LEU A 1 132 . 22.988 -9.492 1.909 1 14.69 ? CB LEU A 112 1 
ATOM 862 C CG . LEU A 1 132 . 22.326 -10.083 3.162 1 14.8 ? CG LEU A 112 1 
ATOM 863 C CD1 . LEU A 1 132 . 22.02 -11.562 2.968 1 14.33 ? CD1 LEU A 112 1 
ATOM 864 C CD2 . LEU A 1 132 . 23.119 -9.828 4.447 1 14.51 ? CD2 LEU A 112 1 
ATOM 865 N N . PRO A 1 133 . 23.691 -7.159 -0.349 1 14.46 ? N PRO A 113 1 
ATOM 866 C CA . PRO A 1 133 . 24.716 -6.559 -1.233 1 14.26 ? CA PRO A 113 1 
ATOM 867 C C . PRO A 1 133 . 25.231 -5.158 -0.805 1 13.89 ? C PRO A 113 1 
ATOM 868 O O . PRO A 1 133 . 26.297 -4.724 -1.263 1 13.33 ? O PRO A 113 1 
ATOM 869 C CB . PRO A 1 133 . 24.025 -6.498 -2.6 1 14.35 ? CB PRO A 113 1 
ATOM 870 C CG . PRO A 1 133 . 22.975 -7.55 -2.54 1 14.6 ? CG PRO A 113 1 
ATOM 871 C CD . PRO A 1 133 . 22.508 -7.602 -1.113 1 14.47 ? CD PRO A 113 1 
ATOM 872 N N . ASP A 1 134 . 24.497 -4.491 0.079 1 13.25 ? N ASP A 114 1 
ATOM 873 C CA . ASP A 1 134 . 24.821 -3.131 0.497 1 13.78 ? CA ASP A 114 1 
ATOM 874 C C . ASP A 1 134 . 25.649 -3.087 1.79 1 14.4 ? C ASP A 114 1 
ATOM 875 O O . ASP A 1 134 . 26.172 -2.035 2.154 1 14.78 ? O ASP A 114 1 
ATOM 876 C CB . ASP A 1 134 . 23.526 -2.337 0.748 1 12.95 ? CB ASP A 114 1 
ATOM 877 C CG . ASP A 1 134 . 22.586 -2.333 -0.433 1 12.65 ? CG ASP A 114 1 
ATOM 878 O OD1 . ASP A 1 134 . 22.949 -1.761 -1.486 1 12.08 ? OD1 ASP A 114 1 
ATOM 879 O OD2 . ASP A 1 134 . 21.461 -2.869 -0.283 1 12.39 ? OD2 ASP A 114 1 
ATOM 880 N N . LEU A 1 135 . 25.72 -4.208 2.508 1 14.61 ? N LEU A 115 1 
ATOM 881 C CA . LEU A 1 135 . 26.329 -4.239 3.848 1 14.96 ? CA LEU A 115 1 
ATOM 882 C C . LEU A 1 135 . 27.763 -3.694 3.897 1 15.17 ? C LEU A 115 1 
ATOM 883 O O . LEU A 1 135 . 28.073 -2.834 4.729 1 15.45 ? O LEU A 115 1 
ATOM 884 C CB . LEU A 1 135 . 26.156 -5.637 4.489 1 14.67 ? CB LEU A 115 1 
ATOM 885 C CG . LEU A 1 135 . 27.127 -6.57 5.236 1 15.18 ? CG LEU A 115 1 
ATOM 886 C CD1 . LEU A 1 135 . 28.263 -5.937 6.049 1 14.6 ? CD1 LEU A 115 1 
ATOM 887 C CD2 . LEU A 1 135 . 26.312 -7.517 6.109 1 14.31 ? CD2 LEU A 115 1 
ATOM 888 N N . LYS A 1 136 . 28.613 -4.139 2.982 1 15.3 ? N LYS A 116 1 
ATOM 889 C CA . LYS A 1 136 . 29.99 -3.643 2.935 1 15.66 ? CA LYS A 116 1 
ATOM 890 C C . LYS A 1 136 . 30.113 -2.164 2.557 1 15.36 ? C LYS A 116 1 
ATOM 891 O O . LYS A 1 136 . 30.963 -1.459 3.105 1 15.32 ? O LYS A 116 1 
ATOM 892 C CB . LYS A 1 136 . 30.864 -4.519 2.033 1 16.52 ? CB LYS A 116 1 
ATOM 893 C CG . LYS A 1 136 . 31.212 -5.85 2.68 1 17.36 ? CG LYS A 116 1 
ATOM 894 C CD . LYS A 1 136 . 32.551 -6.39 2.209 1 18.69 ? CD LYS A 116 1 
ATOM 895 C CE . LYS A 1 136 . 32.448 -7.002 0.826 1 19.05 ? CE LYS A 116 1 
ATOM 896 N NZ . LYS A 1 136 . 33.441 -8.099 0.687 1 19.87 ? NZ LYS A 116 1 
ATOM 897 N N . ALA A 1 137 . 29.278 -1.693 1.627 1 14.85 ? N ALA A 117 1 
ATOM 898 C CA . ALA A 1 137 . 29.271 -0.272 1.279 1 14.38 ? CA ALA A 117 1 
ATOM 899 C C . ALA A 1 137 . 28.779 0.541 2.47 1 14.32 ? C ALA A 117 1 
ATOM 900 O O . ALA A 1 137 . 29.319 1.608 2.774 1 14.47 ? O ALA A 117 1 
ATOM 901 C CB . ALA A 1 137 . 28.419 -0.002 0.041 1 13.78 ? CB ALA A 117 1 
ATOM 902 N N . VAL A 1 138 . 27.759 0.025 3.146 1 14.39 ? N VAL A 118 1 
ATOM 903 C CA . VAL A 1 138 . 27.23 0.656 4.36 1 14.69 ? CA VAL A 118 1 
ATOM 904 C C . VAL A 1 138 . 28.288 0.696 5.466 1 15.44 ? C VAL A 118 1 
ATOM 905 O O . VAL A 1 138 . 28.443 1.706 6.162 1 15.19 ? O VAL A 118 1 
ATOM 906 C CB . VAL A 1 138 . 25.949 -0.054 4.861 1 14.37 ? CB VAL A 118 1 
ATOM 907 C CG1 . VAL A 1 138 . 25.632 0.328 6.312 1 13.98 ? CG1 VAL A 118 1 
ATOM 908 C CG2 . VAL A 1 138 . 24.779 0.268 3.948 1 13.61 ? CG2 VAL A 118 1 
ATOM 909 N N . ARG A 1 139 . 29.012 -0.408 5.618 1 16.5 ? N ARG A 119 1 
ATOM 910 C CA . ARG A 1 139 . 30.038 -0.51 6.646 1 17.7 ? CA ARG A 119 1 
ATOM 911 C C . ARG A 1 139 . 31.212 0.403 6.325 1 17.95 ? C ARG A 119 1 
ATOM 912 O O . ARG A 1 139 . 31.704 1.105 7.198 1 17.1 ? O ARG A 119 1 
ATOM 913 C CB . ARG A 1 139 . 30.538 -1.947 6.769 1 17.89 ? CB ARG A 119 1 
ATOM 914 C CG . ARG A 1 139 . 31.607 -2.147 7.837 1 18.68 ? CG ARG A 119 1 
ATOM 915 C CD . ARG A 1 139 . 32.709 -3.059 7.305 1 18.6 ? CD ARG A 119 1 
ATOM 916 N NE . ARG A 1 139 . 32.312 -4.452 7.305 1 18.82 ? NE ARG A 119 1 
ATOM 917 C CZ . ARG A 1 139 . 32.693 -5.368 6.414 1 18.93 ? CZ ARG A 119 1 
ATOM 918 N NH1 . ARG A 1 139 . 33.49 -5.051 5.395 1 18.17 ? NH1 ARG A 119 1 
ATOM 919 N NH2 . ARG A 1 139 . 32.25 -6.615 6.546 1 18.61 ? NH2 ARG A 119 1 
ATOM 920 N N . GLU A 1 140 . 31.651 0.392 5.068 1 18.47 ? N GLU A 120 1 
ATOM 921 C CA . GLU A 1 140 . 32.925 1.008 4.74 1 19.56 ? CA GLU A 120 1 
ATOM 922 C C . GLU A 1 140 . 32.86 2.504 4.425 1 19.69 ? C GLU A 120 1 
ATOM 923 O O . GLU A 1 140 . 33.878 3.192 4.533 1 19.68 ? O GLU A 120 1 
ATOM 924 C CB . GLU A 1 140 . 33.661 0.237 3.636 1 19.98 ? CB GLU A 120 1 
ATOM 925 C CG . GLU A 1 140 . 34.149 -1.156 4.033 1 21.37 ? CG GLU A 120 1 
ATOM 926 C CD . GLU A 1 140 . 35.066 -1.175 5.255 1 21.63 ? CD GLU A 120 1 
ATOM 927 O OE1 . GLU A 1 140 . 35.905 -0.266 5.433 1 21.14 ? OE1 GLU A 120 1 
ATOM 928 O OE2 . GLU A 1 140 . 34.947 -2.121 6.054 1 22.98 ? OE2 GLU A 120 1 
ATOM 929 N N . ALA A 1 141 . 31.68 3.002 4.053 1 19.33 ? N ALA A 121 1 
ATOM 930 C CA . ALA A 1 141 . 31.515 4.439 3.753 1 19.43 ? CA ALA A 121 1 
ATOM 931 C C . ALA A 1 141 . 31.67 5.301 5.001 1 19.01 ? C ALA A 121 1 
ATOM 932 O O . ALA A 1 141 . 31.436 4.84 6.125 1 19.32 ? O ALA A 121 1 
ATOM 933 C CB . ALA A 1 141 . 30.166 4.71 3.092 1 19.22 ? CB ALA A 121 1 
ATOM 934 N N . GLY A 1 142 . 32.053 6.557 4.806 1 18.69 ? N GLY A 122 1 
ATOM 935 C CA . GLY A 1 142 . 32.144 7.495 5.922 1 18.09 ? CA GLY A 122 1 
ATOM 936 C C . GLY A 1 142 . 30.859 7.57 6.73 1 17.68 ? C GLY A 122 1 
ATOM 937 O O . GLY A 1 142 . 30.886 7.61 7.961 1 17.79 ? O GLY A 122 1 
ATOM 938 N N . PHE A 1 143 . 29.731 7.605 6.031 1 16.62 ? N PHE A 123 1 
ATOM 939 C CA . PHE A 1 143 . 28.431 7.611 6.683 1 16 ? CA PHE A 123 1 
ATOM 940 C C . PHE A 1 143 . 27.55 6.511 6.081 1 15.84 ? C PHE A 123 1 
ATOM 941 O O . PHE A 1 143 . 27.143 6.59 4.918 1 15.69 ? O PHE A 123 1 
ATOM 942 C CB . PHE A 1 143 . 27.784 8.993 6.568 1 15.52 ? CB PHE A 123 1 
ATOM 943 C CG . PHE A 1 143 . 26.48 9.132 7.315 1 15.59 ? CG PHE A 123 1 
ATOM 944 C CD1 . PHE A 1 143 . 26.273 8.49 8.535 1 15.92 ? CD1 PHE A 123 1 
ATOM 945 C CD2 . PHE A 1 143 . 25.472 9.959 6.819 1 15.28 ? CD2 PHE A 123 1 
ATOM 946 C CE1 . PHE A 1 143 . 25.077 8.65 9.226 1 15.54 ? CE1 PHE A 123 1 
ATOM 947 C CE2 . PHE A 1 143 . 24.279 10.119 7.507 1 15.31 ? CE2 PHE A 123 1 
ATOM 948 C CZ . PHE A 1 143 . 24.077 9.456 8.704 1 15.09 ? CZ PHE A 123 1 
ATOM 949 N N . GLY A 1 144 . 27.298 5.469 6.871 1 15.28 ? N GLY A 124 1 
ATOM 950 C CA . GLY A 1 144 . 26.513 4.341 6.404 1 14.72 ? CA GLY A 124 1 
ATOM 951 C C . GLY A 1 144 . 25.137 4.324 7.025 1 14.31 ? C GLY A 124 1 
ATOM 952 O O . GLY A 1 144 . 25.001 4.42 8.257 1 14.49 ? O GLY A 124 1 
ATOM 953 N N . ILE A 1 145 . 24.122 4.175 6.174 1 13.68 ? N ILE A 125 1 
ATOM 954 C CA . ILE A 1 145 . 22.731 4.2 6.612 1 13.74 ? CA ILE A 125 1 
ATOM 955 C C . ILE A 1 145 . 21.95 2.959 6.16 1 13.99 ? C ILE A 125 1 
ATOM 956 O O . ILE A 1 145 . 22.124 2.477 5.031 1 12.96 ? O ILE A 125 1 
ATOM 957 C CB . ILE A 1 145 . 21.974 5.46 6.104 1 13.67 ? CB ILE A 125 1 
ATOM 958 C CG1 . ILE A 1 145 . 22.781 6.752 6.305 1 13.88 ? CG1 ILE A 125 1 
ATOM 959 C CG2 . ILE A 1 145 . 20.638 5.605 6.805 1 13.68 ? CG2 ILE A 125 1 
ATOM 960 C CD1 . ILE A 1 145 . 23.506 7.247 5.068 1 13.51 ? CD1 ILE A 125 1 
ATOM 961 N N . SER A 1 146 . 21.089 2.454 7.047 1 13.95 ? N SER A 126 1 
ATOM 962 C CA . SER A 1 146 . 20.075 1.491 6.637 1 15.07 ? CA SER A 126 1 
ATOM 963 C C . SER A 1 146 . 18.682 1.91 7.122 1 16.25 ? C SER A 126 1 
ATOM 964 O O . SER A 1 146 . 18.49 3.025 7.608 1 16.99 ? O SER A 126 1 
ATOM 965 C CB . SER A 1 146 . 20.427 0.065 7.077 1 14.58 ? CB SER A 126 1 
ATOM 966 O OG . SER A 1 146 . 19.587 -0.863 6.431 1 14.11 ? OG SER A 126 1 
ATOM 967 N N . VAL A 1 147 . 17.711 1.018 6.969 1 17.53 ? N VAL A 127 1 
ATOM 968 C CA . VAL A 1 147 . 16.304 1.356 7.193 1 17.63 ? CA VAL A 127 1 
ATOM 969 C C . VAL A 1 147 . 15.655 0.324 8.118 1 18.45 ? C VAL A 127 1 
ATOM 970 O O . VAL A 1 147 . 16.219 -0.759 8.315 1 18.27 ? O VAL A 127 1 
ATOM 971 C CB . VAL A 1 147 . 15.539 1.472 5.855 1 17.54 ? CB VAL A 127 1 
ATOM 972 C CG1 . VAL A 1 147 . 16.005 2.707 5.09 1 17.49 ? CG1 VAL A 127 1 
ATOM 973 C CG2 . VAL A 1 147 . 15.692 0.21 5.002 1 17.29 ? CG2 VAL A 127 1 
ATOM 974 N N . PRO A 1 148 . 14.471 0.643 8.693 1 19.28 ? N PRO A 128 1 
ATOM 975 C CA . PRO A 1 148 . 13.898 -0.279 9.683 1 19.62 ? CA PRO A 128 1 
ATOM 976 C C . PRO A 1 148 . 13.607 -1.672 9.109 1 20.72 ? C PRO A 128 1 
ATOM 977 O O . PRO A 1 148 . 13.744 -2.674 9.815 1 21.54 ? O PRO A 128 1 
ATOM 978 C CB . PRO A 1 148 . 12.607 0.43 10.119 1 19.59 ? CB PRO A 128 1 
ATOM 979 C CG . PRO A 1 148 . 12.818 1.869 9.757 1 19.39 ? CG PRO A 128 1 
ATOM 980 C CD . PRO A 1 148 . 13.605 1.821 8.488 1 18.9 ? CD PRO A 128 1 
ATOM 981 N N . ASN A 1 149 . 13.241 -1.744 7.835 1 21.28 ? N ASN A 129 1 
ATOM 982 C CA . ASN A 1 149 . 13.031 -3.036 7.213 1 21.65 ? CA ASN A 129 1 
ATOM 983 C C . ASN A 1 149 . 14.266 -3.572 6.484 1 20.9 ? C ASN A 129 1 
ATOM 984 O O . ASN A 1 149 . 14.178 -4.483 5.661 1 21.13 ? O ASN A 129 1 
ATOM 985 C CB . ASN A 1 149 . 11.781 -3.012 6.333 1 23.02 ? CB ASN A 129 1 
ATOM 986 C CG . ASN A 1 149 . 10.503 -2.971 7.157 1 24.49 ? CG ASN A 129 1 
ATOM 987 O OD1 . ASN A 1 149 . 9.998 -4.01 7.59 1 25.85 ? OD1 ASN A 129 1 
ATOM 988 N ND2 . ASN A 1 149 . 9.98 -1.768 7.391 1 24.95 ? ND2 ASN A 129 1 
ATOM 989 N N . GLY A 1 150 . 15.419 -3.008 6.813 1 20.04 ? N GLY A 130 1 
ATOM 990 C CA . GLY A 1 150 . 16.688 -3.526 6.321 1 18.92 ? CA GLY A 130 1 
ATOM 991 C C . GLY A 1 150 . 16.988 -4.853 6.999 1 18.3 ? C GLY A 130 1 
ATOM 992 O O . GLY A 1 150 . 16.523 -5.095 8.119 1 17.27 ? O GLY A 130 1 
ATOM 993 N N . CYS A 1 151 . 17.749 -5.719 6.321 1 17.58 ? N CYS A 131 1 
ATOM 994 C CA . CYS A 1 151 . 18.153 -6.987 6.911 1 17.7 ? CA CYS A 131 1 
ATOM 995 C C . CYS A 1 151 . 19.051 -6.674 8.097 1 18.02 ? C CYS A 131 1 
ATOM 996 O O . CYS A 1 151 . 19.748 -5.661 8.099 1 17.48 ? O CYS A 131 1 
ATOM 997 C CB . CYS A 1 151 . 18.863 -7.878 5.894 1 17.55 ? CB CYS A 131 1 
ATOM 998 S SG . CYS A 1 151 . 20.48 -7.269 5.384 1 17.89 ? SG CYS A 131 1 
ATOM 999 N N . GLU A 1 152 . 19.007 -7.53 9.108 1 18.51 ? N GLU A 132 1 
ATOM 1000 C CA . GLU A 1 152 . 19.675 -7.28 10.38 1 19.81 ? CA GLU A 132 1 
ATOM 1001 C C . GLU A 1 152 . 21.165 -7.02 10.222 1 19.14 ? C GLU A 132 1 
ATOM 1002 O O . GLU A 1 152 . 21.729 -6.147 10.89 1 18.8 ? O GLU A 132 1 
ATOM 1003 C CB . GLU A 1 152 . 19.455 -8.477 11.31 1 22.35 ? CB GLU A 132 1 
ATOM 1004 C CG . GLU A 1 152 . 19.916 -8.287 12.741 1 25.22 ? CG GLU A 132 1 
ATOM 1005 C CD . GLU A 1 152 . 19.486 -9.438 13.64 1 28.66 ? CD GLU A 132 1 
ATOM 1006 O OE1 . GLU A 1 152 . 18.824 -10.369 13.119 1 29.4 ? OE1 GLU A 132 1 
ATOM 1007 O OE2 . GLU A 1 152 . 19.796 -9.408 14.864 1 27.9 ? OE2 GLU A 132 1 
ATOM 1008 N N . GLN A 1 153 . 21.787 -7.784 9.327 1 18.59 ? N GLN A 133 1 
ATOM 1009 C CA . GLN A 1 153 . 23.238 -7.759 9.11 1 17.9 ? CA GLN A 133 1 
ATOM 1010 C C . GLN A 1 153 . 23.726 -6.401 8.607 1 17.61 ? C GLN A 133 1 
ATOM 1011 O O . GLN A 1 153 . 24.77 -5.913 9.054 1 17.1 ? O GLN A 133 1 
ATOM 1012 C CB . GLN A 1 153 . 23.655 -8.864 8.132 1 17.94 ? CB GLN A 133 1 
ATOM 1013 C CG . GLN A 1 153 . 23.397 -10.283 8.614 1 17.73 ? CG GLN A 133 1 
ATOM 1014 C CD . GLN A 1 153 . 21.942 -10.702 8.523 1 17.56 ? CD GLN A 133 1 
ATOM 1015 O OE1 . GLN A 1 153 . 21.53 -11.656 9.181 1 18.59 ? OE1 GLN A 133 1 
ATOM 1016 N NE2 . GLN A 1 153 . 21.153 -9.99 7.728 1 17.33 ? NE2 GLN A 133 1 
ATOM 1017 N N . THR A 1 154 . 22.967 -5.799 7.688 1 16.84 ? N THR A 134 1 
ATOM 1018 C CA . THR A 1 154 . 23.269 -4.46 7.205 1 16.75 ? CA THR A 134 1 
ATOM 1019 C C . THR A 1 154 . 22.984 -3.381 8.267 1 17.29 ? C THR A 134 1 
ATOM 1020 O O . THR A 1 154 . 23.73 -2.404 8.387 1 16.7 ? O THR A 134 1 
ATOM 1021 C CB . THR A 1 154 . 22.502 -4.142 5.918 1 16.56 ? CB THR A 134 1 
ATOM 1022 O OG1 . THR A 1 154 . 22.866 -5.082 4.896 1 16.04 ? OG1 THR A 134 1 
ATOM 1023 C CG2 . THR A 1 154 . 22.838 -2.735 5.441 1 16.22 ? CG2 THR A 134 1 
ATOM 1024 N N . ARG A 1 155 . 21.906 -3.561 9.026 1 17.69 ? N ARG A 135 1 
ATOM 1025 C CA . ARG A 1 155 . 21.564 -2.631 10.107 1 18.7 ? CA ARG A 135 1 
ATOM 1026 C C . ARG A 1 155 . 22.621 -2.656 11.2 1 19.2 ? C ARG A 135 1 
ATOM 1027 O O . ARG A 1 155 . 22.955 -1.611 11.768 1 19.98 ? O ARG A 135 1 
ATOM 1028 C CB . ARG A 1 155 . 20.187 -2.95 10.708 1 18.16 ? CB ARG A 135 1 
ATOM 1029 C CG . ARG A 1 155 . 19.009 -2.462 9.885 1 17.69 ? CG ARG A 135 1 
ATOM 1030 C CD . ARG A 1 155 . 17.694 -2.669 10.622 1 18.28 ? CD ARG A 135 1 
ATOM 1031 N NE . ARG A 1 155 . 17.192 -4.047 10.521 1 19.03 ? NE ARG A 135 1 
ATOM 1032 C CZ . ARG A 1 155 . 16.994 -4.858 11.56 1 19.04 ? CZ ARG A 135 1 
ATOM 1033 N NH1 . ARG A 1 155 . 17.239 -4.448 12.794 1 19.95 ? NH1 ARG A 135 1 
ATOM 1034 N NH2 . ARG A 1 155 . 16.537 -6.081 11.373 1 19.38 ? NH2 ARG A 135 1 
ATOM 1035 N N . ALA A 1 156 . 23.151 -3.851 11.47 1 19.27 ? N ALA A 136 1 
ATOM 1036 C CA . ALA A 1 156 . 24.174 -4.065 12.494 1 19.11 ? CA ALA A 136 1 
ATOM 1037 C C . ALA A 1 156 . 25.428 -3.235 12.242 1 19.33 ? C ALA A 136 1 
ATOM 1038 O O . ALA A 1 156 . 26.139 -2.846 13.183 1 18.93 ? O ALA A 136 1 
ATOM 1039 C CB . ALA A 1 156 . 24.54 -5.539 12.563 1 18.82 ? CB ALA A 136 1 
ATOM 1040 N N . VAL A 1 157 . 25.664 -2.955 10.963 1 18.78 ? N VAL A 137 1 
ATOM 1041 C CA . VAL A 1 157 . 26.915 -2.397 10.479 1 18.77 ? CA VAL A 137 1 
ATOM 1042 C C . VAL A 1 157 . 26.77 -0.906 10.071 1 19.06 ? C VAL A 137 1 
ATOM 1043 O O . VAL A 1 157 . 27.705 -0.274 9.566 1 18.69 ? O VAL A 137 1 
ATOM 1044 C CB . VAL A 1 157 . 27.442 -3.334 9.353 1 18.86 ? CB VAL A 137 1 
ATOM 1045 C CG1 . VAL A 1 157 . 27.128 -2.846 7.941 1 17.9 ? CG1 VAL A 137 1 
ATOM 1046 C CG2 . VAL A 1 157 . 28.895 -3.713 9.575 1 18.89 ? CG2 VAL A 137 1 
ATOM 1047 N N . SER A 1 158 . 25.598 -0.333 10.325 1 19.15 ? N SER A 138 1 
ATOM 1048 C CA . SER A 1 158 . 25.327 1.018 9.869 1 19.13 ? CA SER A 138 1 
ATOM 1049 C C . SER A 1 158 . 25.6 2.03 10.979 1 19.24 ? C SER A 138 1 
ATOM 1050 O O . SER A 1 158 . 25.64 1.669 12.159 1 20.2 ? O SER A 138 1 
ATOM 1051 C CB . SER A 1 158 . 23.897 1.12 9.377 1 19.43 ? CB SER A 138 1 
ATOM 1052 O OG . SER A 1 158 . 23.007 1.081 10.468 1 20.38 ? OG SER A 138 1 
ATOM 1053 N N . ASP A 1 159 . 25.804 3.29 10.597 1 18.68 ? N ASP A 139 1 
ATOM 1054 C CA . ASP A 1 159 . 25.994 4.378 11.564 1 18.23 ? CA ASP A 139 1 
ATOM 1055 C C . ASP A 1 159 . 24.654 4.927 11.996 1 18.55 ? C ASP A 139 1 
ATOM 1056 O O . ASP A 1 159 . 24.528 5.533 13.065 1 19.79 ? O ASP A 139 1 
ATOM 1057 C CB . ASP A 1 159 . 26.802 5.508 10.939 1 17.52 ? CB ASP A 139 1 
ATOM 1058 C CG . ASP A 1 159 . 28.174 5.066 10.531 1 17.32 ? CG ASP A 139 1 
ATOM 1059 O OD1 . ASP A 1 159 . 28.922 4.589 11.414 1 17.21 ? OD1 ASP A 139 1 
ATOM 1060 O OD2 . ASP A 1 159 . 28.497 5.178 9.33 1 17.28 ? OD2 ASP A 139 1 
ATOM 1061 N N . TYR A 1 160 . 23.657 4.738 11.147 1 17.88 ? N TYR A 140 1 
ATOM 1062 C CA . TYR A 1 160 . 22.346 5.29 11.391 1 17.61 ? CA TYR A 140 1 
ATOM 1063 C C . TYR A 1 160 . 21.294 4.428 10.714 1 17.45 ? C TYR A 140 1 
ATOM 1064 O O . TYR A 1 160 . 21.514 3.895 9.621 1 17.17 ? O TYR A 140 1 
ATOM 1065 C CB . TYR A 1 160 . 22.292 6.732 10.875 1 18.2 ? CB TYR A 140 1 
ATOM 1066 C CG . TYR A 1 160 . 20.969 7.42 11.098 1 18.6 ? CG TYR A 140 1 
ATOM 1067 C CD1 . TYR A 1 160 . 20.541 7.753 12.386 1 18.62 ? CD1 TYR A 140 1 
ATOM 1068 C CD2 . TYR A 1 160 . 20.143 7.742 10.018 1 18.49 ? CD2 TYR A 140 1 
ATOM 1069 C CE1 . TYR A 1 160 . 19.319 8.38 12.594 1 19.03 ? CE1 TYR A 140 1 
ATOM 1070 C CE2 . TYR A 1 160 . 18.922 8.369 10.216 1 18.49 ? CE2 TYR A 140 1 
ATOM 1071 C CZ . TYR A 1 160 . 18.512 8.686 11.501 1 18.94 ? CZ TYR A 140 1 
ATOM 1072 O OH . TYR A 1 160 . 17.298 9.315 11.701 1 18.32 ? OH TYR A 140 1 
ATOM 1073 N N . ILE A 1 161 . 20.172 4.268 11.404 1 17.7 ? N ILE A 141 1 
ATOM 1074 C CA . ILE A 1 161 . 18.981 3.621 10.878 1 17.79 ? CA ILE A 141 1 
ATOM 1075 C C . ILE A 1 161 . 17.885 4.669 10.862 1 17.15 ? C ILE A 141 1 
ATOM 1076 O O . ILE A 1 161 . 17.558 5.252 11.901 1 16.48 ? O ILE A 141 1 
ATOM 1077 C CB . ILE A 1 161 . 18.494 2.467 11.78 1 18.08 ? CB ILE A 141 1 
ATOM 1078 C CG1 . ILE A 1 161 . 19.595 1.43 11.987 1 18.54 ? CG1 ILE A 141 1 
ATOM 1079 C CG2 . ILE A 1 161 . 17.253 1.812 11.176 1 18.54 ? CG2 ILE A 141 1 
ATOM 1080 C CD1 . ILE A 1 161 . 20.191 0.925 10.693 1 19.29 ? CD1 ILE A 141 1 
ATOM 1081 N N . THR A 1 162 . 17.305 4.903 9.693 1 16.75 ? N THR A 142 1 
ATOM 1082 C CA . THR A 1 162 . 16.269 5.921 9.583 1 16.91 ? CA THR A 142 1 
ATOM 1083 C C . THR A 1 162 . 15.071 5.534 10.438 1 17.29 ? C THR A 142 1 
ATOM 1084 O O . THR A 1 162 . 14.91 4.357 10.794 1 16.57 ? O THR A 142 1 
ATOM 1085 C CB . THR A 1 162 . 15.839 6.119 8.123 1 16.94 ? CB THR A 142 1 
ATOM 1086 O OG1 . THR A 1 162 . 15.27 4.905 7.625 1 16.47 ? OG1 THR A 142 1 
ATOM 1087 C CG2 . THR A 1 162 . 17.044 6.492 7.285 1 16.74 ? CG2 THR A 142 1 
ATOM 1088 N N . THR A 1 163 . 14.263 6.529 10.798 1 18.12 ? N THR A 143 1 
ATOM 1089 C CA . THR A 1 163 . 12.961 6.291 11.43 1 19.09 ? CA THR A 143 1 
ATOM 1090 C C . THR A 1 163 . 11.916 5.929 10.366 1 19.4 ? C THR A 143 1 
ATOM 1091 O O . THR A 1 163 . 11.201 4.939 10.513 1 19.66 ? O THR A 143 1 
ATOM 1092 C CB . THR A 1 163 . 12.489 7.518 12.234 1 19.69 ? CB THR A 143 1 
ATOM 1093 O OG1 . THR A 1 163 . 13.452 7.811 13.257 1 21.18 ? OG1 THR A 143 1 
ATOM 1094 C CG2 . THR A 1 163 . 11.123 7.271 12.885 1 19.48 ? CG2 THR A 143 1 
ATOM 1095 N N . LYS A 1 164 . 11.83 6.73 9.307 1 19.26 ? N LYS A 144 1 
ATOM 1096 C CA . LYS A 1 164 . 10.915 6.443 8.203 1 19.44 ? CA LYS A 144 1 
ATOM 1097 C C . LYS A 1 164 . 11.459 5.297 7.368 1 18.38 ? C LYS A 144 1 
ATOM 1098 O O . LYS A 1 164 . 12.663 5.089 7.304 1 18.28 ? O LYS A 144 1 
ATOM 1099 C CB . LYS A 1 164 . 10.685 7.686 7.339 1 20.89 ? CB LYS A 144 1 
ATOM 1100 C CG . LYS A 1 164 . 9.859 8.77 8.022 1 22.85 ? CG LYS A 144 1 
ATOM 1101 C CD . LYS A 1 164 . 10.263 10.147 7.517 1 24.29 ? CD LYS A 144 1 
ATOM 1102 C CE . LYS A 1 164 . 9.651 11.267 8.347 1 24.89 ? CE LYS A 144 1 
ATOM 1103 N NZ . LYS A 1 164 . 8.75 12.146 7.542 1 25.78 ? NZ LYS A 144 1 
ATOM 1104 N N . THR A 1 165 . 10.561 4.552 6.744 1 17.34 ? N THR A 145 1 
ATOM 1105 C CA . THR A 1 165 . 10.92 3.368 5.993 1 17.01 ? CA THR A 145 1 
ATOM 1106 C C . THR A 1 165 . 11.168 3.712 4.521 1 16.55 ? C THR A 145 1 
ATOM 1107 O O . THR A 1 165 . 10.859 4.818 4.083 1 15.78 ? O THR A 145 1 
ATOM 1108 C CB . THR A 1 165 . 9.793 2.336 6.07 1 17.5 ? CB THR A 145 1 
ATOM 1109 O OG1 . THR A 1 165 . 8.6 2.91 5.523 1 18.86 ? OG1 THR A 145 1 
ATOM 1110 C CG2 . THR A 1 165 . 9.527 1.935 7.508 1 18.1 ? CG2 THR A 145 1 
ATOM 1111 N N . GLY A 1 166 . 11.693 2.74 3.765 1 16.04 ? N GLY A 146 1 
ATOM 1112 C CA . GLY A 1 166 . 12.052 2.92 2.351 1 15.23 ? CA GLY A 146 1 
ATOM 1113 C C . GLY A 1 166 . 10.857 3.223 1.478 1 14.95 ? C GLY A 146 1 
ATOM 1114 O O . GLY A 1 166 . 9.807 2.605 1.621 1 14.38 ? O GLY A 146 1 
ATOM 1115 N N . GLY A 1 167 . 11.008 4.194 0.587 1 14.78 ? N GLY A 147 1 
ATOM 1116 C CA . GLY A 1 167 . 9.886 4.655 -0.237 1 16.36 ? CA GLY A 147 1 
ATOM 1117 C C . GLY A 1 167 . 8.827 5.367 0.59 1 16.82 ? C GLY A 147 1 
ATOM 1118 O O . GLY A 1 167 . 7.701 5.537 0.155 1 17.3 ? O GLY A 147 1 
ATOM 1119 N N . ASN A 1 168 . 9.198 5.786 1.791 1 17.27 ? N ASN A 148 1 
ATOM 1120 C CA . ASN A 1 168 . 8.283 6.492 2.67 1 18.24 ? CA ASN A 148 1 
ATOM 1121 C C . ASN A 1 168 . 8.976 7.625 3.415 1 17.4 ? C ASN A 148 1 
ATOM 1122 O O . ASN A 1 168 . 8.482 8.112 4.428 1 17.12 ? O ASN A 148 1 
ATOM 1123 C CB . ASN A 1 168 . 7.632 5.513 3.652 1 19.85 ? CB ASN A 148 1 
ATOM 1124 C CG . ASN A 1 168 . 6.431 4.816 3.055 1 21.28 ? CG ASN A 148 1 
ATOM 1125 O OD1 . ASN A 1 168 . 6.456 3.607 2.802 1 22.45 ? OD1 ASN A 148 1 
ATOM 1126 N ND2 . ASN A 1 168 . 5.374 5.585 2.796 1 22.05 ? ND2 ASN A 148 1 
ATOM 1127 N N . GLY A 1 169 . 10.131 8.036 2.905 1 17.22 ? N GLY A 149 1 
ATOM 1128 C CA . GLY A 1 169 . 10.819 9.204 3.448 1 16.81 ? CA GLY A 149 1 
ATOM 1129 C C . GLY A 1 169 . 12.065 8.89 4.244 1 16.21 ? C GLY A 149 1 
ATOM 1130 O O . GLY A 1 169 . 12.573 9.758 4.964 1 16.33 ? O GLY A 149 1 
ATOM 1131 N N . ALA A 1 170 . 12.561 7.657 4.125 1 15.22 ? N ALA A 150 1 
ATOM 1132 C CA . ALA A 1 170 . 13.883 7.325 4.653 1 14.62 ? CA ALA A 150 1 
ATOM 1133 C C . ALA A 1 170 . 14.947 8.235 4.032 1 14.36 ? C ALA A 150 1 
ATOM 1134 O O . ALA A 1 170 . 15.81 8.765 4.737 1 14.23 ? O ALA A 150 1 
ATOM 1135 C CB . ALA A 1 170 . 14.213 5.864 4.394 1 14.39 ? CB ALA A 150 1 
ATOM 1136 N N . VAL A 1 171 . 14.871 8.415 2.714 1 13.91 ? N VAL A 151 1 
ATOM 1137 C CA . VAL A 1 171 . 15.814 9.264 1.978 1 13.98 ? CA VAL A 151 1 
ATOM 1138 C C . VAL A 1 171 . 15.669 10.739 2.366 1 13.92 ? C VAL A 151 1 
ATOM 1139 O O . VAL A 1 171 . 16.651 11.41 2.708 1 14.03 ? O VAL A 151 1 
ATOM 1140 C CB . VAL A 1 171 . 15.683 9.068 0.45 1 13.88 ? CB VAL A 151 1 
ATOM 1141 C CG1 . VAL A 1 171 . 16.508 10.095 -0.302 1 13.69 ? CG1 VAL A 151 1 
ATOM 1142 C CG2 . VAL A 1 171 . 16.109 7.66 0.069 1 13.97 ? CG2 VAL A 151 1 
ATOM 1143 N N . ARG A 1 172 . 14.442 11.242 2.324 1 14.07 ? N ARG A 152 1 
ATOM 1144 C CA . ARG A 1 172 . 14.172 12.595 2.788 1 13.88 ? CA ARG A 152 1 
ATOM 1145 C C . ARG A 1 172 . 14.845 12.808 4.136 1 13.89 ? C ARG A 152 1 
ATOM 1146 O O . ARG A 1 172 . 15.554 13.787 4.325 1 13.82 ? O ARG A 152 1 
ATOM 1147 C CB . ARG A 1 172 . 12.661 12.855 2.867 1 13.6 ? CB ARG A 152 1 
ATOM 1148 C CG . ARG A 1 172 . 12.265 14.204 3.463 1 13.54 ? CG ARG A 152 1 
ATOM 1149 C CD . ARG A 1 172 . 12.993 15.394 2.835 1 13.41 ? CD ARG A 152 1 
ATOM 1150 N NE . ARG A 1 172 . 12.333 16.642 3.224 1 13.48 ? NE ARG A 152 1 
ATOM 1151 C CZ . ARG A 1 172 . 11.293 17.168 2.571 1 13.33 ? CZ ARG A 152 1 
ATOM 1152 N NH1 . ARG A 1 172 . 10.822 16.569 1.485 1 12.91 ? NH1 ARG A 152 1 
ATOM 1153 N NH2 . ARG A 1 172 . 10.726 18.288 3.003 1 13.23 ? NH2 ARG A 152 1 
ATOM 1154 N N . GLU A 1 173 . 14.641 11.864 5.052 1 14.35 ? N GLU A 153 1 
ATOM 1155 C CA . GLU A 1 173 . 15.158 11.957 6.408 1 15 ? CA GLU A 153 1 
ATOM 1156 C C . GLU A 1 173 . 16.687 12.076 6.454 1 15.04 ? C GLU A 153 1 
ATOM 1157 O O . GLU A 1 173 . 17.232 12.904 7.194 1 15.05 ? O GLU A 153 1 
ATOM 1158 C CB . GLU A 1 173 . 14.685 10.745 7.211 1 15.62 ? CB GLU A 153 1 
ATOM 1159 C CG . GLU A 1 173 . 15.11 10.743 8.661 1 16.6 ? CG GLU A 153 1 
ATOM 1160 C CD . GLU A 1 173 . 14.571 9.538 9.405 1 17.36 ? CD GLU A 153 1 
ATOM 1161 O OE1 . GLU A 1 173 . 13.484 9.043 9.046 1 18.11 ? OE1 GLU A 153 1 
ATOM 1162 O OE2 . GLU A 1 173 . 15.24 9.073 10.344 1 18 ? OE2 GLU A 153 1 
ATOM 1163 N N . VAL A 1 174 . 17.375 11.255 5.661 1 14.75 ? N VAL A 154 1 
ATOM 1164 C CA . VAL A 1 174 . 18.835 11.288 5.622 1 14.57 ? CA VAL A 154 1 
ATOM 1165 C C . VAL A 1 174 . 19.351 12.56 4.932 1 14.4 ? C VAL A 154 1 
ATOM 1166 O O . VAL A 1 174 . 20.411 13.095 5.295 1 14.56 ? O VAL A 154 1 
ATOM 1167 C CB . VAL A 1 174 . 19.447 9.973 5.055 1 14.48 ? CB VAL A 154 1 
ATOM 1168 C CG1 . VAL A 1 174 . 18.887 9.635 3.689 1 15.07 ? CG1 VAL A 154 1 
ATOM 1169 C CG2 . VAL A 1 174 . 20.958 10.052 4.989 1 14.45 ? CG2 VAL A 154 1 
ATOM 1170 N N . CYS A 1 175 . 18.583 13.073 3.975 1 14.19 ? N CYS A 155 1 
ATOM 1171 C CA . CYS A 1 175 . 18.95 14.31 3.314 1 14.16 ? CA CYS A 155 1 
ATOM 1172 C C . CYS A 1 175 . 18.954 15.453 4.305 1 14.11 ? C CYS A 155 1 
ATOM 1173 O O . CYS A 1 175 . 19.877 16.272 4.348 1 13.74 ? O CYS A 155 1 
ATOM 1174 C CB . CYS A 1 175 . 17.973 14.606 2.196 1 14.48 ? CB CYS A 155 1 
ATOM 1175 S SG . CYS A 1 175 . 18.212 13.51 0.801 1 14.49 ? SG CYS A 155 1 
ATOM 1176 N N . GLU A 1 176 . 17.909 15.487 5.112 1 14.1 ? N GLU A 156 1 
ATOM 1177 C CA . GLU A 1 176 . 17.771 16.496 6.138 1 14.71 ? CA GLU A 156 1 
ATOM 1178 C C . GLU A 1 176 . 18.878 16.396 7.166 1 14.72 ? C GLU A 156 1 
ATOM 1179 O O . GLU A 1 176 . 19.4 17.407 7.6 1 14.97 ? O GLU A 156 1 
ATOM 1180 C CB . GLU A 1 176 . 16.402 16.393 6.781 1 14.89 ? CB GLU A 156 1 
ATOM 1181 C CG . GLU A 1 176 . 15.311 16.762 5.795 1 15.33 ? CG GLU A 156 1 
ATOM 1182 C CD . GLU A 1 176 . 13.971 16.975 6.455 1 16.36 ? CD GLU A 156 1 
ATOM 1183 O OE1 . GLU A 1 176 . 13.878 16.82 7.699 1 15.29 ? OE1 GLU A 156 1 
ATOM 1184 O OE2 . GLU A 1 176 . 13.015 17.298 5.707 1 16.6 ? OE2 GLU A 156 1 
ATOM 1185 N N . LEU A 1 177 . 19.258 15.169 7.499 1 14.73 ? N LEU A 157 1 
ATOM 1186 C CA . LEU A 1 177 . 20.327 14.907 8.446 1 15.05 ? CA LEU A 157 1 
ATOM 1187 C C . LEU A 1 177 . 21.698 15.409 7.967 1 14.6 ? C LEU A 157 1 
ATOM 1188 O O . LEU A 1 177 . 22.432 16.058 8.716 1 13.99 ? O LEU A 157 1 
ATOM 1189 C CB . LEU A 1 177 . 20.391 13.409 8.717 1 15.82 ? CB LEU A 157 1 
ATOM 1190 C CG . LEU A 1 177 . 20.503 12.981 10.177 1 16.57 ? CG LEU A 157 1 
ATOM 1191 C CD1 . LEU A 1 177 . 20.231 11.491 10.304 1 16.82 ? CD1 LEU A 157 1 
ATOM 1192 C CD2 . LEU A 1 177 . 21.872 13.312 10.746 1 17.01 ? CD2 LEU A 157 1 
ATOM 1193 N N . ILE A 1 178 . 22.044 15.099 6.717 1 14.9 ? N ILE A 158 1 
ATOM 1194 C CA . ILE A 1 178 . 23.299 15.569 6.144 1 14.88 ? CA ILE A 158 1 
ATOM 1195 C C . ILE A 1 178 . 23.297 17.1 6.055 1 14.75 ? C ILE A 158 1 
ATOM 1196 O O . ILE A 1 178 . 24.279 17.758 6.426 1 14.37 ? O ILE A 158 1 
ATOM 1197 C CB . ILE A 1 178 . 23.595 14.915 4.78 1 14.84 ? CB ILE A 158 1 
ATOM 1198 C CG1 . ILE A 1 178 . 23.775 13.398 4.951 1 15.13 ? CG1 ILE A 158 1 
ATOM 1199 C CG2 . ILE A 1 178 . 24.853 15.515 4.193 1 15.13 ? CG2 ILE A 158 1 
ATOM 1200 C CD1 . ILE A 1 178 . 23.626 12.586 3.683 1 14.73 ? CD1 ILE A 158 1 
ATOM 1201 N N . LEU A 1 179 . 22.184 17.663 5.596 1 14.65 ? N LEU A 159 1 
ATOM 1202 C CA . LEU A 1 179 . 22.048 19.117 5.536 1 14.98 ? CA LEU A 159 1 
ATOM 1203 C C . LEU A 1 179 . 22.32 19.779 6.895 1 15.03 ? C LEU A 159 1 
ATOM 1204 O O . LEU A 1 179 . 23.081 20.746 6.955 1 14.71 ? O LEU A 159 1 
ATOM 1205 C CB . LEU A 1 179 . 20.68 19.521 4.983 1 14.97 ? CB LEU A 159 1 
ATOM 1206 C CG . LEU A 1 179 . 20.446 19.308 3.477 1 15.14 ? CG LEU A 159 1 
ATOM 1207 C CD1 . LEU A 1 179 . 18.979 19.539 3.129 1 14.66 ? CD1 LEU A 159 1 
ATOM 1208 C CD2 . LEU A 1 179 . 21.337 20.223 2.64 1 15.17 ? CD2 LEU A 159 1 
ATOM 1209 N N . LYS A 1 180 . 21.729 19.238 7.968 1 15.33 ? N LYS A 160 1 
ATOM 1210 C CA . LYS A 1 180 . 21.885 19.777 9.34 1 16.14 ? CA LYS A 160 1 
ATOM 1211 C C . LYS A 1 180 . 23.326 19.664 9.848 1 16.41 ? C LYS A 160 1 
ATOM 1212 O O . LYS A 1 180 . 23.843 20.57 10.519 1 16.11 ? O LYS A 160 1 
ATOM 1213 C CB . LYS A 1 180 . 20.957 19.056 10.315 1 16.9 ? CB LYS A 160 1 
ATOM 1214 C CG . LYS A 1 180 . 19.491 19.429 10.172 1 18.32 ? CG LYS A 160 1 
ATOM 1215 C CD . LYS A 1 180 . 18.591 18.367 10.78 1 19.7 ? CD LYS A 160 1 
ATOM 1216 C CE . LYS A 1 180 . 17.174 18.877 11 1 20.33 ? CE LYS A 160 1 
ATOM 1217 N NZ . LYS A 1 180 . 16.332 17.828 11.65 1 21.36 ? NZ LYS A 160 1 
ATOM 1218 N N . ALA A 1 181 . 23.972 18.549 9.512 1 16.19 ? N ALA A 161 1 
ATOM 1219 C CA . ALA A 1 181 . 25.365 18.354 9.865 1 16.45 ? CA ALA A 161 1 
ATOM 1220 C C . ALA A 1 181 . 26.262 19.377 9.166 1 16.61 ? C ALA A 161 1 
ATOM 1221 O O . ALA A 1 181 . 27.245 19.826 9.739 1 16.19 ? O ALA A 161 1 
ATOM 1222 C CB . ALA A 1 181 . 25.794 16.941 9.543 1 16.06 ? CB ALA A 161 1 
ATOM 1223 N N . GLN A 1 182 . 25.888 19.773 7.948 1 17.15 ? N GLN A 162 1 
ATOM 1224 C CA . GLN A 1 182 . 26.686 20.709 7.146 1 16.75 ? CA GLN A 162 1 
ATOM 1225 C C . GLN A 1 182 . 26.216 22.18 7.254 1 17.22 ? C GLN A 162 1 
ATOM 1226 O O . GLN A 1 182 . 26.672 23.055 6.499 1 16.43 ? O GLN A 162 1 
ATOM 1227 C CB . GLN A 1 182 . 26.759 20.23 5.69 1 16.81 ? CB GLN A 162 1 
ATOM 1228 C CG . GLN A 1 182 . 27.201 18.767 5.576 1 16.78 ? CG GLN A 162 1 
ATOM 1229 C CD . GLN A 1 182 . 27.676 18.361 4.186 1 17.15 ? CD GLN A 162 1 
ATOM 1230 O OE1 . GLN A 1 182 . 27.565 19.124 3.224 1 17.04 ? OE1 GLN A 162 1 
ATOM 1231 N NE2 . GLN A 1 182 . 28.228 17.149 4.081 1 16.82 ? NE2 GLN A 162 1 
ATOM 1232 N N . ASN A 1 183 . 25.335 22.44 8.222 1 17.32 ? N ASN A 163 1 
ATOM 1233 C CA . ASN A 1 183 . 24.765 23.766 8.456 1 18.21 ? CA ASN A 163 1 
ATOM 1234 C C . ASN A 1 183 . 24.091 24.359 7.217 1 18.33 ? C ASN A 163 1 
ATOM 1235 O O . ASN A 1 183 . 24.265 25.548 6.926 1 18.06 ? O ASN A 163 1 
ATOM 1236 C CB . ASN A 1 183 . 25.839 24.735 8.986 1 18.73 ? CB ASN A 163 1 
ATOM 1237 C CG . ASN A 1 183 . 26.554 24.203 10.205 1 18.52 ? CG ASN A 163 1 
ATOM 1238 O OD1 . ASN A 1 183 . 25.956 23.58 11.077 1 18.59 ? OD1 ASN A 163 1 
ATOM 1239 N ND2 . ASN A 1 183 . 27.848 24.457 10.273 1 19.45 ? ND2 ASN A 163 1 
ATOM 1240 N N . ASN A 1 184 . 23.333 23.529 6.498 1 17.61 ? N ASN A 164 1 
ATOM 1241 C CA . ASN A 1 184 . 22.663 23.958 5.275 1 18.08 ? CA ASN A 164 1 
ATOM 1242 C C . ASN A 1 184 . 21.143 23.794 5.303 1 17.8 ? C ASN A 164 1 
ATOM 1243 O O . ASN A 1 184 . 20.441 24.254 4.403 1 18.16 ? O ASN A 164 1 
ATOM 1244 C CB . ASN A 1 184 . 23.275 23.237 4.067 1 18.87 ? CB ASN A 164 1 
ATOM 1245 C CG . ASN A 1 184 . 24.699 23.689 3.792 1 19.63 ? CG ASN A 164 1 
ATOM 1246 O OD1 . ASN A 1 184 . 24.983 24.883 3.81 1 20.05 ? OD1 ASN A 164 1 
ATOM 1247 N ND2 . ASN A 1 184 . 25.602 22.739 3.544 1 19.64 ? ND2 ASN A 164 1 
ATOM 1248 N N . PHE A 1 185 . 20.638 23.168 6.359 1 17.97 ? N PHE A 165 1 
ATOM 1249 C CA . PHE A 1 185 . 19.224 22.821 6.442 1 17.41 ? CA PHE A 165 1 
ATOM 1250 C C . PHE A 1 185 . 18.346 24.028 6.745 1 17.35 ? C PHE A 165 1 
ATOM 1251 O O . PHE A 1 185 . 17.439 24.346 5.96 1 16.96 ? O PHE A 165 1 
ATOM 1252 C CB . PHE A 1 185 . 18.993 21.716 7.483 1 17.71 ? CB PHE A 165 1 
ATOM 1253 C CG . PHE A 1 185 . 17.542 21.298 7.618 1 18.07 ? CG PHE A 165 1 
ATOM 1254 C CD1 . PHE A 1 185 . 16.902 20.592 6.592 1 17.97 ? CD1 PHE A 165 1 
ATOM 1255 C CD2 . PHE A 1 185 . 16.809 21.631 8.756 1 17.77 ? CD2 PHE A 165 1 
ATOM 1256 C CE1 . PHE A 1 185 . 15.566 20.223 6.707 1 18.13 ? CE1 PHE A 165 1 
ATOM 1257 C CE2 . PHE A 1 185 . 15.475 21.254 8.875 1 17.85 ? CE2 PHE A 165 1 
ATOM 1258 C CZ . PHE A 1 185 . 14.853 20.552 7.85 1 17.97 ? CZ PHE A 165 1 
ATOM 1259 N N . ASP A 1 186 . 18.61 24.687 7.882 1 17 ? N ASP A 166 1 
ATOM 1260 C CA . ASP A 1 186 . 17.828 25.853 8.303 1 16.78 ? CA ASP A 166 1 
ATOM 1261 C C . ASP A 1 186 . 17.746 26.92 7.215 1 16.59 ? C ASP A 166 1 
ATOM 1262 O O . ASP A 1 186 . 16.672 27.477 6.972 1 16.65 ? O ASP A 166 1 
ATOM 1263 C CB . ASP A 1 186 . 18.354 26.444 9.619 1 17.3 ? CB ASP A 166 1 
ATOM 1264 C CG . ASP A 1 186 . 18.063 25.554 10.821 1 17.79 ? CG ASP A 166 1 
ATOM 1265 O OD1 . ASP A 1 186 . 17.567 24.421 10.62 1 17.29 ? OD1 ASP A 166 1 
ATOM 1266 O OD2 . ASP A 1 186 . 18.347 25.982 11.967 1 18.04 ? OD2 ASP A 166 1 
ATOM 1267 N N . ALA A 1 187 . 18.866 27.189 6.548 1 16.16 ? N ALA A 167 1 
ATOM 1268 C CA . ALA A 1 187 . 18.879 28.146 5.432 1 15.87 ? CA ALA A 167 1 
ATOM 1269 C C . ALA A 1 187 . 17.953 27.718 4.289 1 15.59 ? C ALA A 167 1 
ATOM 1270 O O . ALA A 1 187 . 17.211 28.539 3.743 1 15.56 ? O ALA A 167 1 
ATOM 1271 C CB . ALA A 1 187 . 20.298 28.364 4.918 1 15.66 ? CB ALA A 167 1 
ATOM 1272 N N . PHE A 1 188 . 18.002 26.436 3.936 1 15.68 ? N PHE A 168 1 
ATOM 1273 C CA . PHE A 1 188 . 17.147 25.888 2.883 1 15.98 ? CA PHE A 168 1 
ATOM 1274 C C . PHE A 1 188 . 15.666 26.082 3.239 1 16.15 ? C PHE A 168 1 
ATOM 1275 O O . PHE A 1 188 . 14.87 26.606 2.44 1 15.8 ? O PHE A 168 1 
ATOM 1276 C CB . PHE A 1 188 . 17.48 24.405 2.641 1 15.76 ? CB PHE A 168 1 
ATOM 1277 C CG . PHE A 1 188 . 16.596 23.738 1.616 1 15.66 ? CG PHE A 168 1 
ATOM 1278 C CD1 . PHE A 1 188 . 16.702 24.065 0.259 1 15.22 ? CD1 PHE A 168 1 
ATOM 1279 C CD2 . PHE A 1 188 . 15.661 22.774 2.004 1 15.35 ? CD2 PHE A 168 1 
ATOM 1280 C CE1 . PHE A 1 188 . 15.882 23.456 -0.691 1 15.41 ? CE1 PHE A 168 1 
ATOM 1281 C CE2 . PHE A 1 188 . 14.835 22.168 1.054 1 15.46 ? CE2 PHE A 168 1 
ATOM 1282 C CZ . PHE A 1 188 . 14.95 22.507 -0.294 1 14.69 ? CZ PHE A 168 1 
ATOM 1283 N N . ILE A 1 189 . 15.323 25.67 4.454 1 16.29 ? N ILE A 169 1 
ATOM 1284 C CA . ILE A 1 189 . 13.988 25.852 5.007 1 16.63 ? CA ILE A 169 1 
ATOM 1285 C C . ILE A 1 189 . 13.571 27.3 4.862 1 16.7 ? C ILE A 169 1 
ATOM 1286 O O . ILE A 1 189 . 12.501 27.581 4.337 1 16.66 ? O ILE A 169 1 
ATOM 1287 C CB . ILE A 1 189 . 13.941 25.466 6.501 1 16.9 ? CB ILE A 169 1 
ATOM 1288 C CG1 . ILE A 1 189 . 14.099 23.954 6.684 1 17.11 ? CG1 ILE A 169 1 
ATOM 1289 C CG2 . ILE A 1 189 . 12.668 25.971 7.166 1 16.84 ? CG2 ILE A 169 1 
ATOM 1290 C CD1 . ILE A 1 189 . 13.479 23.127 5.575 1 17.67 ? CD1 ILE A 169 1 
ATOM 1291 N N . ALA A 1 190 . 14.432 28.211 5.322 1 16.88 ? N ALA A 170 1 
ATOM 1292 C CA . ALA A 1 190 . 14.154 29.653 5.273 1 16.31 ? CA ALA A 170 1 
ATOM 1293 C C . ALA A 1 190 . 13.722 30.167 3.895 1 16.06 ? C ALA A 170 1 
ATOM 1294 O O . ALA A 1 190 . 12.958 31.126 3.823 1 15.46 ? O ALA A 170 1 
ATOM 1295 C CB . ALA A 1 190 . 15.339 30.458 5.809 1 16.06 ? CB ALA A 170 1 
ATOM 1296 N N . THR A 1 191 . 14.194 29.544 2.809 1 16.17 ? N THR A 171 1 
ATOM 1297 C CA . THR A 1 191 . 13.792 29.987 1.454 1 15.78 ? CA THR A 171 1 
ATOM 1298 C C . THR A 1 191 . 12.31 29.718 1.146 1 15.75 ? C THR A 171 1 
ATOM 1299 O O . THR A 1 191 . 11.78 30.181 0.128 1 15.23 ? O THR A 171 1 
ATOM 1300 C CB . THR A 1 191 . 14.651 29.376 0.321 1 16.3 ? CB THR A 171 1 
ATOM 1301 O OG1 . THR A 1 191 . 14.339 27.984 0.166 1 16.33 ? OG1 THR A 171 1 
ATOM 1302 C CG2 . THR A 1 191 . 16.144 29.567 0.584 1 16.51 ? CG2 THR A 171 1 
ATOM 1303 N N . PHE A 1 192 . 11.651 28.977 2.037 1 15.41 ? N PHE A 172 1 
ATOM 1304 C CA . PHE A 1 192 . 10.248 28.619 1.863 1 15.37 ? CA PHE A 172 1 
ATOM 1305 C C . PHE A 1 192 . 9.392 29.351 2.882 1 15.83 ? C PHE A 172 1 
ATOM 1306 O O . PHE A 1 192 . 8.184 29.126 2.96 1 16.04 ? O PHE A 172 1 
ATOM 1307 C CB . PHE A 1 192 . 10.057 27.102 1.989 1 14.9 ? CB PHE A 172 1 
ATOM 1308 C CG . PHE A 1 192 . 10.676 26.318 0.857 1 14.81 ? CG PHE A 172 1 
ATOM 1309 C CD1 . PHE A 1 192 . 10.03 26.224 -0.386 1 14.76 ? CD1 PHE A 172 1 
ATOM 1310 C CD2 . PHE A 1 192 . 11.902 25.691 1.021 1 14.46 ? CD2 PHE A 172 1 
ATOM 1311 C CE1 . PHE A 1 192 . 10.599 25.522 -1.444 1 14.52 ? CE1 PHE A 172 1 
ATOM 1312 C CE2 . PHE A 1 192 . 12.478 24.981 -0.029 1 15.22 ? CE2 PHE A 172 1 
ATOM 1313 C CZ . PHE A 1 192 . 11.824 24.887 -1.263 1 14.79 ? CZ PHE A 172 1 
ATOM 1314 N N . GLN A 1 193 . 10.03 30.214 3.671 1 15.56 ? N GLN A 173 1 
ATOM 1315 C CA . GLN A 1 193 . 9.338 30.963 4.712 1 15.64 ? CA GLN A 173 1 
ATOM 1316 C C . GLN A 1 193 . 9.375 32.454 4.42 1 15.47 ? C GLN A 173 1 
ATOM 1317 O O . GLN A 1 193 . 8.64 33.2 5.044 1 15.85 ? O GLN A 173 1 
ATOM 1318 C CB . GLN A 1 193 . 9.974 30.694 6.075 1 15.53 ? CB GLN A 173 1 
ATOM 1319 C CG . GLN A 1 193 . 9.893 29.253 6.552 1 15.1 ? CG GLN A 173 1 
ATOM 1320 C CD . GLN A 1 193 . 10.679 29.051 7.832 1 14.91 ? CD GLN A 173 1 
ATOM 1321 O OE1 . GLN A 1 193 . 11.781 29.572 7.982 1 14.75 ? OE1 GLN A 173 1 
ATOM 1322 N NE2 . GLN A 1 193 . 10.113 28.305 8.766 1 15.17 ? NE2 GLN A 173 1 
ATOM 1323 N N . HIS A-2 1 20 . -10.104 22.583 21.041 1 48.34 ? N HIS A-2 0 1 
ATOM 1324 C CA . HIS A-2 1 20 . -11.566 22.545 20.738 1 49.45 ? CA HIS A-2 0 1 
ATOM 1325 C C . HIS A-2 1 20 . -11.876 23.043 19.326 1 46.41 ? C HIS A-2 0 1 
ATOM 1326 O O . HIS A-2 1 20 . -11.283 24.013 18.851 1 45.94 ? O HIS A-2 0 1 
ATOM 1327 C CB . HIS A-2 1 20 . -12.363 23.348 21.773 1 52.97 ? CB HIS A-2 0 1 
ATOM 1328 C CG . HIS A-2 1 20 . -13.85 23.221 21.62 1 57.04 ? CG HIS A-2 0 1 
ATOM 1329 N ND1 . HIS A-2 1 20 . -14.578 23.991 20.736 1 57.4 ? ND1 HIS A-2 0 1 
ATOM 1330 C CD2 . HIS A-2 1 20 . -14.743 22.406 22.23 1 58.45 ? CD2 HIS A-2 0 1 
ATOM 1331 C CE1 . HIS A-2 1 20 . -15.855 23.662 20.815 1 57.94 ? CE1 HIS A-2 0 1 
ATOM 1332 N NE2 . HIS A-2 1 20 . -15.983 22.705 21.717 1 58.53 ? NE2 HIS A-2 0 1 
ATOM 1333 N N . MET A-2 1 21 . -12.842 22.389 18.689 1 43.8 ? N MET A-2 1 1 
ATOM 1334 C CA . MET A-2 1 21 . -13.091 22.533 17.256 1 42.39 ? CA MET A-2 1 1 
ATOM 1335 C C . MET A-2 1 21 . -13.675 23.865 16.785 1 39.99 ? C MET A-2 1 1 
ATOM 1336 O O . MET A-2 1 21 . -13.447 24.257 15.639 1 38.36 ? O MET A-2 1 1 
ATOM 1337 C CB . MET A-2 1 21 . -13.956 21.376 16.754 1 44.52 ? CB MET A-2 1 1 
ATOM 1338 C CG . MET A-2 1 21 . -13.616 20.911 15.345 1 47.55 ? CG MET A-2 1 1 
ATOM 1339 S SD . MET A-2 1 21 . -12.177 19.825 15.271 1 50 ? SD MET A-2 1 1 
ATOM 1340 C CE . MET A-2 1 21 . -10.855 20.983 14.925 1 49.59 ? CE MET A-2 1 1 
ATOM 1341 N N . ASN A-2 1 22 . -14.436 24.55 17.644 1 38.82 ? N ASN A-2 2 1 
ATOM 1342 C CA . ASN A-2 1 22 . -15.035 25.84 17.268 1 36.62 ? CA ASN A-2 2 1 
ATOM 1343 C C . ASN A-2 1 22 . -13.997 26.865 16.82 1 35.42 ? C ASN A-2 2 1 
ATOM 1344 O O . ASN A-2 1 22 . -14.267 27.692 15.942 1 33.97 ? O ASN A-2 2 1 
ATOM 1345 C CB . ASN A-2 1 22 . -15.908 26.427 18.381 1 36.59 ? CB ASN A-2 2 1 
ATOM 1346 C CG . ASN A-2 1 22 . -16.652 27.68 17.932 1 36.28 ? CG ASN A-2 2 1 
ATOM 1347 O OD1 . ASN A-2 1 22 . -17.231 27.716 16.848 1 35.62 ? OD1 ASN A-2 2 1 
ATOM 1348 N ND2 . ASN A-2 1 22 . -16.629 28.712 18.758 1 35.55 ? ND2 ASN A-2 2 1 
ATOM 1349 N N . GLU A-2 1 23 . -12.811 26.79 17.419 1 35.48 ? N GLU A-2 3 1 
ATOM 1350 C CA . GLU A-2 1 23 . -11.677 27.619 17.018 1 36.55 ? CA GLU A-2 3 1 
ATOM 1351 C C . GLU A-2 1 23 . -11.352 27.421 15.538 1 34.33 ? C GLU A-2 3 1 
ATOM 1352 O O . GLU A-2 1 23 . -11.007 28.368 14.84 1 34 ? O GLU A-2 3 1 
ATOM 1353 C CB . GLU A-2 1 23 . -10.446 27.302 17.866 1 37.94 ? CB GLU A-2 3 1 
ATOM 1354 C CG . GLU A-2 1 23 . -10.661 27.483 19.358 1 40.69 ? CG GLU A-2 3 1 
ATOM 1355 C CD . GLU A-2 1 23 . -9.378 27.796 20.106 1 42.48 ? CD GLU A-2 3 1 
ATOM 1356 O OE1 . GLU A-2 1 23 . -8.429 26.98 20.039 1 43.46 ? OE1 GLU A-2 3 1 
ATOM 1357 O OE2 . GLU A-2 1 23 . -9.321 28.867 20.755 1 40.81 ? OE2 GLU A-2 3 1 
ATOM 1358 N N . ILE A-2 1 24 . -11.489 26.189 15.066 1 32.57 ? N ILE A-2 4 1 
ATOM 1359 C CA . ILE A-2 1 24 . -11.204 25.869 13.672 1 32.59 ? CA ILE A-2 4 1 
ATOM 1360 C C . ILE A-2 1 24 . -12.382 26.257 12.766 1 32.45 ? C ILE A-2 4 1 
ATOM 1361 O O . ILE A-2 1 24 . -12.181 26.824 11.682 1 31.49 ? O ILE A-2 4 1 
ATOM 1362 C CB . ILE A-2 1 24 . -10.75 24.394 13.517 1 32.86 ? CB ILE A-2 4 1 
ATOM 1363 C CG1 . ILE A-2 1 24 . -9.255 24.255 13.828 1 34.21 ? CG1 ILE A-2 4 1 
ATOM 1364 C CG2 . ILE A-2 1 24 . -10.942 23.893 12.099 1 34.2 ? CG2 ILE A-2 4 1 
ATOM 1365 C CD1 . ILE A-2 1 24 . -8.88 24.244 15.296 1 33.68 ? CD1 ILE A-2 4 1 
ATOM 1366 N N . TYR A-2 1 25 . -13.605 25.974 13.225 1 32.58 ? N TYR A-2 5 1 
ATOM 1367 C CA . TYR A-2 1 25 . -14.826 26.395 12.524 1 31.73 ? CA TYR A-2 5 1 
ATOM 1368 C C . TYR A-2 1 25 . -14.867 27.909 12.315 1 30.44 ? C TYR A-2 5 1 
ATOM 1369 O O . TYR A-2 1 25 . -15.382 28.391 11.302 1 29.2 ? O TYR A-2 5 1 
ATOM 1370 C CB . TYR A-2 1 25 . -16.088 25.951 13.28 1 34.8 ? CB TYR A-2 5 1 
ATOM 1371 C CG . TYR A-2 1 25 . -16.267 24.453 13.435 1 36.87 ? CG TYR A-2 5 1 
ATOM 1372 C CD1 . TYR A-2 1 25 . -16.184 23.6 12.332 1 38.24 ? CD1 TYR A-2 5 1 
ATOM 1373 C CD2 . TYR A-2 1 25 . -16.531 23.888 14.686 1 37.76 ? CD2 TYR A-2 5 1 
ATOM 1374 C CE1 . TYR A-2 1 25 . -16.35 22.231 12.468 1 38.85 ? CE1 TYR A-2 5 1 
ATOM 1375 C CE2 . TYR A-2 1 25 . -16.703 22.52 14.832 1 39.31 ? CE2 TYR A-2 5 1 
ATOM 1376 C CZ . TYR A-2 1 25 . -16.605 21.695 13.715 1 39.98 ? CZ TYR A-2 5 1 
ATOM 1377 O OH . TYR A-2 1 25 . -16.765 20.332 13.84 1 41.2 ? OH TYR A-2 5 1 
ATOM 1378 N N . GLN A-2 1 26 . -14.323 28.653 13.279 1 29.41 ? N GLN A-2 6 1 
ATOM 1379 C CA . GLN A-2 1 26 . -14.195 30.104 13.163 1 28.7 ? CA GLN A-2 6 1 
ATOM 1380 C C . GLN A-2 1 26 . -13.365 30.487 11.942 1 28.69 ? C GLN A-2 6 1 
ATOM 1381 O O . GLN A-2 1 26 . -13.691 31.451 11.248 1 29.35 ? O GLN A-2 6 1 
ATOM 1382 C CB . GLN A-2 1 26 . -13.607 30.712 14.447 1 29.35 ? CB GLN A-2 6 1 
ATOM 1383 C CG . GLN A-2 1 26 . -14.623 30.847 15.581 1 30.2 ? CG GLN A-2 6 1 
ATOM 1384 C CD . GLN A-2 1 26 . -13.991 31.078 16.945 1 31.73 ? CD GLN A-2 6 1 
ATOM 1385 O OE1 . GLN A-2 1 26 . -12.78 30.915 17.125 1 32.26 ? OE1 GLN A-2 6 1 
ATOM 1386 N NE2 . GLN A-2 1 26 . -14.816 31.458 17.918 1 31.27 ? NE2 GLN A-2 6 1 
ATOM 1387 N N . LYS A-2 1 27 . -12.32 29.707 11.665 1 27.82 ? N LYS A-2 7 1 
ATOM 1388 C CA . LYS A-2 1 27 . -11.452 29.954 10.513 1 27.26 ? CA LYS A-2 7 1 
ATOM 1389 C C . LYS A-2 1 27 . -12.048 29.513 9.171 1 26.8 ? C LYS A-2 7 1 
ATOM 1390 O O . LYS A-2 1 27 . -11.901 30.218 8.175 1 26.55 ? O LYS A-2 7 1 
ATOM 1391 C CB . LYS A-2 1 27 . -10.072 29.325 10.733 1 28.56 ? CB LYS A-2 7 1 
ATOM 1392 C CG . LYS A-2 1 27 . -9.18 30.146 11.649 1 29.48 ? CG LYS A-2 7 1 
ATOM 1393 C CD . LYS A-2 1 27 . -8.024 29.329 12.201 1 31.72 ? CD LYS A-2 7 1 
ATOM 1394 C CE . LYS A-2 1 27 . -7.186 30.156 13.173 1 32.67 ? CE LYS A-2 7 1 
ATOM 1395 N NZ . LYS A-2 1 27 . -6.056 29.378 13.763 1 33.56 ? NZ LYS A-2 7 1 
ATOM 1396 N N . ALA A-2 1 28 . -12.717 28.359 9.15 1 25.43 ? N ALA A-2 8 1 
ATOM 1397 C CA . ALA A-2 1 28 . -13.331 27.823 7.932 1 24.75 ? CA ALA A-2 8 1 
ATOM 1398 C C . ALA A-2 1 28 . -14.643 28.527 7.557 1 25.42 ? C ALA A-2 8 1 
ATOM 1399 O O . ALA A-2 1 28 . -15.129 28.409 6.421 1 23.42 ? O ALA A-2 8 1 
ATOM 1400 C CB . ALA A-2 1 28 . -13.549 26.324 8.072 1 24.5 ? CB ALA A-2 8 1 
ATOM 1401 N N . LYS A-2 1 29 . -15.187 29.272 8.523 1 26.88 ? N LYS A-2 9 1 
ATOM 1402 C CA . LYS A-2 1 29 . -16.487 29.95 8.439 1 27.79 ? CA LYS A-2 9 1 
ATOM 1403 C C . LYS A-2 1 29 . -16.761 30.69 7.125 1 27.72 ? C LYS A-2 9 1 
ATOM 1404 O O . LYS A-2 1 29 . -17.873 30.615 6.594 1 27.16 ? O LYS A-2 9 1 
ATOM 1405 C CB . LYS A-2 1 29 . -16.614 30.946 9.604 1 30.33 ? CB LYS A-2 9 1 
ATOM 1406 C CG . LYS A-2 1 29 . -18.032 31.21 10.088 1 32.08 ? CG LYS A-2 9 1 
ATOM 1407 C CD . LYS A-2 1 29 . -18.304 30.548 11.435 1 33.34 ? CD LYS A-2 9 1 
ATOM 1408 C CE . LYS A-2 1 29 . -18.856 29.135 11.271 1 33.82 ? CE LYS A-2 9 1 
ATOM 1409 N NZ . LYS A-2 1 29 . -19.043 28.367 12.536 1 31.73 ? NZ LYS A-2 9 1 
ATOM 1410 N N . HIS A-2 1 30 . -15.752 31.401 6.619 1 26.59 ? N HIS A-2 10 1 
ATOM 1411 C CA . HIS A-2 1 30 . -15.918 32.302 5.474 1 26.79 ? CA HIS A-2 10 1 
ATOM 1412 C C . HIS A-2 1 30 . -15.14 31.887 4.214 1 25.03 ? C HIS A-2 10 1 
ATOM 1413 O O . HIS A-2 1 30 . -14.878 32.718 3.329 1 24.31 ? O HIS A-2 10 1 
ATOM 1414 C CB . HIS A-2 1 30 . -15.564 33.751 5.877 1 29.44 ? CB HIS A-2 10 1 
ATOM 1415 C CG . HIS A-2 1 30 . -16.506 34.347 6.881 1 31 ? CG HIS A-2 10 1 
ATOM 1416 N ND1 . HIS A-2 1 30 . -17.848 34.536 6.623 1 31.33 ? ND1 HIS A-2 10 1 
ATOM 1417 C CD2 . HIS A-2 1 30 . -16.301 34.787 8.147 1 31.72 ? CD2 HIS A-2 10 1 
ATOM 1418 C CE1 . HIS A-2 1 30 . -18.428 35.064 7.686 1 32.04 ? CE1 HIS A-2 10 1 
ATOM 1419 N NE2 . HIS A-2 1 30 . -17.512 35.229 8.624 1 31.32 ? NE2 HIS A-2 10 1 
ATOM 1420 N N . ILE A-2 1 31 . -14.784 30.604 4.127 1 22.28 ? N ILE A-2 11 1 
ATOM 1421 C CA . ILE A-2 1 31 . -14.047 30.087 2.973 1 19.31 ? CA ILE A-2 11 1 
ATOM 1422 C C . ILE A-2 1 31 . -14.924 30.115 1.729 1 18.66 ? C ILE A-2 11 1 
ATOM 1423 O O . ILE A-2 1 31 . -16.07 29.688 1.764 1 18.14 ? O ILE A-2 11 1 
ATOM 1424 C CB . ILE A-2 1 31 . -13.546 28.65 3.213 1 18.94 ? CB ILE A-2 11 1 
ATOM 1425 C CG1 . ILE A-2 1 31 . -12.629 28.575 4.448 1 18.66 ? CG1 ILE A-2 11 1 
ATOM 1426 C CG2 . ILE A-2 1 31 . -12.891 28.088 1.953 1 18.45 ? CG2 ILE A-2 11 1 
ATOM 1427 C CD1 . ILE A-2 1 31 . -11.541 29.638 4.54 1 18.49 ? CD1 ILE A-2 11 1 
ATOM 1428 N N . LYS A-2 1 32 . -14.375 30.639 0.643 1 17.82 ? N LYS A-2 12 1 
ATOM 1429 C CA . LYS A-2 1 32 . -15.068 30.69 -0.639 1 17.54 ? CA LYS A-2 12 1 
ATOM 1430 C C . LYS A-2 1 32 . -14.344 29.826 -1.648 1 16.42 ? C LYS A-2 12 1 
ATOM 1431 O O . LYS A-2 1 32 . -14.902 29.444 -2.681 1 15.79 ? O LYS A-2 12 1 
ATOM 1432 C CB . LYS A-2 1 32 . -15.115 32.125 -1.16 1 18.45 ? CB LYS A-2 12 1 
ATOM 1433 C CG . LYS A-2 1 32 . -16.122 33.017 -0.452 1 19.81 ? CG LYS A-2 12 1 
ATOM 1434 C CD . LYS A-2 1 32 . -15.755 34.483 -0.634 1 20.77 ? CD LYS A-2 12 1 
ATOM 1435 C CE . LYS A-2 1 32 . -16.722 35.382 0.116 1 21.62 ? CE LYS A-2 12 1 
ATOM 1436 N NZ . LYS A-2 1 32 . -17.995 35.56 -0.641 1 22.79 ? NZ LYS A-2 12 1 
ATOM 1437 N N . LEU A-2 1 33 . -13.091 29.521 -1.34 1 15.68 ? N LEU A-2 13 1 
ATOM 1438 C CA . LEU A-2 1 33 . -12.253 28.759 -2.248 1 15.06 ? CA LEU A-2 13 1 
ATOM 1439 C C . LEU A-2 1 33 . -11.404 27.784 -1.474 1 14.26 ? C LEU A-2 13 1 
ATOM 1440 O O . LEU A-2 1 33 . -10.768 28.151 -0.483 1 14.01 ? O LEU A-2 13 1 
ATOM 1441 C CB . LEU A-2 1 33 . -11.345 29.682 -3.08 1 15.36 ? CB LEU A-2 13 1 
ATOM 1442 C CG . LEU A-2 1 33 . -10.445 28.987 -4.119 1 15.27 ? CG LEU A-2 13 1 
ATOM 1443 C CD1 . LEU A-2 1 33 . -10.215 29.855 -5.337 1 15.93 ? CD1 LEU A-2 13 1 
ATOM 1444 C CD2 . LEU A-2 1 33 . -9.111 28.582 -3.523 1 15.65 ? CD2 LEU A-2 13 1 
ATOM 1445 N N . PHE A-2 1 34 . -11.381 26.548 -1.962 1 13.55 ? N PHE A-2 14 1 
ATOM 1446 C CA . PHE A-2 1 34 . -10.542 25.509 -1.395 1 13.45 ? CA PHE A-2 14 1 
ATOM 1447 C C . PHE A-2 1 34 . -9.545 25.073 -2.453 1 13.27 ? C PHE A-2 14 1 
ATOM 1448 O O . PHE A-2 1 34 . -9.929 24.557 -3.532 1 12.88 ? O PHE A-2 14 1 
ATOM 1449 C CB . PHE A-2 1 34 . -11.403 24.342 -0.874 1 13.07 ? CB PHE A-2 14 1 
ATOM 1450 C CG . PHE A-2 1 34 . -10.617 23.207 -0.268 1 13.24 ? CG PHE A-2 14 1 
ATOM 1451 C CD1 . PHE A-2 1 34 . -9.538 23.446 0.588 1 13.53 ? CD1 PHE A-2 14 1 
ATOM 1452 C CD2 . PHE A-2 1 34 . -10.987 21.887 -0.516 1 13.04 ? CD2 PHE A-2 14 1 
ATOM 1453 C CE1 . PHE A-2 1 34 . -8.829 22.391 1.154 1 13.44 ? CE1 PHE A-2 14 1 
ATOM 1454 C CE2 . PHE A-2 1 34 . -10.289 20.832 0.051 1 13.33 ? CE2 PHE A-2 14 1 
ATOM 1455 C CZ . PHE A-2 1 34 . -9.208 21.081 0.883 1 13.4 ? CZ PHE A-2 14 1 
ATOM 1456 N N . ALA A-2 1 35 . -8.269 25.308 -2.145 1 13.05 ? N ALA A-2 15 1 
ATOM 1457 C CA . ALA A-2 1 35 . -7.157 24.936 -3.02 1 13.33 ? CA ALA A-2 15 1 
ATOM 1458 C C . ALA A-2 1 35 . -6.328 23.809 -2.419 1 13.72 ? C ALA A-2 15 1 
ATOM 1459 O O . ALA A-2 1 35 . -6.112 23.741 -1.193 1 13.4 ? O ALA A-2 15 1 
ATOM 1460 C CB . ALA A-2 1 35 . -6.281 26.137 -3.317 1 13.07 ? CB ALA A-2 15 1 
ATOM 1461 N N . MET A-2 1 36 . -5.864 22.918 -3.291 1 13.91 ? N MET A-2 16 1 
ATOM 1462 C CA . MET A-2 1 36 . -5.184 21.719 -2.823 1 14.22 ? CA MET A-2 16 1 
ATOM 1463 C C . MET A-2 1 36 . -3.891 21.479 -3.563 1 13.81 ? C MET A-2 16 1 
ATOM 1464 O O . MET A-2 1 36 . -3.808 21.633 -4.783 1 13.75 ? O MET A-2 16 1 
ATOM 1465 C CB . MET A-2 1 36 . -6.067 20.479 -2.99 1 15.07 ? CB MET A-2 16 1 
ATOM 1466 C CG . MET A-2 1 36 . -7.365 20.45 -2.193 1 15.82 ? CG MET A-2 16 1 
ATOM 1467 S SD . MET A-2 1 36 . -8.567 19.387 -3.028 1 16.38 ? SD MET A-2 16 1 
ATOM 1468 C CE . MET A-2 1 36 . -9.234 20.52 -4.257 1 15.94 ? CE MET A-2 16 1 
ATOM 1469 N N . ASP A-2 1 37 . -2.885 21.08 -2.807 1 13.77 ? N ASP A-2 17 1 
ATOM 1470 C CA . ASP A-2 1 37 . -1.729 20.418 -3.374 1 13.6 ? CA ASP A-2 17 1 
ATOM 1471 C C . ASP A-2 1 37 . -2.157 19 -3.763 1 13.13 ? C ASP A-2 17 1 
ATOM 1472 O O . ASP A-2 1 37 . -3.121 18.481 -3.208 1 12.82 ? O ASP A-2 17 1 
ATOM 1473 C CB . ASP A-2 1 37 . -0.623 20.376 -2.334 1 13.99 ? CB ASP A-2 17 1 
ATOM 1474 C CG . ASP A-2 1 37 . 0.604 19.67 -2.828 1 14.53 ? CG ASP A-2 17 1 
ATOM 1475 O OD1 . ASP A-2 1 37 . 1.005 19.888 -4 1 14.23 ? OD1 ASP A-2 17 1 
ATOM 1476 O OD2 . ASP A-2 1 37 . 1.158 18.882 -2.029 1 15.16 ? OD2 ASP A-2 17 1 
ATOM 1477 N N . VAL A-2 1 38 . -1.466 18.38 -4.724 1 13.2 ? N VAL A-2 18 1 
ATOM 1478 C CA . VAL A-2 1 38 . -1.81 17.015 -5.148 1 13.06 ? CA VAL A-2 18 1 
ATOM 1479 C C . VAL A-2 1 38 . -0.985 15.956 -4.413 1 13.37 ? C VAL A-2 18 1 
ATOM 1480 O O . VAL A-2 1 38 . -1.536 15.213 -3.594 1 13.15 ? O VAL A-2 18 1 
ATOM 1481 C CB . VAL A-2 1 38 . -1.719 16.805 -6.675 1 12.96 ? CB VAL A-2 18 1 
ATOM 1482 C CG1 . VAL A-2 1 38 . -1.943 15.34 -7.03 1 12.62 ? CG1 VAL A-2 18 1 
ATOM 1483 C CG2 . VAL A-2 1 38 . -2.739 17.674 -7.386 1 12.87 ? CG2 VAL A-2 18 1 
ATOM 1484 N N . ASP A-2 1 39 . 0.323 15.905 -4.684 1 13.54 ? N ASP A-2 19 1 
ATOM 1485 C CA . ASP A-2 1 39 . 1.163 14.829 -4.16 1 13.96 ? CA ASP A-2 19 1 
ATOM 1486 C C . ASP A-2 1 39 . 1.335 14.91 -2.658 1 13.29 ? C ASP A-2 19 1 
ATOM 1487 O O . ASP A-2 1 39 . 1.835 15.897 -2.143 1 13.13 ? O ASP A-2 19 1 
ATOM 1488 C CB . ASP A-2 1 39 . 2.514 14.819 -4.855 1 14.64 ? CB ASP A-2 19 1 
ATOM 1489 C CG . ASP A-2 1 39 . 2.382 14.724 -6.345 1 15.7 ? CG ASP A-2 19 1 
ATOM 1490 O OD1 . ASP A-2 1 39 . 1.915 13.663 -6.832 1 16.7 ? OD1 ASP A-2 19 1 
ATOM 1491 O OD2 . ASP A-2 1 39 . 2.727 15.713 -7.034 1 16.23 ? OD2 ASP A-2 19 1 
ATOM 1492 N N . GLY A-2 1 40 . 0.903 13.867 -1.962 1 12.97 ? N GLY A-2 20 1 
ATOM 1493 C CA . GLY A-2 1 40 . 0.969 13.822 -0.507 1 12.66 ? CA GLY A-2 20 1 
ATOM 1494 C C . GLY A-2 1 40 . -0.308 14.286 0.182 1 12.81 ? C GLY A-2 20 1 
ATOM 1495 O O . GLY A-2 1 40 . -0.437 14.17 1.413 1 12.52 ? O GLY A-2 20 1 
ATOM 1496 N N . ILE A-2 1 41 . -1.238 14.829 -0.609 1 12.55 ? N ILE A-2 21 1 
ATOM 1497 C CA . ILE A-2 1 41 . -2.522 15.341 -0.112 1 12.77 ? CA ILE A-2 21 1 
ATOM 1498 C C . ILE A-2 1 41 . -3.67 14.561 -0.795 1 13.32 ? C ILE A-2 21 1 
ATOM 1499 O O . ILE A-2 1 41 . -4.392 13.781 -0.153 1 13.31 ? O ILE A-2 21 1 
ATOM 1500 C CB . ILE A-2 1 41 . -2.662 16.88 -0.363 1 12.7 ? CB ILE A-2 21 1 
ATOM 1501 C CG1 . ILE A-2 1 41 . -1.583 17.674 0.375 1 12.18 ? CG1 ILE A-2 21 1 
ATOM 1502 C CG2 . ILE A-2 1 41 . -4.043 17.399 0.034 1 12.39 ? CG2 ILE A-2 21 1 
ATOM 1503 C CD1 . ILE A-2 1 41 . -1.598 17.504 1.88 1 12.06 ? CD1 ILE A-2 21 1 
ATOM 1504 N N . LEU A-2 1 42 . -3.813 14.764 -2.101 1 13 ? N LEU A-2 22 1 
ATOM 1505 C CA . LEU A-2 1 42 . -4.767 14.015 -2.891 1 13.22 ? CA LEU A-2 22 1 
ATOM 1506 C C . LEU A-2 1 42 . -4.274 12.599 -3.194 1 14.15 ? C LEU A-2 22 1 
ATOM 1507 O O . LEU A-2 1 42 . -5.081 11.702 -3.423 1 14.6 ? O LEU A-2 22 1 
ATOM 1508 C CB . LEU A-2 1 42 . -5.094 14.774 -4.171 1 12.5 ? CB LEU A-2 22 1 
ATOM 1509 C CG . LEU A-2 1 42 . -6.04 15.964 -3.957 1 12.24 ? CG LEU A-2 22 1 
ATOM 1510 C CD1 . LEU A-2 1 42 . -6.181 16.789 -5.224 1 12.28 ? CD1 LEU A-2 22 1 
ATOM 1511 C CD2 . LEU A-2 1 42 . -7.412 15.526 -3.461 1 12.07 ? CD2 LEU A-2 22 1 
ATOM 1512 N N . SER A-2 1 43 . -2.953 12.403 -3.215 1 15 ? N SER A-2 23 1 
ATOM 1513 C CA . SER A-2 1 43 . -2.365 11.057 -3.287 1 15.51 ? CA SER A-2 23 1 
ATOM 1514 C C . SER A-2 1 43 . -1.607 10.824 -1.998 1 15.8 ? C SER A-2 23 1 
ATOM 1515 O O . SER A-2 1 43 . -1.477 11.748 -1.194 1 16.03 ? O SER A-2 23 1 
ATOM 1516 C CB . SER A-2 1 43 . -1.423 10.92 -4.485 1 15.48 ? CB SER A-2 23 1 
ATOM 1517 O OG . SER A-2 1 43 . -0.267 11.733 -4.33 1 16.16 ? OG SER A-2 23 1 
ATOM 1518 N N . ASP A-2 1 44 . -1.084 9.613 -1.806 1 16.28 ? N ASP A-2 24 1 
ATOM 1519 C CA . ASP A-2 1 44 . -0.236 9.316 -0.637 1 15.96 ? CA ASP A-2 24 1 
ATOM 1520 C C . ASP A-2 1 44 . 1.25 9.598 -0.869 1 15.36 ? C ASP A-2 24 1 
ATOM 1521 O O . ASP A-2 1 44 . 2.095 9.205 -0.058 1 15.54 ? O ASP A-2 24 1 
ATOM 1522 C CB . ASP A-2 1 44 . -0.436 7.875 -0.158 1 16.63 ? CB ASP A-2 24 1 
ATOM 1523 C CG . ASP A-2 1 44 . 0.128 6.848 -1.125 1 17.53 ? CG ASP A-2 24 1 
ATOM 1524 O OD1 . ASP A-2 1 44 . 0.424 7.193 -2.298 1 17.63 ? OD1 ASP A-2 24 1 
ATOM 1525 O OD2 . ASP A-2 1 44 . 0.279 5.684 -0.696 1 18.16 ? OD2 ASP A-2 24 1 
ATOM 1526 N N . GLY A-2 1 45 . 1.567 10.285 -1.965 1 14.56 ? N GLY A-2 25 1 
ATOM 1527 C CA . GLY A-2 1 45 . 2.934 10.74 -2.221 1 13.96 ? CA GLY A-2 25 1 
ATOM 1528 C C . GLY A-2 1 45 . 3.731 9.823 -3.135 1 13.86 ? C GLY A-2 25 1 
ATOM 1529 O O . GLY A-2 1 45 . 4.854 10.134 -3.52 1 13.94 ? O GLY A-2 25 1 
ATOM 1530 N N . GLN A-2 1 46 . 3.162 8.683 -3.491 1 13.74 ? N GLN A-2 26 1 
ATOM 1531 C CA . GLN A-2 1 46 . 3.84 7.81 -4.426 1 13.8 ? CA GLN A-2 26 1 
ATOM 1532 C C . GLN A-2 1 46 . 3.922 8.447 -5.8 1 13.48 ? C GLN A-2 26 1 
ATOM 1533 O O . GLN A-2 1 46 . 2.937 8.986 -6.292 1 12.96 ? O GLN A-2 26 1 
ATOM 1534 C CB . GLN A-2 1 46 . 3.192 6.426 -4.474 1 14.55 ? CB GLN A-2 26 1 
ATOM 1535 C CG . GLN A-2 1 46 . 3.604 5.558 -3.3 1 15.53 ? CG GLN A-2 26 1 
ATOM 1536 C CD . GLN A-2 1 46 . 2.923 4.209 -3.306 1 16.79 ? CD GLN A-2 26 1 
ATOM 1537 O OE1 . GLN A-2 1 46 . 2.991 3.47 -4.281 1 17.39 ? OE1 GLN A-2 26 1 
ATOM 1538 N NE2 . GLN A-2 1 46 . 2.264 3.876 -2.207 1 17.7 ? NE2 GLN A-2 26 1 
ATOM 1539 N N . ILE A-2 1 47 . 5.126 8.426 -6.372 1 13.66 ? N ILE A-2 27 1 
ATOM 1540 C CA . ILE A-2 1 47 . 5.369 8.789 -7.773 1 13.9 ? CA ILE A-2 27 1 
ATOM 1541 C C . ILE A-2 1 47 . 5.781 7.502 -8.498 1 13.96 ? C ILE A-2 27 1 
ATOM 1542 O O . ILE A-2 1 47 . 6.803 6.871 -8.16 1 13.85 ? O ILE A-2 27 1 
ATOM 1543 C CB . ILE A-2 1 47 . 6.5 9.847 -7.932 1 13.92 ? CB ILE A-2 27 1 
ATOM 1544 C CG1 . ILE A-2 1 47 . 6.33 11.048 -6.972 1 13.73 ? CG1 ILE A-2 27 1 
ATOM 1545 C CG2 . ILE A-2 1 47 . 6.64 10.282 -9.39 1 13.82 ? CG2 ILE A-2 27 1 
ATOM 1546 C CD1 . ILE A-2 1 47 . 5.107 11.904 -7.213 1 13.61 ? CD1 ILE A-2 27 1 
ATOM 1547 N N . ILE A-2 1 48 . 4.979 7.122 -9.492 1 14.18 ? N ILE A-2 28 1 
ATOM 1548 C CA . ILE A-2 1 48 . 5 5.775 -10.048 1 13.98 ? CA ILE A-2 28 1 
ATOM 1549 C C . ILE A-2 1 48 . 5.279 5.803 -11.557 1 14.34 ? C ILE A-2 28 1 
ATOM 1550 O O . ILE A-2 1 48 . 4.535 6.411 -12.324 1 14.2 ? O ILE A-2 28 1 
ATOM 1551 C CB . ILE A-2 1 48 . 3.654 5.067 -9.778 1 13.96 ? CB ILE A-2 28 1 
ATOM 1552 C CG1 . ILE A-2 1 48 . 3.271 5.102 -8.287 1 13.75 ? CG1 ILE A-2 28 1 
ATOM 1553 C CG2 . ILE A-2 1 48 . 3.672 3.629 -10.278 1 13.87 ? CG2 ILE A-2 28 1 
ATOM 1554 C CD1 . ILE A-2 1 48 . 1.788 4.895 -8.041 1 12.91 ? CD1 ILE A-2 28 1 
ATOM 1555 N N . TYR A-2 1 49 . 6.35 5.126 -11.967 1 14.66 ? N TYR A-2 29 1 
ATOM 1556 C CA . TYR A-2 1 49 . 6.756 5.05 -13.376 1 14.52 ? CA TYR A-2 29 1 
ATOM 1557 C C . TYR A-2 1 49 . 6.781 3.606 -13.854 1 15.21 ? C TYR A-2 29 1 
ATOM 1558 O O . TYR A-2 1 49 . 7.004 2.686 -13.061 1 15.22 ? O TYR A-2 29 1 
ATOM 1559 C CB . TYR A-2 1 49 . 8.159 5.64 -13.575 1 14.22 ? CB TYR A-2 29 1 
ATOM 1560 C CG . TYR A-2 1 49 . 8.304 7.107 -13.247 1 13.91 ? CG TYR A-2 29 1 
ATOM 1561 C CD1 . TYR A-2 1 49 . 7.318 8.021 -13.617 1 14.34 ? CD1 TYR A-2 29 1 
ATOM 1562 C CD2 . TYR A-2 1 49 . 9.437 7.589 -12.597 1 13.73 ? CD2 TYR A-2 29 1 
ATOM 1563 C CE1 . TYR A-2 1 49 . 7.442 9.369 -13.325 1 14.14 ? CE1 TYR A-2 29 1 
ATOM 1564 C CE2 . TYR A-2 1 49 . 9.574 8.943 -12.303 1 13.66 ? CE2 TYR A-2 29 1 
ATOM 1565 C CZ . TYR A-2 1 49 . 8.57 9.825 -12.675 1 13.83 ? CZ TYR A-2 29 1 
ATOM 1566 O OH . TYR A-2 1 49 . 8.659 11.172 -12.409 1 13.82 ? OH TYR A-2 29 1 
ATOM 1567 N N . ASN A-2 1 50 . 6.566 3.399 -15.152 1 15.48 ? N ASN A-2 30 1 
ATOM 1568 C CA . ASN A-2 1 50 . 6.726 2.067 -15.705 1 15.71 ? CA ASN A-2 30 1 
ATOM 1569 C C . ASN A-2 1 50 . 7.658 2 -16.916 1 15.84 ? C ASN A-2 30 1 
ATOM 1570 O O . ASN A-2 1 50 . 8.084 3.037 -17.441 1 16.41 ? O ASN A-2 30 1 
ATOM 1571 C CB . ASN A-2 1 50 . 5.372 1.364 -15.916 1 15.37 ? CB ASN A-2 30 1 
ATOM 1572 C CG . ASN A-2 1 50 . 4.67 1.771 -17.196 1 15.88 ? CG ASN A-2 30 1 
ATOM 1573 O OD1 . ASN A-2 1 50 . 5.296 2.163 -18.186 1 15.52 ? OD1 ASN A-2 30 1 
ATOM 1574 N ND2 . ASN A-2 1 50 . 3.347 1.625 -17.195 1 15.99 ? ND2 ASN A-2 30 1 
ATOM 1575 N N . SER A-2 1 51 . 7.953 0.779 -17.359 1 16.07 ? N SER A-2 31 1 
ATOM 1576 C CA . SER A-2 1 51 . 9.006 0.537 -18.348 1 16.82 ? CA SER A-2 31 1 
ATOM 1577 C C . SER A-2 1 51 . 8.654 0.99 -19.752 1 17.87 ? C SER A-2 31 1 
ATOM 1578 O O . SER A-2 1 51 . 9.501 0.955 -20.633 1 17.94 ? O SER A-2 31 1 
ATOM 1579 C CB . SER A-2 1 51 . 9.422 -0.939 -18.369 1 16.29 ? CB SER A-2 31 1 
ATOM 1580 O OG . SER A-2 1 51 . 8.357 -1.785 -18.771 1 15.66 ? OG SER A-2 31 1 
ATOM 1581 N N . GLU A-2 1 52 . 7.407 1.411 -19.95 1 20.05 ? N GLU A-2 32 1 
ATOM 1582 C CA . GLU A-2 1 52 . 6.947 1.959 -21.231 1 21.43 ? CA GLU A-2 32 1 
ATOM 1583 C C . GLU A-2 1 52 . 6.931 3.483 -21.209 1 20.94 ? C GLU A-2 32 1 
ATOM 1584 O O . GLU A-2 1 52 . 6.474 4.115 -22.159 1 20.78 ? O GLU A-2 32 1 
ATOM 1585 C CB . GLU A-2 1 52 . 5.55 1.426 -21.575 1 23.92 ? CB GLU A-2 32 1 
ATOM 1586 C CG . GLU A-2 1 52 . 5.52 -0.057 -21.931 1 27.66 ? CG GLU A-2 32 1 
ATOM 1587 C CD . GLU A-2 1 52 . 4.186 -0.51 -22.505 1 30.86 ? CD GLU A-2 32 1 
ATOM 1588 O OE1 . GLU A-2 1 52 . 3.143 -0.353 -21.832 1 32.19 ? OE1 GLU A-2 32 1 
ATOM 1589 O OE2 . GLU A-2 1 52 . 4.183 -1.041 -23.637 1 33.9 ? OE2 GLU A-2 32 1 
ATOM 1590 N N . GLY A-2 1 53 . 7.429 4.069 -20.12 1 20.41 ? N GLY A-2 33 1 
ATOM 1591 C CA . GLY A-2 1 53 . 7.487 5.527 -19.974 1 18.51 ? CA GLY A-2 33 1 
ATOM 1592 C C . GLY A-2 1 53 . 6.218 6.128 -19.383 1 17.72 ? C GLY A-2 33 1 
ATOM 1593 O O . GLY A-2 1 53 . 6.03 7.344 -19.401 1 17.2 ? O GLY A-2 33 1 
ATOM 1594 N N . THR A-2 1 54 . 5.355 5.278 -18.845 1 16.94 ? N THR A-2 34 1 
ATOM 1595 C CA . THR A-2 1 54 . 4.042 5.704 -18.367 1 16.76 ? CA THR A-2 34 1 
ATOM 1596 C C . THR A-2 1 54 . 4.062 6.026 -16.871 1 16.02 ? C THR A-2 34 1 
ATOM 1597 O O . THR A-2 1 54 . 4.688 5.303 -16.088 1 15.53 ? O THR A-2 34 1 
ATOM 1598 C CB . THR A-2 1 54 . 2.998 4.622 -18.687 1 17 ? CB THR A-2 34 1 
ATOM 1599 O OG1 . THR A-2 1 54 . 2.917 4.455 -20.106 1 18.34 ? OG1 THR A-2 34 1 
ATOM 1600 C CG2 . THR A-2 1 54 . 1.641 5.001 -18.173 1 17.36 ? CG2 THR A-2 34 1 
ATOM 1601 N N . GLU A-2 1 55 . 3.376 7.103 -16.485 1 15.18 ? N GLU A-2 35 1 
ATOM 1602 C CA . GLU A-2 1 55 . 3.304 7.53 -15.077 1 14.56 ? CA GLU A-2 35 1 
ATOM 1603 C C . GLU A-2 1 55 . 1.936 7.24 -14.487 1 13.96 ? C GLU A-2 35 1 
ATOM 1604 O O . GLU A-2 1 55 . 0.928 7.333 -15.184 1 13.87 ? O GLU A-2 35 1 
ATOM 1605 C CB . GLU A-2 1 55 . 3.609 9.035 -14.918 1 14.67 ? CB GLU A-2 35 1 
ATOM 1606 C CG . GLU A-2 1 55 . 3.556 9.508 -13.46 1 15.31 ? CG GLU A-2 35 1 
ATOM 1607 C CD . GLU A-2 1 55 . 3.939 10.968 -13.241 1 15.89 ? CD GLU A-2 35 1 
ATOM 1608 O OE1 . GLU A-2 1 55 . 4.153 11.701 -14.227 1 16.64 ? OE1 GLU A-2 35 1 
ATOM 1609 O OE2 . GLU A-2 1 55 . 4.039 11.386 -12.065 1 16.37 ? OE2 GLU A-2 35 1 
ATOM 1610 N N . THR A-2 1 56 . 1.914 6.929 -13.194 1 13.21 ? N THR A-2 36 1 
ATOM 1611 C CA . THR A-2 1 56 . 0.695 6.56 -12.494 1 12.8 ? CA THR A-2 36 1 
ATOM 1612 C C . THR A-2 1 56 . 0.558 7.377 -11.201 1 12.78 ? C THR A-2 36 1 
ATOM 1613 O O . THR A-2 1 56 . 1.561 7.691 -10.537 1 13.06 ? O THR A-2 36 1 
ATOM 1614 C CB . THR A-2 1 56 . 0.675 5.032 -12.232 1 12.69 ? CB THR A-2 36 1 
ATOM 1615 O OG1 . THR A-2 1 56 . 0.562 4.339 -13.486 1 12.08 ? OG1 THR A-2 36 1 
ATOM 1616 C CG2 . THR A-2 1 56 . -0.477 4.592 -11.308 1 12.34 ? CG2 THR A-2 36 1 
ATOM 1617 N N . LYS A-2 1 57 . -0.679 7.739 -10.864 1 12.32 ? N LYS A-2 37 1 
ATOM 1618 C CA . LYS A-2 1 57 . -0.975 8.36 -9.576 1 12.51 ? CA LYS A-2 37 1 
ATOM 1619 C C . LYS A-2 1 57 . -2.292 7.803 -9.02 1 12.24 ? C LYS A-2 37 1 
ATOM 1620 O O . LYS A-2 1 57 . -3.248 7.551 -9.77 1 12.04 ? O LYS A-2 37 1 
ATOM 1621 C CB . LYS A-2 1 57 . -1.034 9.89 -9.691 1 12.69 ? CB LYS A-2 37 1 
ATOM 1622 C CG . LYS A-2 1 57 . -0.516 10.616 -8.454 1 13.12 ? CG LYS A-2 37 1 
ATOM 1623 C CD . LYS A-2 1 57 . -0.646 12.13 -8.583 1 13.42 ? CD LYS A-2 37 1 
ATOM 1624 C CE . LYS A-2 1 57 . 0.192 12.684 -9.736 1 13.51 ? CE LYS A-2 37 1 
ATOM 1625 N NZ . LYS A-2 1 57 . 1.649 12.569 -9.468 1 13.62 ? NZ LYS A-2 37 1 
ATOM 1626 N N . ALA A-2 1 58 . -2.327 7.597 -7.709 1 11.72 ? N ALA A-2 38 1 
ATOM 1627 C CA . ALA A-2 1 58 . -3.494 7.023 -7.058 1 11.68 ? CA ALA A-2 38 1 
ATOM 1628 C C . ALA A-2 1 58 . -4.208 8.066 -6.201 1 11.97 ? C ALA A-2 38 1 
ATOM 1629 O O . ALA A-2 1 58 . -3.581 8.783 -5.416 1 11.94 ? O ALA A-2 38 1 
ATOM 1630 C CB . ALA A-2 1 58 . -3.087 5.827 -6.211 1 11.78 ? CB ALA A-2 38 1 
ATOM 1631 N N . PHE A-2 1 59 . -5.526 8.139 -6.358 1 12.23 ? N PHE A-2 39 1 
ATOM 1632 C CA . PHE A-2 1 59 . -6.364 9.038 -5.571 1 12.42 ? CA PHE A-2 39 1 
ATOM 1633 C C . PHE A-2 1 59 . -7.274 8.218 -4.646 1 12.63 ? C PHE A-2 39 1 
ATOM 1634 O O . PHE A-2 1 59 . -7.303 6.995 -4.743 1 12.86 ? O PHE A-2 39 1 
ATOM 1635 C CB . PHE A-2 1 59 . -7.183 9.952 -6.498 1 12.17 ? CB PHE A-2 39 1 
ATOM 1636 C CG . PHE A-2 1 59 . -6.348 10.763 -7.456 1 12.08 ? CG PHE A-2 39 1 
ATOM 1637 C CD1 . PHE A-2 1 59 . -5.778 11.981 -7.06 1 12.27 ? CD1 PHE A-2 39 1 
ATOM 1638 C CD2 . PHE A-2 1 59 . -6.136 10.322 -8.761 1 12.15 ? CD2 PHE A-2 39 1 
ATOM 1639 C CE1 . PHE A-2 1 59 . -5.002 12.727 -7.944 1 12.03 ? CE1 PHE A-2 39 1 
ATOM 1640 C CE2 . PHE A-2 1 59 . -5.368 11.066 -9.655 1 11.99 ? CE2 PHE A-2 39 1 
ATOM 1641 C CZ . PHE A-2 1 59 . -4.798 12.265 -9.243 1 12.29 ? CZ PHE A-2 39 1 
ATOM 1642 N N . TYR A-2 1 60 . -8.012 8.892 -3.76 1 12.96 ? N TYR A-2 40 1 
ATOM 1643 C CA . TYR A-2 1 60 . -8.918 8.231 -2.825 1 13.11 ? CA TYR A-2 40 1 
ATOM 1644 C C . TYR A-2 1 60 . -10.374 8.568 -3.094 1 13.31 ? C TYR A-2 40 1 
ATOM 1645 O O . TYR A-2 1 60 . -10.749 9.745 -3.163 1 12.95 ? O TYR A-2 40 1 
ATOM 1646 C CB . TYR A-2 1 60 . -8.568 8.637 -1.406 1 13.32 ? CB TYR A-2 40 1 
ATOM 1647 C CG . TYR A-2 1 60 . -9.251 7.86 -0.311 1 13.32 ? CG TYR A-2 40 1 
ATOM 1648 C CD1 . TYR A-2 1 60 . -9.298 6.463 -0.326 1 13.57 ? CD1 TYR A-2 40 1 
ATOM 1649 C CD2 . TYR A-2 1 60 . -9.794 8.523 0.78 1 13.67 ? CD2 TYR A-2 40 1 
ATOM 1650 C CE1 . TYR A-2 1 60 . -9.895 5.752 0.711 1 13.81 ? CE1 TYR A-2 40 1 
ATOM 1651 C CE2 . TYR A-2 1 60 . -10.39 7.826 1.825 1 13.85 ? CE2 TYR A-2 40 1 
ATOM 1652 C CZ . TYR A-2 1 60 . -10.437 6.444 1.789 1 14.18 ? CZ TYR A-2 40 1 
ATOM 1653 O OH . TYR A-2 1 60 . -11.029 5.768 2.84 1 14.5 ? OH TYR A-2 40 1 
ATOM 1654 N N . VAL A-2 1 61 . -11.185 7.516 -3.208 1 13.63 ? N VAL A-2 41 1 
ATOM 1655 C CA . VAL A-2 1 61 . -12.621 7.603 -3.555 1 13.92 ? CA VAL A-2 41 1 
ATOM 1656 C C . VAL A-2 1 61 . -13.479 8.479 -2.601 1 14.26 ? C VAL A-2 41 1 
ATOM 1657 O O . VAL A-2 1 61 . -14.367 9.21 -3.049 1 14.57 ? O VAL A-2 41 1 
ATOM 1658 C CB . VAL A-2 1 61 . -13.236 6.178 -3.734 1 13.31 ? CB VAL A-2 41 1 
ATOM 1659 C CG1 . VAL A-2 1 61 . -13.415 5.46 -2.4 1 13.13 ? CG1 VAL A-2 41 1 
ATOM 1660 C CG2 . VAL A-2 1 61 . -14.56 6.25 -4.47 1 13.58 ? CG2 VAL A-2 41 1 
ATOM 1661 N N . GLN A-2 1 62 . -13.205 8.421 -1.303 1 14.41 ? N GLN A-2 42 1 
ATOM 1662 C CA . GLN A-2 1 62 . -13.968 9.225 -0.337 1 15.2 ? CA GLN A-2 42 1 
ATOM 1663 C C . GLN A-2 1 62 . -13.638 10.719 -0.406 1 14.9 ? C GLN A-2 42 1 
ATOM 1664 O O . GLN A-2 1 62 . -14.459 11.559 -0.026 1 15.14 ? O GLN A-2 42 1 
ATOM 1665 C CB . GLN A-2 1 62 . -13.775 8.699 1.073 1 15.38 ? CB GLN A-2 42 1 
ATOM 1666 C CG . GLN A-2 1 62 . -14.19 7.249 1.23 1 16.73 ? CG GLN A-2 42 1 
ATOM 1667 C CD . GLN A-2 1 62 . -14.446 6.878 2.672 1 17.67 ? CD GLN A-2 42 1 
ATOM 1668 O OE1 . GLN A-2 1 62 . -14.299 7.713 3.567 1 18.87 ? OE1 GLN A-2 42 1 
ATOM 1669 N NE2 . GLN A-2 1 62 . -14.829 5.618 2.913 1 17.95 ? NE2 GLN A-2 42 1 
ATOM 1670 N N . ASP A-2 1 63 . -12.445 11.043 -0.904 1 14.54 ? N ASP A-2 43 1 
ATOM 1671 C CA . ASP A-2 1 63 . -12.059 12.439 -1.143 1 14.12 ? CA ASP A-2 43 1 
ATOM 1672 C C . ASP A-2 1 63 . -12.913 13.054 -2.229 1 14.45 ? C ASP A-2 43 1 
ATOM 1673 O O . ASP A-2 1 63 . -13.34 14.209 -2.115 1 15.18 ? O ASP A-2 43 1 
ATOM 1674 C CB . ASP A-2 1 63 . -10.575 12.544 -1.496 1 13.46 ? CB ASP A-2 43 1 
ATOM 1675 C CG . ASP A-2 1 63 . -9.681 12.211 -0.32 1 13.42 ? CG ASP A-2 43 1 
ATOM 1676 O OD1 . ASP A-2 1 63 . -10.134 12.369 0.843 1 13.27 ? OD1 ASP A-2 43 1 
ATOM 1677 O OD2 . ASP A-2 1 63 . -8.526 11.814 -0.55 1 12.83 ? OD2 ASP A-2 43 1 
ATOM 1678 N N . GLY A-2 1 64 . -13.189 12.272 -3.266 1 14.57 ? N GLY A-2 44 1 
ATOM 1679 C CA . GLY A-2 1 64 . -13.991 12.741 -4.394 1 15.16 ? CA GLY A-2 44 1 
ATOM 1680 C C . GLY A-2 1 64 . -15.383 13.173 -3.974 1 15.39 ? C GLY A-2 44 1 
ATOM 1681 O O . GLY A-2 1 64 . -15.899 14.196 -4.429 1 15.57 ? O GLY A-2 44 1 
ATOM 1682 N N . LEU A-2 1 65 . -15.988 12.389 -3.092 1 14.9 ? N LEU A-2 45 1 
ATOM 1683 C CA . LEU A-2 1 65 . -17.347 12.642 -2.682 1 14.95 ? CA LEU A-2 45 1 
ATOM 1684 C C . LEU A-2 1 65 . -17.39 13.844 -1.738 1 14.55 ? C LEU A-2 45 1 
ATOM 1685 O O . LEU A-2 1 65 . -18.317 14.654 -1.794 1 14.46 ? O LEU A-2 45 1 
ATOM 1686 C CB . LEU A-2 1 65 . -17.951 11.376 -2.072 1 14.9 ? CB LEU A-2 45 1 
ATOM 1687 C CG . LEU A-2 1 65 . -19.466 11.201 -1.905 1 15.72 ? CG LEU A-2 45 1 
ATOM 1688 C CD1 . LEU A-2 1 65 . -19.861 11.282 -0.435 1 15.61 ? CD1 LEU A-2 45 1 
ATOM 1689 C CD2 . LEU A-2 1 65 . -20.314 12.135 -2.78 1 15.59 ? CD2 LEU A-2 45 1 
ATOM 1690 N N . GLY A-2 1 66 . -16.37 13.968 -0.894 1 14.54 ? N GLY A-2 46 1 
ATOM 1691 C CA . GLY A-2 1 66 . -16.26 15.107 0.011 1 15.24 ? CA GLY A-2 46 1 
ATOM 1692 C C . GLY A-2 1 66 . -16.031 16.403 -0.74 1 15.57 ? C GLY A-2 46 1 
ATOM 1693 O O . GLY A-2 1 66 . -16.479 17.463 -0.308 1 14.92 ? O GLY A-2 46 1 
ATOM 1694 N N . LEU A-2 1 67 . -15.339 16.306 -1.876 1 16.24 ? N LEU A-2 47 1 
ATOM 1695 C CA . LEU A-2 1 67 . -15.028 17.478 -2.683 1 16.57 ? CA LEU A-2 47 1 
ATOM 1696 C C . LEU A-2 1 67 . -16.277 17.937 -3.42 1 16.96 ? C LEU A-2 47 1 
ATOM 1697 O O . LEU A-2 1 67 . -16.524 19.133 -3.535 1 16.39 ? O LEU A-2 47 1 
ATOM 1698 C CB . LEU A-2 1 67 . -13.858 17.222 -3.645 1 16.71 ? CB LEU A-2 47 1 
ATOM 1699 C CG . LEU A-2 1 67 . -12.449 17.307 -3.019 1 17.09 ? CG LEU A-2 47 1 
ATOM 1700 C CD1 . LEU A-2 1 67 . -11.379 16.725 -3.933 1 17.08 ? CD1 LEU A-2 47 1 
ATOM 1701 C CD2 . LEU A-2 1 67 . -12.085 18.729 -2.62 1 17.07 ? CD2 LEU A-2 47 1 
ATOM 1702 N N . GLN A-2 1 68 . -17.076 16.989 -3.894 1 17.46 ? N GLN A-2 48 1 
ATOM 1703 C CA . GLN A-2 1 68 . -18.337 17.344 -4.531 1 18.32 ? CA GLN A-2 48 1 
ATOM 1704 C C . GLN A-2 1 68 . -19.306 18.002 -3.546 1 17.41 ? C GLN A-2 48 1 
ATOM 1705 O O . GLN A-2 1 68 . -19.95 18.984 -3.895 1 17.03 ? O GLN A-2 48 1 
ATOM 1706 C CB . GLN A-2 1 68 . -18.965 16.143 -5.237 1 20.46 ? CB GLN A-2 48 1 
ATOM 1707 C CG . GLN A-2 1 68 . -18.406 15.909 -6.635 1 23.55 ? CG GLN A-2 48 1 
ATOM 1708 C CD . GLN A-2 1 68 . -18.592 14.478 -7.105 1 26.39 ? CD GLN A-2 48 1 
ATOM 1709 O OE1 . GLN A-2 1 68 . -18.922 13.59 -6.314 1 28.63 ? OE1 GLN A-2 48 1 
ATOM 1710 N NE2 . GLN A-2 1 68 . -18.365 14.241 -8.386 1 26.87 ? NE2 GLN A-2 48 1 
ATOM 1711 N N . ALA A-2 1 69 . -19.37 17.484 -2.321 1 16.77 ? N ALA A-2 49 1 
ATOM 1712 C CA . ALA A-2 1 69 . -20.152 18.095 -1.246 1 16.78 ? CA ALA A-2 49 1 
ATOM 1713 C C . ALA A-2 1 69 . -19.765 19.557 -1.033 1 16.51 ? C ALA A-2 49 1 
ATOM 1714 O O . ALA A-2 1 69 . -20.607 20.452 -1.147 1 16.17 ? O ALA A-2 49 1 
ATOM 1715 C CB . ALA A-2 1 69 . -19.991 17.311 0.037 1 16.84 ? CB ALA A-2 49 1 
ATOM 1716 N N . LEU A-2 1 70 . -18.493 19.798 -0.733 1 16.84 ? N LEU A-2 50 1 
ATOM 1717 C CA . LEU A-2 1 70 . -17.965 21.157 -0.637 1 16.75 ? CA LEU A-2 50 1 
ATOM 1718 C C . LEU A-2 1 70 . -18.373 21.979 -1.844 1 16.99 ? C LEU A-2 50 1 
ATOM 1719 O O . LEU A-2 1 70 . -18.993 23.03 -1.699 1 16.65 ? O LEU A-2 50 1 
ATOM 1720 C CB . LEU A-2 1 70 . -16.438 21.149 -0.571 1 16.75 ? CB LEU A-2 50 1 
ATOM 1721 C CG . LEU A-2 1 70 . -15.702 21.49 0.715 1 16.49 ? CG LEU A-2 50 1 
ATOM 1722 C CD1 . LEU A-2 1 70 . -14.452 22.265 0.322 1 16.57 ? CD1 LEU A-2 50 1 
ATOM 1723 C CD2 . LEU A-2 1 70 . -16.546 22.298 1.688 1 15.91 ? CD2 LEU A-2 50 1 
ATOM 1724 N N . LYS A-2 1 71 . -18.025 21.478 -3.028 1 17.72 ? N LYS A-2 51 1 
ATOM 1725 C CA . LYS A-2 1 71 . -18.298 22.155 -4.297 1 18.88 ? CA LYS A-2 51 1 
ATOM 1726 C C . LYS A-2 1 71 . -19.782 22.5 -4.435 1 19.43 ? C LYS A-2 51 1 
ATOM 1727 O O . LYS A-2 1 71 . -20.134 23.607 -4.826 1 18.88 ? O LYS A-2 51 1 
ATOM 1728 C CB . LYS A-2 1 71 . -17.822 21.283 -5.456 1 19.27 ? CB LYS A-2 51 1 
ATOM 1729 C CG . LYS A-2 1 71 . -17.951 21.901 -6.845 1 20.27 ? CG LYS A-2 51 1 
ATOM 1730 C CD . LYS A-2 1 71 . -19.239 21.488 -7.528 1 20.75 ? CD LYS A-2 51 1 
ATOM 1731 C CE . LYS A-2 1 71 . -19.151 20.081 -8.109 1 20.99 ? CE LYS A-2 51 1 
ATOM 1732 N NZ . LYS A-2 1 71 . -20.172 19.94 -9.186 1 20.05 ? NZ LYS A-2 51 1 
ATOM 1733 N N . GLN A-2 1 72 . -20.637 21.545 -4.083 1 21.18 ? N GLN A-2 52 1 
ATOM 1734 C CA . GLN A-2 1 72 . -22.091 21.718 -4.113 1 22.4 ? CA GLN A-2 52 1 
ATOM 1735 C C . GLN A-2 1 72 . -22.574 22.866 -3.243 1 22.13 ? C GLN A-2 52 1 
ATOM 1736 O O . GLN A-2 1 72 . -23.58 23.506 -3.558 1 21.46 ? O GLN A-2 52 1 
ATOM 1737 C CB . GLN A-2 1 72 . -22.783 20.462 -3.601 1 24.02 ? CB GLN A-2 52 1 
ATOM 1738 C CG . GLN A-2 1 72 . -22.843 19.314 -4.576 1 27.35 ? CG GLN A-2 52 1 
ATOM 1739 C CD . GLN A-2 1 72 . -23.764 18.22 -4.084 1 29.94 ? CD GLN A-2 52 1 
ATOM 1740 O OE1 . GLN A-2 1 72 . -24.46 18.386 -3.073 1 32.19 ? OE1 GLN A-2 52 1 
ATOM 1741 N NE2 . GLN A-2 1 72 . -23.777 17.093 -4.79 1 30.54 ? NE2 GLN A-2 52 1 
ATOM 1742 N N . SER A-2 1 73 . -21.889 23.086 -2.122 1 21.56 ? N SER A-2 53 1 
ATOM 1743 C CA . SER A-2 1 73 . -22.292 24.124 -1.182 1 20.55 ? CA SER A-2 53 1 
ATOM 1744 C C . SER A-2 1 73 . -21.829 25.49 -1.658 1 20.46 ? C SER A-2 53 1 
ATOM 1745 O O . SER A-2 1 73 . -22.011 26.48 -0.963 1 21.04 ? O SER A-2 53 1 
ATOM 1746 C CB . SER A-2 1 73 . -21.759 23.834 0.219 1 20.26 ? CB SER A-2 53 1 
ATOM 1747 O OG . SER A-2 1 73 . -20.375 24.093 0.287 1 20.5 ? OG SER A-2 53 1 
ATOM 1748 N N . GLY A-2 1 74 . -21.235 25.534 -2.847 1 20.43 ? N GLY A-2 54 1 
ATOM 1749 C CA . GLY A-2 1 74 . -20.819 26.786 -3.461 1 20.23 ? CA GLY A-2 54 1 
ATOM 1750 C C . GLY A-2 1 74 . -19.398 27.211 -3.144 1 20.15 ? C GLY A-2 54 1 
ATOM 1751 O O . GLY A-2 1 74 . -19.104 28.392 -3.09 1 20.96 ? O GLY A-2 54 1 
ATOM 1752 N N . ILE A-2 1 75 . -18.513 26.251 -2.922 1 19.8 ? N ILE A-2 55 1 
ATOM 1753 C CA . ILE A-2 1 75 . -17.102 26.563 -2.764 1 18.63 ? CA ILE A-2 55 1 
ATOM 1754 C C . ILE A-2 1 75 . -16.375 26.183 -4.054 1 18.4 ? C ILE A-2 55 1 
ATOM 1755 O O . ILE A-2 1 75 . -16.672 25.161 -4.673 1 18.17 ? O ILE A-2 55 1 
ATOM 1756 C CB . ILE A-2 1 75 . -16.516 25.933 -1.478 1 18.7 ? CB ILE A-2 55 1 
ATOM 1757 C CG1 . ILE A-2 1 75 . -17.101 26.663 -0.255 1 18.5 ? CG1 ILE A-2 55 1 
ATOM 1758 C CG2 . ILE A-2 1 75 . -14.989 25.993 -1.461 1 18.24 ? CG2 ILE A-2 55 1 
ATOM 1759 C CD1 . ILE A-2 1 75 . -16.927 25.95 1.068 1 18.61 ? CD1 ILE A-2 55 1 
ATOM 1760 N N . ILE A-2 1 76 . -15.478 27.061 -4.486 1 18.04 ? N ILE A-2 56 1 
ATOM 1761 C CA . ILE A-2 1 76 . -14.677 26.846 -5.686 1 17.63 ? CA ILE A-2 56 1 
ATOM 1762 C C . ILE A-2 1 76 . -13.466 25.985 -5.336 1 16.99 ? C ILE A-2 56 1 
ATOM 1763 O O . ILE A-2 1 76 . -12.808 26.198 -4.309 1 16.43 ? O ILE A-2 56 1 
ATOM 1764 C CB . ILE A-2 1 76 . -14.225 28.195 -6.292 1 17.96 ? CB ILE A-2 56 1 
ATOM 1765 C CG1 . ILE A-2 1 76 . -15.458 29.052 -6.623 1 18.29 ? CG1 ILE A-2 56 1 
ATOM 1766 C CG2 . ILE A-2 1 76 . -13.352 27.982 -7.53 1 17.55 ? CG2 ILE A-2 56 1 
ATOM 1767 C CD1 . ILE A-2 1 76 . -15.219 30.545 -6.533 1 19.03 ? CD1 ILE A-2 56 1 
ATOM 1768 N N . LEU A-2 1 77 . -13.194 25.009 -6.198 1 16.23 ? N LEU A-2 57 1 
ATOM 1769 C CA . LEU A-2 1 77 . -12.122 24.054 -5.98 1 15.68 ? CA LEU A-2 57 1 
ATOM 1770 C C . LEU A-2 1 77 . -10.979 24.273 -6.97 1 15.42 ? C LEU A-2 57 1 
ATOM 1771 O O . LEU A-2 1 77 . -11.205 24.468 -8.167 1 14.95 ? O LEU A-2 57 1 
ATOM 1772 C CB . LEU A-2 1 77 . -12.658 22.622 -6.086 1 15.58 ? CB LEU A-2 57 1 
ATOM 1773 C CG . LEU A-2 1 77 . -13.84 22.166 -5.221 1 15.36 ? CG LEU A-2 57 1 
ATOM 1774 C CD1 . LEU A-2 1 77 . -14.106 20.689 -5.481 1 15.71 ? CD1 LEU A-2 57 1 
ATOM 1775 C CD2 . LEU A-2 1 77 . -13.629 22.398 -3.733 1 15.55 ? CD2 LEU A-2 57 1 
ATOM 1776 N N . ALA A-2 1 78 . -9.756 24.233 -6.448 1 15.14 ? N ALA A-2 58 1 
ATOM 1777 C CA . ALA A-2 1 78 . -8.551 24.483 -7.232 1 14.83 ? CA ALA A-2 58 1 
ATOM 1778 C C . ALA A-2 1 78 . -7.441 23.524 -6.849 1 14.71 ? C ALA A-2 58 1 
ATOM 1779 O O . ALA A-2 1 78 . -7.37 23.048 -5.704 1 14.64 ? O ALA A-2 58 1 
ATOM 1780 C CB . ALA A-2 1 78 . -8.077 25.915 -7.051 1 14.86 ? CB ALA A-2 58 1 
ATOM 1781 N N . ILE A-2 1 79 . -6.586 23.241 -7.825 1 14.09 ? N ILE A-2 59 1 
ATOM 1782 C CA . ILE A-2 1 79 . -5.377 22.482 -7.603 1 13.69 ? CA ILE A-2 59 1 
ATOM 1783 C C . ILE A-2 1 79 . -4.163 23.373 -7.883 1 14.01 ? C ILE A-2 59 1 
ATOM 1784 O O . ILE A-2 1 79 . -4.139 24.131 -8.859 1 13.75 ? O ILE A-2 59 1 
ATOM 1785 C CB . ILE A-2 1 79 . -5.362 21.2 -8.468 1 13.4 ? CB ILE A-2 59 1 
ATOM 1786 C CG1 . ILE A-2 1 79 . -6.094 20.059 -7.735 1 13.06 ? CG1 ILE A-2 59 1 
ATOM 1787 C CG2 . ILE A-2 1 79 . -3.94 20.778 -8.798 1 12.97 ? CG2 ILE A-2 59 1 
ATOM 1788 C CD1 . ILE A-2 1 79 . -6.34 18.824 -8.581 1 13.35 ? CD1 ILE A-2 59 1 
ATOM 1789 N N . ILE A-2 1 80 . -3.176 23.312 -6.989 1 14.04 ? N ILE A-2 60 1 
ATOM 1790 C CA . ILE A-2 1 80 . -1.889 23.959 -7.217 1 14.07 ? CA ILE A-2 60 1 
ATOM 1791 C C . ILE A-2 1 80 . -0.794 22.944 -6.904 1 14.34 ? C ILE A-2 60 1 
ATOM 1792 O O . ILE A-2 1 80 . -0.587 22.569 -5.747 1 14.12 ? O ILE A-2 60 1 
ATOM 1793 C CB . ILE A-2 1 80 . -1.711 25.276 -6.41 1 14.01 ? CB ILE A-2 60 1 
ATOM 1794 C CG1 . ILE A-2 1 80 . -2.978 26.148 -6.475 1 14.14 ? CG1 ILE A-2 60 1 
ATOM 1795 C CG2 . ILE A-2 1 80 . -0.514 26.059 -6.95 1 14.07 ? CG2 ILE A-2 60 1 
ATOM 1796 C CD1 . ILE A-2 1 80 . -2.885 27.459 -5.721 1 14.39 ? CD1 ILE A-2 60 1 
ATOM 1797 N N . THR A-2 1 81 . -0.117 22.474 -7.942 1 14.77 ? N THR A-2 61 1 
ATOM 1798 C CA . THR A-2 1 81 . 0.848 21.397 -7.767 1 15.62 ? CA THR A-2 61 1 
ATOM 1799 C C . THR A-2 1 81 . 2.145 21.686 -8.5 1 15.96 ? C THR A-2 61 1 
ATOM 1800 O O . THR A-2 1 81 . 2.15 22.301 -9.574 1 15.86 ? O THR A-2 61 1 
ATOM 1801 C CB . THR A-2 1 81 . 0.287 20.001 -8.157 1 15.79 ? CB THR A-2 61 1 
ATOM 1802 O OG1 . THR A-2 1 81 . 1.318 19.014 -8.016 1 16.99 ? OG1 THR A-2 61 1 
ATOM 1803 C CG2 . THR A-2 1 81 . -0.214 19.965 -9.599 1 16.03 ? CG2 THR A-2 61 1 
ATOM 1804 N N . GLY A-2 1 82 . 3.24 21.253 -7.887 1 16.22 ? N GLY A-2 62 1 
ATOM 1805 C CA . GLY A-2 1 82 . 4.567 21.466 -8.42 1 16.82 ? CA GLY A-2 62 1 
ATOM 1806 C C . GLY A-2 1 82 . 4.829 20.626 -9.642 1 17.26 ? C GLY A-2 62 1 
ATOM 1807 O O . GLY A-2 1 82 . 5.574 21.039 -10.521 1 18.49 ? O GLY A-2 62 1 
ATOM 1808 N N . ARG A-2 1 83 . 4.219 19.447 -9.707 1 17.83 ? N ARG A-2 63 1 
ATOM 1809 C CA . ARG A-2 1 83 . 4.401 18.565 -10.853 1 18.36 ? CA ARG A-2 63 1 
ATOM 1810 C C . ARG A-2 1 83 . 3.313 18.801 -11.886 1 19.33 ? C ARG A-2 63 1 
ATOM 1811 O O . ARG A-2 1 83 . 2.502 19.71 -11.739 1 20.52 ? O ARG A-2 63 1 
ATOM 1812 C CB . ARG A-2 1 83 . 4.458 17.1 -10.411 1 17.96 ? CB ARG A-2 63 1 
ATOM 1813 C CG . ARG A-2 1 83 . 5.759 16.74 -9.696 1 17.91 ? CG ARG A-2 63 1 
ATOM 1814 C CD . ARG A-2 1 83 . 5.741 15.329 -9.123 1 18.01 ? CD ARG A-2 63 1 
ATOM 1815 N NE . ARG A-2 1 83 . 5.688 14.323 -10.185 1 17.34 ? NE ARG A-2 63 1 
ATOM 1816 C CZ . ARG A-2 1 83 . 6.751 13.854 -10.826 1 16.87 ? CZ ARG A-2 63 1 
ATOM 1817 N NH1 . ARG A-2 1 83 . 7.969 14.27 -10.504 1 16.57 ? NH1 ARG A-2 63 1 
ATOM 1818 N NH2 . ARG A-2 1 83 . 6.592 12.952 -11.781 1 16.23 ? NH2 ARG A-2 63 1 
ATOM 1819 N N . SER A-2 1 84 . 3.296 17.991 -12.938 1 19.47 ? N SER A-2 64 1 
ATOM 1820 C CA . SER A-2 1 84 . 2.312 18.162 -14.003 1 19.07 ? CA SER A-2 64 1 
ATOM 1821 C C . SER A-2 1 84 . 1.999 16.846 -14.722 1 18.38 ? C SER A-2 64 1 
ATOM 1822 O O . SER A-2 1 84 . 2.913 16.167 -15.185 1 18.82 ? O SER A-2 64 1 
ATOM 1823 C CB . SER A-2 1 84 . 2.829 19.194 -15.002 1 19.47 ? CB SER A-2 64 1 
ATOM 1824 O OG . SER A-2 1 84 . 2.004 19.211 -16.139 1 20.11 ? OG SER A-2 64 1 
ATOM 1825 N N . SER A-2 1 85 . 0.713 16.498 -14.832 1 17.75 ? N SER A-2 65 1 
ATOM 1826 C CA . SER A-2 1 85 . 0.299 15.238 -15.477 1 17.13 ? CA SER A-2 65 1 
ATOM 1827 C C . SER A-2 1 85 . -1.153 15.229 -15.972 1 16.95 ? C SER A-2 65 1 
ATOM 1828 O O . SER A-2 1 85 . -1.994 15.99 -15.48 1 16.64 ? O SER A-2 65 1 
ATOM 1829 C CB . SER A-2 1 85 . 0.529 14.044 -14.537 1 16.56 ? CB SER A-2 65 1 
ATOM 1830 O OG . SER A-2 1 85 . -0.428 14.014 -13.48 1 15.94 ? OG SER A-2 65 1 
ATOM 1831 N N . ALA A-2 1 86 . -1.443 14.353 -16.939 1 16.55 ? N ALA A-2 66 1 
ATOM 1832 C CA . ALA A-2 1 86 . -2.824 14.139 -17.397 1 16.96 ? CA ALA A-2 66 1 
ATOM 1833 C C . ALA A-2 1 86 . -3.688 13.502 -16.297 1 17.43 ? C ALA A-2 66 1 
ATOM 1834 O O . ALA A-2 1 86 . -4.904 13.663 -16.296 1 17.65 ? O ALA A-2 66 1 
ATOM 1835 C CB . ALA A-2 1 86 . -2.864 13.292 -18.659 1 16.4 ? CB ALA A-2 66 1 
ATOM 1836 N N . MET A-2 1 87 . -3.066 12.795 -15.358 1 17.5 ? N MET A-2 67 1 
ATOM 1837 C CA . MET A-2 1 87 . -3.835 12.182 -14.277 1 18.4 ? CA MET A-2 67 1 
ATOM 1838 C C . MET A-2 1 87 . -4.519 13.235 -13.427 1 18.15 ? C MET A-2 67 1 
ATOM 1839 O O . MET A-2 1 87 . -5.695 13.099 -13.095 1 18.63 ? O MET A-2 67 1 
ATOM 1840 C CB . MET A-2 1 87 . -2.969 11.268 -13.41 1 18.33 ? CB MET A-2 67 1 
ATOM 1841 C CG . MET A-2 1 87 . -2.369 10.105 -14.171 1 19.02 ? CG MET A-2 67 1 
ATOM 1842 S SD . MET A-2 1 87 . -0.836 10.539 -14.998 1 19.97 ? SD MET A-2 67 1 
ATOM 1843 C CE . MET A-2 1 87 . 0.263 10.467 -13.586 1 18.94 ? CE MET A-2 67 1 
ATOM 1844 N N . VAL A-2 1 88 . -3.777 14.283 -13.082 1 18.83 ? N VAL A-2 68 1 
ATOM 1845 C CA . VAL A-2 1 88 . -4.312 15.382 -12.286 1 19.55 ? CA VAL A-2 68 1 
ATOM 1846 C C . VAL A-2 1 88 . -5.487 16.055 -12.991 1 20.71 ? C VAL A-2 68 1 
ATOM 1847 O O . VAL A-2 1 88 . -6.533 16.286 -12.368 1 20.54 ? O VAL A-2 68 1 
ATOM 1848 C CB . VAL A-2 1 88 . -3.225 16.425 -11.964 1 19.61 ? CB VAL A-2 68 1 
ATOM 1849 C CG1 . VAL A-2 1 88 . -3.843 17.696 -11.397 1 19.41 ? CG1 VAL A-2 68 1 
ATOM 1850 C CG2 . VAL A-2 1 88 . -2.192 15.837 -11.007 1 19.06 ? CG2 VAL A-2 68 1 
ATOM 1851 N N . ASP A-2 1 89 . -5.302 16.357 -14.281 1 21.17 ? N ASP A-2 69 1 
ATOM 1852 C CA . ASP A-2 1 89 . -6.331 16.987 -15.107 1 22.32 ? CA ASP A-2 69 1 
ATOM 1853 C C . ASP A-2 1 89 . -7.612 16.158 -15.146 1 21.73 ? C ASP A-2 69 1 
ATOM 1854 O O . ASP A-2 1 89 . -8.716 16.695 -14.982 1 21.9 ? O ASP A-2 69 1 
ATOM 1855 C CB . ASP A-2 1 89 . -5.817 17.217 -16.535 1 23.24 ? CB ASP A-2 69 1 
ATOM 1856 C CG . ASP A-2 1 89 . -5.011 18.498 -16.667 1 24.4 ? CG ASP A-2 69 1 
ATOM 1857 O OD1 . ASP A-2 1 89 . -5.599 19.607 -16.613 1 24.83 ? OD1 ASP A-2 69 1 
ATOM 1858 O OD2 . ASP A-2 1 89 . -3.777 18.401 -16.823 1 25.73 ? OD2 ASP A-2 69 1 
ATOM 1859 N N . ARG A-2 1 90 . -7.45 14.852 -15.35 1 20.4 ? N ARG A-2 70 1 
ATOM 1860 C CA . ARG A-2 1 90 . -8.571 13.928 -15.388 1 19.78 ? CA ARG A-2 70 1 
ATOM 1861 C C . ARG A-2 1 90 . -9.295 13.858 -14.038 1 18.52 ? C ARG A-2 70 1 
ATOM 1862 O O . ARG A-2 1 90 . -10.52 13.973 -13.995 1 18.15 ? O ARG A-2 70 1 
ATOM 1863 C CB . ARG A-2 1 90 . -8.119 12.538 -15.862 1 20.63 ? CB ARG A-2 70 1 
ATOM 1864 C CG . ARG A-2 1 90 . -9.216 11.482 -15.888 1 21.38 ? CG ARG A-2 70 1 
ATOM 1865 C CD . ARG A-2 1 90 . -8.656 10.099 -16.206 1 22.58 ? CD ARG A-2 70 1 
ATOM 1866 N NE . ARG A-2 1 90 . -9.717 9.097 -16.302 1 23.77 ? NE ARG A-2 70 1 
ATOM 1867 C CZ . ARG A-2 1 90 . -9.574 7.851 -16.763 1 24.7 ? CZ ARG A-2 70 1 
ATOM 1868 N NH1 . ARG A-2 1 90 . -8.391 7.394 -17.187 1 24.1 ? NH1 ARG A-2 70 1 
ATOM 1869 N NH2 . ARG A-2 1 90 . -10.636 7.054 -16.796 1 23.65 ? NH2 ARG A-2 70 1 
ATOM 1870 N N . ARG A-2 1 91 . -8.551 13.688 -12.945 1 17.53 ? N ARG A-2 71 1 
ATOM 1871 C CA . ARG A-2 1 91 . -9.168 13.63 -11.632 1 16.72 ? CA ARG A-2 71 1 
ATOM 1872 C C . ARG A-2 1 91 . -9.883 14.938 -11.324 1 17.14 ? C ARG A-2 71 1 
ATOM 1873 O O . ARG A-2 1 91 . -11.01 14.935 -10.824 1 16.74 ? O ARG A-2 71 1 
ATOM 1874 C CB . ARG A-2 1 91 . -8.144 13.3 -10.551 1 16.24 ? CB ARG A-2 71 1 
ATOM 1875 C CG . ARG A-2 1 91 . -8.73 13.113 -9.158 1 16.1 ? CG ARG A-2 71 1 
ATOM 1876 C CD . ARG A-2 1 91 . -9.662 11.906 -9.054 1 16.25 ? CD ARG A-2 71 1 
ATOM 1877 N NE . ARG A-2 1 91 . -10.115 11.66 -7.676 1 16.08 ? NE ARG A-2 71 1 
ATOM 1878 C CZ . ARG A-2 1 91 . -11.146 10.889 -7.323 1 16.47 ? CZ ARG A-2 71 1 
ATOM 1879 N NH1 . ARG A-2 1 91 . -11.881 10.261 -8.237 1 16.45 ? NH1 ARG A-2 71 1 
ATOM 1880 N NH2 . ARG A-2 1 91 . -11.449 10.747 -6.036 1 16.48 ? NH2 ARG A-2 71 1 
ATOM 1881 N N . ALA A-2 1 92 . -9.235 16.056 -11.647 1 17.78 ? N ALA A-2 72 1 
ATOM 1882 C CA . ALA A-2 1 92 . -9.821 17.372 -11.422 1 18.13 ? CA ALA A-2 72 1 
ATOM 1883 C C . ALA A-2 1 92 . -11.123 17.54 -12.213 1 18.69 ? C ALA A-2 72 1 
ATOM 1884 O O . ALA A-2 1 92 . -12.137 17.955 -11.658 1 18.36 ? O ALA A-2 72 1 
ATOM 1885 C CB . ALA A-2 1 92 . -8.825 18.466 -11.776 1 17.69 ? CB ALA A-2 72 1 
ATOM 1886 N N . LYS A-2 1 93 . -11.09 17.197 -13.5 1 19.88 ? N LYS A-2 73 1 
ATOM 1887 C CA . LYS A-2 1 93 . -12.269 17.299 -14.364 1 20.32 ? CA LYS A-2 73 1 
ATOM 1888 C C . LYS A-2 1 93 . -13.497 16.535 -13.863 1 20 ? C LYS A-2 73 1 
ATOM 1889 O O . LYS A-2 1 93 . -14.604 17.071 -13.885 1 20.82 ? O LYS A-2 73 1 
ATOM 1890 C CB . LYS A-2 1 93 . -11.919 16.9 -15.799 1 22.04 ? CB LYS A-2 73 1 
ATOM 1891 C CG . LYS A-2 1 93 . -11.25 18.036 -16.561 1 24.21 ? CG LYS A-2 73 1 
ATOM 1892 C CD . LYS A-2 1 93 . -10.635 17.585 -17.873 1 26.69 ? CD LYS A-2 73 1 
ATOM 1893 C CE . LYS A-2 1 93 . -9.833 18.723 -18.49 1 28.37 ? CE LYS A-2 73 1 
ATOM 1894 N NZ . LYS A-2 1 93 . -9.522 18.466 -19.92 1 30.02 ? NZ LYS A-2 73 1 
ATOM 1895 N N . GLU A-2 1 94 . -13.315 15.306 -13.385 1 18.9 ? N GLU A-2 74 1 
ATOM 1896 C CA . GLU A-2 1 94 . -14.471 14.499 -12.933 1 17.97 ? CA GLU A-2 74 1 
ATOM 1897 C C . GLU A-2 1 94 . -15.087 14.983 -11.615 1 17 ? C GLU A-2 74 1 
ATOM 1898 O O . GLU A-2 1 94 . -16.26 14.722 -11.34 1 16.98 ? O GLU A-2 74 1 
ATOM 1899 C CB . GLU A-2 1 94 . -14.107 13.009 -12.842 1 18.21 ? CB GLU A-2 74 1 
ATOM 1900 C CG . GLU A-2 1 94 . -13.251 12.657 -11.637 1 17.42 ? CG GLU A-2 74 1 
ATOM 1901 C CD . GLU A-2 1 94 . -12.847 11.204 -11.59 1 17.32 ? CD GLU A-2 74 1 
ATOM 1902 O OE1 . GLU A-2 1 94 . -13.614 10.347 -12.059 1 17.27 ? OE1 GLU A-2 74 1 
ATOM 1903 O OE2 . GLU A-2 1 94 . -11.76 10.918 -11.047 1 17.13 ? OE2 GLU A-2 74 1 
ATOM 1904 N N . LEU A-2 1 95 . -14.302 15.677 -10.796 1 16.3 ? N LEU A-2 75 1 
ATOM 1905 C CA . LEU A-2 1 95 . -14.807 16.194 -9.521 1 15.89 ? CA LEU A-2 75 1 
ATOM 1906 C C . LEU A-2 1 95 . -15.233 17.66 -9.615 1 15.82 ? C LEU A-2 75 1 
ATOM 1907 O O . LEU A-2 1 95 . -15.795 18.213 -8.666 1 15.61 ? O LEU A-2 75 1 
ATOM 1908 C CB . LEU A-2 1 95 . -13.762 16.004 -8.407 1 15.63 ? CB LEU A-2 75 1 
ATOM 1909 C CG . LEU A-2 1 95 . -13.334 14.556 -8.13 1 15.53 ? CG LEU A-2 75 1 
ATOM 1910 C CD1 . LEU A-2 1 95 . -12.212 14.503 -7.104 1 15.56 ? CD1 LEU A-2 75 1 
ATOM 1911 C CD2 . LEU A-2 1 95 . -14.516 13.712 -7.67 1 15.59 ? CD2 LEU A-2 75 1 
ATOM 1912 N N . GLY A-2 1 96 . -14.955 18.289 -10.757 1 15.49 ? N GLY A-2 76 1 
ATOM 1913 C CA . GLY A-2 1 96 . -15.222 19.71 -10.925 1 15.56 ? CA GLY A-2 76 1 
ATOM 1914 C C . GLY A-2 1 96 . -14.309 20.585 -10.074 1 15.67 ? C GLY A-2 76 1 
ATOM 1915 O O . GLY A-2 1 96 . -14.749 21.601 -9.514 1 15.34 ? O GLY A-2 76 1 
ATOM 1916 N N . ILE A-2 1 97 . -13.044 20.179 -9.952 1 15.16 ? N ILE A-2 77 1 
ATOM 1917 C CA . ILE A-2 1 97 . -11.995 21.087 -9.499 1 15.1 ? CA ILE A-2 77 1 
ATOM 1918 C C . ILE A-2 1 97 . -11.718 21.961 -10.71 1 15.34 ? C ILE A-2 77 1 
ATOM 1919 O O . ILE A-2 1 97 . -11.237 21.467 -11.731 1 15.63 ? O ILE A-2 77 1 
ATOM 1920 C CB . ILE A-2 1 97 . -10.72 20.345 -9.079 1 14.89 ? CB ILE A-2 77 1 
ATOM 1921 C CG1 . ILE A-2 1 97 . -10.962 19.56 -7.783 1 14.5 ? CG1 ILE A-2 77 1 
ATOM 1922 C CG2 . ILE A-2 1 97 . -9.564 21.327 -8.918 1 14.81 ? CG2 ILE A-2 77 1 
ATOM 1923 C CD1 . ILE A-2 1 97 . -9.955 18.462 -7.541 1 14.32 ? CD1 ILE A-2 77 1 
ATOM 1924 N N . SER A-2 1 98 . -12.05 23.245 -10.606 1 15.42 ? N SER A-2 78 1 
ATOM 1925 C CA . SER A-2 1 98 . -12.216 24.08 -11.799 1 15.5 ? CA SER A-2 78 1 
ATOM 1926 C C . SER A-2 1 98 . -11.015 24.933 -12.198 1 15.45 ? C SER A-2 78 1 
ATOM 1927 O O . SER A-2 1 98 . -10.968 25.437 -13.334 1 15.25 ? O SER A-2 78 1 
ATOM 1928 C CB . SER A-2 1 98 . -13.459 24.962 -11.655 1 15.58 ? CB SER A-2 78 1 
ATOM 1929 O OG . SER A-2 1 98 . -13.494 25.591 -10.382 1 16.15 ? OG SER A-2 78 1 
ATOM 1930 N N . HIS A-2 1 99 . -10.07 25.12 -11.274 1 15.26 ? N HIS A-2 79 1 
ATOM 1931 C CA . HIS A-2 1 99 . -8.83 25.838 -11.576 1 15.57 ? CA HIS A-2 79 1 
ATOM 1932 C C . HIS A-2 1 99 . -7.659 24.913 -11.313 1 16.2 ? C HIS A-2 79 1 
ATOM 1933 O O . HIS A-2 1 99 . -7.392 24.524 -10.163 1 16.09 ? O HIS A-2 79 1 
ATOM 1934 C CB . HIS A-2 1 99 . -8.712 27.149 -10.778 1 15.49 ? CB HIS A-2 79 1 
ATOM 1935 C CG . HIS A-2 1 99 . -9.789 28.14 -11.096 1 15.79 ? CG HIS A-2 79 1 
ATOM 1936 N ND1 . HIS A-2 1 99 . -11.009 28.149 -10.449 1 16.42 ? ND1 HIS A-2 79 1 
ATOM 1937 C CD2 . HIS A-2 1 99 . -9.849 29.13 -12.019 1 15.66 ? CD2 HIS A-2 79 1 
ATOM 1938 C CE1 . HIS A-2 1 99 . -11.768 29.107 -10.955 1 15.81 ? CE1 HIS A-2 79 1 
ATOM 1939 N NE2 . HIS A-2 1 99 . -11.086 29.719 -11.904 1 15.36 ? NE2 HIS A-2 79 1 
ATOM 1940 N N . ILE A-2 1 100 . -6.981 24.526 -12.389 1 16.22 ? N ILE A-2 80 1 
ATOM 1941 C CA . ILE A-2 1 100 . -5.947 23.525 -12.263 1 16.88 ? CA ILE A-2 80 1 
ATOM 1942 C C . ILE A-2 1 100 . -4.584 24.112 -12.587 1 17 ? C ILE A-2 80 1 
ATOM 1943 O O . ILE A-2 1 100 . -4.223 24.273 -13.75 1 17.44 ? O ILE A-2 80 1 
ATOM 1944 C CB . ILE A-2 1 100 . -6.25 22.275 -13.109 1 16.45 ? CB ILE A-2 80 1 
ATOM 1945 C CG1 . ILE A-2 1 100 . -7.717 21.857 -12.934 1 16.28 ? CG1 ILE A-2 80 1 
ATOM 1946 C CG2 . ILE A-2 1 100 . -5.315 21.138 -12.72 1 16.62 ? CG2 ILE A-2 80 1 
ATOM 1947 C CD1 . ILE A-2 1 100 . -8.36 21.344 -14.204 1 16.11 ? CD1 ILE A-2 80 1 
ATOM 1948 N N . ILE A-2 1 101 . -3.833 24.438 -11.542 1 16.48 ? N ILE A-2 81 1 
ATOM 1949 C CA . ILE A-2 1 101 . -2.513 24.999 -11.74 1 16.23 ? CA ILE A-2 81 1 
ATOM 1950 C C . ILE A-2 1 101 . -1.478 23.92 -11.449 1 16.13 ? C ILE A-2 81 1 
ATOM 1951 O O . ILE A-2 1 101 . -1.399 23.401 -10.328 1 15.79 ? O ILE A-2 81 1 
ATOM 1952 C CB . ILE A-2 1 101 . -2.292 26.27 -10.9 1 16.21 ? CB ILE A-2 81 1 
ATOM 1953 C CG1 . ILE A-2 1 101 . -3.399 27.293 -11.192 1 16.1 ? CG1 ILE A-2 81 1 
ATOM 1954 C CG2 . ILE A-2 1 101 . -0.914 26.85 -11.188 1 15.89 ? CG2 ILE A-2 81 1 
ATOM 1955 C CD1 . ILE A-2 1 101 . -3.338 28.551 -10.342 1 15.74 ? CD1 ILE A-2 81 1 
ATOM 1956 N N . GLN A-2 1 102 . -0.721 23.573 -12.49 1 16.1 ? N GLN A-2 82 1 
ATOM 1957 C CA . GLN A-2 1 102 . 0.288 22.511 -12.451 1 16.51 ? CA GLN A-2 82 1 
ATOM 1958 C C . GLN A-2 1 102 . 1.638 23.074 -12.87 1 16.72 ? C GLN A-2 82 1 
ATOM 1959 O O . GLN A-2 1 102 . 1.703 24.136 -13.492 1 16.02 ? O GLN A-2 82 1 
ATOM 1960 C CB . GLN A-2 1 102 . -0.089 21.369 -13.403 1 16.49 ? CB GLN A-2 82 1 
ATOM 1961 C CG . GLN A-2 1 102 . -1.39 20.656 -13.074 1 16.03 ? CG GLN A-2 82 1 
ATOM 1962 C CD . GLN A-2 1 102 . -1.492 19.279 -13.718 1 16.37 ? CD GLN A-2 82 1 
ATOM 1963 O OE1 . GLN A-2 1 102 . -0.867 18.322 -13.265 1 16.2 ? OE1 GLN A-2 82 1 
ATOM 1964 N NE2 . GLN A-2 1 102 . -2.31 19.169 -14.754 1 15.74 ? NE2 GLN A-2 82 1 
ATOM 1965 N N . GLY A-2 1 103 . 2.712 22.354 -12.544 1 16.7 ? N GLY A-2 83 1 
ATOM 1966 C CA . GLY A-2 1 103 . 4.058 22.817 -12.847 1 16.68 ? CA GLY A-2 83 1 
ATOM 1967 C C . GLY A-2 1 103 . 4.382 24.108 -12.111 1 17.66 ? C GLY A-2 83 1 
ATOM 1968 O O . GLY A-2 1 103 . 5.186 24.918 -12.588 1 17.17 ? O GLY A-2 83 1 
ATOM 1969 N N . GLN A-2 1 104 . 3.745 24.3 -10.953 1 17.8 ? N GLN A-2 84 1 
ATOM 1970 C CA . GLN A-2 1 104 . 3.919 25.503 -10.148 1 18.62 ? CA GLN A-2 84 1 
ATOM 1971 C C . GLN A-2 1 104 . 4.166 25.158 -8.682 1 18.69 ? C GLN A-2 84 1 
ATOM 1972 O O . GLN A-2 1 104 . 3.263 24.662 -7.993 1 18.14 ? O GLN A-2 84 1 
ATOM 1973 C CB . GLN A-2 1 104 . 2.684 26.407 -10.286 1 19.67 ? CB GLN A-2 84 1 
ATOM 1974 C CG . GLN A-2 1 104 . 2.631 27.618 -9.355 1 20.38 ? CG GLN A-2 84 1 
ATOM 1975 C CD . GLN A-2 1 104 . 3.763 28.608 -9.592 1 20.97 ? CD GLN A-2 84 1 
ATOM 1976 O OE1 . GLN A-2 1 104 . 4.913 28.373 -9.198 1 20.68 ? OE1 GLN A-2 84 1 
ATOM 1977 N NE2 . GLN A-2 1 104 . 3.439 29.73 -10.235 1 20.37 ? NE2 GLN A-2 84 1 
ATOM 1978 N N . ASP A-2 1 105 . 5.383 25.43 -8.213 1 19.17 ? N ASP A-2 85 1 
ATOM 1979 C CA . ASP A-2 1 105 . 5.748 25.208 -6.809 1 19.67 ? CA ASP A-2 85 1 
ATOM 1980 C C . ASP A-2 1 105 . 5.621 26.461 -5.925 1 19.34 ? C ASP A-2 85 1 
ATOM 1981 O O . ASP A-2 1 105 . 5.597 26.352 -4.702 1 19.07 ? O ASP A-2 85 1 
ATOM 1982 C CB . ASP A-2 1 105 . 7.153 24.583 -6.689 1 21.59 ? CB ASP A-2 85 1 
ATOM 1983 C CG . ASP A-2 1 105 . 7.113 23.055 -6.501 1 23.09 ? CG ASP A-2 85 1 
ATOM 1984 O OD1 . ASP A-2 1 105 . 6.249 22.552 -5.755 1 24.65 ? OD1 ASP A-2 85 1 
ATOM 1985 O OD2 . ASP A-2 1 105 . 7.953 22.348 -7.091 1 25.05 ? OD2 ASP A-2 85 1 
ATOM 1986 N N . ASP A-2 1 106 . 5.532 27.64 -6.544 1 18.8 ? N ASP A-2 86 1 
ATOM 1987 C CA . ASP A-2 1 106 . 5.279 28.889 -5.818 1 18.66 ? CA ASP A-2 86 1 
ATOM 1988 C C . ASP A-2 1 106 . 3.78 29.004 -5.532 1 17.49 ? C ASP A-2 86 1 
ATOM 1989 O O . ASP A-2 1 106 . 3.049 29.721 -6.218 1 16.96 ? O ASP A-2 86 1 
ATOM 1990 C CB . ASP A-2 1 106 . 5.809 30.092 -6.623 1 20.16 ? CB ASP A-2 86 1 
ATOM 1991 C CG . ASP A-2 1 106 . 5.843 31.403 -5.817 1 21.4 ? CG ASP A-2 86 1 
ATOM 1992 O OD1 . ASP A-2 1 106 . 5.556 31.424 -4.591 1 22.53 ? OD1 ASP A-2 86 1 
ATOM 1993 O OD2 . ASP A-2 1 106 . 6.156 32.443 -6.437 1 22.1 ? OD2 ASP A-2 86 1 
ATOM 1994 N N . LYS A-2 1 107 . 3.343 28.273 -4.509 1 16.78 ? N LYS A-2 87 1 
ATOM 1995 C CA . LYS A-2 1 107 . 1.927 28.072 -4.214 1 16.54 ? CA LYS A-2 87 1 
ATOM 1996 C C . LYS A-2 1 107 . 1.197 29.349 -3.793 1 16.69 ? C LYS A-2 87 1 
ATOM 1997 O O . LYS A-2 1 107 . 0.103 29.607 -4.274 1 16.07 ? O LYS A-2 87 1 
ATOM 1998 C CB . LYS A-2 1 107 . 1.733 26.968 -3.149 1 16.58 ? CB LYS A-2 87 1 
ATOM 1999 C CG . LYS A-2 1 107 . 2.41 25.617 -3.442 1 15.91 ? CG LYS A-2 87 1 
ATOM 2000 C CD . LYS A-2 1 107 . 1.869 24.933 -4.688 1 15.22 ? CD LYS A-2 87 1 
ATOM 2001 C CE . LYS A-2 1 107 . 2.448 23.534 -4.879 1 14.69 ? CE LYS A-2 87 1 
ATOM 2002 N NZ . LYS A-2 1 107 . 1.741 22.499 -4.086 1 13.84 ? NZ LYS A-2 87 1 
ATOM 2003 N N . LEU A-2 1 108 . 1.793 30.139 -2.893 1 16.92 ? N LEU A-2 88 1 
ATOM 2004 C CA . LEU A-2 1 108 . 1.172 31.4 -2.447 1 16.45 ? CA LEU A-2 88 1 
ATOM 2005 C C . LEU A-2 1 108 . 0.947 32.357 -3.622 1 16.66 ? C LEU A-2 88 1 
ATOM 2006 O O . LEU A-2 1 108 . -0.133 32.931 -3.773 1 16.6 ? O LEU A-2 88 1 
ATOM 2007 C CB . LEU A-2 1 108 . 2.025 32.081 -1.379 1 16.74 ? CB LEU A-2 88 1 
ATOM 2008 C CG . LEU A-2 1 108 . 1.358 32.752 -0.161 1 17.27 ? CG LEU A-2 88 1 
ATOM 2009 C CD1 . LEU A-2 1 108 . 2.257 33.85 0.405 1 16.93 ? CD1 LEU A-2 88 1 
ATOM 2010 C CD2 . LEU A-2 1 108 . -0.024 33.289 -0.462 1 17.03 ? CD2 LEU A-2 88 1 
ATOM 2011 N N . THR A-2 1 109 . 1.965 32.518 -4.462 1 16.29 ? N THR A-2 89 1 
ATOM 2012 C CA . THR A-2 1 109 . 1.836 33.372 -5.635 1 16.15 ? CA THR A-2 89 1 
ATOM 2013 C C . THR A-2 1 109 . 0.667 32.889 -6.467 1 15.69 ? C THR A-2 89 1 
ATOM 2014 O O . THR A-2 1 109 . -0.187 33.684 -6.84 1 14.92 ? O THR A-2 89 1 
ATOM 2015 C CB . THR A-2 1 109 . 3.114 33.378 -6.486 1 16.43 ? CB THR A-2 89 1 
ATOM 2016 O OG1 . THR A-2 1 109 . 4.186 33.931 -5.716 1 16.78 ? OG1 THR A-2 89 1 
ATOM 2017 C CG2 . THR A-2 1 109 . 2.924 34.202 -7.778 1 16.59 ? CG2 THR A-2 89 1 
ATOM 2018 N N . ALA A-2 1 110 . 0.62 31.583 -6.73 1 15.88 ? N ALA A-2 90 1 
ATOM 2019 C CA . ALA A-2 1 110 . -0.467 31.006 -7.522 1 16.26 ? CA ALA A-2 90 1 
ATOM 2020 C C . ALA A-2 1 110 . -1.845 31.244 -6.866 1 16.62 ? C ALA A-2 90 1 
ATOM 2021 O O . ALA A-2 1 110 . -2.809 31.618 -7.542 1 16.81 ? O ALA A-2 90 1 
ATOM 2022 C CB . ALA A-2 1 110 . -0.218 29.528 -7.763 1 16.71 ? CB ALA A-2 90 1 
ATOM 2023 N N . LEU A-2 1 111 . -1.912 31.07 -5.547 1 16.29 ? N LEU A-2 91 1 
ATOM 2024 C CA . LEU A-2 1 111 . -3.138 31.301 -4.798 1 16.4 ? CA LEU A-2 91 1 
ATOM 2025 C C . LEU A-2 1 111 . -3.592 32.763 -4.913 1 17.38 ? C LEU A-2 91 1 
ATOM 2026 O O . LEU A-2 1 111 . -4.731 33.046 -5.318 1 17.67 ? O LEU A-2 91 1 
ATOM 2027 C CB . LEU A-2 1 111 . -2.951 30.869 -3.345 1 15.98 ? CB LEU A-2 91 1 
ATOM 2028 C CG . LEU A-2 1 111 . -4.13 30.938 -2.368 1 15.93 ? CG LEU A-2 91 1 
ATOM 2029 C CD1 . LEU A-2 1 111 . -5.357 30.199 -2.887 1 15.96 ? CD1 LEU A-2 91 1 
ATOM 2030 C CD2 . LEU A-2 1 111 . -3.715 30.395 -1.015 1 15.67 ? CD2 LEU A-2 91 1 
ATOM 2031 N N . VAL A-2 1 112 . -2.683 33.681 -4.588 1 17.31 ? N VAL A-2 92 1 
ATOM 2032 C CA . VAL A-2 1 112 . -2.909 35.115 -4.753 1 17.06 ? CA VAL A-2 92 1 
ATOM 2033 C C . VAL A-2 1 112 . -3.406 35.471 -6.173 1 17.59 ? C VAL A-2 92 1 
ATOM 2034 O O . VAL A-2 1 112 . -4.33 36.262 -6.324 1 18.66 ? O VAL A-2 92 1 
ATOM 2035 C CB . VAL A-2 1 112 . -1.639 35.912 -4.353 1 16.66 ? CB VAL A-2 92 1 
ATOM 2036 C CG1 . VAL A-2 1 112 . -1.689 37.349 -4.853 1 16.45 ? CG1 VAL A-2 92 1 
ATOM 2037 C CG2 . VAL A-2 1 112 . -1.456 35.884 -2.839 1 16.28 ? CG2 VAL A-2 92 1 
ATOM 2038 N N . GLY A-2 1 113 . -2.797 34.887 -7.203 1 17.61 ? N GLY A-2 93 1 
ATOM 2039 C CA . GLY A-2 1 113 . -3.247 35.058 -8.586 1 17.97 ? CA GLY A-2 93 1 
ATOM 2040 C C . GLY A-2 1 113 . -4.695 34.645 -8.793 1 18.52 ? C GLY A-2 93 1 
ATOM 2041 O O . GLY A-2 1 113 . -5.449 35.346 -9.458 1 18.59 ? O GLY A-2 93 1 
ATOM 2042 N N . LEU A-2 1 114 . -5.086 33.507 -8.219 1 19.3 ? N LEU A-2 94 1 
ATOM 2043 C CA . LEU A-2 1 114 . -6.477 33.053 -8.254 1 20.52 ? CA LEU A-2 94 1 
ATOM 2044 C C . LEU A-2 1 114 . -7.423 34.012 -7.531 1 20.68 ? C LEU A-2 94 1 
ATOM 2045 O O . LEU A-2 1 114 . -8.535 34.277 -7.987 1 20.38 ? O LEU A-2 94 1 
ATOM 2046 C CB . LEU A-2 1 114 . -6.605 31.656 -7.631 1 21.02 ? CB LEU A-2 94 1 
ATOM 2047 C CG . LEU A-2 1 114 . -6.44 30.444 -8.545 1 21.73 ? CG LEU A-2 94 1 
ATOM 2048 C CD1 . LEU A-2 1 114 . -6.717 29.188 -7.743 1 21.48 ? CD1 LEU A-2 94 1 
ATOM 2049 C CD2 . LEU A-2 1 114 . -7.336 30.515 -9.78 1 21.35 ? CD2 LEU A-2 94 1 
ATOM 2050 N N . THR A-2 1 115 . -6.952 34.517 -6.399 1 22.1 ? N THR A-2 95 1 
ATOM 2051 C CA . THR A-2 1 115 . -7.69 35.433 -5.554 1 23.61 ? CA THR A-2 95 1 
ATOM 2052 C C . THR A-2 1 115 . -8.055 36.682 -6.36 1 24.5 ? C THR A-2 95 1 
ATOM 2053 O O . THR A-2 1 115 . -9.157 37.218 -6.243 1 25.41 ? O THR A-2 95 1 
ATOM 2054 C CB . THR A-2 1 115 . -6.843 35.744 -4.3 1 24.5 ? CB THR A-2 95 1 
ATOM 2055 O OG1 . THR A-2 1 115 . -7.616 35.521 -3.117 1 27.66 ? OG1 THR A-2 95 1 
ATOM 2056 C CG2 . THR A-2 1 115 . -6.277 37.144 -4.308 1 23.73 ? CG2 THR A-2 95 1 
ATOM 2057 N N . LYS A-2 1 116 . -7.133 37.098 -7.22 1 25.75 ? N LYS A-2 96 1 
ATOM 2058 C CA . LYS A-2 1 116 . -7.31 38.261 -8.07 1 26.71 ? CA LYS A-2 96 1 
ATOM 2059 C C . LYS A-2 1 116 . -8.268 38.021 -9.236 1 26.25 ? C LYS A-2 96 1 
ATOM 2060 O O . LYS A-2 1 116 . -9.047 38.904 -9.574 1 26.25 ? O LYS A-2 96 1 
ATOM 2061 C CB . LYS A-2 1 116 . -5.953 38.753 -8.59 1 27.77 ? CB LYS A-2 96 1 
ATOM 2062 C CG . LYS A-2 1 116 . -5.052 39.338 -7.513 1 29.03 ? CG LYS A-2 96 1 
ATOM 2063 C CD . LYS A-2 1 116 . -3.766 39.857 -8.13 1 31.43 ? CD LYS A-2 96 1 
ATOM 2064 C CE . LYS A-2 1 116 . -2.78 40.32 -7.069 1 34.11 ? CE LYS A-2 96 1 
ATOM 2065 N NZ . LYS A-2 1 116 . -1.505 40.782 -7.693 1 35.29 ? NZ LYS A-2 96 1 
ATOM 2066 N N . LYS A-2 1 117 . -8.225 36.844 -9.855 1 26.62 ? N LYS A-2 97 1 
ATOM 2067 C CA . LYS A-2 1 117 . -9.096 36.612 -11.013 1 27.8 ? CA LYS A-2 97 1 
ATOM 2068 C C . LYS A-2 1 117 . -10.538 36.227 -10.641 1 27.53 ? C LYS A-2 97 1 
ATOM 2069 O O . LYS A-2 1 117 . -11.435 36.21 -11.497 1 26.52 ? O LYS A-2 97 1 
ATOM 2070 C CB . LYS A-2 1 117 . -8.451 35.653 -12.031 1 29.12 ? CB LYS A-2 97 1 
ATOM 2071 C CG . LYS A-2 1 117 . -8.757 34.179 -11.871 1 30.7 ? CG LYS A-2 97 1 
ATOM 2072 C CD . LYS A-2 1 117 . -8.14 33.402 -13.027 1 32.61 ? CD LYS A-2 97 1 
ATOM 2073 C CE . LYS A-2 1 117 . -8.928 32.133 -13.319 1 33.52 ? CE LYS A-2 97 1 
ATOM 2074 N NZ . LYS A-2 1 117 . -8.484 31.434 -14.558 1 34.78 ? NZ LYS A-2 97 1 
ATOM 2075 N N . LEU A-2 1 118 . -10.751 35.929 -9.359 1 27.51 ? N LEU A-2 98 1 
ATOM 2076 C CA . LEU A-2 1 118 . -12.076 35.598 -8.863 1 27.89 ? CA LEU A-2 98 1 
ATOM 2077 C C . LEU A-2 1 118 . -12.659 36.71 -8.009 1 28.46 ? C LEU A-2 98 1 
ATOM 2078 O O . LEU A-2 1 118 . -13.843 36.679 -7.688 1 28.14 ? O LEU A-2 98 1 
ATOM 2079 C CB . LEU A-2 1 118 . -12.064 34.29 -8.063 1 27.73 ? CB LEU A-2 98 1 
ATOM 2080 C CG . LEU A-2 1 118 . -11.491 33.026 -8.705 1 28.2 ? CG LEU A-2 98 1 
ATOM 2081 C CD1 . LEU A-2 1 118 . -11.663 31.842 -7.771 1 28.06 ? CD1 LEU A-2 98 1 
ATOM 2082 C CD2 . LEU A-2 1 118 . -12.122 32.731 -10.054 1 28.69 ? CD2 LEU A-2 98 1 
ATOM 2083 N N . GLY A-2 1 119 . -11.827 37.681 -7.637 1 29.03 ? N GLY A-2 99 1 
ATOM 2084 C CA . GLY A-2 1 119 . -12.264 38.778 -6.778 1 30.77 ? CA GLY A-2 99 1 
ATOM 2085 C C . GLY A-2 1 119 . -12.543 38.276 -5.373 1 32.8 ? C GLY A-2 99 1 
ATOM 2086 O O . GLY A-2 1 119 . -13.648 38.424 -4.853 1 34.03 ? O GLY A-2 99 1 
ATOM 2087 N N . ILE A-2 1 120 . -11.518 37.693 -4.761 1 32.92 ? N ILE A-2 100 1 
ATOM 2088 C CA . ILE A-2 1 120 . -11.644 36.98 -3.5 1 31.96 ? CA ILE A-2 100 1 
ATOM 2089 C C . ILE A-2 1 120 . -10.425 37.312 -2.642 1 31.43 ? C ILE A-2 100 1 
ATOM 2090 O O . ILE A-2 1 120 . -9.34 37.532 -3.165 1 31.3 ? O ILE A-2 100 1 
ATOM 2091 C CB . ILE A-2 1 120 . -11.806 35.461 -3.784 1 32.3 ? CB ILE A-2 100 1 
ATOM 2092 C CG1 . ILE A-2 1 120 . -13.29 35.101 -3.8 1 32.81 ? CG1 ILE A-2 100 1 
ATOM 2093 C CG2 . ILE A-2 1 120 . -11.071 34.582 -2.786 1 33.71 ? CG2 ILE A-2 100 1 
ATOM 2094 C CD1 . ILE A-2 1 120 . -13.625 33.907 -4.665 1 34 ? CD1 ILE A-2 100 1 
ATOM 2095 N N . GLU A-2 1 121 . -10.61 37.379 -1.331 1 30.37 ? N GLU A-2 101 1 
ATOM 2096 C CA . GLU A-2 1 121 . -9.492 37.623 -0.44 1 30.68 ? CA GLU A-2 101 1 
ATOM 2097 C C . GLU A-2 1 121 . -8.87 36.306 -0.008 1 28.71 ? C GLU A-2 101 1 
ATOM 2098 O O . GLU A-2 1 121 . -9.545 35.28 0.02 1 27.7 ? O GLU A-2 101 1 
ATOM 2099 C CB . GLU A-2 1 121 . -9.944 38.405 0.793 1 33.65 ? CB GLU A-2 101 1 
ATOM 2100 C CG . GLU A-2 1 121 . -10.599 39.748 0.513 1 36.59 ? CG GLU A-2 101 1 
ATOM 2101 C CD . GLU A-2 1 121 . -11.378 40.252 1.712 1 40.07 ? CD GLU A-2 101 1 
ATOM 2102 O OE1 . GLU A-2 1 121 . -10.791 40.321 2.822 1 41.68 ? OE1 GLU A-2 101 1 
ATOM 2103 O OE2 . GLU A-2 1 121 . -12.579 40.57 1.553 1 41.16 ? OE2 GLU A-2 101 1 
ATOM 2104 N N . LEU A-2 1 122 . -7.58 36.357 0.33 1 28.09 ? N LEU A-2 102 1 
ATOM 2105 C CA . LEU A-2 1 122 . -6.859 35.233 0.945 1 26.46 ? CA LEU A-2 102 1 
ATOM 2106 C C . LEU A-2 1 122 . -7.529 34.66 2.19 1 25.23 ? C LEU A-2 102 1 
ATOM 2107 O O . LEU A-2 1 122 . -7.521 33.442 2.404 1 24.02 ? O LEU A-2 102 1 
ATOM 2108 C CB . LEU A-2 1 122 . -5.43 35.643 1.313 1 25.91 ? CB LEU A-2 102 1 
ATOM 2109 C CG . LEU A-2 1 122 . -4.292 35.182 0.41 1 26.5 ? CG LEU A-2 102 1 
ATOM 2110 C CD1 . LEU A-2 1 122 . -2.957 35.472 1.087 1 26.35 ? CD1 LEU A-2 102 1 
ATOM 2111 C CD2 . LEU A-2 1 122 . -4.405 33.701 0.069 1 25.16 ? CD2 LEU A-2 102 1 
ATOM 2112 N N . SER A-2 1 123 . -8.077 35.546 3.022 1 24.71 ? N SER A-2 103 1 
ATOM 2113 C CA . SER A-2 1 123 . -8.813 35.136 4.212 1 24.28 ? CA SER A-2 103 1 
ATOM 2114 C C . SER A-2 1 123 . -9.991 34.23 3.846 1 23.75 ? C SER A-2 103 1 
ATOM 2115 O O . SER A-2 1 123 . -10.453 33.441 4.67 1 23.83 ? O SER A-2 103 1 
ATOM 2116 C CB . SER A-2 1 123 . -9.283 36.358 5.005 1 25.39 ? CB SER A-2 103 1 
ATOM 2117 O OG . SER A-2 1 123 . -9.949 37.298 4.171 1 25.63 ? OG SER A-2 103 1 
ATOM 2118 N N . HIS A-2 1 124 . -10.448 34.329 2.599 1 23.78 ? N HIS A-2 104 1 
ATOM 2119 C CA . HIS A-2 1 124 . -11.518 33.468 2.091 1 23.95 ? CA HIS A-2 104 1 
ATOM 2120 C C . HIS A-2 1 124 . -11.011 32.225 1.346 1 22.23 ? C HIS A-2 104 1 
ATOM 2121 O O . HIS A-2 1 124 . -11.799 31.482 0.754 1 20.57 ? O HIS A-2 104 1 
ATOM 2122 C CB . HIS A-2 1 124 . -12.493 34.274 1.219 1 26.83 ? CB HIS A-2 104 1 
ATOM 2123 C CG . HIS A-2 1 124 . -13.17 35.392 1.957 1 30.15 ? CG HIS A-2 104 1 
ATOM 2124 N ND1 . HIS A-2 1 124 . -13.488 36.595 1.361 1 31.63 ? ND1 HIS A-2 104 1 
ATOM 2125 C CD2 . HIS A-2 1 124 . -13.555 35.499 3.253 1 30.02 ? CD2 HIS A-2 104 1 
ATOM 2126 C CE1 . HIS A-2 1 124 . -14.06 37.383 2.255 1 33.55 ? CE1 HIS A-2 104 1 
ATOM 2127 N NE2 . HIS A-2 1 124 . -14.112 36.742 3.41 1 32.09 ? NE2 HIS A-2 104 1 
ATOM 2128 N N . CYS A-2 1 125 . -9.696 32.015 1.377 1 20.24 ? N CYS A-2 105 1 
ATOM 2129 C CA . CYS A-2 1 125 . -9.095 30.827 0.789 1 19.06 ? CA CYS A-2 105 1 
ATOM 2130 C C . CYS A-2 1 125 . -8.681 29.829 1.859 1 17.46 ? C CYS A-2 105 1 
ATOM 2131 O O . CYS A-2 1 125 . -8.116 30.201 2.888 1 17.08 ? O CYS A-2 105 1 
ATOM 2132 C CB . CYS A-2 1 125 . -7.895 31.198 -0.071 1 19.1 ? CB CYS A-2 105 1 
ATOM 2133 S SG . CYS A-2 1 125 . -8.356 32.2 -1.494 1 21.6 ? SG CYS A-2 105 1 
ATOM 2134 N N . ALA A-2 1 126 . -8.993 28.563 1.613 1 16.01 ? N ALA A-2 106 1 
ATOM 2135 C CA . ALA A-2 1 126 . -8.46 27.48 2.414 1 15.1 ? CA ALA A-2 106 1 
ATOM 2136 C C . ALA A-2 1 126 . -7.417 26.792 1.55 1 14.64 ? C ALA A-2 106 1 
ATOM 2137 O O . ALA A-2 1 126 . -7.591 26.674 0.328 1 13.74 ? O ALA A-2 106 1 
ATOM 2138 C CB . ALA A-2 1 126 . -9.56 26.516 2.83 1 14.83 ? CB ALA A-2 106 1 
ATOM 2139 N N . TYR A-2 1 127 . -6.323 26.363 2.175 1 14.19 ? N TYR A-2 107 1 
ATOM 2140 C CA . TYR A-2 1 127 . -5.258 25.669 1.448 1 14.08 ? CA TYR A-2 107 1 
ATOM 2141 C C . TYR A-2 1 127 . -4.696 24.518 2.271 1 14.03 ? C TYR A-2 107 1 
ATOM 2142 O O . TYR A-2 1 127 . -4.467 24.654 3.482 1 13.38 ? O TYR A-2 107 1 
ATOM 2143 C CB . TYR A-2 1 127 . -4.12 26.631 1.017 1 13.7 ? CB TYR A-2 107 1 
ATOM 2144 C CG . TYR A-2 1 127 . -3.076 25.966 0.118 1 13.33 ? CG TYR A-2 107 1 
ATOM 2145 C CD1 . TYR A-2 1 127 . -3.263 25.895 -1.258 1 13.24 ? CD1 TYR A-2 107 1 
ATOM 2146 C CD2 . TYR A-2 1 127 . -1.925 25.383 0.657 1 13.15 ? CD2 TYR A-2 107 1 
ATOM 2147 C CE1 . TYR A-2 1 127 . -2.338 25.266 -2.079 1 13.28 ? CE1 TYR A-2 107 1 
ATOM 2148 C CE2 . TYR A-2 1 127 . -0.996 24.752 -0.153 1 12.98 ? CE2 TYR A-2 107 1 
ATOM 2149 C CZ . TYR A-2 1 127 . -1.203 24.703 -1.518 1 12.96 ? CZ TYR A-2 107 1 
ATOM 2150 O OH . TYR A-2 1 127 . -0.291 24.069 -2.338 1 12.95 ? OH TYR A-2 107 1 
ATOM 2151 N N . ILE A-2 1 128 . -4.459 23.405 1.578 1 13.62 ? N ILE A-2 108 1 
ATOM 2152 C CA . ILE A-2 1 128 . -3.874 22.213 2.168 1 13.4 ? CA ILE A-2 108 1 
ATOM 2153 C C . ILE A-2 1 128 . -2.646 21.719 1.386 1 13.46 ? C ILE A-2 108 1 
ATOM 2154 O O . ILE A-2 1 128 . -2.682 21.561 0.148 1 12.85 ? O ILE A-2 108 1 
ATOM 2155 C CB . ILE A-2 1 128 . -4.924 21.088 2.318 1 13.2 ? CB ILE A-2 108 1 
ATOM 2156 C CG1 . ILE A-2 1 128 . -4.302 19.855 2.988 1 13.18 ? CG1 ILE A-2 108 1 
ATOM 2157 C CG2 . ILE A-2 1 128 . -5.552 20.753 0.963 1 12.96 ? CG2 ILE A-2 108 1 
ATOM 2158 C CD1 . ILE A-2 1 128 . -5.315 18.843 3.499 1 13.27 ? CD1 ILE A-2 108 1 
ATOM 2159 N N . GLY A-2 1 129 . -1.566 21.475 2.131 1 13.43 ? N GLY A-2 109 1 
ATOM 2160 C CA . GLY A-2 1 129 . -0.307 20.99 1.555 1 13.68 ? CA GLY A-2 109 1 
ATOM 2161 C C . GLY A-2 1 129 . 0.517 20.199 2.551 1 13.92 ? C GLY A-2 109 1 
ATOM 2162 O O . GLY A-2 1 129 . 0.34 20.332 3.776 1 13.7 ? O GLY A-2 109 1 
ATOM 2163 N N . ASP A-2 1 130 . 1.432 19.389 2.028 1 14.3 ? N ASP A-2 110 1 
ATOM 2164 C CA . ASP A-2 1 130 . 2.229 18.475 2.854 1 15.09 ? CA ASP A-2 110 1 
ATOM 2165 C C . ASP A-2 1 130 . 3.706 18.862 3.028 1 15.55 ? C ASP A-2 110 1 
ATOM 2166 O O . ASP A-2 1 130 . 4.365 18.336 3.923 1 16.37 ? O ASP A-2 110 1 
ATOM 2167 C CB . ASP A-2 1 130 . 2.152 17.042 2.304 1 14.94 ? CB ASP A-2 110 1 
ATOM 2168 C CG . ASP A-2 1 130 . 2.908 16.884 0.979 1 15.16 ? CG ASP A-2 110 1 
ATOM 2169 O OD1 . ASP A-2 1 130 . 2.648 17.685 0.05 1 14.79 ? OD1 ASP A-2 110 1 
ATOM 2170 O OD2 . ASP A-2 1 130 . 3.768 15.978 0.876 1 14.6 ? OD2 ASP A-2 110 1 
ATOM 2171 N N . ASP A-2 1 131 . 4.239 19.748 2.186 1 15.6 ? N ASP A-2 111 1 
ATOM 2172 C CA . ASP A-2 1 131 . 5.693 19.958 2.154 1 15.57 ? CA ASP A-2 111 1 
ATOM 2173 C C . ASP A-2 1 131 . 6.107 21.437 2.088 1 15.87 ? C ASP A-2 111 1 
ATOM 2174 O O . ASP A-2 1 131 . 5.282 22.341 2.231 1 16.4 ? O ASP A-2 111 1 
ATOM 2175 C CB . ASP A-2 1 131 . 6.335 19.148 1.001 1 15.26 ? CB ASP A-2 111 1 
ATOM 2176 C CG . ASP A-2 1 131 . 7.712 18.572 1.37 1 15.54 ? CG ASP A-2 111 1 
ATOM 2177 O OD1 . ASP A-2 1 131 . 8.352 19.11 2.298 1 16.1 ? OD1 ASP A-2 111 1 
ATOM 2178 O OD2 . ASP A-2 1 131 . 8.167 17.589 0.736 1 14.83 ? OD2 ASP A-2 111 1 
ATOM 2179 N N . LEU A-2 1 132 . 7.395 21.671 1.871 1 15.47 ? N LEU A-2 112 1 
ATOM 2180 C CA . LEU A-2 1 132 . 7.956 23.021 1.922 1 15.2 ? CA LEU A-2 112 1 
ATOM 2181 C C . LEU A-2 1 132 . 7.4 24.058 0.935 1 14.69 ? C LEU A-2 112 1 
ATOM 2182 O O . LEU A-2 1 132 . 7.191 25.196 1.344 1 15.12 ? O LEU A-2 112 1 
ATOM 2183 C CB . LEU A-2 1 132 . 9.492 22.988 1.909 1 14.69 ? CB LEU A-2 112 1 
ATOM 2184 C CG . LEU A-2 1 132 . 10.083 22.326 3.162 1 14.8 ? CG LEU A-2 112 1 
ATOM 2185 C CD1 . LEU A-2 1 132 . 11.562 22.02 2.968 1 14.33 ? CD1 LEU A-2 112 1 
ATOM 2186 C CD2 . LEU A-2 1 132 . 9.828 23.119 4.447 1 14.51 ? CD2 LEU A-2 112 1 
ATOM 2187 N N . PRO A-2 1 133 . 7.159 23.691 -0.349 1 14.46 ? N PRO A-2 113 1 
ATOM 2188 C CA . PRO A-2 1 133 . 6.559 24.716 -1.233 1 14.26 ? CA PRO A-2 113 1 
ATOM 2189 C C . PRO A-2 1 133 . 5.158 25.231 -0.805 1 13.89 ? C PRO A-2 113 1 
ATOM 2190 O O . PRO A-2 1 133 . 4.724 26.297 -1.263 1 13.33 ? O PRO A-2 113 1 
ATOM 2191 C CB . PRO A-2 1 133 . 6.498 24.025 -2.6 1 14.35 ? CB PRO A-2 113 1 
ATOM 2192 C CG . PRO A-2 1 133 . 7.55 22.975 -2.54 1 14.6 ? CG PRO A-2 113 1 
ATOM 2193 C CD . PRO A-2 1 133 . 7.602 22.508 -1.113 1 14.47 ? CD PRO A-2 113 1 
ATOM 2194 N N . ASP A-2 1 134 . 4.491 24.497 0.079 1 13.25 ? N ASP A-2 114 1 
ATOM 2195 C CA . ASP A-2 1 134 . 3.131 24.821 0.497 1 13.78 ? CA ASP A-2 114 1 
ATOM 2196 C C . ASP A-2 1 134 . 3.087 25.649 1.79 1 14.4 ? C ASP A-2 114 1 
ATOM 2197 O O . ASP A-2 1 134 . 2.035 26.172 2.154 1 14.78 ? O ASP A-2 114 1 
ATOM 2198 C CB . ASP A-2 1 134 . 2.337 23.526 0.748 1 12.95 ? CB ASP A-2 114 1 
ATOM 2199 C CG . ASP A-2 1 134 . 2.333 22.586 -0.433 1 12.65 ? CG ASP A-2 114 1 
ATOM 2200 O OD1 . ASP A-2 1 134 . 1.761 22.949 -1.486 1 12.08 ? OD1 ASP A-2 114 1 
ATOM 2201 O OD2 . ASP A-2 1 134 . 2.869 21.461 -0.283 1 12.39 ? OD2 ASP A-2 114 1 
ATOM 2202 N N . LEU A-2 1 135 . 4.208 25.72 2.508 1 14.61 ? N LEU A-2 115 1 
ATOM 2203 C CA . LEU A-2 1 135 . 4.239 26.329 3.848 1 14.96 ? CA LEU A-2 115 1 
ATOM 2204 C C . LEU A-2 1 135 . 3.694 27.763 3.897 1 15.17 ? C LEU A-2 115 1 
ATOM 2205 O O . LEU A-2 1 135 . 2.834 28.073 4.729 1 15.45 ? O LEU A-2 115 1 
ATOM 2206 C CB . LEU A-2 1 135 . 5.637 26.156 4.489 1 14.67 ? CB LEU A-2 115 1 
ATOM 2207 C CG . LEU A-2 1 135 . 6.57 27.127 5.236 1 15.18 ? CG LEU A-2 115 1 
ATOM 2208 C CD1 . LEU A-2 1 135 . 5.937 28.263 6.049 1 14.6 ? CD1 LEU A-2 115 1 
ATOM 2209 C CD2 . LEU A-2 1 135 . 7.517 26.312 6.109 1 14.31 ? CD2 LEU A-2 115 1 
ATOM 2210 N N . LYS A-2 1 136 . 4.139 28.613 2.982 1 15.3 ? N LYS A-2 116 1 
ATOM 2211 C CA . LYS A-2 1 136 . 3.643 29.99 2.935 1 15.66 ? CA LYS A-2 116 1 
ATOM 2212 C C . LYS A-2 1 136 . 2.164 30.113 2.557 1 15.36 ? C LYS A-2 116 1 
ATOM 2213 O O . LYS A-2 1 136 . 1.459 30.963 3.105 1 15.32 ? O LYS A-2 116 1 
ATOM 2214 C CB . LYS A-2 1 136 . 4.519 30.864 2.033 1 16.52 ? CB LYS A-2 116 1 
ATOM 2215 C CG . LYS A-2 1 136 . 5.85 31.212 2.68 1 17.36 ? CG LYS A-2 116 1 
ATOM 2216 C CD . LYS A-2 1 136 . 6.39 32.551 2.209 1 18.69 ? CD LYS A-2 116 1 
ATOM 2217 C CE . LYS A-2 1 136 . 7.002 32.448 0.826 1 19.05 ? CE LYS A-2 116 1 
ATOM 2218 N NZ . LYS A-2 1 136 . 8.099 33.441 0.687 1 19.87 ? NZ LYS A-2 116 1 
ATOM 2219 N N . ALA A-2 1 137 . 1.693 29.278 1.627 1 14.85 ? N ALA A-2 117 1 
ATOM 2220 C CA . ALA A-2 1 137 . 0.272 29.271 1.279 1 14.38 ? CA ALA A-2 117 1 
ATOM 2221 C C . ALA A-2 1 137 . -0.541 28.779 2.47 1 14.32 ? C ALA A-2 117 1 
ATOM 2222 O O . ALA A-2 1 137 . -1.608 29.319 2.774 1 14.47 ? O ALA A-2 117 1 
ATOM 2223 C CB . ALA A-2 1 137 . 0.002 28.419 0.041 1 13.78 ? CB ALA A-2 117 1 
ATOM 2224 N N . VAL A-2 1 138 . -0.025 27.759 3.146 1 14.39 ? N VAL A-2 118 1 
ATOM 2225 C CA . VAL A-2 1 138 . -0.656 27.23 4.36 1 14.69 ? CA VAL A-2 118 1 
ATOM 2226 C C . VAL A-2 1 138 . -0.696 28.288 5.466 1 15.44 ? C VAL A-2 118 1 
ATOM 2227 O O . VAL A-2 1 138 . -1.706 28.443 6.162 1 15.19 ? O VAL A-2 118 1 
ATOM 2228 C CB . VAL A-2 1 138 . 0.054 25.949 4.861 1 14.37 ? CB VAL A-2 118 1 
ATOM 2229 C CG1 . VAL A-2 1 138 . -0.328 25.632 6.312 1 13.98 ? CG1 VAL A-2 118 1 
ATOM 2230 C CG2 . VAL A-2 1 138 . -0.268 24.779 3.948 1 13.61 ? CG2 VAL A-2 118 1 
ATOM 2231 N N . ARG A-2 1 139 . 0.408 29.012 5.618 1 16.5 ? N ARG A-2 119 1 
ATOM 2232 C CA . ARG A-2 1 139 . 0.51 30.038 6.646 1 17.7 ? CA ARG A-2 119 1 
ATOM 2233 C C . ARG A-2 1 139 . -0.403 31.212 6.325 1 17.95 ? C ARG A-2 119 1 
ATOM 2234 O O . ARG A-2 1 139 . -1.105 31.704 7.198 1 17.1 ? O ARG A-2 119 1 
ATOM 2235 C CB . ARG A-2 1 139 . 1.947 30.538 6.769 1 17.89 ? CB ARG A-2 119 1 
ATOM 2236 C CG . ARG A-2 1 139 . 2.147 31.607 7.837 1 18.68 ? CG ARG A-2 119 1 
ATOM 2237 C CD . ARG A-2 1 139 . 3.059 32.709 7.305 1 18.6 ? CD ARG A-2 119 1 
ATOM 2238 N NE . ARG A-2 1 139 . 4.452 32.312 7.305 1 18.82 ? NE ARG A-2 119 1 
ATOM 2239 C CZ . ARG A-2 1 139 . 5.368 32.693 6.414 1 18.93 ? CZ ARG A-2 119 1 
ATOM 2240 N NH1 . ARG A-2 1 139 . 5.051 33.49 5.395 1 18.17 ? NH1 ARG A-2 119 1 
ATOM 2241 N NH2 . ARG A-2 1 139 . 6.615 32.25 6.546 1 18.61 ? NH2 ARG A-2 119 1 
ATOM 2242 N N . GLU A-2 1 140 . -0.392 31.651 5.068 1 18.47 ? N GLU A-2 120 1 
ATOM 2243 C CA . GLU A-2 1 140 . -1.008 32.925 4.74 1 19.56 ? CA GLU A-2 120 1 
ATOM 2244 C C . GLU A-2 1 140 . -2.504 32.86 4.425 1 19.69 ? C GLU A-2 120 1 
ATOM 2245 O O . GLU A-2 1 140 . -3.192 33.878 4.533 1 19.68 ? O GLU A-2 120 1 
ATOM 2246 C CB . GLU A-2 1 140 . -0.237 33.661 3.636 1 19.98 ? CB GLU A-2 120 1 
ATOM 2247 C CG . GLU A-2 1 140 . 1.156 34.149 4.033 1 21.37 ? CG GLU A-2 120 1 
ATOM 2248 C CD . GLU A-2 1 140 . 1.175 35.066 5.255 1 21.63 ? CD GLU A-2 120 1 
ATOM 2249 O OE1 . GLU A-2 1 140 . 0.266 35.905 5.433 1 21.14 ? OE1 GLU A-2 120 1 
ATOM 2250 O OE2 . GLU A-2 1 140 . 2.121 34.947 6.054 1 22.98 ? OE2 GLU A-2 120 1 
ATOM 2251 N N . ALA A-2 1 141 . -3.002 31.68 4.053 1 19.33 ? N ALA A-2 121 1 
ATOM 2252 C CA . ALA A-2 1 141 . -4.439 31.515 3.753 1 19.43 ? CA ALA A-2 121 1 
ATOM 2253 C C . ALA A-2 1 141 . -5.301 31.67 5.001 1 19.01 ? C ALA A-2 121 1 
ATOM 2254 O O . ALA A-2 1 141 . -4.84 31.436 6.125 1 19.32 ? O ALA A-2 121 1 
ATOM 2255 C CB . ALA A-2 1 141 . -4.71 30.166 3.092 1 19.22 ? CB ALA A-2 121 1 
ATOM 2256 N N . GLY A-2 1 142 . -6.557 32.053 4.806 1 18.69 ? N GLY A-2 122 1 
ATOM 2257 C CA . GLY A-2 1 142 . -7.495 32.144 5.922 1 18.09 ? CA GLY A-2 122 1 
ATOM 2258 C C . GLY A-2 1 142 . -7.57 30.859 6.73 1 17.68 ? C GLY A-2 122 1 
ATOM 2259 O O . GLY A-2 1 142 . -7.61 30.886 7.961 1 17.79 ? O GLY A-2 122 1 
ATOM 2260 N N . PHE A-2 1 143 . -7.605 29.731 6.031 1 16.62 ? N PHE A-2 123 1 
ATOM 2261 C CA . PHE A-2 1 143 . -7.611 28.431 6.683 1 16 ? CA PHE A-2 123 1 
ATOM 2262 C C . PHE A-2 1 143 . -6.511 27.55 6.081 1 15.84 ? C PHE A-2 123 1 
ATOM 2263 O O . PHE A-2 1 143 . -6.59 27.143 4.918 1 15.69 ? O PHE A-2 123 1 
ATOM 2264 C CB . PHE A-2 1 143 . -8.993 27.784 6.568 1 15.52 ? CB PHE A-2 123 1 
ATOM 2265 C CG . PHE A-2 1 143 . -9.132 26.48 7.315 1 15.59 ? CG PHE A-2 123 1 
ATOM 2266 C CD1 . PHE A-2 1 143 . -8.49 26.273 8.535 1 15.92 ? CD1 PHE A-2 123 1 
ATOM 2267 C CD2 . PHE A-2 1 143 . -9.959 25.472 6.819 1 15.28 ? CD2 PHE A-2 123 1 
ATOM 2268 C CE1 . PHE A-2 1 143 . -8.65 25.077 9.226 1 15.54 ? CE1 PHE A-2 123 1 
ATOM 2269 C CE2 . PHE A-2 1 143 . -10.119 24.279 7.507 1 15.31 ? CE2 PHE A-2 123 1 
ATOM 2270 C CZ . PHE A-2 1 143 . -9.456 24.077 8.704 1 15.09 ? CZ PHE A-2 123 1 
ATOM 2271 N N . GLY A-2 1 144 . -5.469 27.298 6.871 1 15.28 ? N GLY A-2 124 1 
ATOM 2272 C CA . GLY A-2 1 144 . -4.341 26.513 6.404 1 14.72 ? CA GLY A-2 124 1 
ATOM 2273 C C . GLY A-2 1 144 . -4.324 25.137 7.025 1 14.31 ? C GLY A-2 124 1 
ATOM 2274 O O . GLY A-2 1 144 . -4.42 25.001 8.257 1 14.49 ? O GLY A-2 124 1 
ATOM 2275 N N . ILE A-2 1 145 . -4.175 24.122 6.174 1 13.68 ? N ILE A-2 125 1 
ATOM 2276 C CA . ILE A-2 1 145 . -4.2 22.731 6.612 1 13.74 ? CA ILE A-2 125 1 
ATOM 2277 C C . ILE A-2 1 145 . -2.959 21.95 6.16 1 13.99 ? C ILE A-2 125 1 
ATOM 2278 O O . ILE A-2 1 145 . -2.477 22.124 5.031 1 12.96 ? O ILE A-2 125 1 
ATOM 2279 C CB . ILE A-2 1 145 . -5.46 21.974 6.104 1 13.67 ? CB ILE A-2 125 1 
ATOM 2280 C CG1 . ILE A-2 1 145 . -6.752 22.781 6.305 1 13.88 ? CG1 ILE A-2 125 1 
ATOM 2281 C CG2 . ILE A-2 1 145 . -5.605 20.638 6.805 1 13.68 ? CG2 ILE A-2 125 1 
ATOM 2282 C CD1 . ILE A-2 1 145 . -7.247 23.506 5.068 1 13.51 ? CD1 ILE A-2 125 1 
ATOM 2283 N N . SER A-2 1 146 . -2.454 21.089 7.047 1 13.95 ? N SER A-2 126 1 
ATOM 2284 C CA . SER A-2 1 146 . -1.491 20.075 6.637 1 15.07 ? CA SER A-2 126 1 
ATOM 2285 C C . SER A-2 1 146 . -1.91 18.682 7.122 1 16.25 ? C SER A-2 126 1 
ATOM 2286 O O . SER A-2 1 146 . -3.025 18.49 7.608 1 16.99 ? O SER A-2 126 1 
ATOM 2287 C CB . SER A-2 1 146 . -0.065 20.427 7.077 1 14.58 ? CB SER A-2 126 1 
ATOM 2288 O OG . SER A-2 1 146 . 0.863 19.587 6.431 1 14.11 ? OG SER A-2 126 1 
ATOM 2289 N N . VAL A-2 1 147 . -1.018 17.711 6.969 1 17.53 ? N VAL A-2 127 1 
ATOM 2290 C CA . VAL A-2 1 147 . -1.356 16.304 7.193 1 17.63 ? CA VAL A-2 127 1 
ATOM 2291 C C . VAL A-2 1 147 . -0.324 15.655 8.118 1 18.45 ? C VAL A-2 127 1 
ATOM 2292 O O . VAL A-2 1 147 . 0.759 16.219 8.315 1 18.27 ? O VAL A-2 127 1 
ATOM 2293 C CB . VAL A-2 1 147 . -1.472 15.539 5.855 1 17.54 ? CB VAL A-2 127 1 
ATOM 2294 C CG1 . VAL A-2 1 147 . -2.707 16.005 5.09 1 17.49 ? CG1 VAL A-2 127 1 
ATOM 2295 C CG2 . VAL A-2 1 147 . -0.21 15.692 5.002 1 17.29 ? CG2 VAL A-2 127 1 
ATOM 2296 N N . PRO A-2 1 148 . -0.643 14.471 8.693 1 19.28 ? N PRO A-2 128 1 
ATOM 2297 C CA . PRO A-2 1 148 . 0.279 13.898 9.683 1 19.62 ? CA PRO A-2 128 1 
ATOM 2298 C C . PRO A-2 1 148 . 1.672 13.607 9.109 1 20.72 ? C PRO A-2 128 1 
ATOM 2299 O O . PRO A-2 1 148 . 2.674 13.744 9.815 1 21.54 ? O PRO A-2 128 1 
ATOM 2300 C CB . PRO A-2 1 148 . -0.43 12.607 10.119 1 19.59 ? CB PRO A-2 128 1 
ATOM 2301 C CG . PRO A-2 1 148 . -1.869 12.818 9.757 1 19.39 ? CG PRO A-2 128 1 
ATOM 2302 C CD . PRO A-2 1 148 . -1.821 13.605 8.488 1 18.9 ? CD PRO A-2 128 1 
ATOM 2303 N N . ASN A-2 1 149 . 1.744 13.241 7.835 1 21.28 ? N ASN A-2 129 1 
ATOM 2304 C CA . ASN A-2 1 149 . 3.036 13.031 7.213 1 21.65 ? CA ASN A-2 129 1 
ATOM 2305 C C . ASN A-2 1 149 . 3.572 14.266 6.484 1 20.9 ? C ASN A-2 129 1 
ATOM 2306 O O . ASN A-2 1 149 . 4.483 14.178 5.661 1 21.13 ? O ASN A-2 129 1 
ATOM 2307 C CB . ASN A-2 1 149 . 3.012 11.781 6.333 1 23.02 ? CB ASN A-2 129 1 
ATOM 2308 C CG . ASN A-2 1 149 . 2.971 10.503 7.157 1 24.49 ? CG ASN A-2 129 1 
ATOM 2309 O OD1 . ASN A-2 1 149 . 4.01 9.998 7.59 1 25.85 ? OD1 ASN A-2 129 1 
ATOM 2310 N ND2 . ASN A-2 1 149 . 1.768 9.98 7.391 1 24.95 ? ND2 ASN A-2 129 1 
ATOM 2311 N N . GLY A-2 1 150 . 3.008 15.419 6.813 1 20.04 ? N GLY A-2 130 1 
ATOM 2312 C CA . GLY A-2 1 150 . 3.526 16.688 6.321 1 18.92 ? CA GLY A-2 130 1 
ATOM 2313 C C . GLY A-2 1 150 . 4.853 16.988 6.999 1 18.3 ? C GLY A-2 130 1 
ATOM 2314 O O . GLY A-2 1 150 . 5.095 16.523 8.119 1 17.27 ? O GLY A-2 130 1 
ATOM 2315 N N . CYS A-2 1 151 . 5.719 17.749 6.321 1 17.58 ? N CYS A-2 131 1 
ATOM 2316 C CA . CYS A-2 1 151 . 6.987 18.153 6.911 1 17.7 ? CA CYS A-2 131 1 
ATOM 2317 C C . CYS A-2 1 151 . 6.674 19.051 8.097 1 18.02 ? C CYS A-2 131 1 
ATOM 2318 O O . CYS A-2 1 151 . 5.661 19.748 8.099 1 17.48 ? O CYS A-2 131 1 
ATOM 2319 C CB . CYS A-2 1 151 . 7.878 18.863 5.894 1 17.55 ? CB CYS A-2 131 1 
ATOM 2320 S SG . CYS A-2 1 151 . 7.269 20.48 5.384 1 17.89 ? SG CYS A-2 131 1 
ATOM 2321 N N . GLU A-2 1 152 . 7.53 19.007 9.108 1 18.51 ? N GLU A-2 132 1 
ATOM 2322 C CA . GLU A-2 1 152 . 7.28 19.675 10.38 1 19.81 ? CA GLU A-2 132 1 
ATOM 2323 C C . GLU A-2 1 152 . 7.02 21.165 10.222 1 19.14 ? C GLU A-2 132 1 
ATOM 2324 O O . GLU A-2 1 152 . 6.147 21.729 10.89 1 18.8 ? O GLU A-2 132 1 
ATOM 2325 C CB . GLU A-2 1 152 . 8.477 19.455 11.31 1 22.35 ? CB GLU A-2 132 1 
ATOM 2326 C CG . GLU A-2 1 152 . 8.287 19.916 12.741 1 25.22 ? CG GLU A-2 132 1 
ATOM 2327 C CD . GLU A-2 1 152 . 9.438 19.486 13.64 1 28.66 ? CD GLU A-2 132 1 
ATOM 2328 O OE1 . GLU A-2 1 152 . 10.369 18.824 13.119 1 29.4 ? OE1 GLU A-2 132 1 
ATOM 2329 O OE2 . GLU A-2 1 152 . 9.408 19.796 14.864 1 27.9 ? OE2 GLU A-2 132 1 
ATOM 2330 N N . GLN A-2 1 153 . 7.784 21.787 9.327 1 18.59 ? N GLN A-2 133 1 
ATOM 2331 C CA . GLN A-2 1 153 . 7.759 23.238 9.11 1 17.9 ? CA GLN A-2 133 1 
ATOM 2332 C C . GLN A-2 1 153 . 6.401 23.726 8.607 1 17.61 ? C GLN A-2 133 1 
ATOM 2333 O O . GLN A-2 1 153 . 5.913 24.77 9.054 1 17.1 ? O GLN A-2 133 1 
ATOM 2334 C CB . GLN A-2 1 153 . 8.864 23.655 8.132 1 17.94 ? CB GLN A-2 133 1 
ATOM 2335 C CG . GLN A-2 1 153 . 10.283 23.397 8.614 1 17.73 ? CG GLN A-2 133 1 
ATOM 2336 C CD . GLN A-2 1 153 . 10.702 21.942 8.523 1 17.56 ? CD GLN A-2 133 1 
ATOM 2337 O OE1 . GLN A-2 1 153 . 11.656 21.53 9.181 1 18.59 ? OE1 GLN A-2 133 1 
ATOM 2338 N NE2 . GLN A-2 1 153 . 9.99 21.153 7.728 1 17.33 ? NE2 GLN A-2 133 1 
ATOM 2339 N N . THR A-2 1 154 . 5.799 22.967 7.688 1 16.84 ? N THR A-2 134 1 
ATOM 2340 C CA . THR A-2 1 154 . 4.46 23.269 7.205 1 16.75 ? CA THR A-2 134 1 
ATOM 2341 C C . THR A-2 1 154 . 3.381 22.984 8.267 1 17.29 ? C THR A-2 134 1 
ATOM 2342 O O . THR A-2 1 154 . 2.404 23.73 8.387 1 16.7 ? O THR A-2 134 1 
ATOM 2343 C CB . THR A-2 1 154 . 4.142 22.502 5.918 1 16.56 ? CB THR A-2 134 1 
ATOM 2344 O OG1 . THR A-2 1 154 . 5.082 22.866 4.896 1 16.04 ? OG1 THR A-2 134 1 
ATOM 2345 C CG2 . THR A-2 1 154 . 2.735 22.838 5.441 1 16.22 ? CG2 THR A-2 134 1 
ATOM 2346 N N . ARG A-2 1 155 . 3.561 21.906 9.026 1 17.69 ? N ARG A-2 135 1 
ATOM 2347 C CA . ARG A-2 1 155 . 2.631 21.564 10.107 1 18.7 ? CA ARG A-2 135 1 
ATOM 2348 C C . ARG A-2 1 155 . 2.656 22.621 11.2 1 19.2 ? C ARG A-2 135 1 
ATOM 2349 O O . ARG A-2 1 155 . 1.611 22.955 11.768 1 19.98 ? O ARG A-2 135 1 
ATOM 2350 C CB . ARG A-2 1 155 . 2.95 20.187 10.708 1 18.16 ? CB ARG A-2 135 1 
ATOM 2351 C CG . ARG A-2 1 155 . 2.462 19.009 9.885 1 17.69 ? CG ARG A-2 135 1 
ATOM 2352 C CD . ARG A-2 1 155 . 2.669 17.694 10.622 1 18.28 ? CD ARG A-2 135 1 
ATOM 2353 N NE . ARG A-2 1 155 . 4.047 17.192 10.521 1 19.03 ? NE ARG A-2 135 1 
ATOM 2354 C CZ . ARG A-2 1 155 . 4.858 16.994 11.56 1 19.04 ? CZ ARG A-2 135 1 
ATOM 2355 N NH1 . ARG A-2 1 155 . 4.448 17.239 12.794 1 19.95 ? NH1 ARG A-2 135 1 
ATOM 2356 N NH2 . ARG A-2 1 155 . 6.081 16.537 11.373 1 19.38 ? NH2 ARG A-2 135 1 
ATOM 2357 N N . ALA A-2 1 156 . 3.851 23.151 11.47 1 19.27 ? N ALA A-2 136 1 
ATOM 2358 C CA . ALA A-2 1 156 . 4.065 24.174 12.494 1 19.11 ? CA ALA A-2 136 1 
ATOM 2359 C C . ALA A-2 1 156 . 3.235 25.428 12.242 1 19.33 ? C ALA A-2 136 1 
ATOM 2360 O O . ALA A-2 1 156 . 2.846 26.139 13.183 1 18.93 ? O ALA A-2 136 1 
ATOM 2361 C CB . ALA A-2 1 156 . 5.539 24.54 12.563 1 18.82 ? CB ALA A-2 136 1 
ATOM 2362 N N . VAL A-2 1 157 . 2.955 25.664 10.963 1 18.78 ? N VAL A-2 137 1 
ATOM 2363 C CA . VAL A-2 1 157 . 2.397 26.915 10.479 1 18.77 ? CA VAL A-2 137 1 
ATOM 2364 C C . VAL A-2 1 157 . 0.906 26.77 10.071 1 19.06 ? C VAL A-2 137 1 
ATOM 2365 O O . VAL A-2 1 157 . 0.274 27.705 9.566 1 18.69 ? O VAL A-2 137 1 
ATOM 2366 C CB . VAL A-2 1 157 . 3.334 27.442 9.353 1 18.86 ? CB VAL A-2 137 1 
ATOM 2367 C CG1 . VAL A-2 1 157 . 2.846 27.128 7.941 1 17.9 ? CG1 VAL A-2 137 1 
ATOM 2368 C CG2 . VAL A-2 1 157 . 3.713 28.895 9.575 1 18.89 ? CG2 VAL A-2 137 1 
ATOM 2369 N N . SER A-2 1 158 . 0.333 25.598 10.325 1 19.15 ? N SER A-2 138 1 
ATOM 2370 C CA . SER A-2 1 158 . -1.018 25.327 9.869 1 19.13 ? CA SER A-2 138 1 
ATOM 2371 C C . SER A-2 1 158 . -2.03 25.6 10.979 1 19.24 ? C SER A-2 138 1 
ATOM 2372 O O . SER A-2 1 158 . -1.669 25.64 12.159 1 20.2 ? O SER A-2 138 1 
ATOM 2373 C CB . SER A-2 1 158 . -1.12 23.897 9.377 1 19.43 ? CB SER A-2 138 1 
ATOM 2374 O OG . SER A-2 1 158 . -1.081 23.007 10.468 1 20.38 ? OG SER A-2 138 1 
ATOM 2375 N N . ASP A-2 1 159 . -3.29 25.804 10.597 1 18.68 ? N ASP A-2 139 1 
ATOM 2376 C CA . ASP A-2 1 159 . -4.378 25.994 11.564 1 18.23 ? CA ASP A-2 139 1 
ATOM 2377 C C . ASP A-2 1 159 . -4.927 24.654 11.996 1 18.55 ? C ASP A-2 139 1 
ATOM 2378 O O . ASP A-2 1 159 . -5.533 24.528 13.065 1 19.79 ? O ASP A-2 139 1 
ATOM 2379 C CB . ASP A-2 1 159 . -5.508 26.802 10.939 1 17.52 ? CB ASP A-2 139 1 
ATOM 2380 C CG . ASP A-2 1 159 . -5.066 28.174 10.531 1 17.32 ? CG ASP A-2 139 1 
ATOM 2381 O OD1 . ASP A-2 1 159 . -4.589 28.922 11.414 1 17.21 ? OD1 ASP A-2 139 1 
ATOM 2382 O OD2 . ASP A-2 1 159 . -5.178 28.497 9.33 1 17.28 ? OD2 ASP A-2 139 1 
ATOM 2383 N N . TYR A-2 1 160 . -4.738 23.657 11.147 1 17.88 ? N TYR A-2 140 1 
ATOM 2384 C CA . TYR A-2 1 160 . -5.29 22.346 11.391 1 17.61 ? CA TYR A-2 140 1 
ATOM 2385 C C . TYR A-2 1 160 . -4.428 21.294 10.714 1 17.45 ? C TYR A-2 140 1 
ATOM 2386 O O . TYR A-2 1 160 . -3.895 21.514 9.621 1 17.17 ? O TYR A-2 140 1 
ATOM 2387 C CB . TYR A-2 1 160 . -6.732 22.292 10.875 1 18.2 ? CB TYR A-2 140 1 
ATOM 2388 C CG . TYR A-2 1 160 . -7.42 20.969 11.098 1 18.6 ? CG TYR A-2 140 1 
ATOM 2389 C CD1 . TYR A-2 1 160 . -7.753 20.541 12.386 1 18.62 ? CD1 TYR A-2 140 1 
ATOM 2390 C CD2 . TYR A-2 1 160 . -7.742 20.143 10.018 1 18.49 ? CD2 TYR A-2 140 1 
ATOM 2391 C CE1 . TYR A-2 1 160 . -8.38 19.319 12.594 1 19.03 ? CE1 TYR A-2 140 1 
ATOM 2392 C CE2 . TYR A-2 1 160 . -8.369 18.922 10.216 1 18.49 ? CE2 TYR A-2 140 1 
ATOM 2393 C CZ . TYR A-2 1 160 . -8.686 18.512 11.501 1 18.94 ? CZ TYR A-2 140 1 
ATOM 2394 O OH . TYR A-2 1 160 . -9.315 17.298 11.701 1 18.32 ? OH TYR A-2 140 1 
ATOM 2395 N N . ILE A-2 1 161 . -4.268 20.172 11.404 1 17.7 ? N ILE A-2 141 1 
ATOM 2396 C CA . ILE A-2 1 161 . -3.621 18.981 10.878 1 17.79 ? CA ILE A-2 141 1 
ATOM 2397 C C . ILE A-2 1 161 . -4.669 17.885 10.862 1 17.15 ? C ILE A-2 141 1 
ATOM 2398 O O . ILE A-2 1 161 . -5.252 17.558 11.901 1 16.48 ? O ILE A-2 141 1 
ATOM 2399 C CB . ILE A-2 1 161 . -2.467 18.494 11.78 1 18.08 ? CB ILE A-2 141 1 
ATOM 2400 C CG1 . ILE A-2 1 161 . -1.43 19.595 11.987 1 18.54 ? CG1 ILE A-2 141 1 
ATOM 2401 C CG2 . ILE A-2 1 161 . -1.812 17.253 11.176 1 18.54 ? CG2 ILE A-2 141 1 
ATOM 2402 C CD1 . ILE A-2 1 161 . -0.925 20.191 10.693 1 19.29 ? CD1 ILE A-2 141 1 
ATOM 2403 N N . THR A-2 1 162 . -4.903 17.305 9.693 1 16.75 ? N THR A-2 142 1 
ATOM 2404 C CA . THR A-2 1 162 . -5.921 16.269 9.583 1 16.91 ? CA THR A-2 142 1 
ATOM 2405 C C . THR A-2 1 162 . -5.534 15.071 10.438 1 17.29 ? C THR A-2 142 1 
ATOM 2406 O O . THR A-2 1 162 . -4.357 14.91 10.794 1 16.57 ? O THR A-2 142 1 
ATOM 2407 C CB . THR A-2 1 162 . -6.119 15.839 8.123 1 16.94 ? CB THR A-2 142 1 
ATOM 2408 O OG1 . THR A-2 1 162 . -4.905 15.27 7.625 1 16.47 ? OG1 THR A-2 142 1 
ATOM 2409 C CG2 . THR A-2 1 162 . -6.492 17.044 7.285 1 16.74 ? CG2 THR A-2 142 1 
ATOM 2410 N N . THR A-2 1 163 . -6.529 14.263 10.798 1 18.12 ? N THR A-2 143 1 
ATOM 2411 C CA . THR A-2 1 163 . -6.291 12.961 11.43 1 19.09 ? CA THR A-2 143 1 
ATOM 2412 C C . THR A-2 1 163 . -5.929 11.916 10.366 1 19.4 ? C THR A-2 143 1 
ATOM 2413 O O . THR A-2 1 163 . -4.939 11.201 10.513 1 19.66 ? O THR A-2 143 1 
ATOM 2414 C CB . THR A-2 1 163 . -7.518 12.489 12.234 1 19.69 ? CB THR A-2 143 1 
ATOM 2415 O OG1 . THR A-2 1 163 . -7.811 13.452 13.257 1 21.18 ? OG1 THR A-2 143 1 
ATOM 2416 C CG2 . THR A-2 1 163 . -7.271 11.123 12.885 1 19.48 ? CG2 THR A-2 143 1 
ATOM 2417 N N . LYS A-2 1 164 . -6.73 11.83 9.307 1 19.26 ? N LYS A-2 144 1 
ATOM 2418 C CA . LYS A-2 1 164 . -6.443 10.915 8.203 1 19.44 ? CA LYS A-2 144 1 
ATOM 2419 C C . LYS A-2 1 164 . -5.297 11.459 7.368 1 18.38 ? C LYS A-2 144 1 
ATOM 2420 O O . LYS A-2 1 164 . -5.089 12.663 7.304 1 18.28 ? O LYS A-2 144 1 
ATOM 2421 C CB . LYS A-2 1 164 . -7.686 10.685 7.339 1 20.89 ? CB LYS A-2 144 1 
ATOM 2422 C CG . LYS A-2 1 164 . -8.77 9.859 8.022 1 22.85 ? CG LYS A-2 144 1 
ATOM 2423 C CD . LYS A-2 1 164 . -10.147 10.263 7.517 1 24.29 ? CD LYS A-2 144 1 
ATOM 2424 C CE . LYS A-2 1 164 . -11.267 9.651 8.347 1 24.89 ? CE LYS A-2 144 1 
ATOM 2425 N NZ . LYS A-2 1 164 . -12.146 8.75 7.542 1 25.78 ? NZ LYS A-2 144 1 
ATOM 2426 N N . THR A-2 1 165 . -4.552 10.561 6.744 1 17.34 ? N THR A-2 145 1 
ATOM 2427 C CA . THR A-2 1 165 . -3.368 10.92 5.993 1 17.01 ? CA THR A-2 145 1 
ATOM 2428 C C . THR A-2 1 165 . -3.712 11.168 4.521 1 16.55 ? C THR A-2 145 1 
ATOM 2429 O O . THR A-2 1 165 . -4.818 10.859 4.083 1 15.78 ? O THR A-2 145 1 
ATOM 2430 C CB . THR A-2 1 165 . -2.336 9.793 6.07 1 17.5 ? CB THR A-2 145 1 
ATOM 2431 O OG1 . THR A-2 1 165 . -2.91 8.6 5.523 1 18.86 ? OG1 THR A-2 145 1 
ATOM 2432 C CG2 . THR A-2 1 165 . -1.935 9.527 7.508 1 18.1 ? CG2 THR A-2 145 1 
ATOM 2433 N N . GLY A-2 1 166 . -2.74 11.693 3.765 1 16.04 ? N GLY A-2 146 1 
ATOM 2434 C CA . GLY A-2 1 166 . -2.92 12.052 2.351 1 15.23 ? CA GLY A-2 146 1 
ATOM 2435 C C . GLY A-2 1 166 . -3.223 10.857 1.478 1 14.95 ? C GLY A-2 146 1 
ATOM 2436 O O . GLY A-2 1 166 . -2.605 9.807 1.621 1 14.38 ? O GLY A-2 146 1 
ATOM 2437 N N . GLY A-2 1 167 . -4.194 11.008 0.587 1 14.78 ? N GLY A-2 147 1 
ATOM 2438 C CA . GLY A-2 1 167 . -4.655 9.886 -0.237 1 16.36 ? CA GLY A-2 147 1 
ATOM 2439 C C . GLY A-2 1 167 . -5.367 8.827 0.59 1 16.82 ? C GLY A-2 147 1 
ATOM 2440 O O . GLY A-2 1 167 . -5.537 7.701 0.155 1 17.3 ? O GLY A-2 147 1 
ATOM 2441 N N . ASN A-2 1 168 . -5.786 9.198 1.791 1 17.27 ? N ASN A-2 148 1 
ATOM 2442 C CA . ASN A-2 1 168 . -6.492 8.283 2.67 1 18.24 ? CA ASN A-2 148 1 
ATOM 2443 C C . ASN A-2 1 168 . -7.625 8.976 3.415 1 17.4 ? C ASN A-2 148 1 
ATOM 2444 O O . ASN A-2 1 168 . -8.112 8.482 4.428 1 17.12 ? O ASN A-2 148 1 
ATOM 2445 C CB . ASN A-2 1 168 . -5.513 7.632 3.652 1 19.85 ? CB ASN A-2 148 1 
ATOM 2446 C CG . ASN A-2 1 168 . -4.816 6.431 3.055 1 21.28 ? CG ASN A-2 148 1 
ATOM 2447 O OD1 . ASN A-2 1 168 . -3.607 6.456 2.802 1 22.45 ? OD1 ASN A-2 148 1 
ATOM 2448 N ND2 . ASN A-2 1 168 . -5.585 5.374 2.796 1 22.05 ? ND2 ASN A-2 148 1 
ATOM 2449 N N . GLY A-2 1 169 . -8.036 10.131 2.905 1 17.22 ? N GLY A-2 149 1 
ATOM 2450 C CA . GLY A-2 1 169 . -9.204 10.819 3.448 1 16.81 ? CA GLY A-2 149 1 
ATOM 2451 C C . GLY A-2 1 169 . -8.89 12.065 4.244 1 16.21 ? C GLY A-2 149 1 
ATOM 2452 O O . GLY A-2 1 169 . -9.758 12.573 4.964 1 16.33 ? O GLY A-2 149 1 
ATOM 2453 N N . ALA A-2 1 170 . -7.657 12.561 4.125 1 15.22 ? N ALA A-2 150 1 
ATOM 2454 C CA . ALA A-2 1 170 . -7.325 13.883 4.653 1 14.62 ? CA ALA A-2 150 1 
ATOM 2455 C C . ALA A-2 1 170 . -8.235 14.947 4.032 1 14.36 ? C ALA A-2 150 1 
ATOM 2456 O O . ALA A-2 1 170 . -8.765 15.81 4.737 1 14.23 ? O ALA A-2 150 1 
ATOM 2457 C CB . ALA A-2 1 170 . -5.864 14.213 4.394 1 14.39 ? CB ALA A-2 150 1 
ATOM 2458 N N . VAL A-2 1 171 . -8.415 14.871 2.714 1 13.91 ? N VAL A-2 151 1 
ATOM 2459 C CA . VAL A-2 1 171 . -9.264 15.814 1.978 1 13.98 ? CA VAL A-2 151 1 
ATOM 2460 C C . VAL A-2 1 171 . -10.739 15.669 2.366 1 13.92 ? C VAL A-2 151 1 
ATOM 2461 O O . VAL A-2 1 171 . -11.41 16.651 2.708 1 14.03 ? O VAL A-2 151 1 
ATOM 2462 C CB . VAL A-2 1 171 . -9.068 15.683 0.45 1 13.88 ? CB VAL A-2 151 1 
ATOM 2463 C CG1 . VAL A-2 1 171 . -10.095 16.508 -0.302 1 13.69 ? CG1 VAL A-2 151 1 
ATOM 2464 C CG2 . VAL A-2 1 171 . -7.66 16.109 0.069 1 13.97 ? CG2 VAL A-2 151 1 
ATOM 2465 N N . ARG A-2 1 172 . -11.242 14.442 2.324 1 14.07 ? N ARG A-2 152 1 
ATOM 2466 C CA . ARG A-2 1 172 . -12.595 14.172 2.788 1 13.88 ? CA ARG A-2 152 1 
ATOM 2467 C C . ARG A-2 1 172 . -12.808 14.845 4.136 1 13.89 ? C ARG A-2 152 1 
ATOM 2468 O O . ARG A-2 1 172 . -13.787 15.554 4.325 1 13.82 ? O ARG A-2 152 1 
ATOM 2469 C CB . ARG A-2 1 172 . -12.855 12.661 2.867 1 13.6 ? CB ARG A-2 152 1 
ATOM 2470 C CG . ARG A-2 1 172 . -14.204 12.265 3.463 1 13.54 ? CG ARG A-2 152 1 
ATOM 2471 C CD . ARG A-2 1 172 . -15.394 12.993 2.835 1 13.41 ? CD ARG A-2 152 1 
ATOM 2472 N NE . ARG A-2 1 172 . -16.642 12.333 3.224 1 13.48 ? NE ARG A-2 152 1 
ATOM 2473 C CZ . ARG A-2 1 172 . -17.168 11.293 2.571 1 13.33 ? CZ ARG A-2 152 1 
ATOM 2474 N NH1 . ARG A-2 1 172 . -16.569 10.822 1.485 1 12.91 ? NH1 ARG A-2 152 1 
ATOM 2475 N NH2 . ARG A-2 1 172 . -18.288 10.726 3.003 1 13.23 ? NH2 ARG A-2 152 1 
ATOM 2476 N N . GLU A-2 1 173 . -11.864 14.641 5.052 1 14.35 ? N GLU A-2 153 1 
ATOM 2477 C CA . GLU A-2 1 173 . -11.957 15.158 6.408 1 15 ? CA GLU A-2 153 1 
ATOM 2478 C C . GLU A-2 1 173 . -12.076 16.687 6.454 1 15.04 ? C GLU A-2 153 1 
ATOM 2479 O O . GLU A-2 1 173 . -12.904 17.232 7.194 1 15.05 ? O GLU A-2 153 1 
ATOM 2480 C CB . GLU A-2 1 173 . -10.745 14.685 7.211 1 15.62 ? CB GLU A-2 153 1 
ATOM 2481 C CG . GLU A-2 1 173 . -10.743 15.11 8.661 1 16.6 ? CG GLU A-2 153 1 
ATOM 2482 C CD . GLU A-2 1 173 . -9.538 14.571 9.405 1 17.36 ? CD GLU A-2 153 1 
ATOM 2483 O OE1 . GLU A-2 1 173 . -9.043 13.484 9.046 1 18.11 ? OE1 GLU A-2 153 1 
ATOM 2484 O OE2 . GLU A-2 1 173 . -9.073 15.24 10.344 1 18 ? OE2 GLU A-2 153 1 
ATOM 2485 N N . VAL A-2 1 174 . -11.255 17.375 5.661 1 14.75 ? N VAL A-2 154 1 
ATOM 2486 C CA . VAL A-2 1 174 . -11.288 18.835 5.622 1 14.57 ? CA VAL A-2 154 1 
ATOM 2487 C C . VAL A-2 1 174 . -12.56 19.351 4.932 1 14.4 ? C VAL A-2 154 1 
ATOM 2488 O O . VAL A-2 1 174 . -13.095 20.411 5.295 1 14.56 ? O VAL A-2 154 1 
ATOM 2489 C CB . VAL A-2 1 174 . -9.973 19.447 5.055 1 14.48 ? CB VAL A-2 154 1 
ATOM 2490 C CG1 . VAL A-2 1 174 . -9.635 18.887 3.689 1 15.07 ? CG1 VAL A-2 154 1 
ATOM 2491 C CG2 . VAL A-2 1 174 . -10.052 20.958 4.989 1 14.45 ? CG2 VAL A-2 154 1 
ATOM 2492 N N . CYS A-2 1 175 . -13.073 18.583 3.975 1 14.19 ? N CYS A-2 155 1 
ATOM 2493 C CA . CYS A-2 1 175 . -14.31 18.95 3.314 1 14.16 ? CA CYS A-2 155 1 
ATOM 2494 C C . CYS A-2 1 175 . -15.453 18.954 4.305 1 14.11 ? C CYS A-2 155 1 
ATOM 2495 O O . CYS A-2 1 175 . -16.272 19.877 4.348 1 13.74 ? O CYS A-2 155 1 
ATOM 2496 C CB . CYS A-2 1 175 . -14.606 17.973 2.196 1 14.48 ? CB CYS A-2 155 1 
ATOM 2497 S SG . CYS A-2 1 175 . -13.51 18.212 0.801 1 14.49 ? SG CYS A-2 155 1 
ATOM 2498 N N . GLU A-2 1 176 . -15.487 17.909 5.112 1 14.1 ? N GLU A-2 156 1 
ATOM 2499 C CA . GLU A-2 1 176 . -16.496 17.771 6.138 1 14.71 ? CA GLU A-2 156 1 
ATOM 2500 C C . GLU A-2 1 176 . -16.396 18.878 7.166 1 14.72 ? C GLU A-2 156 1 
ATOM 2501 O O . GLU A-2 1 176 . -17.407 19.4 7.6 1 14.97 ? O GLU A-2 156 1 
ATOM 2502 C CB . GLU A-2 1 176 . -16.393 16.402 6.781 1 14.89 ? CB GLU A-2 156 1 
ATOM 2503 C CG . GLU A-2 1 176 . -16.762 15.311 5.795 1 15.33 ? CG GLU A-2 156 1 
ATOM 2504 C CD . GLU A-2 1 176 . -16.975 13.971 6.455 1 16.36 ? CD GLU A-2 156 1 
ATOM 2505 O OE1 . GLU A-2 1 176 . -16.82 13.878 7.699 1 15.29 ? OE1 GLU A-2 156 1 
ATOM 2506 O OE2 . GLU A-2 1 176 . -17.298 13.015 5.707 1 16.6 ? OE2 GLU A-2 156 1 
ATOM 2507 N N . LEU A-2 1 177 . -15.169 19.258 7.499 1 14.73 ? N LEU A-2 157 1 
ATOM 2508 C CA . LEU A-2 1 177 . -14.907 20.327 8.446 1 15.05 ? CA LEU A-2 157 1 
ATOM 2509 C C . LEU A-2 1 177 . -15.409 21.698 7.967 1 14.6 ? C LEU A-2 157 1 
ATOM 2510 O O . LEU A-2 1 177 . -16.058 22.432 8.716 1 13.99 ? O LEU A-2 157 1 
ATOM 2511 C CB . LEU A-2 1 177 . -13.409 20.391 8.717 1 15.82 ? CB LEU A-2 157 1 
ATOM 2512 C CG . LEU A-2 1 177 . -12.981 20.503 10.177 1 16.57 ? CG LEU A-2 157 1 
ATOM 2513 C CD1 . LEU A-2 1 177 . -11.491 20.231 10.304 1 16.82 ? CD1 LEU A-2 157 1 
ATOM 2514 C CD2 . LEU A-2 1 177 . -13.312 21.872 10.746 1 17.01 ? CD2 LEU A-2 157 1 
ATOM 2515 N N . ILE A-2 1 178 . -15.099 22.044 6.717 1 14.9 ? N ILE A-2 158 1 
ATOM 2516 C CA . ILE A-2 1 178 . -15.569 23.299 6.144 1 14.88 ? CA ILE A-2 158 1 
ATOM 2517 C C . ILE A-2 1 178 . -17.1 23.297 6.055 1 14.75 ? C ILE A-2 158 1 
ATOM 2518 O O . ILE A-2 1 178 . -17.758 24.279 6.426 1 14.37 ? O ILE A-2 158 1 
ATOM 2519 C CB . ILE A-2 1 178 . -14.915 23.595 4.78 1 14.84 ? CB ILE A-2 158 1 
ATOM 2520 C CG1 . ILE A-2 1 178 . -13.398 23.775 4.951 1 15.13 ? CG1 ILE A-2 158 1 
ATOM 2521 C CG2 . ILE A-2 1 178 . -15.515 24.853 4.193 1 15.13 ? CG2 ILE A-2 158 1 
ATOM 2522 C CD1 . ILE A-2 1 178 . -12.586 23.626 3.683 1 14.73 ? CD1 ILE A-2 158 1 
ATOM 2523 N N . LEU A-2 1 179 . -17.663 22.184 5.596 1 14.65 ? N LEU A-2 159 1 
ATOM 2524 C CA . LEU A-2 1 179 . -19.117 22.048 5.536 1 14.98 ? CA LEU A-2 159 1 
ATOM 2525 C C . LEU A-2 1 179 . -19.779 22.32 6.895 1 15.03 ? C LEU A-2 159 1 
ATOM 2526 O O . LEU A-2 1 179 . -20.746 23.081 6.955 1 14.71 ? O LEU A-2 159 1 
ATOM 2527 C CB . LEU A-2 1 179 . -19.521 20.68 4.983 1 14.97 ? CB LEU A-2 159 1 
ATOM 2528 C CG . LEU A-2 1 179 . -19.308 20.446 3.477 1 15.14 ? CG LEU A-2 159 1 
ATOM 2529 C CD1 . LEU A-2 1 179 . -19.539 18.979 3.129 1 14.66 ? CD1 LEU A-2 159 1 
ATOM 2530 C CD2 . LEU A-2 1 179 . -20.223 21.337 2.64 1 15.17 ? CD2 LEU A-2 159 1 
ATOM 2531 N N . LYS A-2 1 180 . -19.238 21.729 7.968 1 15.33 ? N LYS A-2 160 1 
ATOM 2532 C CA . LYS A-2 1 180 . -19.777 21.885 9.34 1 16.14 ? CA LYS A-2 160 1 
ATOM 2533 C C . LYS A-2 1 180 . -19.664 23.326 9.848 1 16.41 ? C LYS A-2 160 1 
ATOM 2534 O O . LYS A-2 1 180 . -20.57 23.843 10.519 1 16.11 ? O LYS A-2 160 1 
ATOM 2535 C CB . LYS A-2 1 180 . -19.056 20.957 10.315 1 16.9 ? CB LYS A-2 160 1 
ATOM 2536 C CG . LYS A-2 1 180 . -19.429 19.491 10.172 1 18.32 ? CG LYS A-2 160 1 
ATOM 2537 C CD . LYS A-2 1 180 . -18.367 18.591 10.78 1 19.7 ? CD LYS A-2 160 1 
ATOM 2538 C CE . LYS A-2 1 180 . -18.877 17.174 11 1 20.33 ? CE LYS A-2 160 1 
ATOM 2539 N NZ . LYS A-2 1 180 . -17.828 16.332 11.65 1 21.36 ? NZ LYS A-2 160 1 
ATOM 2540 N N . ALA A-2 1 181 . -18.549 23.972 9.512 1 16.19 ? N ALA A-2 161 1 
ATOM 2541 C CA . ALA A-2 1 181 . -18.354 25.365 9.865 1 16.45 ? CA ALA A-2 161 1 
ATOM 2542 C C . ALA A-2 1 181 . -19.377 26.262 9.166 1 16.61 ? C ALA A-2 161 1 
ATOM 2543 O O . ALA A-2 1 181 . -19.826 27.245 9.739 1 16.19 ? O ALA A-2 161 1 
ATOM 2544 C CB . ALA A-2 1 181 . -16.941 25.794 9.543 1 16.06 ? CB ALA A-2 161 1 
ATOM 2545 N N . GLN A-2 1 182 . -19.773 25.888 7.948 1 17.15 ? N GLN A-2 162 1 
ATOM 2546 C CA . GLN A-2 1 182 . -20.709 26.686 7.146 1 16.75 ? CA GLN A-2 162 1 
ATOM 2547 C C . GLN A-2 1 182 . -22.18 26.216 7.254 1 17.22 ? C GLN A-2 162 1 
ATOM 2548 O O . GLN A-2 1 182 . -23.055 26.672 6.499 1 16.43 ? O GLN A-2 162 1 
ATOM 2549 C CB . GLN A-2 1 182 . -20.23 26.759 5.69 1 16.81 ? CB GLN A-2 162 1 
ATOM 2550 C CG . GLN A-2 1 182 . -18.767 27.201 5.576 1 16.78 ? CG GLN A-2 162 1 
ATOM 2551 C CD . GLN A-2 1 182 . -18.361 27.676 4.186 1 17.15 ? CD GLN A-2 162 1 
ATOM 2552 O OE1 . GLN A-2 1 182 . -19.124 27.565 3.224 1 17.04 ? OE1 GLN A-2 162 1 
ATOM 2553 N NE2 . GLN A-2 1 182 . -17.149 28.228 4.081 1 16.82 ? NE2 GLN A-2 162 1 
ATOM 2554 N N . ASN A-2 1 183 . -22.44 25.335 8.222 1 17.32 ? N ASN A-2 163 1 
ATOM 2555 C CA . ASN A-2 1 183 . -23.766 24.765 8.456 1 18.21 ? CA ASN A-2 163 1 
ATOM 2556 C C . ASN A-2 1 183 . -24.359 24.091 7.217 1 18.33 ? C ASN A-2 163 1 
ATOM 2557 O O . ASN A-2 1 183 . -25.548 24.265 6.926 1 18.06 ? O ASN A-2 163 1 
ATOM 2558 C CB . ASN A-2 1 183 . -24.735 25.839 8.986 1 18.73 ? CB ASN A-2 163 1 
ATOM 2559 C CG . ASN A-2 1 183 . -24.203 26.554 10.205 1 18.52 ? CG ASN A-2 163 1 
ATOM 2560 O OD1 . ASN A-2 1 183 . -23.58 25.956 11.077 1 18.59 ? OD1 ASN A-2 163 1 
ATOM 2561 N ND2 . ASN A-2 1 183 . -24.457 27.848 10.273 1 19.45 ? ND2 ASN A-2 163 1 
ATOM 2562 N N . ASN A-2 1 184 . -23.529 23.333 6.498 1 17.61 ? N ASN A-2 164 1 
ATOM 2563 C CA . ASN A-2 1 184 . -23.958 22.663 5.275 1 18.08 ? CA ASN A-2 164 1 
ATOM 2564 C C . ASN A-2 1 184 . -23.794 21.143 5.303 1 17.8 ? C ASN A-2 164 1 
ATOM 2565 O O . ASN A-2 1 184 . -24.254 20.441 4.403 1 18.16 ? O ASN A-2 164 1 
ATOM 2566 C CB . ASN A-2 1 184 . -23.237 23.275 4.067 1 18.87 ? CB ASN A-2 164 1 
ATOM 2567 C CG . ASN A-2 1 184 . -23.689 24.699 3.792 1 19.63 ? CG ASN A-2 164 1 
ATOM 2568 O OD1 . ASN A-2 1 184 . -24.883 24.983 3.81 1 20.05 ? OD1 ASN A-2 164 1 
ATOM 2569 N ND2 . ASN A-2 1 184 . -22.739 25.602 3.544 1 19.64 ? ND2 ASN A-2 164 1 
ATOM 2570 N N . PHE A-2 1 185 . -23.168 20.638 6.359 1 17.97 ? N PHE A-2 165 1 
ATOM 2571 C CA . PHE A-2 1 185 . -22.821 19.224 6.442 1 17.41 ? CA PHE A-2 165 1 
ATOM 2572 C C . PHE A-2 1 185 . -24.028 18.346 6.745 1 17.35 ? C PHE A-2 165 1 
ATOM 2573 O O . PHE A-2 1 185 . -24.346 17.439 5.96 1 16.96 ? O PHE A-2 165 1 
ATOM 2574 C CB . PHE A-2 1 185 . -21.716 18.993 7.483 1 17.71 ? CB PHE A-2 165 1 
ATOM 2575 C CG . PHE A-2 1 185 . -21.298 17.542 7.618 1 18.07 ? CG PHE A-2 165 1 
ATOM 2576 C CD1 . PHE A-2 1 185 . -20.592 16.902 6.592 1 17.97 ? CD1 PHE A-2 165 1 
ATOM 2577 C CD2 . PHE A-2 1 185 . -21.631 16.809 8.756 1 17.77 ? CD2 PHE A-2 165 1 
ATOM 2578 C CE1 . PHE A-2 1 185 . -20.223 15.566 6.707 1 18.13 ? CE1 PHE A-2 165 1 
ATOM 2579 C CE2 . PHE A-2 1 185 . -21.254 15.475 8.875 1 17.85 ? CE2 PHE A-2 165 1 
ATOM 2580 C CZ . PHE A-2 1 185 . -20.552 14.853 7.85 1 17.97 ? CZ PHE A-2 165 1 
ATOM 2581 N N . ASP A-2 1 186 . -24.687 18.61 7.882 1 17 ? N ASP A-2 166 1 
ATOM 2582 C CA . ASP A-2 1 186 . -25.853 17.828 8.303 1 16.78 ? CA ASP A-2 166 1 
ATOM 2583 C C . ASP A-2 1 186 . -26.92 17.746 7.215 1 16.59 ? C ASP A-2 166 1 
ATOM 2584 O O . ASP A-2 1 186 . -27.477 16.672 6.972 1 16.65 ? O ASP A-2 166 1 
ATOM 2585 C CB . ASP A-2 1 186 . -26.444 18.354 9.619 1 17.3 ? CB ASP A-2 166 1 
ATOM 2586 C CG . ASP A-2 1 186 . -25.554 18.063 10.821 1 17.79 ? CG ASP A-2 166 1 
ATOM 2587 O OD1 . ASP A-2 1 186 . -24.421 17.567 10.62 1 17.29 ? OD1 ASP A-2 166 1 
ATOM 2588 O OD2 . ASP A-2 1 186 . -25.982 18.347 11.967 1 18.04 ? OD2 ASP A-2 166 1 
ATOM 2589 N N . ALA A-2 1 187 . -27.189 18.866 6.548 1 16.16 ? N ALA A-2 167 1 
ATOM 2590 C CA . ALA A-2 1 187 . -28.146 18.879 5.432 1 15.87 ? CA ALA A-2 167 1 
ATOM 2591 C C . ALA A-2 1 187 . -27.718 17.953 4.289 1 15.59 ? C ALA A-2 167 1 
ATOM 2592 O O . ALA A-2 1 187 . -28.539 17.211 3.743 1 15.56 ? O ALA A-2 167 1 
ATOM 2593 C CB . ALA A-2 1 187 . -28.364 20.298 4.918 1 15.66 ? CB ALA A-2 167 1 
ATOM 2594 N N . PHE A-2 1 188 . -26.436 18.002 3.936 1 15.68 ? N PHE A-2 168 1 
ATOM 2595 C CA . PHE A-2 1 188 . -25.888 17.147 2.883 1 15.98 ? CA PHE A-2 168 1 
ATOM 2596 C C . PHE A-2 1 188 . -26.082 15.666 3.239 1 16.15 ? C PHE A-2 168 1 
ATOM 2597 O O . PHE A-2 1 188 . -26.606 14.87 2.44 1 15.8 ? O PHE A-2 168 1 
ATOM 2598 C CB . PHE A-2 1 188 . -24.405 17.48 2.641 1 15.76 ? CB PHE A-2 168 1 
ATOM 2599 C CG . PHE A-2 1 188 . -23.738 16.596 1.616 1 15.66 ? CG PHE A-2 168 1 
ATOM 2600 C CD1 . PHE A-2 1 188 . -24.065 16.702 0.259 1 15.22 ? CD1 PHE A-2 168 1 
ATOM 2601 C CD2 . PHE A-2 1 188 . -22.774 15.661 2.004 1 15.35 ? CD2 PHE A-2 168 1 
ATOM 2602 C CE1 . PHE A-2 1 188 . -23.456 15.882 -0.691 1 15.41 ? CE1 PHE A-2 168 1 
ATOM 2603 C CE2 . PHE A-2 1 188 . -22.168 14.835 1.054 1 15.46 ? CE2 PHE A-2 168 1 
ATOM 2604 C CZ . PHE A-2 1 188 . -22.507 14.95 -0.294 1 14.69 ? CZ PHE A-2 168 1 
ATOM 2605 N N . ILE A-2 1 189 . -25.67 15.323 4.454 1 16.29 ? N ILE A-2 169 1 
ATOM 2606 C CA . ILE A-2 1 189 . -25.852 13.988 5.007 1 16.63 ? CA ILE A-2 169 1 
ATOM 2607 C C . ILE A-2 1 189 . -27.3 13.571 4.862 1 16.7 ? C ILE A-2 169 1 
ATOM 2608 O O . ILE A-2 1 189 . -27.581 12.501 4.337 1 16.66 ? O ILE A-2 169 1 
ATOM 2609 C CB . ILE A-2 1 189 . -25.466 13.941 6.501 1 16.9 ? CB ILE A-2 169 1 
ATOM 2610 C CG1 . ILE A-2 1 189 . -23.954 14.099 6.684 1 17.11 ? CG1 ILE A-2 169 1 
ATOM 2611 C CG2 . ILE A-2 1 189 . -25.971 12.668 7.166 1 16.84 ? CG2 ILE A-2 169 1 
ATOM 2612 C CD1 . ILE A-2 1 189 . -23.127 13.479 5.575 1 17.67 ? CD1 ILE A-2 169 1 
ATOM 2613 N N . ALA A-2 1 190 . -28.211 14.432 5.322 1 16.88 ? N ALA A-2 170 1 
ATOM 2614 C CA . ALA A-2 1 190 . -29.653 14.154 5.273 1 16.31 ? CA ALA A-2 170 1 
ATOM 2615 C C . ALA A-2 1 190 . -30.167 13.722 3.895 1 16.06 ? C ALA A-2 170 1 
ATOM 2616 O O . ALA A-2 1 190 . -31.126 12.958 3.823 1 15.46 ? O ALA A-2 170 1 
ATOM 2617 C CB . ALA A-2 1 190 . -30.458 15.339 5.809 1 16.06 ? CB ALA A-2 170 1 
ATOM 2618 N N . THR A-2 1 191 . -29.544 14.194 2.809 1 16.17 ? N THR A-2 171 1 
ATOM 2619 C CA . THR A-2 1 191 . -29.987 13.792 1.454 1 15.78 ? CA THR A-2 171 1 
ATOM 2620 C C . THR A-2 1 191 . -29.718 12.31 1.146 1 15.75 ? C THR A-2 171 1 
ATOM 2621 O O . THR A-2 1 191 . -30.181 11.78 0.128 1 15.23 ? O THR A-2 171 1 
ATOM 2622 C CB . THR A-2 1 191 . -29.376 14.651 0.321 1 16.3 ? CB THR A-2 171 1 
ATOM 2623 O OG1 . THR A-2 1 191 . -27.984 14.339 0.166 1 16.33 ? OG1 THR A-2 171 1 
ATOM 2624 C CG2 . THR A-2 1 191 . -29.567 16.144 0.584 1 16.51 ? CG2 THR A-2 171 1 
ATOM 2625 N N . PHE A-2 1 192 . -28.977 11.651 2.037 1 15.41 ? N PHE A-2 172 1 
ATOM 2626 C CA . PHE A-2 1 192 . -28.619 10.248 1.863 1 15.37 ? CA PHE A-2 172 1 
ATOM 2627 C C . PHE A-2 1 192 . -29.351 9.392 2.882 1 15.83 ? C PHE A-2 172 1 
ATOM 2628 O O . PHE A-2 1 192 . -29.126 8.184 2.96 1 16.04 ? O PHE A-2 172 1 
ATOM 2629 C CB . PHE A-2 1 192 . -27.102 10.057 1.989 1 14.9 ? CB PHE A-2 172 1 
ATOM 2630 C CG . PHE A-2 1 192 . -26.318 10.676 0.857 1 14.81 ? CG PHE A-2 172 1 
ATOM 2631 C CD1 . PHE A-2 1 192 . -26.224 10.03 -0.386 1 14.76 ? CD1 PHE A-2 172 1 
ATOM 2632 C CD2 . PHE A-2 1 192 . -25.691 11.902 1.021 1 14.46 ? CD2 PHE A-2 172 1 
ATOM 2633 C CE1 . PHE A-2 1 192 . -25.522 10.599 -1.444 1 14.52 ? CE1 PHE A-2 172 1 
ATOM 2634 C CE2 . PHE A-2 1 192 . -24.981 12.478 -0.029 1 15.22 ? CE2 PHE A-2 172 1 
ATOM 2635 C CZ . PHE A-2 1 192 . -24.887 11.824 -1.263 1 14.79 ? CZ PHE A-2 172 1 
ATOM 2636 N N . GLN A-2 1 193 . -30.214 10.03 3.671 1 15.56 ? N GLN A-2 173 1 
ATOM 2637 C CA . GLN A-2 1 193 . -30.963 9.338 4.712 1 15.64 ? CA GLN A-2 173 1 
ATOM 2638 C C . GLN A-2 1 193 . -32.454 9.375 4.42 1 15.47 ? C GLN A-2 173 1 
ATOM 2639 O O . GLN A-2 1 193 . -33.2 8.64 5.044 1 15.85 ? O GLN A-2 173 1 
ATOM 2640 C CB . GLN A-2 1 193 . -30.694 9.974 6.075 1 15.53 ? CB GLN A-2 173 1 
ATOM 2641 C CG . GLN A-2 1 193 . -29.253 9.893 6.552 1 15.1 ? CG GLN A-2 173 1 
ATOM 2642 C CD . GLN A-2 1 193 . -29.051 10.679 7.832 1 14.91 ? CD GLN A-2 173 1 
ATOM 2643 O OE1 . GLN A-2 1 193 . -29.572 11.781 7.982 1 14.75 ? OE1 GLN A-2 173 1 
ATOM 2644 N NE2 . GLN A-2 1 193 . -28.305 10.113 8.766 1 15.17 ? NE2 GLN A-2 173 1 
ATOM 2645 N N . HIS A-3 1 20 . 10.104 -22.583 21.041 1 48.34 ? N HIS A-3 0 1 
ATOM 2646 C CA . HIS A-3 1 20 . 11.566 -22.545 20.738 1 49.45 ? CA HIS A-3 0 1 
ATOM 2647 C C . HIS A-3 1 20 . 11.876 -23.043 19.326 1 46.41 ? C HIS A-3 0 1 
ATOM 2648 O O . HIS A-3 1 20 . 11.283 -24.013 18.851 1 45.94 ? O HIS A-3 0 1 
ATOM 2649 C CB . HIS A-3 1 20 . 12.363 -23.348 21.773 1 52.97 ? CB HIS A-3 0 1 
ATOM 2650 C CG . HIS A-3 1 20 . 13.85 -23.221 21.62 1 57.04 ? CG HIS A-3 0 1 
ATOM 2651 N ND1 . HIS A-3 1 20 . 14.578 -23.991 20.736 1 57.4 ? ND1 HIS A-3 0 1 
ATOM 2652 C CD2 . HIS A-3 1 20 . 14.743 -22.406 22.23 1 58.45 ? CD2 HIS A-3 0 1 
ATOM 2653 C CE1 . HIS A-3 1 20 . 15.855 -23.662 20.815 1 57.94 ? CE1 HIS A-3 0 1 
ATOM 2654 N NE2 . HIS A-3 1 20 . 15.983 -22.705 21.717 1 58.53 ? NE2 HIS A-3 0 1 
ATOM 2655 N N . MET A-3 1 21 . 12.842 -22.389 18.689 1 43.8 ? N MET A-3 1 1 
ATOM 2656 C CA . MET A-3 1 21 . 13.091 -22.533 17.256 1 42.39 ? CA MET A-3 1 1 
ATOM 2657 C C . MET A-3 1 21 . 13.675 -23.865 16.785 1 39.99 ? C MET A-3 1 1 
ATOM 2658 O O . MET A-3 1 21 . 13.447 -24.257 15.639 1 38.36 ? O MET A-3 1 1 
ATOM 2659 C CB . MET A-3 1 21 . 13.956 -21.376 16.754 1 44.52 ? CB MET A-3 1 1 
ATOM 2660 C CG . MET A-3 1 21 . 13.616 -20.911 15.345 1 47.55 ? CG MET A-3 1 1 
ATOM 2661 S SD . MET A-3 1 21 . 12.177 -19.825 15.271 1 50 ? SD MET A-3 1 1 
ATOM 2662 C CE . MET A-3 1 21 . 10.855 -20.983 14.925 1 49.59 ? CE MET A-3 1 1 
ATOM 2663 N N . ASN A-3 1 22 . 14.436 -24.55 17.644 1 38.82 ? N ASN A-3 2 1 
ATOM 2664 C CA . ASN A-3 1 22 . 15.035 -25.84 17.268 1 36.62 ? CA ASN A-3 2 1 
ATOM 2665 C C . ASN A-3 1 22 . 13.997 -26.865 16.82 1 35.42 ? C ASN A-3 2 1 
ATOM 2666 O O . ASN A-3 1 22 . 14.267 -27.692 15.942 1 33.97 ? O ASN A-3 2 1 
ATOM 2667 C CB . ASN A-3 1 22 . 15.908 -26.427 18.381 1 36.59 ? CB ASN A-3 2 1 
ATOM 2668 C CG . ASN A-3 1 22 . 16.652 -27.68 17.932 1 36.28 ? CG ASN A-3 2 1 
ATOM 2669 O OD1 . ASN A-3 1 22 . 17.231 -27.716 16.848 1 35.62 ? OD1 ASN A-3 2 1 
ATOM 2670 N ND2 . ASN A-3 1 22 . 16.629 -28.712 18.758 1 35.55 ? ND2 ASN A-3 2 1 
ATOM 2671 N N . GLU A-3 1 23 . 12.811 -26.79 17.419 1 35.48 ? N GLU A-3 3 1 
ATOM 2672 C CA . GLU A-3 1 23 . 11.677 -27.619 17.018 1 36.55 ? CA GLU A-3 3 1 
ATOM 2673 C C . GLU A-3 1 23 . 11.352 -27.421 15.538 1 34.33 ? C GLU A-3 3 1 
ATOM 2674 O O . GLU A-3 1 23 . 11.007 -28.368 14.84 1 34 ? O GLU A-3 3 1 
ATOM 2675 C CB . GLU A-3 1 23 . 10.446 -27.302 17.866 1 37.94 ? CB GLU A-3 3 1 
ATOM 2676 C CG . GLU A-3 1 23 . 10.661 -27.483 19.358 1 40.69 ? CG GLU A-3 3 1 
ATOM 2677 C CD . GLU A-3 1 23 . 9.378 -27.796 20.106 1 42.48 ? CD GLU A-3 3 1 
ATOM 2678 O OE1 . GLU A-3 1 23 . 8.429 -26.98 20.039 1 43.46 ? OE1 GLU A-3 3 1 
ATOM 2679 O OE2 . GLU A-3 1 23 . 9.321 -28.867 20.755 1 40.81 ? OE2 GLU A-3 3 1 
ATOM 2680 N N . ILE A-3 1 24 . 11.489 -26.189 15.066 1 32.57 ? N ILE A-3 4 1 
ATOM 2681 C CA . ILE A-3 1 24 . 11.204 -25.869 13.672 1 32.59 ? CA ILE A-3 4 1 
ATOM 2682 C C . ILE A-3 1 24 . 12.382 -26.257 12.766 1 32.45 ? C ILE A-3 4 1 
ATOM 2683 O O . ILE A-3 1 24 . 12.181 -26.824 11.682 1 31.49 ? O ILE A-3 4 1 
ATOM 2684 C CB . ILE A-3 1 24 . 10.75 -24.394 13.517 1 32.86 ? CB ILE A-3 4 1 
ATOM 2685 C CG1 . ILE A-3 1 24 . 9.255 -24.255 13.828 1 34.21 ? CG1 ILE A-3 4 1 
ATOM 2686 C CG2 . ILE A-3 1 24 . 10.942 -23.893 12.099 1 34.2 ? CG2 ILE A-3 4 1 
ATOM 2687 C CD1 . ILE A-3 1 24 . 8.88 -24.244 15.296 1 33.68 ? CD1 ILE A-3 4 1 
ATOM 2688 N N . TYR A-3 1 25 . 13.605 -25.974 13.225 1 32.58 ? N TYR A-3 5 1 
ATOM 2689 C CA . TYR A-3 1 25 . 14.826 -26.395 12.524 1 31.73 ? CA TYR A-3 5 1 
ATOM 2690 C C . TYR A-3 1 25 . 14.867 -27.909 12.315 1 30.44 ? C TYR A-3 5 1 
ATOM 2691 O O . TYR A-3 1 25 . 15.382 -28.391 11.302 1 29.2 ? O TYR A-3 5 1 
ATOM 2692 C CB . TYR A-3 1 25 . 16.088 -25.951 13.28 1 34.8 ? CB TYR A-3 5 1 
ATOM 2693 C CG . TYR A-3 1 25 . 16.267 -24.453 13.435 1 36.87 ? CG TYR A-3 5 1 
ATOM 2694 C CD1 . TYR A-3 1 25 . 16.184 -23.6 12.332 1 38.24 ? CD1 TYR A-3 5 1 
ATOM 2695 C CD2 . TYR A-3 1 25 . 16.531 -23.888 14.686 1 37.76 ? CD2 TYR A-3 5 1 
ATOM 2696 C CE1 . TYR A-3 1 25 . 16.35 -22.231 12.468 1 38.85 ? CE1 TYR A-3 5 1 
ATOM 2697 C CE2 . TYR A-3 1 25 . 16.703 -22.52 14.832 1 39.31 ? CE2 TYR A-3 5 1 
ATOM 2698 C CZ . TYR A-3 1 25 . 16.605 -21.695 13.715 1 39.98 ? CZ TYR A-3 5 1 
ATOM 2699 O OH . TYR A-3 1 25 . 16.765 -20.332 13.84 1 41.2 ? OH TYR A-3 5 1 
ATOM 2700 N N . GLN A-3 1 26 . 14.323 -28.653 13.279 1 29.41 ? N GLN A-3 6 1 
ATOM 2701 C CA . GLN A-3 1 26 . 14.195 -30.104 13.163 1 28.7 ? CA GLN A-3 6 1 
ATOM 2702 C C . GLN A-3 1 26 . 13.365 -30.487 11.942 1 28.69 ? C GLN A-3 6 1 
ATOM 2703 O O . GLN A-3 1 26 . 13.691 -31.451 11.248 1 29.35 ? O GLN A-3 6 1 
ATOM 2704 C CB . GLN A-3 1 26 . 13.607 -30.712 14.447 1 29.35 ? CB GLN A-3 6 1 
ATOM 2705 C CG . GLN A-3 1 26 . 14.623 -30.847 15.581 1 30.2 ? CG GLN A-3 6 1 
ATOM 2706 C CD . GLN A-3 1 26 . 13.991 -31.078 16.945 1 31.73 ? CD GLN A-3 6 1 
ATOM 2707 O OE1 . GLN A-3 1 26 . 12.78 -30.915 17.125 1 32.26 ? OE1 GLN A-3 6 1 
ATOM 2708 N NE2 . GLN A-3 1 26 . 14.816 -31.458 17.918 1 31.27 ? NE2 GLN A-3 6 1 
ATOM 2709 N N . LYS A-3 1 27 . 12.32 -29.707 11.665 1 27.82 ? N LYS A-3 7 1 
ATOM 2710 C CA . LYS A-3 1 27 . 11.452 -29.954 10.513 1 27.26 ? CA LYS A-3 7 1 
ATOM 2711 C C . LYS A-3 1 27 . 12.048 -29.513 9.171 1 26.8 ? C LYS A-3 7 1 
ATOM 2712 O O . LYS A-3 1 27 . 11.901 -30.218 8.175 1 26.55 ? O LYS A-3 7 1 
ATOM 2713 C CB . LYS A-3 1 27 . 10.072 -29.325 10.733 1 28.56 ? CB LYS A-3 7 1 
ATOM 2714 C CG . LYS A-3 1 27 . 9.18 -30.146 11.649 1 29.48 ? CG LYS A-3 7 1 
ATOM 2715 C CD . LYS A-3 1 27 . 8.024 -29.329 12.201 1 31.72 ? CD LYS A-3 7 1 
ATOM 2716 C CE . LYS A-3 1 27 . 7.186 -30.156 13.173 1 32.67 ? CE LYS A-3 7 1 
ATOM 2717 N NZ . LYS A-3 1 27 . 6.056 -29.378 13.763 1 33.56 ? NZ LYS A-3 7 1 
ATOM 2718 N N . ALA A-3 1 28 . 12.717 -28.359 9.15 1 25.43 ? N ALA A-3 8 1 
ATOM 2719 C CA . ALA A-3 1 28 . 13.331 -27.823 7.932 1 24.75 ? CA ALA A-3 8 1 
ATOM 2720 C C . ALA A-3 1 28 . 14.643 -28.527 7.557 1 25.42 ? C ALA A-3 8 1 
ATOM 2721 O O . ALA A-3 1 28 . 15.129 -28.409 6.421 1 23.42 ? O ALA A-3 8 1 
ATOM 2722 C CB . ALA A-3 1 28 . 13.549 -26.324 8.072 1 24.5 ? CB ALA A-3 8 1 
ATOM 2723 N N . LYS A-3 1 29 . 15.187 -29.272 8.523 1 26.88 ? N LYS A-3 9 1 
ATOM 2724 C CA . LYS A-3 1 29 . 16.487 -29.95 8.439 1 27.79 ? CA LYS A-3 9 1 
ATOM 2725 C C . LYS A-3 1 29 . 16.761 -30.69 7.125 1 27.72 ? C LYS A-3 9 1 
ATOM 2726 O O . LYS A-3 1 29 . 17.873 -30.615 6.594 1 27.16 ? O LYS A-3 9 1 
ATOM 2727 C CB . LYS A-3 1 29 . 16.614 -30.946 9.604 1 30.33 ? CB LYS A-3 9 1 
ATOM 2728 C CG . LYS A-3 1 29 . 18.032 -31.21 10.088 1 32.08 ? CG LYS A-3 9 1 
ATOM 2729 C CD . LYS A-3 1 29 . 18.304 -30.548 11.435 1 33.34 ? CD LYS A-3 9 1 
ATOM 2730 C CE . LYS A-3 1 29 . 18.856 -29.135 11.271 1 33.82 ? CE LYS A-3 9 1 
ATOM 2731 N NZ . LYS A-3 1 29 . 19.043 -28.367 12.536 1 31.73 ? NZ LYS A-3 9 1 
ATOM 2732 N N . HIS A-3 1 30 . 15.752 -31.401 6.619 1 26.59 ? N HIS A-3 10 1 
ATOM 2733 C CA . HIS A-3 1 30 . 15.918 -32.302 5.474 1 26.79 ? CA HIS A-3 10 1 
ATOM 2734 C C . HIS A-3 1 30 . 15.14 -31.887 4.214 1 25.03 ? C HIS A-3 10 1 
ATOM 2735 O O . HIS A-3 1 30 . 14.878 -32.718 3.329 1 24.31 ? O HIS A-3 10 1 
ATOM 2736 C CB . HIS A-3 1 30 . 15.564 -33.751 5.877 1 29.44 ? CB HIS A-3 10 1 
ATOM 2737 C CG . HIS A-3 1 30 . 16.506 -34.347 6.881 1 31 ? CG HIS A-3 10 1 
ATOM 2738 N ND1 . HIS A-3 1 30 . 17.848 -34.536 6.623 1 31.33 ? ND1 HIS A-3 10 1 
ATOM 2739 C CD2 . HIS A-3 1 30 . 16.301 -34.787 8.147 1 31.72 ? CD2 HIS A-3 10 1 
ATOM 2740 C CE1 . HIS A-3 1 30 . 18.428 -35.064 7.686 1 32.04 ? CE1 HIS A-3 10 1 
ATOM 2741 N NE2 . HIS A-3 1 30 . 17.512 -35.229 8.624 1 31.32 ? NE2 HIS A-3 10 1 
ATOM 2742 N N . ILE A-3 1 31 . 14.784 -30.604 4.127 1 22.28 ? N ILE A-3 11 1 
ATOM 2743 C CA . ILE A-3 1 31 . 14.047 -30.087 2.973 1 19.31 ? CA ILE A-3 11 1 
ATOM 2744 C C . ILE A-3 1 31 . 14.924 -30.115 1.729 1 18.66 ? C ILE A-3 11 1 
ATOM 2745 O O . ILE A-3 1 31 . 16.07 -29.688 1.764 1 18.14 ? O ILE A-3 11 1 
ATOM 2746 C CB . ILE A-3 1 31 . 13.546 -28.65 3.213 1 18.94 ? CB ILE A-3 11 1 
ATOM 2747 C CG1 . ILE A-3 1 31 . 12.629 -28.575 4.448 1 18.66 ? CG1 ILE A-3 11 1 
ATOM 2748 C CG2 . ILE A-3 1 31 . 12.891 -28.088 1.953 1 18.45 ? CG2 ILE A-3 11 1 
ATOM 2749 C CD1 . ILE A-3 1 31 . 11.541 -29.638 4.54 1 18.49 ? CD1 ILE A-3 11 1 
ATOM 2750 N N . LYS A-3 1 32 . 14.375 -30.639 0.643 1 17.82 ? N LYS A-3 12 1 
ATOM 2751 C CA . LYS A-3 1 32 . 15.068 -30.69 -0.639 1 17.54 ? CA LYS A-3 12 1 
ATOM 2752 C C . LYS A-3 1 32 . 14.344 -29.826 -1.648 1 16.42 ? C LYS A-3 12 1 
ATOM 2753 O O . LYS A-3 1 32 . 14.902 -29.444 -2.681 1 15.79 ? O LYS A-3 12 1 
ATOM 2754 C CB . LYS A-3 1 32 . 15.115 -32.125 -1.16 1 18.45 ? CB LYS A-3 12 1 
ATOM 2755 C CG . LYS A-3 1 32 . 16.122 -33.017 -0.452 1 19.81 ? CG LYS A-3 12 1 
ATOM 2756 C CD . LYS A-3 1 32 . 15.755 -34.483 -0.634 1 20.77 ? CD LYS A-3 12 1 
ATOM 2757 C CE . LYS A-3 1 32 . 16.722 -35.382 0.116 1 21.62 ? CE LYS A-3 12 1 
ATOM 2758 N NZ . LYS A-3 1 32 . 17.995 -35.56 -0.641 1 22.79 ? NZ LYS A-3 12 1 
ATOM 2759 N N . LEU A-3 1 33 . 13.091 -29.521 -1.34 1 15.68 ? N LEU A-3 13 1 
ATOM 2760 C CA . LEU A-3 1 33 . 12.253 -28.759 -2.248 1 15.06 ? CA LEU A-3 13 1 
ATOM 2761 C C . LEU A-3 1 33 . 11.404 -27.784 -1.474 1 14.26 ? C LEU A-3 13 1 
ATOM 2762 O O . LEU A-3 1 33 . 10.768 -28.151 -0.483 1 14.01 ? O LEU A-3 13 1 
ATOM 2763 C CB . LEU A-3 1 33 . 11.345 -29.682 -3.08 1 15.36 ? CB LEU A-3 13 1 
ATOM 2764 C CG . LEU A-3 1 33 . 10.445 -28.987 -4.119 1 15.27 ? CG LEU A-3 13 1 
ATOM 2765 C CD1 . LEU A-3 1 33 . 10.215 -29.855 -5.337 1 15.93 ? CD1 LEU A-3 13 1 
ATOM 2766 C CD2 . LEU A-3 1 33 . 9.111 -28.582 -3.523 1 15.65 ? CD2 LEU A-3 13 1 
ATOM 2767 N N . PHE A-3 1 34 . 11.381 -26.548 -1.962 1 13.55 ? N PHE A-3 14 1 
ATOM 2768 C CA . PHE A-3 1 34 . 10.542 -25.509 -1.395 1 13.45 ? CA PHE A-3 14 1 
ATOM 2769 C C . PHE A-3 1 34 . 9.545 -25.073 -2.453 1 13.27 ? C PHE A-3 14 1 
ATOM 2770 O O . PHE A-3 1 34 . 9.929 -24.557 -3.532 1 12.88 ? O PHE A-3 14 1 
ATOM 2771 C CB . PHE A-3 1 34 . 11.403 -24.342 -0.874 1 13.07 ? CB PHE A-3 14 1 
ATOM 2772 C CG . PHE A-3 1 34 . 10.617 -23.207 -0.268 1 13.24 ? CG PHE A-3 14 1 
ATOM 2773 C CD1 . PHE A-3 1 34 . 9.538 -23.446 0.588 1 13.53 ? CD1 PHE A-3 14 1 
ATOM 2774 C CD2 . PHE A-3 1 34 . 10.987 -21.887 -0.516 1 13.04 ? CD2 PHE A-3 14 1 
ATOM 2775 C CE1 . PHE A-3 1 34 . 8.829 -22.391 1.154 1 13.44 ? CE1 PHE A-3 14 1 
ATOM 2776 C CE2 . PHE A-3 1 34 . 10.289 -20.832 0.051 1 13.33 ? CE2 PHE A-3 14 1 
ATOM 2777 C CZ . PHE A-3 1 34 . 9.208 -21.081 0.883 1 13.4 ? CZ PHE A-3 14 1 
ATOM 2778 N N . ALA A-3 1 35 . 8.269 -25.308 -2.145 1 13.05 ? N ALA A-3 15 1 
ATOM 2779 C CA . ALA A-3 1 35 . 7.157 -24.936 -3.02 1 13.33 ? CA ALA A-3 15 1 
ATOM 2780 C C . ALA A-3 1 35 . 6.328 -23.809 -2.419 1 13.72 ? C ALA A-3 15 1 
ATOM 2781 O O . ALA A-3 1 35 . 6.112 -23.741 -1.193 1 13.4 ? O ALA A-3 15 1 
ATOM 2782 C CB . ALA A-3 1 35 . 6.281 -26.137 -3.317 1 13.07 ? CB ALA A-3 15 1 
ATOM 2783 N N . MET A-3 1 36 . 5.864 -22.918 -3.291 1 13.91 ? N MET A-3 16 1 
ATOM 2784 C CA . MET A-3 1 36 . 5.184 -21.719 -2.823 1 14.22 ? CA MET A-3 16 1 
ATOM 2785 C C . MET A-3 1 36 . 3.891 -21.479 -3.563 1 13.81 ? C MET A-3 16 1 
ATOM 2786 O O . MET A-3 1 36 . 3.808 -21.633 -4.783 1 13.75 ? O MET A-3 16 1 
ATOM 2787 C CB . MET A-3 1 36 . 6.067 -20.479 -2.99 1 15.07 ? CB MET A-3 16 1 
ATOM 2788 C CG . MET A-3 1 36 . 7.365 -20.45 -2.193 1 15.82 ? CG MET A-3 16 1 
ATOM 2789 S SD . MET A-3 1 36 . 8.567 -19.387 -3.028 1 16.38 ? SD MET A-3 16 1 
ATOM 2790 C CE . MET A-3 1 36 . 9.234 -20.52 -4.257 1 15.94 ? CE MET A-3 16 1 
ATOM 2791 N N . ASP A-3 1 37 . 2.885 -21.08 -2.807 1 13.77 ? N ASP A-3 17 1 
ATOM 2792 C CA . ASP A-3 1 37 . 1.729 -20.418 -3.374 1 13.6 ? CA ASP A-3 17 1 
ATOM 2793 C C . ASP A-3 1 37 . 2.157 -19 -3.763 1 13.13 ? C ASP A-3 17 1 
ATOM 2794 O O . ASP A-3 1 37 . 3.121 -18.481 -3.208 1 12.82 ? O ASP A-3 17 1 
ATOM 2795 C CB . ASP A-3 1 37 . 0.623 -20.376 -2.334 1 13.99 ? CB ASP A-3 17 1 
ATOM 2796 C CG . ASP A-3 1 37 . -0.604 -19.67 -2.828 1 14.53 ? CG ASP A-3 17 1 
ATOM 2797 O OD1 . ASP A-3 1 37 . -1.005 -19.888 -4 1 14.23 ? OD1 ASP A-3 17 1 
ATOM 2798 O OD2 . ASP A-3 1 37 . -1.158 -18.882 -2.029 1 15.16 ? OD2 ASP A-3 17 1 
ATOM 2799 N N . VAL A-3 1 38 . 1.466 -18.38 -4.724 1 13.2 ? N VAL A-3 18 1 
ATOM 2800 C CA . VAL A-3 1 38 . 1.81 -17.015 -5.148 1 13.06 ? CA VAL A-3 18 1 
ATOM 2801 C C . VAL A-3 1 38 . 0.985 -15.956 -4.413 1 13.37 ? C VAL A-3 18 1 
ATOM 2802 O O . VAL A-3 1 38 . 1.536 -15.213 -3.594 1 13.15 ? O VAL A-3 18 1 
ATOM 2803 C CB . VAL A-3 1 38 . 1.719 -16.805 -6.675 1 12.96 ? CB VAL A-3 18 1 
ATOM 2804 C CG1 . VAL A-3 1 38 . 1.943 -15.34 -7.03 1 12.62 ? CG1 VAL A-3 18 1 
ATOM 2805 C CG2 . VAL A-3 1 38 . 2.739 -17.674 -7.386 1 12.87 ? CG2 VAL A-3 18 1 
ATOM 2806 N N . ASP A-3 1 39 . -0.323 -15.905 -4.684 1 13.54 ? N ASP A-3 19 1 
ATOM 2807 C CA . ASP A-3 1 39 . -1.163 -14.829 -4.16 1 13.96 ? CA ASP A-3 19 1 
ATOM 2808 C C . ASP A-3 1 39 . -1.335 -14.91 -2.658 1 13.29 ? C ASP A-3 19 1 
ATOM 2809 O O . ASP A-3 1 39 . -1.835 -15.897 -2.143 1 13.13 ? O ASP A-3 19 1 
ATOM 2810 C CB . ASP A-3 1 39 . -2.514 -14.819 -4.855 1 14.64 ? CB ASP A-3 19 1 
ATOM 2811 C CG . ASP A-3 1 39 . -2.382 -14.724 -6.345 1 15.7 ? CG ASP A-3 19 1 
ATOM 2812 O OD1 . ASP A-3 1 39 . -1.915 -13.663 -6.832 1 16.7 ? OD1 ASP A-3 19 1 
ATOM 2813 O OD2 . ASP A-3 1 39 . -2.727 -15.713 -7.034 1 16.23 ? OD2 ASP A-3 19 1 
ATOM 2814 N N . GLY A-3 1 40 . -0.903 -13.867 -1.962 1 12.97 ? N GLY A-3 20 1 
ATOM 2815 C CA . GLY A-3 1 40 . -0.969 -13.822 -0.507 1 12.66 ? CA GLY A-3 20 1 
ATOM 2816 C C . GLY A-3 1 40 . 0.308 -14.286 0.182 1 12.81 ? C GLY A-3 20 1 
ATOM 2817 O O . GLY A-3 1 40 . 0.437 -14.17 1.413 1 12.52 ? O GLY A-3 20 1 
ATOM 2818 N N . ILE A-3 1 41 . 1.238 -14.829 -0.609 1 12.55 ? N ILE A-3 21 1 
ATOM 2819 C CA . ILE A-3 1 41 . 2.522 -15.341 -0.112 1 12.77 ? CA ILE A-3 21 1 
ATOM 2820 C C . ILE A-3 1 41 . 3.67 -14.561 -0.795 1 13.32 ? C ILE A-3 21 1 
ATOM 2821 O O . ILE A-3 1 41 . 4.392 -13.781 -0.153 1 13.31 ? O ILE A-3 21 1 
ATOM 2822 C CB . ILE A-3 1 41 . 2.662 -16.88 -0.363 1 12.7 ? CB ILE A-3 21 1 
ATOM 2823 C CG1 . ILE A-3 1 41 . 1.583 -17.674 0.375 1 12.18 ? CG1 ILE A-3 21 1 
ATOM 2824 C CG2 . ILE A-3 1 41 . 4.043 -17.399 0.034 1 12.39 ? CG2 ILE A-3 21 1 
ATOM 2825 C CD1 . ILE A-3 1 41 . 1.598 -17.504 1.88 1 12.06 ? CD1 ILE A-3 21 1 
ATOM 2826 N N . LEU A-3 1 42 . 3.813 -14.764 -2.101 1 13 ? N LEU A-3 22 1 
ATOM 2827 C CA . LEU A-3 1 42 . 4.767 -14.015 -2.891 1 13.22 ? CA LEU A-3 22 1 
ATOM 2828 C C . LEU A-3 1 42 . 4.274 -12.599 -3.194 1 14.15 ? C LEU A-3 22 1 
ATOM 2829 O O . LEU A-3 1 42 . 5.081 -11.702 -3.423 1 14.6 ? O LEU A-3 22 1 
ATOM 2830 C CB . LEU A-3 1 42 . 5.094 -14.774 -4.171 1 12.5 ? CB LEU A-3 22 1 
ATOM 2831 C CG . LEU A-3 1 42 . 6.04 -15.964 -3.957 1 12.24 ? CG LEU A-3 22 1 
ATOM 2832 C CD1 . LEU A-3 1 42 . 6.181 -16.789 -5.224 1 12.28 ? CD1 LEU A-3 22 1 
ATOM 2833 C CD2 . LEU A-3 1 42 . 7.412 -15.526 -3.461 1 12.07 ? CD2 LEU A-3 22 1 
ATOM 2834 N N . SER A-3 1 43 . 2.953 -12.403 -3.215 1 15 ? N SER A-3 23 1 
ATOM 2835 C CA . SER A-3 1 43 . 2.365 -11.057 -3.287 1 15.51 ? CA SER A-3 23 1 
ATOM 2836 C C . SER A-3 1 43 . 1.607 -10.824 -1.998 1 15.8 ? C SER A-3 23 1 
ATOM 2837 O O . SER A-3 1 43 . 1.477 -11.748 -1.194 1 16.03 ? O SER A-3 23 1 
ATOM 2838 C CB . SER A-3 1 43 . 1.423 -10.92 -4.485 1 15.48 ? CB SER A-3 23 1 
ATOM 2839 O OG . SER A-3 1 43 . 0.267 -11.733 -4.33 1 16.16 ? OG SER A-3 23 1 
ATOM 2840 N N . ASP A-3 1 44 . 1.084 -9.613 -1.806 1 16.28 ? N ASP A-3 24 1 
ATOM 2841 C CA . ASP A-3 1 44 . 0.236 -9.316 -0.637 1 15.96 ? CA ASP A-3 24 1 
ATOM 2842 C C . ASP A-3 1 44 . -1.25 -9.598 -0.869 1 15.36 ? C ASP A-3 24 1 
ATOM 2843 O O . ASP A-3 1 44 . -2.095 -9.205 -0.058 1 15.54 ? O ASP A-3 24 1 
ATOM 2844 C CB . ASP A-3 1 44 . 0.436 -7.875 -0.158 1 16.63 ? CB ASP A-3 24 1 
ATOM 2845 C CG . ASP A-3 1 44 . -0.128 -6.848 -1.125 1 17.53 ? CG ASP A-3 24 1 
ATOM 2846 O OD1 . ASP A-3 1 44 . -0.424 -7.193 -2.298 1 17.63 ? OD1 ASP A-3 24 1 
ATOM 2847 O OD2 . ASP A-3 1 44 . -0.279 -5.684 -0.696 1 18.16 ? OD2 ASP A-3 24 1 
ATOM 2848 N N . GLY A-3 1 45 . -1.567 -10.285 -1.965 1 14.56 ? N GLY A-3 25 1 
ATOM 2849 C CA . GLY A-3 1 45 . -2.934 -10.74 -2.221 1 13.96 ? CA GLY A-3 25 1 
ATOM 2850 C C . GLY A-3 1 45 . -3.731 -9.823 -3.135 1 13.86 ? C GLY A-3 25 1 
ATOM 2851 O O . GLY A-3 1 45 . -4.854 -10.134 -3.52 1 13.94 ? O GLY A-3 25 1 
ATOM 2852 N N . GLN A-3 1 46 . -3.162 -8.683 -3.491 1 13.74 ? N GLN A-3 26 1 
ATOM 2853 C CA . GLN A-3 1 46 . -3.84 -7.81 -4.426 1 13.8 ? CA GLN A-3 26 1 
ATOM 2854 C C . GLN A-3 1 46 . -3.922 -8.447 -5.8 1 13.48 ? C GLN A-3 26 1 
ATOM 2855 O O . GLN A-3 1 46 . -2.937 -8.986 -6.292 1 12.96 ? O GLN A-3 26 1 
ATOM 2856 C CB . GLN A-3 1 46 . -3.192 -6.426 -4.474 1 14.55 ? CB GLN A-3 26 1 
ATOM 2857 C CG . GLN A-3 1 46 . -3.604 -5.558 -3.3 1 15.53 ? CG GLN A-3 26 1 
ATOM 2858 C CD . GLN A-3 1 46 . -2.923 -4.209 -3.306 1 16.79 ? CD GLN A-3 26 1 
ATOM 2859 O OE1 . GLN A-3 1 46 . -2.991 -3.47 -4.281 1 17.39 ? OE1 GLN A-3 26 1 
ATOM 2860 N NE2 . GLN A-3 1 46 . -2.264 -3.876 -2.207 1 17.7 ? NE2 GLN A-3 26 1 
ATOM 2861 N N . ILE A-3 1 47 . -5.126 -8.426 -6.372 1 13.66 ? N ILE A-3 27 1 
ATOM 2862 C CA . ILE A-3 1 47 . -5.369 -8.789 -7.773 1 13.9 ? CA ILE A-3 27 1 
ATOM 2863 C C . ILE A-3 1 47 . -5.781 -7.502 -8.498 1 13.96 ? C ILE A-3 27 1 
ATOM 2864 O O . ILE A-3 1 47 . -6.803 -6.871 -8.16 1 13.85 ? O ILE A-3 27 1 
ATOM 2865 C CB . ILE A-3 1 47 . -6.5 -9.847 -7.932 1 13.92 ? CB ILE A-3 27 1 
ATOM 2866 C CG1 . ILE A-3 1 47 . -6.33 -11.048 -6.972 1 13.73 ? CG1 ILE A-3 27 1 
ATOM 2867 C CG2 . ILE A-3 1 47 . -6.64 -10.282 -9.39 1 13.82 ? CG2 ILE A-3 27 1 
ATOM 2868 C CD1 . ILE A-3 1 47 . -5.107 -11.904 -7.213 1 13.61 ? CD1 ILE A-3 27 1 
ATOM 2869 N N . ILE A-3 1 48 . -4.979 -7.122 -9.492 1 14.18 ? N ILE A-3 28 1 
ATOM 2870 C CA . ILE A-3 1 48 . -5 -5.775 -10.048 1 13.98 ? CA ILE A-3 28 1 
ATOM 2871 C C . ILE A-3 1 48 . -5.279 -5.803 -11.557 1 14.34 ? C ILE A-3 28 1 
ATOM 2872 O O . ILE A-3 1 48 . -4.535 -6.411 -12.324 1 14.2 ? O ILE A-3 28 1 
ATOM 2873 C CB . ILE A-3 1 48 . -3.654 -5.067 -9.778 1 13.96 ? CB ILE A-3 28 1 
ATOM 2874 C CG1 . ILE A-3 1 48 . -3.271 -5.102 -8.287 1 13.75 ? CG1 ILE A-3 28 1 
ATOM 2875 C CG2 . ILE A-3 1 48 . -3.672 -3.629 -10.278 1 13.87 ? CG2 ILE A-3 28 1 
ATOM 2876 C CD1 . ILE A-3 1 48 . -1.788 -4.895 -8.041 1 12.91 ? CD1 ILE A-3 28 1 
ATOM 2877 N N . TYR A-3 1 49 . -6.35 -5.126 -11.967 1 14.66 ? N TYR A-3 29 1 
ATOM 2878 C CA . TYR A-3 1 49 . -6.756 -5.05 -13.376 1 14.52 ? CA TYR A-3 29 1 
ATOM 2879 C C . TYR A-3 1 49 . -6.781 -3.606 -13.854 1 15.21 ? C TYR A-3 29 1 
ATOM 2880 O O . TYR A-3 1 49 . -7.004 -2.686 -13.061 1 15.22 ? O TYR A-3 29 1 
ATOM 2881 C CB . TYR A-3 1 49 . -8.159 -5.64 -13.575 1 14.22 ? CB TYR A-3 29 1 
ATOM 2882 C CG . TYR A-3 1 49 . -8.304 -7.107 -13.247 1 13.91 ? CG TYR A-3 29 1 
ATOM 2883 C CD1 . TYR A-3 1 49 . -7.318 -8.021 -13.617 1 14.34 ? CD1 TYR A-3 29 1 
ATOM 2884 C CD2 . TYR A-3 1 49 . -9.437 -7.589 -12.597 1 13.73 ? CD2 TYR A-3 29 1 
ATOM 2885 C CE1 . TYR A-3 1 49 . -7.442 -9.369 -13.325 1 14.14 ? CE1 TYR A-3 29 1 
ATOM 2886 C CE2 . TYR A-3 1 49 . -9.574 -8.943 -12.303 1 13.66 ? CE2 TYR A-3 29 1 
ATOM 2887 C CZ . TYR A-3 1 49 . -8.57 -9.825 -12.675 1 13.83 ? CZ TYR A-3 29 1 
ATOM 2888 O OH . TYR A-3 1 49 . -8.659 -11.172 -12.409 1 13.82 ? OH TYR A-3 29 1 
ATOM 2889 N N . ASN A-3 1 50 . -6.566 -3.399 -15.152 1 15.48 ? N ASN A-3 30 1 
ATOM 2890 C CA . ASN A-3 1 50 . -6.726 -2.067 -15.705 1 15.71 ? CA ASN A-3 30 1 
ATOM 2891 C C . ASN A-3 1 50 . -7.658 -2 -16.916 1 15.84 ? C ASN A-3 30 1 
ATOM 2892 O O . ASN A-3 1 50 . -8.084 -3.037 -17.441 1 16.41 ? O ASN A-3 30 1 
ATOM 2893 C CB . ASN A-3 1 50 . -5.372 -1.364 -15.916 1 15.37 ? CB ASN A-3 30 1 
ATOM 2894 C CG . ASN A-3 1 50 . -4.67 -1.771 -17.196 1 15.88 ? CG ASN A-3 30 1 
ATOM 2895 O OD1 . ASN A-3 1 50 . -5.296 -2.163 -18.186 1 15.52 ? OD1 ASN A-3 30 1 
ATOM 2896 N ND2 . ASN A-3 1 50 . -3.347 -1.625 -17.195 1 15.99 ? ND2 ASN A-3 30 1 
ATOM 2897 N N . SER A-3 1 51 . -7.953 -0.779 -17.359 1 16.07 ? N SER A-3 31 1 
ATOM 2898 C CA . SER A-3 1 51 . -9.006 -0.537 -18.348 1 16.82 ? CA SER A-3 31 1 
ATOM 2899 C C . SER A-3 1 51 . -8.654 -0.99 -19.752 1 17.87 ? C SER A-3 31 1 
ATOM 2900 O O . SER A-3 1 51 . -9.501 -0.955 -20.633 1 17.94 ? O SER A-3 31 1 
ATOM 2901 C CB . SER A-3 1 51 . -9.422 0.939 -18.369 1 16.29 ? CB SER A-3 31 1 
ATOM 2902 O OG . SER A-3 1 51 . -8.357 1.785 -18.771 1 15.66 ? OG SER A-3 31 1 
ATOM 2903 N N . GLU A-3 1 52 . -7.407 -1.411 -19.95 1 20.05 ? N GLU A-3 32 1 
ATOM 2904 C CA . GLU A-3 1 52 . -6.947 -1.959 -21.231 1 21.43 ? CA GLU A-3 32 1 
ATOM 2905 C C . GLU A-3 1 52 . -6.931 -3.483 -21.209 1 20.94 ? C GLU A-3 32 1 
ATOM 2906 O O . GLU A-3 1 52 . -6.474 -4.115 -22.159 1 20.78 ? O GLU A-3 32 1 
ATOM 2907 C CB . GLU A-3 1 52 . -5.55 -1.426 -21.575 1 23.92 ? CB GLU A-3 32 1 
ATOM 2908 C CG . GLU A-3 1 52 . -5.52 0.057 -21.931 1 27.66 ? CG GLU A-3 32 1 
ATOM 2909 C CD . GLU A-3 1 52 . -4.186 0.51 -22.505 1 30.86 ? CD GLU A-3 32 1 
ATOM 2910 O OE1 . GLU A-3 1 52 . -3.143 0.353 -21.832 1 32.19 ? OE1 GLU A-3 32 1 
ATOM 2911 O OE2 . GLU A-3 1 52 . -4.183 1.041 -23.637 1 33.9 ? OE2 GLU A-3 32 1 
ATOM 2912 N N . GLY A-3 1 53 . -7.429 -4.069 -20.12 1 20.41 ? N GLY A-3 33 1 
ATOM 2913 C CA . GLY A-3 1 53 . -7.487 -5.527 -19.974 1 18.51 ? CA GLY A-3 33 1 
ATOM 2914 C C . GLY A-3 1 53 . -6.218 -6.128 -19.383 1 17.72 ? C GLY A-3 33 1 
ATOM 2915 O O . GLY A-3 1 53 . -6.03 -7.344 -19.401 1 17.2 ? O GLY A-3 33 1 
ATOM 2916 N N . THR A-3 1 54 . -5.355 -5.278 -18.845 1 16.94 ? N THR A-3 34 1 
ATOM 2917 C CA . THR A-3 1 54 . -4.042 -5.704 -18.367 1 16.76 ? CA THR A-3 34 1 
ATOM 2918 C C . THR A-3 1 54 . -4.062 -6.026 -16.871 1 16.02 ? C THR A-3 34 1 
ATOM 2919 O O . THR A-3 1 54 . -4.688 -5.303 -16.088 1 15.53 ? O THR A-3 34 1 
ATOM 2920 C CB . THR A-3 1 54 . -2.998 -4.622 -18.687 1 17 ? CB THR A-3 34 1 
ATOM 2921 O OG1 . THR A-3 1 54 . -2.917 -4.455 -20.106 1 18.34 ? OG1 THR A-3 34 1 
ATOM 2922 C CG2 . THR A-3 1 54 . -1.641 -5.001 -18.173 1 17.36 ? CG2 THR A-3 34 1 
ATOM 2923 N N . GLU A-3 1 55 . -3.376 -7.103 -16.485 1 15.18 ? N GLU A-3 35 1 
ATOM 2924 C CA . GLU A-3 1 55 . -3.304 -7.53 -15.077 1 14.56 ? CA GLU A-3 35 1 
ATOM 2925 C C . GLU A-3 1 55 . -1.936 -7.24 -14.487 1 13.96 ? C GLU A-3 35 1 
ATOM 2926 O O . GLU A-3 1 55 . -0.928 -7.333 -15.184 1 13.87 ? O GLU A-3 35 1 
ATOM 2927 C CB . GLU A-3 1 55 . -3.609 -9.035 -14.918 1 14.67 ? CB GLU A-3 35 1 
ATOM 2928 C CG . GLU A-3 1 55 . -3.556 -9.508 -13.46 1 15.31 ? CG GLU A-3 35 1 
ATOM 2929 C CD . GLU A-3 1 55 . -3.939 -10.968 -13.241 1 15.89 ? CD GLU A-3 35 1 
ATOM 2930 O OE1 . GLU A-3 1 55 . -4.153 -11.701 -14.227 1 16.64 ? OE1 GLU A-3 35 1 
ATOM 2931 O OE2 . GLU A-3 1 55 . -4.039 -11.386 -12.065 1 16.37 ? OE2 GLU A-3 35 1 
ATOM 2932 N N . THR A-3 1 56 . -1.914 -6.929 -13.194 1 13.21 ? N THR A-3 36 1 
ATOM 2933 C CA . THR A-3 1 56 . -0.695 -6.56 -12.494 1 12.8 ? CA THR A-3 36 1 
ATOM 2934 C C . THR A-3 1 56 . -0.558 -7.377 -11.201 1 12.78 ? C THR A-3 36 1 
ATOM 2935 O O . THR A-3 1 56 . -1.561 -7.691 -10.537 1 13.06 ? O THR A-3 36 1 
ATOM 2936 C CB . THR A-3 1 56 . -0.675 -5.032 -12.232 1 12.69 ? CB THR A-3 36 1 
ATOM 2937 O OG1 . THR A-3 1 56 . -0.562 -4.339 -13.486 1 12.08 ? OG1 THR A-3 36 1 
ATOM 2938 C CG2 . THR A-3 1 56 . 0.477 -4.592 -11.308 1 12.34 ? CG2 THR A-3 36 1 
ATOM 2939 N N . LYS A-3 1 57 . 0.679 -7.739 -10.864 1 12.32 ? N LYS A-3 37 1 
ATOM 2940 C CA . LYS A-3 1 57 . 0.975 -8.36 -9.576 1 12.51 ? CA LYS A-3 37 1 
ATOM 2941 C C . LYS A-3 1 57 . 2.292 -7.803 -9.02 1 12.24 ? C LYS A-3 37 1 
ATOM 2942 O O . LYS A-3 1 57 . 3.248 -7.551 -9.77 1 12.04 ? O LYS A-3 37 1 
ATOM 2943 C CB . LYS A-3 1 57 . 1.034 -9.89 -9.691 1 12.69 ? CB LYS A-3 37 1 
ATOM 2944 C CG . LYS A-3 1 57 . 0.516 -10.616 -8.454 1 13.12 ? CG LYS A-3 37 1 
ATOM 2945 C CD . LYS A-3 1 57 . 0.646 -12.13 -8.583 1 13.42 ? CD LYS A-3 37 1 
ATOM 2946 C CE . LYS A-3 1 57 . -0.192 -12.684 -9.736 1 13.51 ? CE LYS A-3 37 1 
ATOM 2947 N NZ . LYS A-3 1 57 . -1.649 -12.569 -9.468 1 13.62 ? NZ LYS A-3 37 1 
ATOM 2948 N N . ALA A-3 1 58 . 2.327 -7.597 -7.709 1 11.72 ? N ALA A-3 38 1 
ATOM 2949 C CA . ALA A-3 1 58 . 3.494 -7.023 -7.058 1 11.68 ? CA ALA A-3 38 1 
ATOM 2950 C C . ALA A-3 1 58 . 4.208 -8.066 -6.201 1 11.97 ? C ALA A-3 38 1 
ATOM 2951 O O . ALA A-3 1 58 . 3.581 -8.783 -5.416 1 11.94 ? O ALA A-3 38 1 
ATOM 2952 C CB . ALA A-3 1 58 . 3.087 -5.827 -6.211 1 11.78 ? CB ALA A-3 38 1 
ATOM 2953 N N . PHE A-3 1 59 . 5.526 -8.139 -6.358 1 12.23 ? N PHE A-3 39 1 
ATOM 2954 C CA . PHE A-3 1 59 . 6.364 -9.038 -5.571 1 12.42 ? CA PHE A-3 39 1 
ATOM 2955 C C . PHE A-3 1 59 . 7.274 -8.218 -4.646 1 12.63 ? C PHE A-3 39 1 
ATOM 2956 O O . PHE A-3 1 59 . 7.303 -6.995 -4.743 1 12.86 ? O PHE A-3 39 1 
ATOM 2957 C CB . PHE A-3 1 59 . 7.183 -9.952 -6.498 1 12.17 ? CB PHE A-3 39 1 
ATOM 2958 C CG . PHE A-3 1 59 . 6.348 -10.763 -7.456 1 12.08 ? CG PHE A-3 39 1 
ATOM 2959 C CD1 . PHE A-3 1 59 . 5.778 -11.981 -7.06 1 12.27 ? CD1 PHE A-3 39 1 
ATOM 2960 C CD2 . PHE A-3 1 59 . 6.136 -10.322 -8.761 1 12.15 ? CD2 PHE A-3 39 1 
ATOM 2961 C CE1 . PHE A-3 1 59 . 5.002 -12.727 -7.944 1 12.03 ? CE1 PHE A-3 39 1 
ATOM 2962 C CE2 . PHE A-3 1 59 . 5.368 -11.066 -9.655 1 11.99 ? CE2 PHE A-3 39 1 
ATOM 2963 C CZ . PHE A-3 1 59 . 4.798 -12.265 -9.243 1 12.29 ? CZ PHE A-3 39 1 
ATOM 2964 N N . TYR A-3 1 60 . 8.012 -8.892 -3.76 1 12.96 ? N TYR A-3 40 1 
ATOM 2965 C CA . TYR A-3 1 60 . 8.918 -8.231 -2.825 1 13.11 ? CA TYR A-3 40 1 
ATOM 2966 C C . TYR A-3 1 60 . 10.374 -8.568 -3.094 1 13.31 ? C TYR A-3 40 1 
ATOM 2967 O O . TYR A-3 1 60 . 10.749 -9.745 -3.163 1 12.95 ? O TYR A-3 40 1 
ATOM 2968 C CB . TYR A-3 1 60 . 8.568 -8.637 -1.406 1 13.32 ? CB TYR A-3 40 1 
ATOM 2969 C CG . TYR A-3 1 60 . 9.251 -7.86 -0.311 1 13.32 ? CG TYR A-3 40 1 
ATOM 2970 C CD1 . TYR A-3 1 60 . 9.298 -6.463 -0.326 1 13.57 ? CD1 TYR A-3 40 1 
ATOM 2971 C CD2 . TYR A-3 1 60 . 9.794 -8.523 0.78 1 13.67 ? CD2 TYR A-3 40 1 
ATOM 2972 C CE1 . TYR A-3 1 60 . 9.895 -5.752 0.711 1 13.81 ? CE1 TYR A-3 40 1 
ATOM 2973 C CE2 . TYR A-3 1 60 . 10.39 -7.826 1.825 1 13.85 ? CE2 TYR A-3 40 1 
ATOM 2974 C CZ . TYR A-3 1 60 . 10.437 -6.444 1.789 1 14.18 ? CZ TYR A-3 40 1 
ATOM 2975 O OH . TYR A-3 1 60 . 11.029 -5.768 2.84 1 14.5 ? OH TYR A-3 40 1 
ATOM 2976 N N . VAL A-3 1 61 . 11.185 -7.516 -3.208 1 13.63 ? N VAL A-3 41 1 
ATOM 2977 C CA . VAL A-3 1 61 . 12.621 -7.603 -3.555 1 13.92 ? CA VAL A-3 41 1 
ATOM 2978 C C . VAL A-3 1 61 . 13.479 -8.479 -2.601 1 14.26 ? C VAL A-3 41 1 
ATOM 2979 O O . VAL A-3 1 61 . 14.367 -9.21 -3.049 1 14.57 ? O VAL A-3 41 1 
ATOM 2980 C CB . VAL A-3 1 61 . 13.236 -6.178 -3.734 1 13.31 ? CB VAL A-3 41 1 
ATOM 2981 C CG1 . VAL A-3 1 61 . 13.415 -5.46 -2.4 1 13.13 ? CG1 VAL A-3 41 1 
ATOM 2982 C CG2 . VAL A-3 1 61 . 14.56 -6.25 -4.47 1 13.58 ? CG2 VAL A-3 41 1 
ATOM 2983 N N . GLN A-3 1 62 . 13.205 -8.421 -1.303 1 14.41 ? N GLN A-3 42 1 
ATOM 2984 C CA . GLN A-3 1 62 . 13.968 -9.225 -0.337 1 15.2 ? CA GLN A-3 42 1 
ATOM 2985 C C . GLN A-3 1 62 . 13.638 -10.719 -0.406 1 14.9 ? C GLN A-3 42 1 
ATOM 2986 O O . GLN A-3 1 62 . 14.459 -11.559 -0.026 1 15.14 ? O GLN A-3 42 1 
ATOM 2987 C CB . GLN A-3 1 62 . 13.775 -8.699 1.073 1 15.38 ? CB GLN A-3 42 1 
ATOM 2988 C CG . GLN A-3 1 62 . 14.19 -7.249 1.23 1 16.73 ? CG GLN A-3 42 1 
ATOM 2989 C CD . GLN A-3 1 62 . 14.446 -6.878 2.672 1 17.67 ? CD GLN A-3 42 1 
ATOM 2990 O OE1 . GLN A-3 1 62 . 14.299 -7.713 3.567 1 18.87 ? OE1 GLN A-3 42 1 
ATOM 2991 N NE2 . GLN A-3 1 62 . 14.829 -5.618 2.913 1 17.95 ? NE2 GLN A-3 42 1 
ATOM 2992 N N . ASP A-3 1 63 . 12.445 -11.043 -0.904 1 14.54 ? N ASP A-3 43 1 
ATOM 2993 C CA . ASP A-3 1 63 . 12.059 -12.439 -1.143 1 14.12 ? CA ASP A-3 43 1 
ATOM 2994 C C . ASP A-3 1 63 . 12.913 -13.054 -2.229 1 14.45 ? C ASP A-3 43 1 
ATOM 2995 O O . ASP A-3 1 63 . 13.34 -14.209 -2.115 1 15.18 ? O ASP A-3 43 1 
ATOM 2996 C CB . ASP A-3 1 63 . 10.575 -12.544 -1.496 1 13.46 ? CB ASP A-3 43 1 
ATOM 2997 C CG . ASP A-3 1 63 . 9.681 -12.211 -0.32 1 13.42 ? CG ASP A-3 43 1 
ATOM 2998 O OD1 . ASP A-3 1 63 . 10.134 -12.369 0.843 1 13.27 ? OD1 ASP A-3 43 1 
ATOM 2999 O OD2 . ASP A-3 1 63 . 8.526 -11.814 -0.55 1 12.83 ? OD2 ASP A-3 43 1 
ATOM 3000 N N . GLY A-3 1 64 . 13.189 -12.272 -3.266 1 14.57 ? N GLY A-3 44 1 
ATOM 3001 C CA . GLY A-3 1 64 . 13.991 -12.741 -4.394 1 15.16 ? CA GLY A-3 44 1 
ATOM 3002 C C . GLY A-3 1 64 . 15.383 -13.173 -3.974 1 15.39 ? C GLY A-3 44 1 
ATOM 3003 O O . GLY A-3 1 64 . 15.899 -14.196 -4.429 1 15.57 ? O GLY A-3 44 1 
ATOM 3004 N N . LEU A-3 1 65 . 15.988 -12.389 -3.092 1 14.9 ? N LEU A-3 45 1 
ATOM 3005 C CA . LEU A-3 1 65 . 17.347 -12.642 -2.682 1 14.95 ? CA LEU A-3 45 1 
ATOM 3006 C C . LEU A-3 1 65 . 17.39 -13.844 -1.738 1 14.55 ? C LEU A-3 45 1 
ATOM 3007 O O . LEU A-3 1 65 . 18.317 -14.654 -1.794 1 14.46 ? O LEU A-3 45 1 
ATOM 3008 C CB . LEU A-3 1 65 . 17.951 -11.376 -2.072 1 14.9 ? CB LEU A-3 45 1 
ATOM 3009 C CG . LEU A-3 1 65 . 19.466 -11.201 -1.905 1 15.72 ? CG LEU A-3 45 1 
ATOM 3010 C CD1 . LEU A-3 1 65 . 19.861 -11.282 -0.435 1 15.61 ? CD1 LEU A-3 45 1 
ATOM 3011 C CD2 . LEU A-3 1 65 . 20.314 -12.135 -2.78 1 15.59 ? CD2 LEU A-3 45 1 
ATOM 3012 N N . GLY A-3 1 66 . 16.37 -13.968 -0.894 1 14.54 ? N GLY A-3 46 1 
ATOM 3013 C CA . GLY A-3 1 66 . 16.26 -15.107 0.011 1 15.24 ? CA GLY A-3 46 1 
ATOM 3014 C C . GLY A-3 1 66 . 16.031 -16.403 -0.74 1 15.57 ? C GLY A-3 46 1 
ATOM 3015 O O . GLY A-3 1 66 . 16.479 -17.463 -0.308 1 14.92 ? O GLY A-3 46 1 
ATOM 3016 N N . LEU A-3 1 67 . 15.339 -16.306 -1.876 1 16.24 ? N LEU A-3 47 1 
ATOM 3017 C CA . LEU A-3 1 67 . 15.028 -17.478 -2.683 1 16.57 ? CA LEU A-3 47 1 
ATOM 3018 C C . LEU A-3 1 67 . 16.277 -17.937 -3.42 1 16.96 ? C LEU A-3 47 1 
ATOM 3019 O O . LEU A-3 1 67 . 16.524 -19.133 -3.535 1 16.39 ? O LEU A-3 47 1 
ATOM 3020 C CB . LEU A-3 1 67 . 13.858 -17.222 -3.645 1 16.71 ? CB LEU A-3 47 1 
ATOM 3021 C CG . LEU A-3 1 67 . 12.449 -17.307 -3.019 1 17.09 ? CG LEU A-3 47 1 
ATOM 3022 C CD1 . LEU A-3 1 67 . 11.379 -16.725 -3.933 1 17.08 ? CD1 LEU A-3 47 1 
ATOM 3023 C CD2 . LEU A-3 1 67 . 12.085 -18.729 -2.62 1 17.07 ? CD2 LEU A-3 47 1 
ATOM 3024 N N . GLN A-3 1 68 . 17.076 -16.989 -3.894 1 17.46 ? N GLN A-3 48 1 
ATOM 3025 C CA . GLN A-3 1 68 . 18.337 -17.344 -4.531 1 18.32 ? CA GLN A-3 48 1 
ATOM 3026 C C . GLN A-3 1 68 . 19.306 -18.002 -3.546 1 17.41 ? C GLN A-3 48 1 
ATOM 3027 O O . GLN A-3 1 68 . 19.95 -18.984 -3.895 1 17.03 ? O GLN A-3 48 1 
ATOM 3028 C CB . GLN A-3 1 68 . 18.965 -16.143 -5.237 1 20.46 ? CB GLN A-3 48 1 
ATOM 3029 C CG . GLN A-3 1 68 . 18.406 -15.909 -6.635 1 23.55 ? CG GLN A-3 48 1 
ATOM 3030 C CD . GLN A-3 1 68 . 18.592 -14.478 -7.105 1 26.39 ? CD GLN A-3 48 1 
ATOM 3031 O OE1 . GLN A-3 1 68 . 18.922 -13.59 -6.314 1 28.63 ? OE1 GLN A-3 48 1 
ATOM 3032 N NE2 . GLN A-3 1 68 . 18.365 -14.241 -8.386 1 26.87 ? NE2 GLN A-3 48 1 
ATOM 3033 N N . ALA A-3 1 69 . 19.37 -17.484 -2.321 1 16.77 ? N ALA A-3 49 1 
ATOM 3034 C CA . ALA A-3 1 69 . 20.152 -18.095 -1.246 1 16.78 ? CA ALA A-3 49 1 
ATOM 3035 C C . ALA A-3 1 69 . 19.765 -19.557 -1.033 1 16.51 ? C ALA A-3 49 1 
ATOM 3036 O O . ALA A-3 1 69 . 20.607 -20.452 -1.147 1 16.17 ? O ALA A-3 49 1 
ATOM 3037 C CB . ALA A-3 1 69 . 19.991 -17.311 0.037 1 16.84 ? CB ALA A-3 49 1 
ATOM 3038 N N . LEU A-3 1 70 . 18.493 -19.798 -0.733 1 16.84 ? N LEU A-3 50 1 
ATOM 3039 C CA . LEU A-3 1 70 . 17.965 -21.157 -0.637 1 16.75 ? CA LEU A-3 50 1 
ATOM 3040 C C . LEU A-3 1 70 . 18.373 -21.979 -1.844 1 16.99 ? C LEU A-3 50 1 
ATOM 3041 O O . LEU A-3 1 70 . 18.993 -23.03 -1.699 1 16.65 ? O LEU A-3 50 1 
ATOM 3042 C CB . LEU A-3 1 70 . 16.438 -21.149 -0.571 1 16.75 ? CB LEU A-3 50 1 
ATOM 3043 C CG . LEU A-3 1 70 . 15.702 -21.49 0.715 1 16.49 ? CG LEU A-3 50 1 
ATOM 3044 C CD1 . LEU A-3 1 70 . 14.452 -22.265 0.322 1 16.57 ? CD1 LEU A-3 50 1 
ATOM 3045 C CD2 . LEU A-3 1 70 . 16.546 -22.298 1.688 1 15.91 ? CD2 LEU A-3 50 1 
ATOM 3046 N N . LYS A-3 1 71 . 18.025 -21.478 -3.028 1 17.72 ? N LYS A-3 51 1 
ATOM 3047 C CA . LYS A-3 1 71 . 18.298 -22.155 -4.297 1 18.88 ? CA LYS A-3 51 1 
ATOM 3048 C C . LYS A-3 1 71 . 19.782 -22.5 -4.435 1 19.43 ? C LYS A-3 51 1 
ATOM 3049 O O . LYS A-3 1 71 . 20.134 -23.607 -4.826 1 18.88 ? O LYS A-3 51 1 
ATOM 3050 C CB . LYS A-3 1 71 . 17.822 -21.283 -5.456 1 19.27 ? CB LYS A-3 51 1 
ATOM 3051 C CG . LYS A-3 1 71 . 17.951 -21.901 -6.845 1 20.27 ? CG LYS A-3 51 1 
ATOM 3052 C CD . LYS A-3 1 71 . 19.239 -21.488 -7.528 1 20.75 ? CD LYS A-3 51 1 
ATOM 3053 C CE . LYS A-3 1 71 . 19.151 -20.081 -8.109 1 20.99 ? CE LYS A-3 51 1 
ATOM 3054 N NZ . LYS A-3 1 71 . 20.172 -19.94 -9.186 1 20.05 ? NZ LYS A-3 51 1 
ATOM 3055 N N . GLN A-3 1 72 . 20.637 -21.545 -4.083 1 21.18 ? N GLN A-3 52 1 
ATOM 3056 C CA . GLN A-3 1 72 . 22.091 -21.718 -4.113 1 22.4 ? CA GLN A-3 52 1 
ATOM 3057 C C . GLN A-3 1 72 . 22.574 -22.866 -3.243 1 22.13 ? C GLN A-3 52 1 
ATOM 3058 O O . GLN A-3 1 72 . 23.58 -23.506 -3.558 1 21.46 ? O GLN A-3 52 1 
ATOM 3059 C CB . GLN A-3 1 72 . 22.783 -20.462 -3.601 1 24.02 ? CB GLN A-3 52 1 
ATOM 3060 C CG . GLN A-3 1 72 . 22.843 -19.314 -4.576 1 27.35 ? CG GLN A-3 52 1 
ATOM 3061 C CD . GLN A-3 1 72 . 23.764 -18.22 -4.084 1 29.94 ? CD GLN A-3 52 1 
ATOM 3062 O OE1 . GLN A-3 1 72 . 24.46 -18.386 -3.073 1 32.19 ? OE1 GLN A-3 52 1 
ATOM 3063 N NE2 . GLN A-3 1 72 . 23.777 -17.093 -4.79 1 30.54 ? NE2 GLN A-3 52 1 
ATOM 3064 N N . SER A-3 1 73 . 21.889 -23.086 -2.122 1 21.56 ? N SER A-3 53 1 
ATOM 3065 C CA . SER A-3 1 73 . 22.292 -24.124 -1.182 1 20.55 ? CA SER A-3 53 1 
ATOM 3066 C C . SER A-3 1 73 . 21.829 -25.49 -1.658 1 20.46 ? C SER A-3 53 1 
ATOM 3067 O O . SER A-3 1 73 . 22.011 -26.48 -0.963 1 21.04 ? O SER A-3 53 1 
ATOM 3068 C CB . SER A-3 1 73 . 21.759 -23.834 0.219 1 20.26 ? CB SER A-3 53 1 
ATOM 3069 O OG . SER A-3 1 73 . 20.375 -24.093 0.287 1 20.5 ? OG SER A-3 53 1 
ATOM 3070 N N . GLY A-3 1 74 . 21.235 -25.534 -2.847 1 20.43 ? N GLY A-3 54 1 
ATOM 3071 C CA . GLY A-3 1 74 . 20.819 -26.786 -3.461 1 20.23 ? CA GLY A-3 54 1 
ATOM 3072 C C . GLY A-3 1 74 . 19.398 -27.211 -3.144 1 20.15 ? C GLY A-3 54 1 
ATOM 3073 O O . GLY A-3 1 74 . 19.104 -28.392 -3.09 1 20.96 ? O GLY A-3 54 1 
ATOM 3074 N N . ILE A-3 1 75 . 18.513 -26.251 -2.922 1 19.8 ? N ILE A-3 55 1 
ATOM 3075 C CA . ILE A-3 1 75 . 17.102 -26.563 -2.764 1 18.63 ? CA ILE A-3 55 1 
ATOM 3076 C C . ILE A-3 1 75 . 16.375 -26.183 -4.054 1 18.4 ? C ILE A-3 55 1 
ATOM 3077 O O . ILE A-3 1 75 . 16.672 -25.161 -4.673 1 18.17 ? O ILE A-3 55 1 
ATOM 3078 C CB . ILE A-3 1 75 . 16.516 -25.933 -1.478 1 18.7 ? CB ILE A-3 55 1 
ATOM 3079 C CG1 . ILE A-3 1 75 . 17.101 -26.663 -0.255 1 18.5 ? CG1 ILE A-3 55 1 
ATOM 3080 C CG2 . ILE A-3 1 75 . 14.989 -25.993 -1.461 1 18.24 ? CG2 ILE A-3 55 1 
ATOM 3081 C CD1 . ILE A-3 1 75 . 16.927 -25.95 1.068 1 18.61 ? CD1 ILE A-3 55 1 
ATOM 3082 N N . ILE A-3 1 76 . 15.478 -27.061 -4.486 1 18.04 ? N ILE A-3 56 1 
ATOM 3083 C CA . ILE A-3 1 76 . 14.677 -26.846 -5.686 1 17.63 ? CA ILE A-3 56 1 
ATOM 3084 C C . ILE A-3 1 76 . 13.466 -25.985 -5.336 1 16.99 ? C ILE A-3 56 1 
ATOM 3085 O O . ILE A-3 1 76 . 12.808 -26.198 -4.309 1 16.43 ? O ILE A-3 56 1 
ATOM 3086 C CB . ILE A-3 1 76 . 14.225 -28.195 -6.292 1 17.96 ? CB ILE A-3 56 1 
ATOM 3087 C CG1 . ILE A-3 1 76 . 15.458 -29.052 -6.623 1 18.29 ? CG1 ILE A-3 56 1 
ATOM 3088 C CG2 . ILE A-3 1 76 . 13.352 -27.982 -7.53 1 17.55 ? CG2 ILE A-3 56 1 
ATOM 3089 C CD1 . ILE A-3 1 76 . 15.219 -30.545 -6.533 1 19.03 ? CD1 ILE A-3 56 1 
ATOM 3090 N N . LEU A-3 1 77 . 13.194 -25.009 -6.198 1 16.23 ? N LEU A-3 57 1 
ATOM 3091 C CA . LEU A-3 1 77 . 12.122 -24.054 -5.98 1 15.68 ? CA LEU A-3 57 1 
ATOM 3092 C C . LEU A-3 1 77 . 10.979 -24.273 -6.97 1 15.42 ? C LEU A-3 57 1 
ATOM 3093 O O . LEU A-3 1 77 . 11.205 -24.468 -8.167 1 14.95 ? O LEU A-3 57 1 
ATOM 3094 C CB . LEU A-3 1 77 . 12.658 -22.622 -6.086 1 15.58 ? CB LEU A-3 57 1 
ATOM 3095 C CG . LEU A-3 1 77 . 13.84 -22.166 -5.221 1 15.36 ? CG LEU A-3 57 1 
ATOM 3096 C CD1 . LEU A-3 1 77 . 14.106 -20.689 -5.481 1 15.71 ? CD1 LEU A-3 57 1 
ATOM 3097 C CD2 . LEU A-3 1 77 . 13.629 -22.398 -3.733 1 15.55 ? CD2 LEU A-3 57 1 
ATOM 3098 N N . ALA A-3 1 78 . 9.756 -24.233 -6.448 1 15.14 ? N ALA A-3 58 1 
ATOM 3099 C CA . ALA A-3 1 78 . 8.551 -24.483 -7.232 1 14.83 ? CA ALA A-3 58 1 
ATOM 3100 C C . ALA A-3 1 78 . 7.441 -23.524 -6.849 1 14.71 ? C ALA A-3 58 1 
ATOM 3101 O O . ALA A-3 1 78 . 7.37 -23.048 -5.704 1 14.64 ? O ALA A-3 58 1 
ATOM 3102 C CB . ALA A-3 1 78 . 8.077 -25.915 -7.051 1 14.86 ? CB ALA A-3 58 1 
ATOM 3103 N N . ILE A-3 1 79 . 6.586 -23.241 -7.825 1 14.09 ? N ILE A-3 59 1 
ATOM 3104 C CA . ILE A-3 1 79 . 5.377 -22.482 -7.603 1 13.69 ? CA ILE A-3 59 1 
ATOM 3105 C C . ILE A-3 1 79 . 4.163 -23.373 -7.883 1 14.01 ? C ILE A-3 59 1 
ATOM 3106 O O . ILE A-3 1 79 . 4.139 -24.131 -8.859 1 13.75 ? O ILE A-3 59 1 
ATOM 3107 C CB . ILE A-3 1 79 . 5.362 -21.2 -8.468 1 13.4 ? CB ILE A-3 59 1 
ATOM 3108 C CG1 . ILE A-3 1 79 . 6.094 -20.059 -7.735 1 13.06 ? CG1 ILE A-3 59 1 
ATOM 3109 C CG2 . ILE A-3 1 79 . 3.94 -20.778 -8.798 1 12.97 ? CG2 ILE A-3 59 1 
ATOM 3110 C CD1 . ILE A-3 1 79 . 6.34 -18.824 -8.581 1 13.35 ? CD1 ILE A-3 59 1 
ATOM 3111 N N . ILE A-3 1 80 . 3.176 -23.312 -6.989 1 14.04 ? N ILE A-3 60 1 
ATOM 3112 C CA . ILE A-3 1 80 . 1.889 -23.959 -7.217 1 14.07 ? CA ILE A-3 60 1 
ATOM 3113 C C . ILE A-3 1 80 . 0.794 -22.944 -6.904 1 14.34 ? C ILE A-3 60 1 
ATOM 3114 O O . ILE A-3 1 80 . 0.587 -22.569 -5.747 1 14.12 ? O ILE A-3 60 1 
ATOM 3115 C CB . ILE A-3 1 80 . 1.711 -25.276 -6.41 1 14.01 ? CB ILE A-3 60 1 
ATOM 3116 C CG1 . ILE A-3 1 80 . 2.978 -26.148 -6.475 1 14.14 ? CG1 ILE A-3 60 1 
ATOM 3117 C CG2 . ILE A-3 1 80 . 0.514 -26.059 -6.95 1 14.07 ? CG2 ILE A-3 60 1 
ATOM 3118 C CD1 . ILE A-3 1 80 . 2.885 -27.459 -5.721 1 14.39 ? CD1 ILE A-3 60 1 
ATOM 3119 N N . THR A-3 1 81 . 0.117 -22.474 -7.942 1 14.77 ? N THR A-3 61 1 
ATOM 3120 C CA . THR A-3 1 81 . -0.848 -21.397 -7.767 1 15.62 ? CA THR A-3 61 1 
ATOM 3121 C C . THR A-3 1 81 . -2.145 -21.686 -8.5 1 15.96 ? C THR A-3 61 1 
ATOM 3122 O O . THR A-3 1 81 . -2.15 -22.301 -9.574 1 15.86 ? O THR A-3 61 1 
ATOM 3123 C CB . THR A-3 1 81 . -0.287 -20.001 -8.157 1 15.79 ? CB THR A-3 61 1 
ATOM 3124 O OG1 . THR A-3 1 81 . -1.318 -19.014 -8.016 1 16.99 ? OG1 THR A-3 61 1 
ATOM 3125 C CG2 . THR A-3 1 81 . 0.214 -19.965 -9.599 1 16.03 ? CG2 THR A-3 61 1 
ATOM 3126 N N . GLY A-3 1 82 . -3.24 -21.253 -7.887 1 16.22 ? N GLY A-3 62 1 
ATOM 3127 C CA . GLY A-3 1 82 . -4.567 -21.466 -8.42 1 16.82 ? CA GLY A-3 62 1 
ATOM 3128 C C . GLY A-3 1 82 . -4.829 -20.626 -9.642 1 17.26 ? C GLY A-3 62 1 
ATOM 3129 O O . GLY A-3 1 82 . -5.574 -21.039 -10.521 1 18.49 ? O GLY A-3 62 1 
ATOM 3130 N N . ARG A-3 1 83 . -4.219 -19.447 -9.707 1 17.83 ? N ARG A-3 63 1 
ATOM 3131 C CA . ARG A-3 1 83 . -4.401 -18.565 -10.853 1 18.36 ? CA ARG A-3 63 1 
ATOM 3132 C C . ARG A-3 1 83 . -3.313 -18.801 -11.886 1 19.33 ? C ARG A-3 63 1 
ATOM 3133 O O . ARG A-3 1 83 . -2.502 -19.71 -11.739 1 20.52 ? O ARG A-3 63 1 
ATOM 3134 C CB . ARG A-3 1 83 . -4.458 -17.1 -10.411 1 17.96 ? CB ARG A-3 63 1 
ATOM 3135 C CG . ARG A-3 1 83 . -5.759 -16.74 -9.696 1 17.91 ? CG ARG A-3 63 1 
ATOM 3136 C CD . ARG A-3 1 83 . -5.741 -15.329 -9.123 1 18.01 ? CD ARG A-3 63 1 
ATOM 3137 N NE . ARG A-3 1 83 . -5.688 -14.323 -10.185 1 17.34 ? NE ARG A-3 63 1 
ATOM 3138 C CZ . ARG A-3 1 83 . -6.751 -13.854 -10.826 1 16.87 ? CZ ARG A-3 63 1 
ATOM 3139 N NH1 . ARG A-3 1 83 . -7.969 -14.27 -10.504 1 16.57 ? NH1 ARG A-3 63 1 
ATOM 3140 N NH2 . ARG A-3 1 83 . -6.592 -12.952 -11.781 1 16.23 ? NH2 ARG A-3 63 1 
ATOM 3141 N N . SER A-3 1 84 . -3.296 -17.991 -12.938 1 19.47 ? N SER A-3 64 1 
ATOM 3142 C CA . SER A-3 1 84 . -2.312 -18.162 -14.003 1 19.07 ? CA SER A-3 64 1 
ATOM 3143 C C . SER A-3 1 84 . -1.999 -16.846 -14.722 1 18.38 ? C SER A-3 64 1 
ATOM 3144 O O . SER A-3 1 84 . -2.913 -16.167 -15.185 1 18.82 ? O SER A-3 64 1 
ATOM 3145 C CB . SER A-3 1 84 . -2.829 -19.194 -15.002 1 19.47 ? CB SER A-3 64 1 
ATOM 3146 O OG . SER A-3 1 84 . -2.004 -19.211 -16.139 1 20.11 ? OG SER A-3 64 1 
ATOM 3147 N N . SER A-3 1 85 . -0.713 -16.498 -14.832 1 17.75 ? N SER A-3 65 1 
ATOM 3148 C CA . SER A-3 1 85 . -0.299 -15.238 -15.477 1 17.13 ? CA SER A-3 65 1 
ATOM 3149 C C . SER A-3 1 85 . 1.153 -15.229 -15.972 1 16.95 ? C SER A-3 65 1 
ATOM 3150 O O . SER A-3 1 85 . 1.994 -15.99 -15.48 1 16.64 ? O SER A-3 65 1 
ATOM 3151 C CB . SER A-3 1 85 . -0.529 -14.044 -14.537 1 16.56 ? CB SER A-3 65 1 
ATOM 3152 O OG . SER A-3 1 85 . 0.428 -14.014 -13.48 1 15.94 ? OG SER A-3 65 1 
ATOM 3153 N N . ALA A-3 1 86 . 1.443 -14.353 -16.939 1 16.55 ? N ALA A-3 66 1 
ATOM 3154 C CA . ALA A-3 1 86 . 2.824 -14.139 -17.397 1 16.96 ? CA ALA A-3 66 1 
ATOM 3155 C C . ALA A-3 1 86 . 3.688 -13.502 -16.297 1 17.43 ? C ALA A-3 66 1 
ATOM 3156 O O . ALA A-3 1 86 . 4.904 -13.663 -16.296 1 17.65 ? O ALA A-3 66 1 
ATOM 3157 C CB . ALA A-3 1 86 . 2.864 -13.292 -18.659 1 16.4 ? CB ALA A-3 66 1 
ATOM 3158 N N . MET A-3 1 87 . 3.066 -12.795 -15.358 1 17.5 ? N MET A-3 67 1 
ATOM 3159 C CA . MET A-3 1 87 . 3.835 -12.182 -14.277 1 18.4 ? CA MET A-3 67 1 
ATOM 3160 C C . MET A-3 1 87 . 4.519 -13.235 -13.427 1 18.15 ? C MET A-3 67 1 
ATOM 3161 O O . MET A-3 1 87 . 5.695 -13.099 -13.095 1 18.63 ? O MET A-3 67 1 
ATOM 3162 C CB . MET A-3 1 87 . 2.969 -11.268 -13.41 1 18.33 ? CB MET A-3 67 1 
ATOM 3163 C CG . MET A-3 1 87 . 2.369 -10.105 -14.171 1 19.02 ? CG MET A-3 67 1 
ATOM 3164 S SD . MET A-3 1 87 . 0.836 -10.539 -14.998 1 19.97 ? SD MET A-3 67 1 
ATOM 3165 C CE . MET A-3 1 87 . -0.263 -10.467 -13.586 1 18.94 ? CE MET A-3 67 1 
ATOM 3166 N N . VAL A-3 1 88 . 3.777 -14.283 -13.082 1 18.83 ? N VAL A-3 68 1 
ATOM 3167 C CA . VAL A-3 1 88 . 4.312 -15.382 -12.286 1 19.55 ? CA VAL A-3 68 1 
ATOM 3168 C C . VAL A-3 1 88 . 5.487 -16.055 -12.991 1 20.71 ? C VAL A-3 68 1 
ATOM 3169 O O . VAL A-3 1 88 . 6.533 -16.286 -12.368 1 20.54 ? O VAL A-3 68 1 
ATOM 3170 C CB . VAL A-3 1 88 . 3.225 -16.425 -11.964 1 19.61 ? CB VAL A-3 68 1 
ATOM 3171 C CG1 . VAL A-3 1 88 . 3.843 -17.696 -11.397 1 19.41 ? CG1 VAL A-3 68 1 
ATOM 3172 C CG2 . VAL A-3 1 88 . 2.192 -15.837 -11.007 1 19.06 ? CG2 VAL A-3 68 1 
ATOM 3173 N N . ASP A-3 1 89 . 5.302 -16.357 -14.281 1 21.17 ? N ASP A-3 69 1 
ATOM 3174 C CA . ASP A-3 1 89 . 6.331 -16.987 -15.107 1 22.32 ? CA ASP A-3 69 1 
ATOM 3175 C C . ASP A-3 1 89 . 7.612 -16.158 -15.146 1 21.73 ? C ASP A-3 69 1 
ATOM 3176 O O . ASP A-3 1 89 . 8.716 -16.695 -14.982 1 21.9 ? O ASP A-3 69 1 
ATOM 3177 C CB . ASP A-3 1 89 . 5.817 -17.217 -16.535 1 23.24 ? CB ASP A-3 69 1 
ATOM 3178 C CG . ASP A-3 1 89 . 5.011 -18.498 -16.667 1 24.4 ? CG ASP A-3 69 1 
ATOM 3179 O OD1 . ASP A-3 1 89 . 5.599 -19.607 -16.613 1 24.83 ? OD1 ASP A-3 69 1 
ATOM 3180 O OD2 . ASP A-3 1 89 . 3.777 -18.401 -16.823 1 25.73 ? OD2 ASP A-3 69 1 
ATOM 3181 N N . ARG A-3 1 90 . 7.45 -14.852 -15.35 1 20.4 ? N ARG A-3 70 1 
ATOM 3182 C CA . ARG A-3 1 90 . 8.571 -13.928 -15.388 1 19.78 ? CA ARG A-3 70 1 
ATOM 3183 C C . ARG A-3 1 90 . 9.295 -13.858 -14.038 1 18.52 ? C ARG A-3 70 1 
ATOM 3184 O O . ARG A-3 1 90 . 10.52 -13.973 -13.995 1 18.15 ? O ARG A-3 70 1 
ATOM 3185 C CB . ARG A-3 1 90 . 8.119 -12.538 -15.862 1 20.63 ? CB ARG A-3 70 1 
ATOM 3186 C CG . ARG A-3 1 90 . 9.216 -11.482 -15.888 1 21.38 ? CG ARG A-3 70 1 
ATOM 3187 C CD . ARG A-3 1 90 . 8.656 -10.099 -16.206 1 22.58 ? CD ARG A-3 70 1 
ATOM 3188 N NE . ARG A-3 1 90 . 9.717 -9.097 -16.302 1 23.77 ? NE ARG A-3 70 1 
ATOM 3189 C CZ . ARG A-3 1 90 . 9.574 -7.851 -16.763 1 24.7 ? CZ ARG A-3 70 1 
ATOM 3190 N NH1 . ARG A-3 1 90 . 8.391 -7.394 -17.187 1 24.1 ? NH1 ARG A-3 70 1 
ATOM 3191 N NH2 . ARG A-3 1 90 . 10.636 -7.054 -16.796 1 23.65 ? NH2 ARG A-3 70 1 
ATOM 3192 N N . ARG A-3 1 91 . 8.551 -13.688 -12.945 1 17.53 ? N ARG A-3 71 1 
ATOM 3193 C CA . ARG A-3 1 91 . 9.168 -13.63 -11.632 1 16.72 ? CA ARG A-3 71 1 
ATOM 3194 C C . ARG A-3 1 91 . 9.883 -14.938 -11.324 1 17.14 ? C ARG A-3 71 1 
ATOM 3195 O O . ARG A-3 1 91 . 11.01 -14.935 -10.824 1 16.74 ? O ARG A-3 71 1 
ATOM 3196 C CB . ARG A-3 1 91 . 8.144 -13.3 -10.551 1 16.24 ? CB ARG A-3 71 1 
ATOM 3197 C CG . ARG A-3 1 91 . 8.73 -13.113 -9.158 1 16.1 ? CG ARG A-3 71 1 
ATOM 3198 C CD . ARG A-3 1 91 . 9.662 -11.906 -9.054 1 16.25 ? CD ARG A-3 71 1 
ATOM 3199 N NE . ARG A-3 1 91 . 10.115 -11.66 -7.676 1 16.08 ? NE ARG A-3 71 1 
ATOM 3200 C CZ . ARG A-3 1 91 . 11.146 -10.889 -7.323 1 16.47 ? CZ ARG A-3 71 1 
ATOM 3201 N NH1 . ARG A-3 1 91 . 11.881 -10.261 -8.237 1 16.45 ? NH1 ARG A-3 71 1 
ATOM 3202 N NH2 . ARG A-3 1 91 . 11.449 -10.747 -6.036 1 16.48 ? NH2 ARG A-3 71 1 
ATOM 3203 N N . ALA A-3 1 92 . 9.235 -16.056 -11.647 1 17.78 ? N ALA A-3 72 1 
ATOM 3204 C CA . ALA A-3 1 92 . 9.821 -17.372 -11.422 1 18.13 ? CA ALA A-3 72 1 
ATOM 3205 C C . ALA A-3 1 92 . 11.123 -17.54 -12.213 1 18.69 ? C ALA A-3 72 1 
ATOM 3206 O O . ALA A-3 1 92 . 12.137 -17.955 -11.658 1 18.36 ? O ALA A-3 72 1 
ATOM 3207 C CB . ALA A-3 1 92 . 8.825 -18.466 -11.776 1 17.69 ? CB ALA A-3 72 1 
ATOM 3208 N N . LYS A-3 1 93 . 11.09 -17.197 -13.5 1 19.88 ? N LYS A-3 73 1 
ATOM 3209 C CA . LYS A-3 1 93 . 12.269 -17.299 -14.364 1 20.32 ? CA LYS A-3 73 1 
ATOM 3210 C C . LYS A-3 1 93 . 13.497 -16.535 -13.863 1 20 ? C LYS A-3 73 1 
ATOM 3211 O O . LYS A-3 1 93 . 14.604 -17.071 -13.885 1 20.82 ? O LYS A-3 73 1 
ATOM 3212 C CB . LYS A-3 1 93 . 11.919 -16.9 -15.799 1 22.04 ? CB LYS A-3 73 1 
ATOM 3213 C CG . LYS A-3 1 93 . 11.25 -18.036 -16.561 1 24.21 ? CG LYS A-3 73 1 
ATOM 3214 C CD . LYS A-3 1 93 . 10.635 -17.585 -17.873 1 26.69 ? CD LYS A-3 73 1 
ATOM 3215 C CE . LYS A-3 1 93 . 9.833 -18.723 -18.49 1 28.37 ? CE LYS A-3 73 1 
ATOM 3216 N NZ . LYS A-3 1 93 . 9.522 -18.466 -19.92 1 30.02 ? NZ LYS A-3 73 1 
ATOM 3217 N N . GLU A-3 1 94 . 13.315 -15.306 -13.385 1 18.9 ? N GLU A-3 74 1 
ATOM 3218 C CA . GLU A-3 1 94 . 14.471 -14.499 -12.933 1 17.97 ? CA GLU A-3 74 1 
ATOM 3219 C C . GLU A-3 1 94 . 15.087 -14.983 -11.615 1 17 ? C GLU A-3 74 1 
ATOM 3220 O O . GLU A-3 1 94 . 16.26 -14.722 -11.34 1 16.98 ? O GLU A-3 74 1 
ATOM 3221 C CB . GLU A-3 1 94 . 14.107 -13.009 -12.842 1 18.21 ? CB GLU A-3 74 1 
ATOM 3222 C CG . GLU A-3 1 94 . 13.251 -12.657 -11.637 1 17.42 ? CG GLU A-3 74 1 
ATOM 3223 C CD . GLU A-3 1 94 . 12.847 -11.204 -11.59 1 17.32 ? CD GLU A-3 74 1 
ATOM 3224 O OE1 . GLU A-3 1 94 . 13.614 -10.347 -12.059 1 17.27 ? OE1 GLU A-3 74 1 
ATOM 3225 O OE2 . GLU A-3 1 94 . 11.76 -10.918 -11.047 1 17.13 ? OE2 GLU A-3 74 1 
ATOM 3226 N N . LEU A-3 1 95 . 14.302 -15.677 -10.796 1 16.3 ? N LEU A-3 75 1 
ATOM 3227 C CA . LEU A-3 1 95 . 14.807 -16.194 -9.521 1 15.89 ? CA LEU A-3 75 1 
ATOM 3228 C C . LEU A-3 1 95 . 15.233 -17.66 -9.615 1 15.82 ? C LEU A-3 75 1 
ATOM 3229 O O . LEU A-3 1 95 . 15.795 -18.213 -8.666 1 15.61 ? O LEU A-3 75 1 
ATOM 3230 C CB . LEU A-3 1 95 . 13.762 -16.004 -8.407 1 15.63 ? CB LEU A-3 75 1 
ATOM 3231 C CG . LEU A-3 1 95 . 13.334 -14.556 -8.13 1 15.53 ? CG LEU A-3 75 1 
ATOM 3232 C CD1 . LEU A-3 1 95 . 12.212 -14.503 -7.104 1 15.56 ? CD1 LEU A-3 75 1 
ATOM 3233 C CD2 . LEU A-3 1 95 . 14.516 -13.712 -7.67 1 15.59 ? CD2 LEU A-3 75 1 
ATOM 3234 N N . GLY A-3 1 96 . 14.955 -18.289 -10.757 1 15.49 ? N GLY A-3 76 1 
ATOM 3235 C CA . GLY A-3 1 96 . 15.222 -19.71 -10.925 1 15.56 ? CA GLY A-3 76 1 
ATOM 3236 C C . GLY A-3 1 96 . 14.309 -20.585 -10.074 1 15.67 ? C GLY A-3 76 1 
ATOM 3237 O O . GLY A-3 1 96 . 14.749 -21.601 -9.514 1 15.34 ? O GLY A-3 76 1 
ATOM 3238 N N . ILE A-3 1 97 . 13.044 -20.179 -9.952 1 15.16 ? N ILE A-3 77 1 
ATOM 3239 C CA . ILE A-3 1 97 . 11.995 -21.087 -9.499 1 15.1 ? CA ILE A-3 77 1 
ATOM 3240 C C . ILE A-3 1 97 . 11.718 -21.961 -10.71 1 15.34 ? C ILE A-3 77 1 
ATOM 3241 O O . ILE A-3 1 97 . 11.237 -21.467 -11.731 1 15.63 ? O ILE A-3 77 1 
ATOM 3242 C CB . ILE A-3 1 97 . 10.72 -20.345 -9.079 1 14.89 ? CB ILE A-3 77 1 
ATOM 3243 C CG1 . ILE A-3 1 97 . 10.962 -19.56 -7.783 1 14.5 ? CG1 ILE A-3 77 1 
ATOM 3244 C CG2 . ILE A-3 1 97 . 9.564 -21.327 -8.918 1 14.81 ? CG2 ILE A-3 77 1 
ATOM 3245 C CD1 . ILE A-3 1 97 . 9.955 -18.462 -7.541 1 14.32 ? CD1 ILE A-3 77 1 
ATOM 3246 N N . SER A-3 1 98 . 12.05 -23.245 -10.606 1 15.42 ? N SER A-3 78 1 
ATOM 3247 C CA . SER A-3 1 98 . 12.216 -24.08 -11.799 1 15.5 ? CA SER A-3 78 1 
ATOM 3248 C C . SER A-3 1 98 . 11.015 -24.933 -12.198 1 15.45 ? C SER A-3 78 1 
ATOM 3249 O O . SER A-3 1 98 . 10.968 -25.437 -13.334 1 15.25 ? O SER A-3 78 1 
ATOM 3250 C CB . SER A-3 1 98 . 13.459 -24.962 -11.655 1 15.58 ? CB SER A-3 78 1 
ATOM 3251 O OG . SER A-3 1 98 . 13.494 -25.591 -10.382 1 16.15 ? OG SER A-3 78 1 
ATOM 3252 N N . HIS A-3 1 99 . 10.07 -25.12 -11.274 1 15.26 ? N HIS A-3 79 1 
ATOM 3253 C CA . HIS A-3 1 99 . 8.83 -25.838 -11.576 1 15.57 ? CA HIS A-3 79 1 
ATOM 3254 C C . HIS A-3 1 99 . 7.659 -24.913 -11.313 1 16.2 ? C HIS A-3 79 1 
ATOM 3255 O O . HIS A-3 1 99 . 7.392 -24.524 -10.163 1 16.09 ? O HIS A-3 79 1 
ATOM 3256 C CB . HIS A-3 1 99 . 8.712 -27.149 -10.778 1 15.49 ? CB HIS A-3 79 1 
ATOM 3257 C CG . HIS A-3 1 99 . 9.789 -28.14 -11.096 1 15.79 ? CG HIS A-3 79 1 
ATOM 3258 N ND1 . HIS A-3 1 99 . 11.009 -28.149 -10.449 1 16.42 ? ND1 HIS A-3 79 1 
ATOM 3259 C CD2 . HIS A-3 1 99 . 9.849 -29.13 -12.019 1 15.66 ? CD2 HIS A-3 79 1 
ATOM 3260 C CE1 . HIS A-3 1 99 . 11.768 -29.107 -10.955 1 15.81 ? CE1 HIS A-3 79 1 
ATOM 3261 N NE2 . HIS A-3 1 99 . 11.086 -29.719 -11.904 1 15.36 ? NE2 HIS A-3 79 1 
ATOM 3262 N N . ILE A-3 1 100 . 6.981 -24.526 -12.389 1 16.22 ? N ILE A-3 80 1 
ATOM 3263 C CA . ILE A-3 1 100 . 5.947 -23.525 -12.263 1 16.88 ? CA ILE A-3 80 1 
ATOM 3264 C C . ILE A-3 1 100 . 4.584 -24.112 -12.587 1 17 ? C ILE A-3 80 1 
ATOM 3265 O O . ILE A-3 1 100 . 4.223 -24.273 -13.75 1 17.44 ? O ILE A-3 80 1 
ATOM 3266 C CB . ILE A-3 1 100 . 6.25 -22.275 -13.109 1 16.45 ? CB ILE A-3 80 1 
ATOM 3267 C CG1 . ILE A-3 1 100 . 7.717 -21.857 -12.934 1 16.28 ? CG1 ILE A-3 80 1 
ATOM 3268 C CG2 . ILE A-3 1 100 . 5.315 -21.138 -12.72 1 16.62 ? CG2 ILE A-3 80 1 
ATOM 3269 C CD1 . ILE A-3 1 100 . 8.36 -21.344 -14.204 1 16.11 ? CD1 ILE A-3 80 1 
ATOM 3270 N N . ILE A-3 1 101 . 3.833 -24.438 -11.542 1 16.48 ? N ILE A-3 81 1 
ATOM 3271 C CA . ILE A-3 1 101 . 2.513 -24.999 -11.74 1 16.23 ? CA ILE A-3 81 1 
ATOM 3272 C C . ILE A-3 1 101 . 1.478 -23.92 -11.449 1 16.13 ? C ILE A-3 81 1 
ATOM 3273 O O . ILE A-3 1 101 . 1.399 -23.401 -10.328 1 15.79 ? O ILE A-3 81 1 
ATOM 3274 C CB . ILE A-3 1 101 . 2.292 -26.27 -10.9 1 16.21 ? CB ILE A-3 81 1 
ATOM 3275 C CG1 . ILE A-3 1 101 . 3.399 -27.293 -11.192 1 16.1 ? CG1 ILE A-3 81 1 
ATOM 3276 C CG2 . ILE A-3 1 101 . 0.914 -26.85 -11.188 1 15.89 ? CG2 ILE A-3 81 1 
ATOM 3277 C CD1 . ILE A-3 1 101 . 3.338 -28.551 -10.342 1 15.74 ? CD1 ILE A-3 81 1 
ATOM 3278 N N . GLN A-3 1 102 . 0.721 -23.573 -12.49 1 16.1 ? N GLN A-3 82 1 
ATOM 3279 C CA . GLN A-3 1 102 . -0.288 -22.511 -12.451 1 16.51 ? CA GLN A-3 82 1 
ATOM 3280 C C . GLN A-3 1 102 . -1.638 -23.074 -12.87 1 16.72 ? C GLN A-3 82 1 
ATOM 3281 O O . GLN A-3 1 102 . -1.703 -24.136 -13.492 1 16.02 ? O GLN A-3 82 1 
ATOM 3282 C CB . GLN A-3 1 102 . 0.089 -21.369 -13.403 1 16.49 ? CB GLN A-3 82 1 
ATOM 3283 C CG . GLN A-3 1 102 . 1.39 -20.656 -13.074 1 16.03 ? CG GLN A-3 82 1 
ATOM 3284 C CD . GLN A-3 1 102 . 1.492 -19.279 -13.718 1 16.37 ? CD GLN A-3 82 1 
ATOM 3285 O OE1 . GLN A-3 1 102 . 0.867 -18.322 -13.265 1 16.2 ? OE1 GLN A-3 82 1 
ATOM 3286 N NE2 . GLN A-3 1 102 . 2.31 -19.169 -14.754 1 15.74 ? NE2 GLN A-3 82 1 
ATOM 3287 N N . GLY A-3 1 103 . -2.712 -22.354 -12.544 1 16.7 ? N GLY A-3 83 1 
ATOM 3288 C CA . GLY A-3 1 103 . -4.058 -22.817 -12.847 1 16.68 ? CA GLY A-3 83 1 
ATOM 3289 C C . GLY A-3 1 103 . -4.382 -24.108 -12.111 1 17.66 ? C GLY A-3 83 1 
ATOM 3290 O O . GLY A-3 1 103 . -5.186 -24.918 -12.588 1 17.17 ? O GLY A-3 83 1 
ATOM 3291 N N . GLN A-3 1 104 . -3.745 -24.3 -10.953 1 17.8 ? N GLN A-3 84 1 
ATOM 3292 C CA . GLN A-3 1 104 . -3.919 -25.503 -10.148 1 18.62 ? CA GLN A-3 84 1 
ATOM 3293 C C . GLN A-3 1 104 . -4.166 -25.158 -8.682 1 18.69 ? C GLN A-3 84 1 
ATOM 3294 O O . GLN A-3 1 104 . -3.263 -24.662 -7.993 1 18.14 ? O GLN A-3 84 1 
ATOM 3295 C CB . GLN A-3 1 104 . -2.684 -26.407 -10.286 1 19.67 ? CB GLN A-3 84 1 
ATOM 3296 C CG . GLN A-3 1 104 . -2.631 -27.618 -9.355 1 20.38 ? CG GLN A-3 84 1 
ATOM 3297 C CD . GLN A-3 1 104 . -3.763 -28.608 -9.592 1 20.97 ? CD GLN A-3 84 1 
ATOM 3298 O OE1 . GLN A-3 1 104 . -4.913 -28.373 -9.198 1 20.68 ? OE1 GLN A-3 84 1 
ATOM 3299 N NE2 . GLN A-3 1 104 . -3.439 -29.73 -10.235 1 20.37 ? NE2 GLN A-3 84 1 
ATOM 3300 N N . ASP A-3 1 105 . -5.383 -25.43 -8.213 1 19.17 ? N ASP A-3 85 1 
ATOM 3301 C CA . ASP A-3 1 105 . -5.748 -25.208 -6.809 1 19.67 ? CA ASP A-3 85 1 
ATOM 3302 C C . ASP A-3 1 105 . -5.621 -26.461 -5.925 1 19.34 ? C ASP A-3 85 1 
ATOM 3303 O O . ASP A-3 1 105 . -5.597 -26.352 -4.702 1 19.07 ? O ASP A-3 85 1 
ATOM 3304 C CB . ASP A-3 1 105 . -7.153 -24.583 -6.689 1 21.59 ? CB ASP A-3 85 1 
ATOM 3305 C CG . ASP A-3 1 105 . -7.113 -23.055 -6.501 1 23.09 ? CG ASP A-3 85 1 
ATOM 3306 O OD1 . ASP A-3 1 105 . -6.249 -22.552 -5.755 1 24.65 ? OD1 ASP A-3 85 1 
ATOM 3307 O OD2 . ASP A-3 1 105 . -7.953 -22.348 -7.091 1 25.05 ? OD2 ASP A-3 85 1 
ATOM 3308 N N . ASP A-3 1 106 . -5.532 -27.64 -6.544 1 18.8 ? N ASP A-3 86 1 
ATOM 3309 C CA . ASP A-3 1 106 . -5.279 -28.889 -5.818 1 18.66 ? CA ASP A-3 86 1 
ATOM 3310 C C . ASP A-3 1 106 . -3.78 -29.004 -5.532 1 17.49 ? C ASP A-3 86 1 
ATOM 3311 O O . ASP A-3 1 106 . -3.049 -29.721 -6.218 1 16.96 ? O ASP A-3 86 1 
ATOM 3312 C CB . ASP A-3 1 106 . -5.809 -30.092 -6.623 1 20.16 ? CB ASP A-3 86 1 
ATOM 3313 C CG . ASP A-3 1 106 . -5.843 -31.403 -5.817 1 21.4 ? CG ASP A-3 86 1 
ATOM 3314 O OD1 . ASP A-3 1 106 . -5.556 -31.424 -4.591 1 22.53 ? OD1 ASP A-3 86 1 
ATOM 3315 O OD2 . ASP A-3 1 106 . -6.156 -32.443 -6.437 1 22.1 ? OD2 ASP A-3 86 1 
ATOM 3316 N N . LYS A-3 1 107 . -3.343 -28.273 -4.509 1 16.78 ? N LYS A-3 87 1 
ATOM 3317 C CA . LYS A-3 1 107 . -1.927 -28.072 -4.214 1 16.54 ? CA LYS A-3 87 1 
ATOM 3318 C C . LYS A-3 1 107 . -1.197 -29.349 -3.793 1 16.69 ? C LYS A-3 87 1 
ATOM 3319 O O . LYS A-3 1 107 . -0.103 -29.607 -4.274 1 16.07 ? O LYS A-3 87 1 
ATOM 3320 C CB . LYS A-3 1 107 . -1.733 -26.968 -3.149 1 16.58 ? CB LYS A-3 87 1 
ATOM 3321 C CG . LYS A-3 1 107 . -2.41 -25.617 -3.442 1 15.91 ? CG LYS A-3 87 1 
ATOM 3322 C CD . LYS A-3 1 107 . -1.869 -24.933 -4.688 1 15.22 ? CD LYS A-3 87 1 
ATOM 3323 C CE . LYS A-3 1 107 . -2.448 -23.534 -4.879 1 14.69 ? CE LYS A-3 87 1 
ATOM 3324 N NZ . LYS A-3 1 107 . -1.741 -22.499 -4.086 1 13.84 ? NZ LYS A-3 87 1 
ATOM 3325 N N . LEU A-3 1 108 . -1.793 -30.139 -2.893 1 16.92 ? N LEU A-3 88 1 
ATOM 3326 C CA . LEU A-3 1 108 . -1.172 -31.4 -2.447 1 16.45 ? CA LEU A-3 88 1 
ATOM 3327 C C . LEU A-3 1 108 . -0.947 -32.357 -3.622 1 16.66 ? C LEU A-3 88 1 
ATOM 3328 O O . LEU A-3 1 108 . 0.133 -32.931 -3.773 1 16.6 ? O LEU A-3 88 1 
ATOM 3329 C CB . LEU A-3 1 108 . -2.025 -32.081 -1.379 1 16.74 ? CB LEU A-3 88 1 
ATOM 3330 C CG . LEU A-3 1 108 . -1.358 -32.752 -0.161 1 17.27 ? CG LEU A-3 88 1 
ATOM 3331 C CD1 . LEU A-3 1 108 . -2.257 -33.85 0.405 1 16.93 ? CD1 LEU A-3 88 1 
ATOM 3332 C CD2 . LEU A-3 1 108 . 0.024 -33.289 -0.462 1 17.03 ? CD2 LEU A-3 88 1 
ATOM 3333 N N . THR A-3 1 109 . -1.965 -32.518 -4.462 1 16.29 ? N THR A-3 89 1 
ATOM 3334 C CA . THR A-3 1 109 . -1.836 -33.372 -5.635 1 16.15 ? CA THR A-3 89 1 
ATOM 3335 C C . THR A-3 1 109 . -0.667 -32.889 -6.467 1 15.69 ? C THR A-3 89 1 
ATOM 3336 O O . THR A-3 1 109 . 0.187 -33.684 -6.84 1 14.92 ? O THR A-3 89 1 
ATOM 3337 C CB . THR A-3 1 109 . -3.114 -33.378 -6.486 1 16.43 ? CB THR A-3 89 1 
ATOM 3338 O OG1 . THR A-3 1 109 . -4.186 -33.931 -5.716 1 16.78 ? OG1 THR A-3 89 1 
ATOM 3339 C CG2 . THR A-3 1 109 . -2.924 -34.202 -7.778 1 16.59 ? CG2 THR A-3 89 1 
ATOM 3340 N N . ALA A-3 1 110 . -0.62 -31.583 -6.73 1 15.88 ? N ALA A-3 90 1 
ATOM 3341 C CA . ALA A-3 1 110 . 0.467 -31.006 -7.522 1 16.26 ? CA ALA A-3 90 1 
ATOM 3342 C C . ALA A-3 1 110 . 1.845 -31.244 -6.866 1 16.62 ? C ALA A-3 90 1 
ATOM 3343 O O . ALA A-3 1 110 . 2.809 -31.618 -7.542 1 16.81 ? O ALA A-3 90 1 
ATOM 3344 C CB . ALA A-3 1 110 . 0.218 -29.528 -7.763 1 16.71 ? CB ALA A-3 90 1 
ATOM 3345 N N . LEU A-3 1 111 . 1.912 -31.07 -5.547 1 16.29 ? N LEU A-3 91 1 
ATOM 3346 C CA . LEU A-3 1 111 . 3.138 -31.301 -4.798 1 16.4 ? CA LEU A-3 91 1 
ATOM 3347 C C . LEU A-3 1 111 . 3.592 -32.763 -4.913 1 17.38 ? C LEU A-3 91 1 
ATOM 3348 O O . LEU A-3 1 111 . 4.731 -33.046 -5.318 1 17.67 ? O LEU A-3 91 1 
ATOM 3349 C CB . LEU A-3 1 111 . 2.951 -30.869 -3.345 1 15.98 ? CB LEU A-3 91 1 
ATOM 3350 C CG . LEU A-3 1 111 . 4.13 -30.938 -2.368 1 15.93 ? CG LEU A-3 91 1 
ATOM 3351 C CD1 . LEU A-3 1 111 . 5.357 -30.199 -2.887 1 15.96 ? CD1 LEU A-3 91 1 
ATOM 3352 C CD2 . LEU A-3 1 111 . 3.715 -30.395 -1.015 1 15.67 ? CD2 LEU A-3 91 1 
ATOM 3353 N N . VAL A-3 1 112 . 2.683 -33.681 -4.588 1 17.31 ? N VAL A-3 92 1 
ATOM 3354 C CA . VAL A-3 1 112 . 2.909 -35.115 -4.753 1 17.06 ? CA VAL A-3 92 1 
ATOM 3355 C C . VAL A-3 1 112 . 3.406 -35.471 -6.173 1 17.59 ? C VAL A-3 92 1 
ATOM 3356 O O . VAL A-3 1 112 . 4.33 -36.262 -6.324 1 18.66 ? O VAL A-3 92 1 
ATOM 3357 C CB . VAL A-3 1 112 . 1.639 -35.912 -4.353 1 16.66 ? CB VAL A-3 92 1 
ATOM 3358 C CG1 . VAL A-3 1 112 . 1.689 -37.349 -4.853 1 16.45 ? CG1 VAL A-3 92 1 
ATOM 3359 C CG2 . VAL A-3 1 112 . 1.456 -35.884 -2.839 1 16.28 ? CG2 VAL A-3 92 1 
ATOM 3360 N N . GLY A-3 1 113 . 2.797 -34.887 -7.203 1 17.61 ? N GLY A-3 93 1 
ATOM 3361 C CA . GLY A-3 1 113 . 3.247 -35.058 -8.586 1 17.97 ? CA GLY A-3 93 1 
ATOM 3362 C C . GLY A-3 1 113 . 4.695 -34.645 -8.793 1 18.52 ? C GLY A-3 93 1 
ATOM 3363 O O . GLY A-3 1 113 . 5.449 -35.346 -9.458 1 18.59 ? O GLY A-3 93 1 
ATOM 3364 N N . LEU A-3 1 114 . 5.086 -33.507 -8.219 1 19.3 ? N LEU A-3 94 1 
ATOM 3365 C CA . LEU A-3 1 114 . 6.477 -33.053 -8.254 1 20.52 ? CA LEU A-3 94 1 
ATOM 3366 C C . LEU A-3 1 114 . 7.423 -34.012 -7.531 1 20.68 ? C LEU A-3 94 1 
ATOM 3367 O O . LEU A-3 1 114 . 8.535 -34.277 -7.987 1 20.38 ? O LEU A-3 94 1 
ATOM 3368 C CB . LEU A-3 1 114 . 6.605 -31.656 -7.631 1 21.02 ? CB LEU A-3 94 1 
ATOM 3369 C CG . LEU A-3 1 114 . 6.44 -30.444 -8.545 1 21.73 ? CG LEU A-3 94 1 
ATOM 3370 C CD1 . LEU A-3 1 114 . 6.717 -29.188 -7.743 1 21.48 ? CD1 LEU A-3 94 1 
ATOM 3371 C CD2 . LEU A-3 1 114 . 7.336 -30.515 -9.78 1 21.35 ? CD2 LEU A-3 94 1 
ATOM 3372 N N . THR A-3 1 115 . 6.952 -34.517 -6.399 1 22.1 ? N THR A-3 95 1 
ATOM 3373 C CA . THR A-3 1 115 . 7.69 -35.433 -5.554 1 23.61 ? CA THR A-3 95 1 
ATOM 3374 C C . THR A-3 1 115 . 8.055 -36.682 -6.36 1 24.5 ? C THR A-3 95 1 
ATOM 3375 O O . THR A-3 1 115 . 9.157 -37.218 -6.243 1 25.41 ? O THR A-3 95 1 
ATOM 3376 C CB . THR A-3 1 115 . 6.843 -35.744 -4.3 1 24.5 ? CB THR A-3 95 1 
ATOM 3377 O OG1 . THR A-3 1 115 . 7.616 -35.521 -3.117 1 27.66 ? OG1 THR A-3 95 1 
ATOM 3378 C CG2 . THR A-3 1 115 . 6.277 -37.144 -4.308 1 23.73 ? CG2 THR A-3 95 1 
ATOM 3379 N N . LYS A-3 1 116 . 7.133 -37.098 -7.22 1 25.75 ? N LYS A-3 96 1 
ATOM 3380 C CA . LYS A-3 1 116 . 7.31 -38.261 -8.07 1 26.71 ? CA LYS A-3 96 1 
ATOM 3381 C C . LYS A-3 1 116 . 8.268 -38.021 -9.236 1 26.25 ? C LYS A-3 96 1 
ATOM 3382 O O . LYS A-3 1 116 . 9.047 -38.904 -9.574 1 26.25 ? O LYS A-3 96 1 
ATOM 3383 C CB . LYS A-3 1 116 . 5.953 -38.753 -8.59 1 27.77 ? CB LYS A-3 96 1 
ATOM 3384 C CG . LYS A-3 1 116 . 5.052 -39.338 -7.513 1 29.03 ? CG LYS A-3 96 1 
ATOM 3385 C CD . LYS A-3 1 116 . 3.766 -39.857 -8.13 1 31.43 ? CD LYS A-3 96 1 
ATOM 3386 C CE . LYS A-3 1 116 . 2.78 -40.32 -7.069 1 34.11 ? CE LYS A-3 96 1 
ATOM 3387 N NZ . LYS A-3 1 116 . 1.505 -40.782 -7.693 1 35.29 ? NZ LYS A-3 96 1 
ATOM 3388 N N . LYS A-3 1 117 . 8.225 -36.844 -9.855 1 26.62 ? N LYS A-3 97 1 
ATOM 3389 C CA . LYS A-3 1 117 . 9.096 -36.612 -11.013 1 27.8 ? CA LYS A-3 97 1 
ATOM 3390 C C . LYS A-3 1 117 . 10.538 -36.227 -10.641 1 27.53 ? C LYS A-3 97 1 
ATOM 3391 O O . LYS A-3 1 117 . 11.435 -36.21 -11.497 1 26.52 ? O LYS A-3 97 1 
ATOM 3392 C CB . LYS A-3 1 117 . 8.451 -35.653 -12.031 1 29.12 ? CB LYS A-3 97 1 
ATOM 3393 C CG . LYS A-3 1 117 . 8.757 -34.179 -11.871 1 30.7 ? CG LYS A-3 97 1 
ATOM 3394 C CD . LYS A-3 1 117 . 8.14 -33.402 -13.027 1 32.61 ? CD LYS A-3 97 1 
ATOM 3395 C CE . LYS A-3 1 117 . 8.928 -32.133 -13.319 1 33.52 ? CE LYS A-3 97 1 
ATOM 3396 N NZ . LYS A-3 1 117 . 8.484 -31.434 -14.558 1 34.78 ? NZ LYS A-3 97 1 
ATOM 3397 N N . LEU A-3 1 118 . 10.751 -35.929 -9.359 1 27.51 ? N LEU A-3 98 1 
ATOM 3398 C CA . LEU A-3 1 118 . 12.076 -35.598 -8.863 1 27.89 ? CA LEU A-3 98 1 
ATOM 3399 C C . LEU A-3 1 118 . 12.659 -36.71 -8.009 1 28.46 ? C LEU A-3 98 1 
ATOM 3400 O O . LEU A-3 1 118 . 13.843 -36.679 -7.688 1 28.14 ? O LEU A-3 98 1 
ATOM 3401 C CB . LEU A-3 1 118 . 12.064 -34.29 -8.063 1 27.73 ? CB LEU A-3 98 1 
ATOM 3402 C CG . LEU A-3 1 118 . 11.491 -33.026 -8.705 1 28.2 ? CG LEU A-3 98 1 
ATOM 3403 C CD1 . LEU A-3 1 118 . 11.663 -31.842 -7.771 1 28.06 ? CD1 LEU A-3 98 1 
ATOM 3404 C CD2 . LEU A-3 1 118 . 12.122 -32.731 -10.054 1 28.69 ? CD2 LEU A-3 98 1 
ATOM 3405 N N . GLY A-3 1 119 . 11.827 -37.681 -7.637 1 29.03 ? N GLY A-3 99 1 
ATOM 3406 C CA . GLY A-3 1 119 . 12.264 -38.778 -6.778 1 30.77 ? CA GLY A-3 99 1 
ATOM 3407 C C . GLY A-3 1 119 . 12.543 -38.276 -5.373 1 32.8 ? C GLY A-3 99 1 
ATOM 3408 O O . GLY A-3 1 119 . 13.648 -38.424 -4.853 1 34.03 ? O GLY A-3 99 1 
ATOM 3409 N N . ILE A-3 1 120 . 11.518 -37.693 -4.761 1 32.92 ? N ILE A-3 100 1 
ATOM 3410 C CA . ILE A-3 1 120 . 11.644 -36.98 -3.5 1 31.96 ? CA ILE A-3 100 1 
ATOM 3411 C C . ILE A-3 1 120 . 10.425 -37.312 -2.642 1 31.43 ? C ILE A-3 100 1 
ATOM 3412 O O . ILE A-3 1 120 . 9.34 -37.532 -3.165 1 31.3 ? O ILE A-3 100 1 
ATOM 3413 C CB . ILE A-3 1 120 . 11.806 -35.461 -3.784 1 32.3 ? CB ILE A-3 100 1 
ATOM 3414 C CG1 . ILE A-3 1 120 . 13.29 -35.101 -3.8 1 32.81 ? CG1 ILE A-3 100 1 
ATOM 3415 C CG2 . ILE A-3 1 120 . 11.071 -34.582 -2.786 1 33.71 ? CG2 ILE A-3 100 1 
ATOM 3416 C CD1 . ILE A-3 1 120 . 13.625 -33.907 -4.665 1 34 ? CD1 ILE A-3 100 1 
ATOM 3417 N N . GLU A-3 1 121 . 10.61 -37.379 -1.331 1 30.37 ? N GLU A-3 101 1 
ATOM 3418 C CA . GLU A-3 1 121 . 9.492 -37.623 -0.44 1 30.68 ? CA GLU A-3 101 1 
ATOM 3419 C C . GLU A-3 1 121 . 8.87 -36.306 -0.008 1 28.71 ? C GLU A-3 101 1 
ATOM 3420 O O . GLU A-3 1 121 . 9.545 -35.28 0.02 1 27.7 ? O GLU A-3 101 1 
ATOM 3421 C CB . GLU A-3 1 121 . 9.944 -38.405 0.793 1 33.65 ? CB GLU A-3 101 1 
ATOM 3422 C CG . GLU A-3 1 121 . 10.599 -39.748 0.513 1 36.59 ? CG GLU A-3 101 1 
ATOM 3423 C CD . GLU A-3 1 121 . 11.378 -40.252 1.712 1 40.07 ? CD GLU A-3 101 1 
ATOM 3424 O OE1 . GLU A-3 1 121 . 10.791 -40.321 2.822 1 41.68 ? OE1 GLU A-3 101 1 
ATOM 3425 O OE2 . GLU A-3 1 121 . 12.579 -40.57 1.553 1 41.16 ? OE2 GLU A-3 101 1 
ATOM 3426 N N . LEU A-3 1 122 . 7.58 -36.357 0.33 1 28.09 ? N LEU A-3 102 1 
ATOM 3427 C CA . LEU A-3 1 122 . 6.859 -35.233 0.945 1 26.46 ? CA LEU A-3 102 1 
ATOM 3428 C C . LEU A-3 1 122 . 7.529 -34.66 2.19 1 25.23 ? C LEU A-3 102 1 
ATOM 3429 O O . LEU A-3 1 122 . 7.521 -33.442 2.404 1 24.02 ? O LEU A-3 102 1 
ATOM 3430 C CB . LEU A-3 1 122 . 5.43 -35.643 1.313 1 25.91 ? CB LEU A-3 102 1 
ATOM 3431 C CG . LEU A-3 1 122 . 4.292 -35.182 0.41 1 26.5 ? CG LEU A-3 102 1 
ATOM 3432 C CD1 . LEU A-3 1 122 . 2.957 -35.472 1.087 1 26.35 ? CD1 LEU A-3 102 1 
ATOM 3433 C CD2 . LEU A-3 1 122 . 4.405 -33.701 0.069 1 25.16 ? CD2 LEU A-3 102 1 
ATOM 3434 N N . SER A-3 1 123 . 8.077 -35.546 3.022 1 24.71 ? N SER A-3 103 1 
ATOM 3435 C CA . SER A-3 1 123 . 8.813 -35.136 4.212 1 24.28 ? CA SER A-3 103 1 
ATOM 3436 C C . SER A-3 1 123 . 9.991 -34.23 3.846 1 23.75 ? C SER A-3 103 1 
ATOM 3437 O O . SER A-3 1 123 . 10.453 -33.441 4.67 1 23.83 ? O SER A-3 103 1 
ATOM 3438 C CB . SER A-3 1 123 . 9.283 -36.358 5.005 1 25.39 ? CB SER A-3 103 1 
ATOM 3439 O OG . SER A-3 1 123 . 9.949 -37.298 4.171 1 25.63 ? OG SER A-3 103 1 
ATOM 3440 N N . HIS A-3 1 124 . 10.448 -34.329 2.599 1 23.78 ? N HIS A-3 104 1 
ATOM 3441 C CA . HIS A-3 1 124 . 11.518 -33.468 2.091 1 23.95 ? CA HIS A-3 104 1 
ATOM 3442 C C . HIS A-3 1 124 . 11.011 -32.225 1.346 1 22.23 ? C HIS A-3 104 1 
ATOM 3443 O O . HIS A-3 1 124 . 11.799 -31.482 0.754 1 20.57 ? O HIS A-3 104 1 
ATOM 3444 C CB . HIS A-3 1 124 . 12.493 -34.274 1.219 1 26.83 ? CB HIS A-3 104 1 
ATOM 3445 C CG . HIS A-3 1 124 . 13.17 -35.392 1.957 1 30.15 ? CG HIS A-3 104 1 
ATOM 3446 N ND1 . HIS A-3 1 124 . 13.488 -36.595 1.361 1 31.63 ? ND1 HIS A-3 104 1 
ATOM 3447 C CD2 . HIS A-3 1 124 . 13.555 -35.499 3.253 1 30.02 ? CD2 HIS A-3 104 1 
ATOM 3448 C CE1 . HIS A-3 1 124 . 14.06 -37.383 2.255 1 33.55 ? CE1 HIS A-3 104 1 
ATOM 3449 N NE2 . HIS A-3 1 124 . 14.112 -36.742 3.41 1 32.09 ? NE2 HIS A-3 104 1 
ATOM 3450 N N . CYS A-3 1 125 . 9.696 -32.015 1.377 1 20.24 ? N CYS A-3 105 1 
ATOM 3451 C CA . CYS A-3 1 125 . 9.095 -30.827 0.789 1 19.06 ? CA CYS A-3 105 1 
ATOM 3452 C C . CYS A-3 1 125 . 8.681 -29.829 1.859 1 17.46 ? C CYS A-3 105 1 
ATOM 3453 O O . CYS A-3 1 125 . 8.116 -30.201 2.888 1 17.08 ? O CYS A-3 105 1 
ATOM 3454 C CB . CYS A-3 1 125 . 7.895 -31.198 -0.071 1 19.1 ? CB CYS A-3 105 1 
ATOM 3455 S SG . CYS A-3 1 125 . 8.356 -32.2 -1.494 1 21.6 ? SG CYS A-3 105 1 
ATOM 3456 N N . ALA A-3 1 126 . 8.993 -28.563 1.613 1 16.01 ? N ALA A-3 106 1 
ATOM 3457 C CA . ALA A-3 1 126 . 8.46 -27.48 2.414 1 15.1 ? CA ALA A-3 106 1 
ATOM 3458 C C . ALA A-3 1 126 . 7.417 -26.792 1.55 1 14.64 ? C ALA A-3 106 1 
ATOM 3459 O O . ALA A-3 1 126 . 7.591 -26.674 0.328 1 13.74 ? O ALA A-3 106 1 
ATOM 3460 C CB . ALA A-3 1 126 . 9.56 -26.516 2.83 1 14.83 ? CB ALA A-3 106 1 
ATOM 3461 N N . TYR A-3 1 127 . 6.323 -26.363 2.175 1 14.19 ? N TYR A-3 107 1 
ATOM 3462 C CA . TYR A-3 1 127 . 5.258 -25.669 1.448 1 14.08 ? CA TYR A-3 107 1 
ATOM 3463 C C . TYR A-3 1 127 . 4.696 -24.518 2.271 1 14.03 ? C TYR A-3 107 1 
ATOM 3464 O O . TYR A-3 1 127 . 4.467 -24.654 3.482 1 13.38 ? O TYR A-3 107 1 
ATOM 3465 C CB . TYR A-3 1 127 . 4.12 -26.631 1.017 1 13.7 ? CB TYR A-3 107 1 
ATOM 3466 C CG . TYR A-3 1 127 . 3.076 -25.966 0.118 1 13.33 ? CG TYR A-3 107 1 
ATOM 3467 C CD1 . TYR A-3 1 127 . 3.263 -25.895 -1.258 1 13.24 ? CD1 TYR A-3 107 1 
ATOM 3468 C CD2 . TYR A-3 1 127 . 1.925 -25.383 0.657 1 13.15 ? CD2 TYR A-3 107 1 
ATOM 3469 C CE1 . TYR A-3 1 127 . 2.338 -25.266 -2.079 1 13.28 ? CE1 TYR A-3 107 1 
ATOM 3470 C CE2 . TYR A-3 1 127 . 0.996 -24.752 -0.153 1 12.98 ? CE2 TYR A-3 107 1 
ATOM 3471 C CZ . TYR A-3 1 127 . 1.203 -24.703 -1.518 1 12.96 ? CZ TYR A-3 107 1 
ATOM 3472 O OH . TYR A-3 1 127 . 0.291 -24.069 -2.338 1 12.95 ? OH TYR A-3 107 1 
ATOM 3473 N N . ILE A-3 1 128 . 4.459 -23.405 1.578 1 13.62 ? N ILE A-3 108 1 
ATOM 3474 C CA . ILE A-3 1 128 . 3.874 -22.213 2.168 1 13.4 ? CA ILE A-3 108 1 
ATOM 3475 C C . ILE A-3 1 128 . 2.646 -21.719 1.386 1 13.46 ? C ILE A-3 108 1 
ATOM 3476 O O . ILE A-3 1 128 . 2.682 -21.561 0.148 1 12.85 ? O ILE A-3 108 1 
ATOM 3477 C CB . ILE A-3 1 128 . 4.924 -21.088 2.318 1 13.2 ? CB ILE A-3 108 1 
ATOM 3478 C CG1 . ILE A-3 1 128 . 4.302 -19.855 2.988 1 13.18 ? CG1 ILE A-3 108 1 
ATOM 3479 C CG2 . ILE A-3 1 128 . 5.552 -20.753 0.963 1 12.96 ? CG2 ILE A-3 108 1 
ATOM 3480 C CD1 . ILE A-3 1 128 . 5.315 -18.843 3.499 1 13.27 ? CD1 ILE A-3 108 1 
ATOM 3481 N N . GLY A-3 1 129 . 1.566 -21.475 2.131 1 13.43 ? N GLY A-3 109 1 
ATOM 3482 C CA . GLY A-3 1 129 . 0.307 -20.99 1.555 1 13.68 ? CA GLY A-3 109 1 
ATOM 3483 C C . GLY A-3 1 129 . -0.517 -20.199 2.551 1 13.92 ? C GLY A-3 109 1 
ATOM 3484 O O . GLY A-3 1 129 . -0.34 -20.332 3.776 1 13.7 ? O GLY A-3 109 1 
ATOM 3485 N N . ASP A-3 1 130 . -1.432 -19.389 2.028 1 14.3 ? N ASP A-3 110 1 
ATOM 3486 C CA . ASP A-3 1 130 . -2.229 -18.475 2.854 1 15.09 ? CA ASP A-3 110 1 
ATOM 3487 C C . ASP A-3 1 130 . -3.706 -18.862 3.028 1 15.55 ? C ASP A-3 110 1 
ATOM 3488 O O . ASP A-3 1 130 . -4.365 -18.336 3.923 1 16.37 ? O ASP A-3 110 1 
ATOM 3489 C CB . ASP A-3 1 130 . -2.152 -17.042 2.304 1 14.94 ? CB ASP A-3 110 1 
ATOM 3490 C CG . ASP A-3 1 130 . -2.908 -16.884 0.979 1 15.16 ? CG ASP A-3 110 1 
ATOM 3491 O OD1 . ASP A-3 1 130 . -2.648 -17.685 0.05 1 14.79 ? OD1 ASP A-3 110 1 
ATOM 3492 O OD2 . ASP A-3 1 130 . -3.768 -15.978 0.876 1 14.6 ? OD2 ASP A-3 110 1 
ATOM 3493 N N . ASP A-3 1 131 . -4.239 -19.748 2.186 1 15.6 ? N ASP A-3 111 1 
ATOM 3494 C CA . ASP A-3 1 131 . -5.693 -19.958 2.154 1 15.57 ? CA ASP A-3 111 1 
ATOM 3495 C C . ASP A-3 1 131 . -6.107 -21.437 2.088 1 15.87 ? C ASP A-3 111 1 
ATOM 3496 O O . ASP A-3 1 131 . -5.282 -22.341 2.231 1 16.4 ? O ASP A-3 111 1 
ATOM 3497 C CB . ASP A-3 1 131 . -6.335 -19.148 1.001 1 15.26 ? CB ASP A-3 111 1 
ATOM 3498 C CG . ASP A-3 1 131 . -7.712 -18.572 1.37 1 15.54 ? CG ASP A-3 111 1 
ATOM 3499 O OD1 . ASP A-3 1 131 . -8.352 -19.11 2.298 1 16.1 ? OD1 ASP A-3 111 1 
ATOM 3500 O OD2 . ASP A-3 1 131 . -8.167 -17.589 0.736 1 14.83 ? OD2 ASP A-3 111 1 
ATOM 3501 N N . LEU A-3 1 132 . -7.395 -21.671 1.871 1 15.47 ? N LEU A-3 112 1 
ATOM 3502 C CA . LEU A-3 1 132 . -7.956 -23.021 1.922 1 15.2 ? CA LEU A-3 112 1 
ATOM 3503 C C . LEU A-3 1 132 . -7.4 -24.058 0.935 1 14.69 ? C LEU A-3 112 1 
ATOM 3504 O O . LEU A-3 1 132 . -7.191 -25.196 1.344 1 15.12 ? O LEU A-3 112 1 
ATOM 3505 C CB . LEU A-3 1 132 . -9.492 -22.988 1.909 1 14.69 ? CB LEU A-3 112 1 
ATOM 3506 C CG . LEU A-3 1 132 . -10.083 -22.326 3.162 1 14.8 ? CG LEU A-3 112 1 
ATOM 3507 C CD1 . LEU A-3 1 132 . -11.562 -22.02 2.968 1 14.33 ? CD1 LEU A-3 112 1 
ATOM 3508 C CD2 . LEU A-3 1 132 . -9.828 -23.119 4.447 1 14.51 ? CD2 LEU A-3 112 1 
ATOM 3509 N N . PRO A-3 1 133 . -7.159 -23.691 -0.349 1 14.46 ? N PRO A-3 113 1 
ATOM 3510 C CA . PRO A-3 1 133 . -6.559 -24.716 -1.233 1 14.26 ? CA PRO A-3 113 1 
ATOM 3511 C C . PRO A-3 1 133 . -5.158 -25.231 -0.805 1 13.89 ? C PRO A-3 113 1 
ATOM 3512 O O . PRO A-3 1 133 . -4.724 -26.297 -1.263 1 13.33 ? O PRO A-3 113 1 
ATOM 3513 C CB . PRO A-3 1 133 . -6.498 -24.025 -2.6 1 14.35 ? CB PRO A-3 113 1 
ATOM 3514 C CG . PRO A-3 1 133 . -7.55 -22.975 -2.54 1 14.6 ? CG PRO A-3 113 1 
ATOM 3515 C CD . PRO A-3 1 133 . -7.602 -22.508 -1.113 1 14.47 ? CD PRO A-3 113 1 
ATOM 3516 N N . ASP A-3 1 134 . -4.491 -24.497 0.079 1 13.25 ? N ASP A-3 114 1 
ATOM 3517 C CA . ASP A-3 1 134 . -3.131 -24.821 0.497 1 13.78 ? CA ASP A-3 114 1 
ATOM 3518 C C . ASP A-3 1 134 . -3.087 -25.649 1.79 1 14.4 ? C ASP A-3 114 1 
ATOM 3519 O O . ASP A-3 1 134 . -2.035 -26.172 2.154 1 14.78 ? O ASP A-3 114 1 
ATOM 3520 C CB . ASP A-3 1 134 . -2.337 -23.526 0.748 1 12.95 ? CB ASP A-3 114 1 
ATOM 3521 C CG . ASP A-3 1 134 . -2.333 -22.586 -0.433 1 12.65 ? CG ASP A-3 114 1 
ATOM 3522 O OD1 . ASP A-3 1 134 . -1.761 -22.949 -1.486 1 12.08 ? OD1 ASP A-3 114 1 
ATOM 3523 O OD2 . ASP A-3 1 134 . -2.869 -21.461 -0.283 1 12.39 ? OD2 ASP A-3 114 1 
ATOM 3524 N N . LEU A-3 1 135 . -4.208 -25.72 2.508 1 14.61 ? N LEU A-3 115 1 
ATOM 3525 C CA . LEU A-3 1 135 . -4.239 -26.329 3.848 1 14.96 ? CA LEU A-3 115 1 
ATOM 3526 C C . LEU A-3 1 135 . -3.694 -27.763 3.897 1 15.17 ? C LEU A-3 115 1 
ATOM 3527 O O . LEU A-3 1 135 . -2.834 -28.073 4.729 1 15.45 ? O LEU A-3 115 1 
ATOM 3528 C CB . LEU A-3 1 135 . -5.637 -26.156 4.489 1 14.67 ? CB LEU A-3 115 1 
ATOM 3529 C CG . LEU A-3 1 135 . -6.57 -27.127 5.236 1 15.18 ? CG LEU A-3 115 1 
ATOM 3530 C CD1 . LEU A-3 1 135 . -5.937 -28.263 6.049 1 14.6 ? CD1 LEU A-3 115 1 
ATOM 3531 C CD2 . LEU A-3 1 135 . -7.517 -26.312 6.109 1 14.31 ? CD2 LEU A-3 115 1 
ATOM 3532 N N . LYS A-3 1 136 . -4.139 -28.613 2.982 1 15.3 ? N LYS A-3 116 1 
ATOM 3533 C CA . LYS A-3 1 136 . -3.643 -29.99 2.935 1 15.66 ? CA LYS A-3 116 1 
ATOM 3534 C C . LYS A-3 1 136 . -2.164 -30.113 2.557 1 15.36 ? C LYS A-3 116 1 
ATOM 3535 O O . LYS A-3 1 136 . -1.459 -30.963 3.105 1 15.32 ? O LYS A-3 116 1 
ATOM 3536 C CB . LYS A-3 1 136 . -4.519 -30.864 2.033 1 16.52 ? CB LYS A-3 116 1 
ATOM 3537 C CG . LYS A-3 1 136 . -5.85 -31.212 2.68 1 17.36 ? CG LYS A-3 116 1 
ATOM 3538 C CD . LYS A-3 1 136 . -6.39 -32.551 2.209 1 18.69 ? CD LYS A-3 116 1 
ATOM 3539 C CE . LYS A-3 1 136 . -7.002 -32.448 0.826 1 19.05 ? CE LYS A-3 116 1 
ATOM 3540 N NZ . LYS A-3 1 136 . -8.099 -33.441 0.687 1 19.87 ? NZ LYS A-3 116 1 
ATOM 3541 N N . ALA A-3 1 137 . -1.693 -29.278 1.627 1 14.85 ? N ALA A-3 117 1 
ATOM 3542 C CA . ALA A-3 1 137 . -0.272 -29.271 1.279 1 14.38 ? CA ALA A-3 117 1 
ATOM 3543 C C . ALA A-3 1 137 . 0.541 -28.779 2.47 1 14.32 ? C ALA A-3 117 1 
ATOM 3544 O O . ALA A-3 1 137 . 1.608 -29.319 2.774 1 14.47 ? O ALA A-3 117 1 
ATOM 3545 C CB . ALA A-3 1 137 . -0.002 -28.419 0.041 1 13.78 ? CB ALA A-3 117 1 
ATOM 3546 N N . VAL A-3 1 138 . 0.025 -27.759 3.146 1 14.39 ? N VAL A-3 118 1 
ATOM 3547 C CA . VAL A-3 1 138 . 0.656 -27.23 4.36 1 14.69 ? CA VAL A-3 118 1 
ATOM 3548 C C . VAL A-3 1 138 . 0.696 -28.288 5.466 1 15.44 ? C VAL A-3 118 1 
ATOM 3549 O O . VAL A-3 1 138 . 1.706 -28.443 6.162 1 15.19 ? O VAL A-3 118 1 
ATOM 3550 C CB . VAL A-3 1 138 . -0.054 -25.949 4.861 1 14.37 ? CB VAL A-3 118 1 
ATOM 3551 C CG1 . VAL A-3 1 138 . 0.328 -25.632 6.312 1 13.98 ? CG1 VAL A-3 118 1 
ATOM 3552 C CG2 . VAL A-3 1 138 . 0.268 -24.779 3.948 1 13.61 ? CG2 VAL A-3 118 1 
ATOM 3553 N N . ARG A-3 1 139 . -0.408 -29.012 5.618 1 16.5 ? N ARG A-3 119 1 
ATOM 3554 C CA . ARG A-3 1 139 . -0.51 -30.038 6.646 1 17.7 ? CA ARG A-3 119 1 
ATOM 3555 C C . ARG A-3 1 139 . 0.403 -31.212 6.325 1 17.95 ? C ARG A-3 119 1 
ATOM 3556 O O . ARG A-3 1 139 . 1.105 -31.704 7.198 1 17.1 ? O ARG A-3 119 1 
ATOM 3557 C CB . ARG A-3 1 139 . -1.947 -30.538 6.769 1 17.89 ? CB ARG A-3 119 1 
ATOM 3558 C CG . ARG A-3 1 139 . -2.147 -31.607 7.837 1 18.68 ? CG ARG A-3 119 1 
ATOM 3559 C CD . ARG A-3 1 139 . -3.059 -32.709 7.305 1 18.6 ? CD ARG A-3 119 1 
ATOM 3560 N NE . ARG A-3 1 139 . -4.452 -32.312 7.305 1 18.82 ? NE ARG A-3 119 1 
ATOM 3561 C CZ . ARG A-3 1 139 . -5.368 -32.693 6.414 1 18.93 ? CZ ARG A-3 119 1 
ATOM 3562 N NH1 . ARG A-3 1 139 . -5.051 -33.49 5.395 1 18.17 ? NH1 ARG A-3 119 1 
ATOM 3563 N NH2 . ARG A-3 1 139 . -6.615 -32.25 6.546 1 18.61 ? NH2 ARG A-3 119 1 
ATOM 3564 N N . GLU A-3 1 140 . 0.392 -31.651 5.068 1 18.47 ? N GLU A-3 120 1 
ATOM 3565 C CA . GLU A-3 1 140 . 1.008 -32.925 4.74 1 19.56 ? CA GLU A-3 120 1 
ATOM 3566 C C . GLU A-3 1 140 . 2.504 -32.86 4.425 1 19.69 ? C GLU A-3 120 1 
ATOM 3567 O O . GLU A-3 1 140 . 3.192 -33.878 4.533 1 19.68 ? O GLU A-3 120 1 
ATOM 3568 C CB . GLU A-3 1 140 . 0.237 -33.661 3.636 1 19.98 ? CB GLU A-3 120 1 
ATOM 3569 C CG . GLU A-3 1 140 . -1.156 -34.149 4.033 1 21.37 ? CG GLU A-3 120 1 
ATOM 3570 C CD . GLU A-3 1 140 . -1.175 -35.066 5.255 1 21.63 ? CD GLU A-3 120 1 
ATOM 3571 O OE1 . GLU A-3 1 140 . -0.266 -35.905 5.433 1 21.14 ? OE1 GLU A-3 120 1 
ATOM 3572 O OE2 . GLU A-3 1 140 . -2.121 -34.947 6.054 1 22.98 ? OE2 GLU A-3 120 1 
ATOM 3573 N N . ALA A-3 1 141 . 3.002 -31.68 4.053 1 19.33 ? N ALA A-3 121 1 
ATOM 3574 C CA . ALA A-3 1 141 . 4.439 -31.515 3.753 1 19.43 ? CA ALA A-3 121 1 
ATOM 3575 C C . ALA A-3 1 141 . 5.301 -31.67 5.001 1 19.01 ? C ALA A-3 121 1 
ATOM 3576 O O . ALA A-3 1 141 . 4.84 -31.436 6.125 1 19.32 ? O ALA A-3 121 1 
ATOM 3577 C CB . ALA A-3 1 141 . 4.71 -30.166 3.092 1 19.22 ? CB ALA A-3 121 1 
ATOM 3578 N N . GLY A-3 1 142 . 6.557 -32.053 4.806 1 18.69 ? N GLY A-3 122 1 
ATOM 3579 C CA . GLY A-3 1 142 . 7.495 -32.144 5.922 1 18.09 ? CA GLY A-3 122 1 
ATOM 3580 C C . GLY A-3 1 142 . 7.57 -30.859 6.73 1 17.68 ? C GLY A-3 122 1 
ATOM 3581 O O . GLY A-3 1 142 . 7.61 -30.886 7.961 1 17.79 ? O GLY A-3 122 1 
ATOM 3582 N N . PHE A-3 1 143 . 7.605 -29.731 6.031 1 16.62 ? N PHE A-3 123 1 
ATOM 3583 C CA . PHE A-3 1 143 . 7.611 -28.431 6.683 1 16 ? CA PHE A-3 123 1 
ATOM 3584 C C . PHE A-3 1 143 . 6.511 -27.55 6.081 1 15.84 ? C PHE A-3 123 1 
ATOM 3585 O O . PHE A-3 1 143 . 6.59 -27.143 4.918 1 15.69 ? O PHE A-3 123 1 
ATOM 3586 C CB . PHE A-3 1 143 . 8.993 -27.784 6.568 1 15.52 ? CB PHE A-3 123 1 
ATOM 3587 C CG . PHE A-3 1 143 . 9.132 -26.48 7.315 1 15.59 ? CG PHE A-3 123 1 
ATOM 3588 C CD1 . PHE A-3 1 143 . 8.49 -26.273 8.535 1 15.92 ? CD1 PHE A-3 123 1 
ATOM 3589 C CD2 . PHE A-3 1 143 . 9.959 -25.472 6.819 1 15.28 ? CD2 PHE A-3 123 1 
ATOM 3590 C CE1 . PHE A-3 1 143 . 8.65 -25.077 9.226 1 15.54 ? CE1 PHE A-3 123 1 
ATOM 3591 C CE2 . PHE A-3 1 143 . 10.119 -24.279 7.507 1 15.31 ? CE2 PHE A-3 123 1 
ATOM 3592 C CZ . PHE A-3 1 143 . 9.456 -24.077 8.704 1 15.09 ? CZ PHE A-3 123 1 
ATOM 3593 N N . GLY A-3 1 144 . 5.469 -27.298 6.871 1 15.28 ? N GLY A-3 124 1 
ATOM 3594 C CA . GLY A-3 1 144 . 4.341 -26.513 6.404 1 14.72 ? CA GLY A-3 124 1 
ATOM 3595 C C . GLY A-3 1 144 . 4.324 -25.137 7.025 1 14.31 ? C GLY A-3 124 1 
ATOM 3596 O O . GLY A-3 1 144 . 4.42 -25.001 8.257 1 14.49 ? O GLY A-3 124 1 
ATOM 3597 N N . ILE A-3 1 145 . 4.175 -24.122 6.174 1 13.68 ? N ILE A-3 125 1 
ATOM 3598 C CA . ILE A-3 1 145 . 4.2 -22.731 6.612 1 13.74 ? CA ILE A-3 125 1 
ATOM 3599 C C . ILE A-3 1 145 . 2.959 -21.95 6.16 1 13.99 ? C ILE A-3 125 1 
ATOM 3600 O O . ILE A-3 1 145 . 2.477 -22.124 5.031 1 12.96 ? O ILE A-3 125 1 
ATOM 3601 C CB . ILE A-3 1 145 . 5.46 -21.974 6.104 1 13.67 ? CB ILE A-3 125 1 
ATOM 3602 C CG1 . ILE A-3 1 145 . 6.752 -22.781 6.305 1 13.88 ? CG1 ILE A-3 125 1 
ATOM 3603 C CG2 . ILE A-3 1 145 . 5.605 -20.638 6.805 1 13.68 ? CG2 ILE A-3 125 1 
ATOM 3604 C CD1 . ILE A-3 1 145 . 7.247 -23.506 5.068 1 13.51 ? CD1 ILE A-3 125 1 
ATOM 3605 N N . SER A-3 1 146 . 2.454 -21.089 7.047 1 13.95 ? N SER A-3 126 1 
ATOM 3606 C CA . SER A-3 1 146 . 1.491 -20.075 6.637 1 15.07 ? CA SER A-3 126 1 
ATOM 3607 C C . SER A-3 1 146 . 1.91 -18.682 7.122 1 16.25 ? C SER A-3 126 1 
ATOM 3608 O O . SER A-3 1 146 . 3.025 -18.49 7.608 1 16.99 ? O SER A-3 126 1 
ATOM 3609 C CB . SER A-3 1 146 . 0.065 -20.427 7.077 1 14.58 ? CB SER A-3 126 1 
ATOM 3610 O OG . SER A-3 1 146 . -0.863 -19.587 6.431 1 14.11 ? OG SER A-3 126 1 
ATOM 3611 N N . VAL A-3 1 147 . 1.018 -17.711 6.969 1 17.53 ? N VAL A-3 127 1 
ATOM 3612 C CA . VAL A-3 1 147 . 1.356 -16.304 7.193 1 17.63 ? CA VAL A-3 127 1 
ATOM 3613 C C . VAL A-3 1 147 . 0.324 -15.655 8.118 1 18.45 ? C VAL A-3 127 1 
ATOM 3614 O O . VAL A-3 1 147 . -0.759 -16.219 8.315 1 18.27 ? O VAL A-3 127 1 
ATOM 3615 C CB . VAL A-3 1 147 . 1.472 -15.539 5.855 1 17.54 ? CB VAL A-3 127 1 
ATOM 3616 C CG1 . VAL A-3 1 147 . 2.707 -16.005 5.09 1 17.49 ? CG1 VAL A-3 127 1 
ATOM 3617 C CG2 . VAL A-3 1 147 . 0.21 -15.692 5.002 1 17.29 ? CG2 VAL A-3 127 1 
ATOM 3618 N N . PRO A-3 1 148 . 0.643 -14.471 8.693 1 19.28 ? N PRO A-3 128 1 
ATOM 3619 C CA . PRO A-3 1 148 . -0.279 -13.898 9.683 1 19.62 ? CA PRO A-3 128 1 
ATOM 3620 C C . PRO A-3 1 148 . -1.672 -13.607 9.109 1 20.72 ? C PRO A-3 128 1 
ATOM 3621 O O . PRO A-3 1 148 . -2.674 -13.744 9.815 1 21.54 ? O PRO A-3 128 1 
ATOM 3622 C CB . PRO A-3 1 148 . 0.43 -12.607 10.119 1 19.59 ? CB PRO A-3 128 1 
ATOM 3623 C CG . PRO A-3 1 148 . 1.869 -12.818 9.757 1 19.39 ? CG PRO A-3 128 1 
ATOM 3624 C CD . PRO A-3 1 148 . 1.821 -13.605 8.488 1 18.9 ? CD PRO A-3 128 1 
ATOM 3625 N N . ASN A-3 1 149 . -1.744 -13.241 7.835 1 21.28 ? N ASN A-3 129 1 
ATOM 3626 C CA . ASN A-3 1 149 . -3.036 -13.031 7.213 1 21.65 ? CA ASN A-3 129 1 
ATOM 3627 C C . ASN A-3 1 149 . -3.572 -14.266 6.484 1 20.9 ? C ASN A-3 129 1 
ATOM 3628 O O . ASN A-3 1 149 . -4.483 -14.178 5.661 1 21.13 ? O ASN A-3 129 1 
ATOM 3629 C CB . ASN A-3 1 149 . -3.012 -11.781 6.333 1 23.02 ? CB ASN A-3 129 1 
ATOM 3630 C CG . ASN A-3 1 149 . -2.971 -10.503 7.157 1 24.49 ? CG ASN A-3 129 1 
ATOM 3631 O OD1 . ASN A-3 1 149 . -4.01 -9.998 7.59 1 25.85 ? OD1 ASN A-3 129 1 
ATOM 3632 N ND2 . ASN A-3 1 149 . -1.768 -9.98 7.391 1 24.95 ? ND2 ASN A-3 129 1 
ATOM 3633 N N . GLY A-3 1 150 . -3.008 -15.419 6.813 1 20.04 ? N GLY A-3 130 1 
ATOM 3634 C CA . GLY A-3 1 150 . -3.526 -16.688 6.321 1 18.92 ? CA GLY A-3 130 1 
ATOM 3635 C C . GLY A-3 1 150 . -4.853 -16.988 6.999 1 18.3 ? C GLY A-3 130 1 
ATOM 3636 O O . GLY A-3 1 150 . -5.095 -16.523 8.119 1 17.27 ? O GLY A-3 130 1 
ATOM 3637 N N . CYS A-3 1 151 . -5.719 -17.749 6.321 1 17.58 ? N CYS A-3 131 1 
ATOM 3638 C CA . CYS A-3 1 151 . -6.987 -18.153 6.911 1 17.7 ? CA CYS A-3 131 1 
ATOM 3639 C C . CYS A-3 1 151 . -6.674 -19.051 8.097 1 18.02 ? C CYS A-3 131 1 
ATOM 3640 O O . CYS A-3 1 151 . -5.661 -19.748 8.099 1 17.48 ? O CYS A-3 131 1 
ATOM 3641 C CB . CYS A-3 1 151 . -7.878 -18.863 5.894 1 17.55 ? CB CYS A-3 131 1 
ATOM 3642 S SG . CYS A-3 1 151 . -7.269 -20.48 5.384 1 17.89 ? SG CYS A-3 131 1 
ATOM 3643 N N . GLU A-3 1 152 . -7.53 -19.007 9.108 1 18.51 ? N GLU A-3 132 1 
ATOM 3644 C CA . GLU A-3 1 152 . -7.28 -19.675 10.38 1 19.81 ? CA GLU A-3 132 1 
ATOM 3645 C C . GLU A-3 1 152 . -7.02 -21.165 10.222 1 19.14 ? C GLU A-3 132 1 
ATOM 3646 O O . GLU A-3 1 152 . -6.147 -21.729 10.89 1 18.8 ? O GLU A-3 132 1 
ATOM 3647 C CB . GLU A-3 1 152 . -8.477 -19.455 11.31 1 22.35 ? CB GLU A-3 132 1 
ATOM 3648 C CG . GLU A-3 1 152 . -8.287 -19.916 12.741 1 25.22 ? CG GLU A-3 132 1 
ATOM 3649 C CD . GLU A-3 1 152 . -9.438 -19.486 13.64 1 28.66 ? CD GLU A-3 132 1 
ATOM 3650 O OE1 . GLU A-3 1 152 . -10.369 -18.824 13.119 1 29.4 ? OE1 GLU A-3 132 1 
ATOM 3651 O OE2 . GLU A-3 1 152 . -9.408 -19.796 14.864 1 27.9 ? OE2 GLU A-3 132 1 
ATOM 3652 N N . GLN A-3 1 153 . -7.784 -21.787 9.327 1 18.59 ? N GLN A-3 133 1 
ATOM 3653 C CA . GLN A-3 1 153 . -7.759 -23.238 9.11 1 17.9 ? CA GLN A-3 133 1 
ATOM 3654 C C . GLN A-3 1 153 . -6.401 -23.726 8.607 1 17.61 ? C GLN A-3 133 1 
ATOM 3655 O O . GLN A-3 1 153 . -5.913 -24.77 9.054 1 17.1 ? O GLN A-3 133 1 
ATOM 3656 C CB . GLN A-3 1 153 . -8.864 -23.655 8.132 1 17.94 ? CB GLN A-3 133 1 
ATOM 3657 C CG . GLN A-3 1 153 . -10.283 -23.397 8.614 1 17.73 ? CG GLN A-3 133 1 
ATOM 3658 C CD . GLN A-3 1 153 . -10.702 -21.942 8.523 1 17.56 ? CD GLN A-3 133 1 
ATOM 3659 O OE1 . GLN A-3 1 153 . -11.656 -21.53 9.181 1 18.59 ? OE1 GLN A-3 133 1 
ATOM 3660 N NE2 . GLN A-3 1 153 . -9.99 -21.153 7.728 1 17.33 ? NE2 GLN A-3 133 1 
ATOM 3661 N N . THR A-3 1 154 . -5.799 -22.967 7.688 1 16.84 ? N THR A-3 134 1 
ATOM 3662 C CA . THR A-3 1 154 . -4.46 -23.269 7.205 1 16.75 ? CA THR A-3 134 1 
ATOM 3663 C C . THR A-3 1 154 . -3.381 -22.984 8.267 1 17.29 ? C THR A-3 134 1 
ATOM 3664 O O . THR A-3 1 154 . -2.404 -23.73 8.387 1 16.7 ? O THR A-3 134 1 
ATOM 3665 C CB . THR A-3 1 154 . -4.142 -22.502 5.918 1 16.56 ? CB THR A-3 134 1 
ATOM 3666 O OG1 . THR A-3 1 154 . -5.082 -22.866 4.896 1 16.04 ? OG1 THR A-3 134 1 
ATOM 3667 C CG2 . THR A-3 1 154 . -2.735 -22.838 5.441 1 16.22 ? CG2 THR A-3 134 1 
ATOM 3668 N N . ARG A-3 1 155 . -3.561 -21.906 9.026 1 17.69 ? N ARG A-3 135 1 
ATOM 3669 C CA . ARG A-3 1 155 . -2.631 -21.564 10.107 1 18.7 ? CA ARG A-3 135 1 
ATOM 3670 C C . ARG A-3 1 155 . -2.656 -22.621 11.2 1 19.2 ? C ARG A-3 135 1 
ATOM 3671 O O . ARG A-3 1 155 . -1.611 -22.955 11.768 1 19.98 ? O ARG A-3 135 1 
ATOM 3672 C CB . ARG A-3 1 155 . -2.95 -20.187 10.708 1 18.16 ? CB ARG A-3 135 1 
ATOM 3673 C CG . ARG A-3 1 155 . -2.462 -19.009 9.885 1 17.69 ? CG ARG A-3 135 1 
ATOM 3674 C CD . ARG A-3 1 155 . -2.669 -17.694 10.622 1 18.28 ? CD ARG A-3 135 1 
ATOM 3675 N NE . ARG A-3 1 155 . -4.047 -17.192 10.521 1 19.03 ? NE ARG A-3 135 1 
ATOM 3676 C CZ . ARG A-3 1 155 . -4.858 -16.994 11.56 1 19.04 ? CZ ARG A-3 135 1 
ATOM 3677 N NH1 . ARG A-3 1 155 . -4.448 -17.239 12.794 1 19.95 ? NH1 ARG A-3 135 1 
ATOM 3678 N NH2 . ARG A-3 1 155 . -6.081 -16.537 11.373 1 19.38 ? NH2 ARG A-3 135 1 
ATOM 3679 N N . ALA A-3 1 156 . -3.851 -23.151 11.47 1 19.27 ? N ALA A-3 136 1 
ATOM 3680 C CA . ALA A-3 1 156 . -4.065 -24.174 12.494 1 19.11 ? CA ALA A-3 136 1 
ATOM 3681 C C . ALA A-3 1 156 . -3.235 -25.428 12.242 1 19.33 ? C ALA A-3 136 1 
ATOM 3682 O O . ALA A-3 1 156 . -2.846 -26.139 13.183 1 18.93 ? O ALA A-3 136 1 
ATOM 3683 C CB . ALA A-3 1 156 . -5.539 -24.54 12.563 1 18.82 ? CB ALA A-3 136 1 
ATOM 3684 N N . VAL A-3 1 157 . -2.955 -25.664 10.963 1 18.78 ? N VAL A-3 137 1 
ATOM 3685 C CA . VAL A-3 1 157 . -2.397 -26.915 10.479 1 18.77 ? CA VAL A-3 137 1 
ATOM 3686 C C . VAL A-3 1 157 . -0.906 -26.77 10.071 1 19.06 ? C VAL A-3 137 1 
ATOM 3687 O O . VAL A-3 1 157 . -0.274 -27.705 9.566 1 18.69 ? O VAL A-3 137 1 
ATOM 3688 C CB . VAL A-3 1 157 . -3.334 -27.442 9.353 1 18.86 ? CB VAL A-3 137 1 
ATOM 3689 C CG1 . VAL A-3 1 157 . -2.846 -27.128 7.941 1 17.9 ? CG1 VAL A-3 137 1 
ATOM 3690 C CG2 . VAL A-3 1 157 . -3.713 -28.895 9.575 1 18.89 ? CG2 VAL A-3 137 1 
ATOM 3691 N N . SER A-3 1 158 . -0.333 -25.598 10.325 1 19.15 ? N SER A-3 138 1 
ATOM 3692 C CA . SER A-3 1 158 . 1.018 -25.327 9.869 1 19.13 ? CA SER A-3 138 1 
ATOM 3693 C C . SER A-3 1 158 . 2.03 -25.6 10.979 1 19.24 ? C SER A-3 138 1 
ATOM 3694 O O . SER A-3 1 158 . 1.669 -25.64 12.159 1 20.2 ? O SER A-3 138 1 
ATOM 3695 C CB . SER A-3 1 158 . 1.12 -23.897 9.377 1 19.43 ? CB SER A-3 138 1 
ATOM 3696 O OG . SER A-3 1 158 . 1.081 -23.007 10.468 1 20.38 ? OG SER A-3 138 1 
ATOM 3697 N N . ASP A-3 1 159 . 3.29 -25.804 10.597 1 18.68 ? N ASP A-3 139 1 
ATOM 3698 C CA . ASP A-3 1 159 . 4.378 -25.994 11.564 1 18.23 ? CA ASP A-3 139 1 
ATOM 3699 C C . ASP A-3 1 159 . 4.927 -24.654 11.996 1 18.55 ? C ASP A-3 139 1 
ATOM 3700 O O . ASP A-3 1 159 . 5.533 -24.528 13.065 1 19.79 ? O ASP A-3 139 1 
ATOM 3701 C CB . ASP A-3 1 159 . 5.508 -26.802 10.939 1 17.52 ? CB ASP A-3 139 1 
ATOM 3702 C CG . ASP A-3 1 159 . 5.066 -28.174 10.531 1 17.32 ? CG ASP A-3 139 1 
ATOM 3703 O OD1 . ASP A-3 1 159 . 4.589 -28.922 11.414 1 17.21 ? OD1 ASP A-3 139 1 
ATOM 3704 O OD2 . ASP A-3 1 159 . 5.178 -28.497 9.33 1 17.28 ? OD2 ASP A-3 139 1 
ATOM 3705 N N . TYR A-3 1 160 . 4.738 -23.657 11.147 1 17.88 ? N TYR A-3 140 1 
ATOM 3706 C CA . TYR A-3 1 160 . 5.29 -22.346 11.391 1 17.61 ? CA TYR A-3 140 1 
ATOM 3707 C C . TYR A-3 1 160 . 4.428 -21.294 10.714 1 17.45 ? C TYR A-3 140 1 
ATOM 3708 O O . TYR A-3 1 160 . 3.895 -21.514 9.621 1 17.17 ? O TYR A-3 140 1 
ATOM 3709 C CB . TYR A-3 1 160 . 6.732 -22.292 10.875 1 18.2 ? CB TYR A-3 140 1 
ATOM 3710 C CG . TYR A-3 1 160 . 7.42 -20.969 11.098 1 18.6 ? CG TYR A-3 140 1 
ATOM 3711 C CD1 . TYR A-3 1 160 . 7.753 -20.541 12.386 1 18.62 ? CD1 TYR A-3 140 1 
ATOM 3712 C CD2 . TYR A-3 1 160 . 7.742 -20.143 10.018 1 18.49 ? CD2 TYR A-3 140 1 
ATOM 3713 C CE1 . TYR A-3 1 160 . 8.38 -19.319 12.594 1 19.03 ? CE1 TYR A-3 140 1 
ATOM 3714 C CE2 . TYR A-3 1 160 . 8.369 -18.922 10.216 1 18.49 ? CE2 TYR A-3 140 1 
ATOM 3715 C CZ . TYR A-3 1 160 . 8.686 -18.512 11.501 1 18.94 ? CZ TYR A-3 140 1 
ATOM 3716 O OH . TYR A-3 1 160 . 9.315 -17.298 11.701 1 18.32 ? OH TYR A-3 140 1 
ATOM 3717 N N . ILE A-3 1 161 . 4.268 -20.172 11.404 1 17.7 ? N ILE A-3 141 1 
ATOM 3718 C CA . ILE A-3 1 161 . 3.621 -18.981 10.878 1 17.79 ? CA ILE A-3 141 1 
ATOM 3719 C C . ILE A-3 1 161 . 4.669 -17.885 10.862 1 17.15 ? C ILE A-3 141 1 
ATOM 3720 O O . ILE A-3 1 161 . 5.252 -17.558 11.901 1 16.48 ? O ILE A-3 141 1 
ATOM 3721 C CB . ILE A-3 1 161 . 2.467 -18.494 11.78 1 18.08 ? CB ILE A-3 141 1 
ATOM 3722 C CG1 . ILE A-3 1 161 . 1.43 -19.595 11.987 1 18.54 ? CG1 ILE A-3 141 1 
ATOM 3723 C CG2 . ILE A-3 1 161 . 1.812 -17.253 11.176 1 18.54 ? CG2 ILE A-3 141 1 
ATOM 3724 C CD1 . ILE A-3 1 161 . 0.925 -20.191 10.693 1 19.29 ? CD1 ILE A-3 141 1 
ATOM 3725 N N . THR A-3 1 162 . 4.903 -17.305 9.693 1 16.75 ? N THR A-3 142 1 
ATOM 3726 C CA . THR A-3 1 162 . 5.921 -16.269 9.583 1 16.91 ? CA THR A-3 142 1 
ATOM 3727 C C . THR A-3 1 162 . 5.534 -15.071 10.438 1 17.29 ? C THR A-3 142 1 
ATOM 3728 O O . THR A-3 1 162 . 4.357 -14.91 10.794 1 16.57 ? O THR A-3 142 1 
ATOM 3729 C CB . THR A-3 1 162 . 6.119 -15.839 8.123 1 16.94 ? CB THR A-3 142 1 
ATOM 3730 O OG1 . THR A-3 1 162 . 4.905 -15.27 7.625 1 16.47 ? OG1 THR A-3 142 1 
ATOM 3731 C CG2 . THR A-3 1 162 . 6.492 -17.044 7.285 1 16.74 ? CG2 THR A-3 142 1 
ATOM 3732 N N . THR A-3 1 163 . 6.529 -14.263 10.798 1 18.12 ? N THR A-3 143 1 
ATOM 3733 C CA . THR A-3 1 163 . 6.291 -12.961 11.43 1 19.09 ? CA THR A-3 143 1 
ATOM 3734 C C . THR A-3 1 163 . 5.929 -11.916 10.366 1 19.4 ? C THR A-3 143 1 
ATOM 3735 O O . THR A-3 1 163 . 4.939 -11.201 10.513 1 19.66 ? O THR A-3 143 1 
ATOM 3736 C CB . THR A-3 1 163 . 7.518 -12.489 12.234 1 19.69 ? CB THR A-3 143 1 
ATOM 3737 O OG1 . THR A-3 1 163 . 7.811 -13.452 13.257 1 21.18 ? OG1 THR A-3 143 1 
ATOM 3738 C CG2 . THR A-3 1 163 . 7.271 -11.123 12.885 1 19.48 ? CG2 THR A-3 143 1 
ATOM 3739 N N . LYS A-3 1 164 . 6.73 -11.83 9.307 1 19.26 ? N LYS A-3 144 1 
ATOM 3740 C CA . LYS A-3 1 164 . 6.443 -10.915 8.203 1 19.44 ? CA LYS A-3 144 1 
ATOM 3741 C C . LYS A-3 1 164 . 5.297 -11.459 7.368 1 18.38 ? C LYS A-3 144 1 
ATOM 3742 O O . LYS A-3 1 164 . 5.089 -12.663 7.304 1 18.28 ? O LYS A-3 144 1 
ATOM 3743 C CB . LYS A-3 1 164 . 7.686 -10.685 7.339 1 20.89 ? CB LYS A-3 144 1 
ATOM 3744 C CG . LYS A-3 1 164 . 8.77 -9.859 8.022 1 22.85 ? CG LYS A-3 144 1 
ATOM 3745 C CD . LYS A-3 1 164 . 10.147 -10.263 7.517 1 24.29 ? CD LYS A-3 144 1 
ATOM 3746 C CE . LYS A-3 1 164 . 11.267 -9.651 8.347 1 24.89 ? CE LYS A-3 144 1 
ATOM 3747 N NZ . LYS A-3 1 164 . 12.146 -8.75 7.542 1 25.78 ? NZ LYS A-3 144 1 
ATOM 3748 N N . THR A-3 1 165 . 4.552 -10.561 6.744 1 17.34 ? N THR A-3 145 1 
ATOM 3749 C CA . THR A-3 1 165 . 3.368 -10.92 5.993 1 17.01 ? CA THR A-3 145 1 
ATOM 3750 C C . THR A-3 1 165 . 3.712 -11.168 4.521 1 16.55 ? C THR A-3 145 1 
ATOM 3751 O O . THR A-3 1 165 . 4.818 -10.859 4.083 1 15.78 ? O THR A-3 145 1 
ATOM 3752 C CB . THR A-3 1 165 . 2.336 -9.793 6.07 1 17.5 ? CB THR A-3 145 1 
ATOM 3753 O OG1 . THR A-3 1 165 . 2.91 -8.6 5.523 1 18.86 ? OG1 THR A-3 145 1 
ATOM 3754 C CG2 . THR A-3 1 165 . 1.935 -9.527 7.508 1 18.1 ? CG2 THR A-3 145 1 
ATOM 3755 N N . GLY A-3 1 166 . 2.74 -11.693 3.765 1 16.04 ? N GLY A-3 146 1 
ATOM 3756 C CA . GLY A-3 1 166 . 2.92 -12.052 2.351 1 15.23 ? CA GLY A-3 146 1 
ATOM 3757 C C . GLY A-3 1 166 . 3.223 -10.857 1.478 1 14.95 ? C GLY A-3 146 1 
ATOM 3758 O O . GLY A-3 1 166 . 2.605 -9.807 1.621 1 14.38 ? O GLY A-3 146 1 
ATOM 3759 N N . GLY A-3 1 167 . 4.194 -11.008 0.587 1 14.78 ? N GLY A-3 147 1 
ATOM 3760 C CA . GLY A-3 1 167 . 4.655 -9.886 -0.237 1 16.36 ? CA GLY A-3 147 1 
ATOM 3761 C C . GLY A-3 1 167 . 5.367 -8.827 0.59 1 16.82 ? C GLY A-3 147 1 
ATOM 3762 O O . GLY A-3 1 167 . 5.537 -7.701 0.155 1 17.3 ? O GLY A-3 147 1 
ATOM 3763 N N . ASN A-3 1 168 . 5.786 -9.198 1.791 1 17.27 ? N ASN A-3 148 1 
ATOM 3764 C CA . ASN A-3 1 168 . 6.492 -8.283 2.67 1 18.24 ? CA ASN A-3 148 1 
ATOM 3765 C C . ASN A-3 1 168 . 7.625 -8.976 3.415 1 17.4 ? C ASN A-3 148 1 
ATOM 3766 O O . ASN A-3 1 168 . 8.112 -8.482 4.428 1 17.12 ? O ASN A-3 148 1 
ATOM 3767 C CB . ASN A-3 1 168 . 5.513 -7.632 3.652 1 19.85 ? CB ASN A-3 148 1 
ATOM 3768 C CG . ASN A-3 1 168 . 4.816 -6.431 3.055 1 21.28 ? CG ASN A-3 148 1 
ATOM 3769 O OD1 . ASN A-3 1 168 . 3.607 -6.456 2.802 1 22.45 ? OD1 ASN A-3 148 1 
ATOM 3770 N ND2 . ASN A-3 1 168 . 5.585 -5.374 2.796 1 22.05 ? ND2 ASN A-3 148 1 
ATOM 3771 N N . GLY A-3 1 169 . 8.036 -10.131 2.905 1 17.22 ? N GLY A-3 149 1 
ATOM 3772 C CA . GLY A-3 1 169 . 9.204 -10.819 3.448 1 16.81 ? CA GLY A-3 149 1 
ATOM 3773 C C . GLY A-3 1 169 . 8.89 -12.065 4.244 1 16.21 ? C GLY A-3 149 1 
ATOM 3774 O O . GLY A-3 1 169 . 9.758 -12.573 4.964 1 16.33 ? O GLY A-3 149 1 
ATOM 3775 N N . ALA A-3 1 170 . 7.657 -12.561 4.125 1 15.22 ? N ALA A-3 150 1 
ATOM 3776 C CA . ALA A-3 1 170 . 7.325 -13.883 4.653 1 14.62 ? CA ALA A-3 150 1 
ATOM 3777 C C . ALA A-3 1 170 . 8.235 -14.947 4.032 1 14.36 ? C ALA A-3 150 1 
ATOM 3778 O O . ALA A-3 1 170 . 8.765 -15.81 4.737 1 14.23 ? O ALA A-3 150 1 
ATOM 3779 C CB . ALA A-3 1 170 . 5.864 -14.213 4.394 1 14.39 ? CB ALA A-3 150 1 
ATOM 3780 N N . VAL A-3 1 171 . 8.415 -14.871 2.714 1 13.91 ? N VAL A-3 151 1 
ATOM 3781 C CA . VAL A-3 1 171 . 9.264 -15.814 1.978 1 13.98 ? CA VAL A-3 151 1 
ATOM 3782 C C . VAL A-3 1 171 . 10.739 -15.669 2.366 1 13.92 ? C VAL A-3 151 1 
ATOM 3783 O O . VAL A-3 1 171 . 11.41 -16.651 2.708 1 14.03 ? O VAL A-3 151 1 
ATOM 3784 C CB . VAL A-3 1 171 . 9.068 -15.683 0.45 1 13.88 ? CB VAL A-3 151 1 
ATOM 3785 C CG1 . VAL A-3 1 171 . 10.095 -16.508 -0.302 1 13.69 ? CG1 VAL A-3 151 1 
ATOM 3786 C CG2 . VAL A-3 1 171 . 7.66 -16.109 0.069 1 13.97 ? CG2 VAL A-3 151 1 
ATOM 3787 N N . ARG A-3 1 172 . 11.242 -14.442 2.324 1 14.07 ? N ARG A-3 152 1 
ATOM 3788 C CA . ARG A-3 1 172 . 12.595 -14.172 2.788 1 13.88 ? CA ARG A-3 152 1 
ATOM 3789 C C . ARG A-3 1 172 . 12.808 -14.845 4.136 1 13.89 ? C ARG A-3 152 1 
ATOM 3790 O O . ARG A-3 1 172 . 13.787 -15.554 4.325 1 13.82 ? O ARG A-3 152 1 
ATOM 3791 C CB . ARG A-3 1 172 . 12.855 -12.661 2.867 1 13.6 ? CB ARG A-3 152 1 
ATOM 3792 C CG . ARG A-3 1 172 . 14.204 -12.265 3.463 1 13.54 ? CG ARG A-3 152 1 
ATOM 3793 C CD . ARG A-3 1 172 . 15.394 -12.993 2.835 1 13.41 ? CD ARG A-3 152 1 
ATOM 3794 N NE . ARG A-3 1 172 . 16.642 -12.333 3.224 1 13.48 ? NE ARG A-3 152 1 
ATOM 3795 C CZ . ARG A-3 1 172 . 17.168 -11.293 2.571 1 13.33 ? CZ ARG A-3 152 1 
ATOM 3796 N NH1 . ARG A-3 1 172 . 16.569 -10.822 1.485 1 12.91 ? NH1 ARG A-3 152 1 
ATOM 3797 N NH2 . ARG A-3 1 172 . 18.288 -10.726 3.003 1 13.23 ? NH2 ARG A-3 152 1 
ATOM 3798 N N . GLU A-3 1 173 . 11.864 -14.641 5.052 1 14.35 ? N GLU A-3 153 1 
ATOM 3799 C CA . GLU A-3 1 173 . 11.957 -15.158 6.408 1 15 ? CA GLU A-3 153 1 
ATOM 3800 C C . GLU A-3 1 173 . 12.076 -16.687 6.454 1 15.04 ? C GLU A-3 153 1 
ATOM 3801 O O . GLU A-3 1 173 . 12.904 -17.232 7.194 1 15.05 ? O GLU A-3 153 1 
ATOM 3802 C CB . GLU A-3 1 173 . 10.745 -14.685 7.211 1 15.62 ? CB GLU A-3 153 1 
ATOM 3803 C CG . GLU A-3 1 173 . 10.743 -15.11 8.661 1 16.6 ? CG GLU A-3 153 1 
ATOM 3804 C CD . GLU A-3 1 173 . 9.538 -14.571 9.405 1 17.36 ? CD GLU A-3 153 1 
ATOM 3805 O OE1 . GLU A-3 1 173 . 9.043 -13.484 9.046 1 18.11 ? OE1 GLU A-3 153 1 
ATOM 3806 O OE2 . GLU A-3 1 173 . 9.073 -15.24 10.344 1 18 ? OE2 GLU A-3 153 1 
ATOM 3807 N N . VAL A-3 1 174 . 11.255 -17.375 5.661 1 14.75 ? N VAL A-3 154 1 
ATOM 3808 C CA . VAL A-3 1 174 . 11.288 -18.835 5.622 1 14.57 ? CA VAL A-3 154 1 
ATOM 3809 C C . VAL A-3 1 174 . 12.56 -19.351 4.932 1 14.4 ? C VAL A-3 154 1 
ATOM 3810 O O . VAL A-3 1 174 . 13.095 -20.411 5.295 1 14.56 ? O VAL A-3 154 1 
ATOM 3811 C CB . VAL A-3 1 174 . 9.973 -19.447 5.055 1 14.48 ? CB VAL A-3 154 1 
ATOM 3812 C CG1 . VAL A-3 1 174 . 9.635 -18.887 3.689 1 15.07 ? CG1 VAL A-3 154 1 
ATOM 3813 C CG2 . VAL A-3 1 174 . 10.052 -20.958 4.989 1 14.45 ? CG2 VAL A-3 154 1 
ATOM 3814 N N . CYS A-3 1 175 . 13.073 -18.583 3.975 1 14.19 ? N CYS A-3 155 1 
ATOM 3815 C CA . CYS A-3 1 175 . 14.31 -18.95 3.314 1 14.16 ? CA CYS A-3 155 1 
ATOM 3816 C C . CYS A-3 1 175 . 15.453 -18.954 4.305 1 14.11 ? C CYS A-3 155 1 
ATOM 3817 O O . CYS A-3 1 175 . 16.272 -19.877 4.348 1 13.74 ? O CYS A-3 155 1 
ATOM 3818 C CB . CYS A-3 1 175 . 14.606 -17.973 2.196 1 14.48 ? CB CYS A-3 155 1 
ATOM 3819 S SG . CYS A-3 1 175 . 13.51 -18.212 0.801 1 14.49 ? SG CYS A-3 155 1 
ATOM 3820 N N . GLU A-3 1 176 . 15.487 -17.909 5.112 1 14.1 ? N GLU A-3 156 1 
ATOM 3821 C CA . GLU A-3 1 176 . 16.496 -17.771 6.138 1 14.71 ? CA GLU A-3 156 1 
ATOM 3822 C C . GLU A-3 1 176 . 16.396 -18.878 7.166 1 14.72 ? C GLU A-3 156 1 
ATOM 3823 O O . GLU A-3 1 176 . 17.407 -19.4 7.6 1 14.97 ? O GLU A-3 156 1 
ATOM 3824 C CB . GLU A-3 1 176 . 16.393 -16.402 6.781 1 14.89 ? CB GLU A-3 156 1 
ATOM 3825 C CG . GLU A-3 1 176 . 16.762 -15.311 5.795 1 15.33 ? CG GLU A-3 156 1 
ATOM 3826 C CD . GLU A-3 1 176 . 16.975 -13.971 6.455 1 16.36 ? CD GLU A-3 156 1 
ATOM 3827 O OE1 . GLU A-3 1 176 . 16.82 -13.878 7.699 1 15.29 ? OE1 GLU A-3 156 1 
ATOM 3828 O OE2 . GLU A-3 1 176 . 17.298 -13.015 5.707 1 16.6 ? OE2 GLU A-3 156 1 
ATOM 3829 N N . LEU A-3 1 177 . 15.169 -19.258 7.499 1 14.73 ? N LEU A-3 157 1 
ATOM 3830 C CA . LEU A-3 1 177 . 14.907 -20.327 8.446 1 15.05 ? CA LEU A-3 157 1 
ATOM 3831 C C . LEU A-3 1 177 . 15.409 -21.698 7.967 1 14.6 ? C LEU A-3 157 1 
ATOM 3832 O O . LEU A-3 1 177 . 16.058 -22.432 8.716 1 13.99 ? O LEU A-3 157 1 
ATOM 3833 C CB . LEU A-3 1 177 . 13.409 -20.391 8.717 1 15.82 ? CB LEU A-3 157 1 
ATOM 3834 C CG . LEU A-3 1 177 . 12.981 -20.503 10.177 1 16.57 ? CG LEU A-3 157 1 
ATOM 3835 C CD1 . LEU A-3 1 177 . 11.491 -20.231 10.304 1 16.82 ? CD1 LEU A-3 157 1 
ATOM 3836 C CD2 . LEU A-3 1 177 . 13.312 -21.872 10.746 1 17.01 ? CD2 LEU A-3 157 1 
ATOM 3837 N N . ILE A-3 1 178 . 15.099 -22.044 6.717 1 14.9 ? N ILE A-3 158 1 
ATOM 3838 C CA . ILE A-3 1 178 . 15.569 -23.299 6.144 1 14.88 ? CA ILE A-3 158 1 
ATOM 3839 C C . ILE A-3 1 178 . 17.1 -23.297 6.055 1 14.75 ? C ILE A-3 158 1 
ATOM 3840 O O . ILE A-3 1 178 . 17.758 -24.279 6.426 1 14.37 ? O ILE A-3 158 1 
ATOM 3841 C CB . ILE A-3 1 178 . 14.915 -23.595 4.78 1 14.84 ? CB ILE A-3 158 1 
ATOM 3842 C CG1 . ILE A-3 1 178 . 13.398 -23.775 4.951 1 15.13 ? CG1 ILE A-3 158 1 
ATOM 3843 C CG2 . ILE A-3 1 178 . 15.515 -24.853 4.193 1 15.13 ? CG2 ILE A-3 158 1 
ATOM 3844 C CD1 . ILE A-3 1 178 . 12.586 -23.626 3.683 1 14.73 ? CD1 ILE A-3 158 1 
ATOM 3845 N N . LEU A-3 1 179 . 17.663 -22.184 5.596 1 14.65 ? N LEU A-3 159 1 
ATOM 3846 C CA . LEU A-3 1 179 . 19.117 -22.048 5.536 1 14.98 ? CA LEU A-3 159 1 
ATOM 3847 C C . LEU A-3 1 179 . 19.779 -22.32 6.895 1 15.03 ? C LEU A-3 159 1 
ATOM 3848 O O . LEU A-3 1 179 . 20.746 -23.081 6.955 1 14.71 ? O LEU A-3 159 1 
ATOM 3849 C CB . LEU A-3 1 179 . 19.521 -20.68 4.983 1 14.97 ? CB LEU A-3 159 1 
ATOM 3850 C CG . LEU A-3 1 179 . 19.308 -20.446 3.477 1 15.14 ? CG LEU A-3 159 1 
ATOM 3851 C CD1 . LEU A-3 1 179 . 19.539 -18.979 3.129 1 14.66 ? CD1 LEU A-3 159 1 
ATOM 3852 C CD2 . LEU A-3 1 179 . 20.223 -21.337 2.64 1 15.17 ? CD2 LEU A-3 159 1 
ATOM 3853 N N . LYS A-3 1 180 . 19.238 -21.729 7.968 1 15.33 ? N LYS A-3 160 1 
ATOM 3854 C CA . LYS A-3 1 180 . 19.777 -21.885 9.34 1 16.14 ? CA LYS A-3 160 1 
ATOM 3855 C C . LYS A-3 1 180 . 19.664 -23.326 9.848 1 16.41 ? C LYS A-3 160 1 
ATOM 3856 O O . LYS A-3 1 180 . 20.57 -23.843 10.519 1 16.11 ? O LYS A-3 160 1 
ATOM 3857 C CB . LYS A-3 1 180 . 19.056 -20.957 10.315 1 16.9 ? CB LYS A-3 160 1 
ATOM 3858 C CG . LYS A-3 1 180 . 19.429 -19.491 10.172 1 18.32 ? CG LYS A-3 160 1 
ATOM 3859 C CD . LYS A-3 1 180 . 18.367 -18.591 10.78 1 19.7 ? CD LYS A-3 160 1 
ATOM 3860 C CE . LYS A-3 1 180 . 18.877 -17.174 11 1 20.33 ? CE LYS A-3 160 1 
ATOM 3861 N NZ . LYS A-3 1 180 . 17.828 -16.332 11.65 1 21.36 ? NZ LYS A-3 160 1 
ATOM 3862 N N . ALA A-3 1 181 . 18.549 -23.972 9.512 1 16.19 ? N ALA A-3 161 1 
ATOM 3863 C CA . ALA A-3 1 181 . 18.354 -25.365 9.865 1 16.45 ? CA ALA A-3 161 1 
ATOM 3864 C C . ALA A-3 1 181 . 19.377 -26.262 9.166 1 16.61 ? C ALA A-3 161 1 
ATOM 3865 O O . ALA A-3 1 181 . 19.826 -27.245 9.739 1 16.19 ? O ALA A-3 161 1 
ATOM 3866 C CB . ALA A-3 1 181 . 16.941 -25.794 9.543 1 16.06 ? CB ALA A-3 161 1 
ATOM 3867 N N . GLN A-3 1 182 . 19.773 -25.888 7.948 1 17.15 ? N GLN A-3 162 1 
ATOM 3868 C CA . GLN A-3 1 182 . 20.709 -26.686 7.146 1 16.75 ? CA GLN A-3 162 1 
ATOM 3869 C C . GLN A-3 1 182 . 22.18 -26.216 7.254 1 17.22 ? C GLN A-3 162 1 
ATOM 3870 O O . GLN A-3 1 182 . 23.055 -26.672 6.499 1 16.43 ? O GLN A-3 162 1 
ATOM 3871 C CB . GLN A-3 1 182 . 20.23 -26.759 5.69 1 16.81 ? CB GLN A-3 162 1 
ATOM 3872 C CG . GLN A-3 1 182 . 18.767 -27.201 5.576 1 16.78 ? CG GLN A-3 162 1 
ATOM 3873 C CD . GLN A-3 1 182 . 18.361 -27.676 4.186 1 17.15 ? CD GLN A-3 162 1 
ATOM 3874 O OE1 . GLN A-3 1 182 . 19.124 -27.565 3.224 1 17.04 ? OE1 GLN A-3 162 1 
ATOM 3875 N NE2 . GLN A-3 1 182 . 17.149 -28.228 4.081 1 16.82 ? NE2 GLN A-3 162 1 
ATOM 3876 N N . ASN A-3 1 183 . 22.44 -25.335 8.222 1 17.32 ? N ASN A-3 163 1 
ATOM 3877 C CA . ASN A-3 1 183 . 23.766 -24.765 8.456 1 18.21 ? CA ASN A-3 163 1 
ATOM 3878 C C . ASN A-3 1 183 . 24.359 -24.091 7.217 1 18.33 ? C ASN A-3 163 1 
ATOM 3879 O O . ASN A-3 1 183 . 25.548 -24.265 6.926 1 18.06 ? O ASN A-3 163 1 
ATOM 3880 C CB . ASN A-3 1 183 . 24.735 -25.839 8.986 1 18.73 ? CB ASN A-3 163 1 
ATOM 3881 C CG . ASN A-3 1 183 . 24.203 -26.554 10.205 1 18.52 ? CG ASN A-3 163 1 
ATOM 3882 O OD1 . ASN A-3 1 183 . 23.58 -25.956 11.077 1 18.59 ? OD1 ASN A-3 163 1 
ATOM 3883 N ND2 . ASN A-3 1 183 . 24.457 -27.848 10.273 1 19.45 ? ND2 ASN A-3 163 1 
ATOM 3884 N N . ASN A-3 1 184 . 23.529 -23.333 6.498 1 17.61 ? N ASN A-3 164 1 
ATOM 3885 C CA . ASN A-3 1 184 . 23.958 -22.663 5.275 1 18.08 ? CA ASN A-3 164 1 
ATOM 3886 C C . ASN A-3 1 184 . 23.794 -21.143 5.303 1 17.8 ? C ASN A-3 164 1 
ATOM 3887 O O . ASN A-3 1 184 . 24.254 -20.441 4.403 1 18.16 ? O ASN A-3 164 1 
ATOM 3888 C CB . ASN A-3 1 184 . 23.237 -23.275 4.067 1 18.87 ? CB ASN A-3 164 1 
ATOM 3889 C CG . ASN A-3 1 184 . 23.689 -24.699 3.792 1 19.63 ? CG ASN A-3 164 1 
ATOM 3890 O OD1 . ASN A-3 1 184 . 24.883 -24.983 3.81 1 20.05 ? OD1 ASN A-3 164 1 
ATOM 3891 N ND2 . ASN A-3 1 184 . 22.739 -25.602 3.544 1 19.64 ? ND2 ASN A-3 164 1 
ATOM 3892 N N . PHE A-3 1 185 . 23.168 -20.638 6.359 1 17.97 ? N PHE A-3 165 1 
ATOM 3893 C CA . PHE A-3 1 185 . 22.821 -19.224 6.442 1 17.41 ? CA PHE A-3 165 1 
ATOM 3894 C C . PHE A-3 1 185 . 24.028 -18.346 6.745 1 17.35 ? C PHE A-3 165 1 
ATOM 3895 O O . PHE A-3 1 185 . 24.346 -17.439 5.96 1 16.96 ? O PHE A-3 165 1 
ATOM 3896 C CB . PHE A-3 1 185 . 21.716 -18.993 7.483 1 17.71 ? CB PHE A-3 165 1 
ATOM 3897 C CG . PHE A-3 1 185 . 21.298 -17.542 7.618 1 18.07 ? CG PHE A-3 165 1 
ATOM 3898 C CD1 . PHE A-3 1 185 . 20.592 -16.902 6.592 1 17.97 ? CD1 PHE A-3 165 1 
ATOM 3899 C CD2 . PHE A-3 1 185 . 21.631 -16.809 8.756 1 17.77 ? CD2 PHE A-3 165 1 
ATOM 3900 C CE1 . PHE A-3 1 185 . 20.223 -15.566 6.707 1 18.13 ? CE1 PHE A-3 165 1 
ATOM 3901 C CE2 . PHE A-3 1 185 . 21.254 -15.475 8.875 1 17.85 ? CE2 PHE A-3 165 1 
ATOM 3902 C CZ . PHE A-3 1 185 . 20.552 -14.853 7.85 1 17.97 ? CZ PHE A-3 165 1 
ATOM 3903 N N . ASP A-3 1 186 . 24.687 -18.61 7.882 1 17 ? N ASP A-3 166 1 
ATOM 3904 C CA . ASP A-3 1 186 . 25.853 -17.828 8.303 1 16.78 ? CA ASP A-3 166 1 
ATOM 3905 C C . ASP A-3 1 186 . 26.92 -17.746 7.215 1 16.59 ? C ASP A-3 166 1 
ATOM 3906 O O . ASP A-3 1 186 . 27.477 -16.672 6.972 1 16.65 ? O ASP A-3 166 1 
ATOM 3907 C CB . ASP A-3 1 186 . 26.444 -18.354 9.619 1 17.3 ? CB ASP A-3 166 1 
ATOM 3908 C CG . ASP A-3 1 186 . 25.554 -18.063 10.821 1 17.79 ? CG ASP A-3 166 1 
ATOM 3909 O OD1 . ASP A-3 1 186 . 24.421 -17.567 10.62 1 17.29 ? OD1 ASP A-3 166 1 
ATOM 3910 O OD2 . ASP A-3 1 186 . 25.982 -18.347 11.967 1 18.04 ? OD2 ASP A-3 166 1 
ATOM 3911 N N . ALA A-3 1 187 . 27.189 -18.866 6.548 1 16.16 ? N ALA A-3 167 1 
ATOM 3912 C CA . ALA A-3 1 187 . 28.146 -18.879 5.432 1 15.87 ? CA ALA A-3 167 1 
ATOM 3913 C C . ALA A-3 1 187 . 27.718 -17.953 4.289 1 15.59 ? C ALA A-3 167 1 
ATOM 3914 O O . ALA A-3 1 187 . 28.539 -17.211 3.743 1 15.56 ? O ALA A-3 167 1 
ATOM 3915 C CB . ALA A-3 1 187 . 28.364 -20.298 4.918 1 15.66 ? CB ALA A-3 167 1 
ATOM 3916 N N . PHE A-3 1 188 . 26.436 -18.002 3.936 1 15.68 ? N PHE A-3 168 1 
ATOM 3917 C CA . PHE A-3 1 188 . 25.888 -17.147 2.883 1 15.98 ? CA PHE A-3 168 1 
ATOM 3918 C C . PHE A-3 1 188 . 26.082 -15.666 3.239 1 16.15 ? C PHE A-3 168 1 
ATOM 3919 O O . PHE A-3 1 188 . 26.606 -14.87 2.44 1 15.8 ? O PHE A-3 168 1 
ATOM 3920 C CB . PHE A-3 1 188 . 24.405 -17.48 2.641 1 15.76 ? CB PHE A-3 168 1 
ATOM 3921 C CG . PHE A-3 1 188 . 23.738 -16.596 1.616 1 15.66 ? CG PHE A-3 168 1 
ATOM 3922 C CD1 . PHE A-3 1 188 . 24.065 -16.702 0.259 1 15.22 ? CD1 PHE A-3 168 1 
ATOM 3923 C CD2 . PHE A-3 1 188 . 22.774 -15.661 2.004 1 15.35 ? CD2 PHE A-3 168 1 
ATOM 3924 C CE1 . PHE A-3 1 188 . 23.456 -15.882 -0.691 1 15.41 ? CE1 PHE A-3 168 1 
ATOM 3925 C CE2 . PHE A-3 1 188 . 22.168 -14.835 1.054 1 15.46 ? CE2 PHE A-3 168 1 
ATOM 3926 C CZ . PHE A-3 1 188 . 22.507 -14.95 -0.294 1 14.69 ? CZ PHE A-3 168 1 
ATOM 3927 N N . ILE A-3 1 189 . 25.67 -15.323 4.454 1 16.29 ? N ILE A-3 169 1 
ATOM 3928 C CA . ILE A-3 1 189 . 25.852 -13.988 5.007 1 16.63 ? CA ILE A-3 169 1 
ATOM 3929 C C . ILE A-3 1 189 . 27.3 -13.571 4.862 1 16.7 ? C ILE A-3 169 1 
ATOM 3930 O O . ILE A-3 1 189 . 27.581 -12.501 4.337 1 16.66 ? O ILE A-3 169 1 
ATOM 3931 C CB . ILE A-3 1 189 . 25.466 -13.941 6.501 1 16.9 ? CB ILE A-3 169 1 
ATOM 3932 C CG1 . ILE A-3 1 189 . 23.954 -14.099 6.684 1 17.11 ? CG1 ILE A-3 169 1 
ATOM 3933 C CG2 . ILE A-3 1 189 . 25.971 -12.668 7.166 1 16.84 ? CG2 ILE A-3 169 1 
ATOM 3934 C CD1 . ILE A-3 1 189 . 23.127 -13.479 5.575 1 17.67 ? CD1 ILE A-3 169 1 
ATOM 3935 N N . ALA A-3 1 190 . 28.211 -14.432 5.322 1 16.88 ? N ALA A-3 170 1 
ATOM 3936 C CA . ALA A-3 1 190 . 29.653 -14.154 5.273 1 16.31 ? CA ALA A-3 170 1 
ATOM 3937 C C . ALA A-3 1 190 . 30.167 -13.722 3.895 1 16.06 ? C ALA A-3 170 1 
ATOM 3938 O O . ALA A-3 1 190 . 31.126 -12.958 3.823 1 15.46 ? O ALA A-3 170 1 
ATOM 3939 C CB . ALA A-3 1 190 . 30.458 -15.339 5.809 1 16.06 ? CB ALA A-3 170 1 
ATOM 3940 N N . THR A-3 1 191 . 29.544 -14.194 2.809 1 16.17 ? N THR A-3 171 1 
ATOM 3941 C CA . THR A-3 1 191 . 29.987 -13.792 1.454 1 15.78 ? CA THR A-3 171 1 
ATOM 3942 C C . THR A-3 1 191 . 29.718 -12.31 1.146 1 15.75 ? C THR A-3 171 1 
ATOM 3943 O O . THR A-3 1 191 . 30.181 -11.78 0.128 1 15.23 ? O THR A-3 171 1 
ATOM 3944 C CB . THR A-3 1 191 . 29.376 -14.651 0.321 1 16.3 ? CB THR A-3 171 1 
ATOM 3945 O OG1 . THR A-3 1 191 . 27.984 -14.339 0.166 1 16.33 ? OG1 THR A-3 171 1 
ATOM 3946 C CG2 . THR A-3 1 191 . 29.567 -16.144 0.584 1 16.51 ? CG2 THR A-3 171 1 
ATOM 3947 N N . PHE A-3 1 192 . 28.977 -11.651 2.037 1 15.41 ? N PHE A-3 172 1 
ATOM 3948 C CA . PHE A-3 1 192 . 28.619 -10.248 1.863 1 15.37 ? CA PHE A-3 172 1 
ATOM 3949 C C . PHE A-3 1 192 . 29.351 -9.392 2.882 1 15.83 ? C PHE A-3 172 1 
ATOM 3950 O O . PHE A-3 1 192 . 29.126 -8.184 2.96 1 16.04 ? O PHE A-3 172 1 
ATOM 3951 C CB . PHE A-3 1 192 . 27.102 -10.057 1.989 1 14.9 ? CB PHE A-3 172 1 
ATOM 3952 C CG . PHE A-3 1 192 . 26.318 -10.676 0.857 1 14.81 ? CG PHE A-3 172 1 
ATOM 3953 C CD1 . PHE A-3 1 192 . 26.224 -10.03 -0.386 1 14.76 ? CD1 PHE A-3 172 1 
ATOM 3954 C CD2 . PHE A-3 1 192 . 25.691 -11.902 1.021 1 14.46 ? CD2 PHE A-3 172 1 
ATOM 3955 C CE1 . PHE A-3 1 192 . 25.522 -10.599 -1.444 1 14.52 ? CE1 PHE A-3 172 1 
ATOM 3956 C CE2 . PHE A-3 1 192 . 24.981 -12.478 -0.029 1 15.22 ? CE2 PHE A-3 172 1 
ATOM 3957 C CZ . PHE A-3 1 192 . 24.887 -11.824 -1.263 1 14.79 ? CZ PHE A-3 172 1 
ATOM 3958 N N . GLN A-3 1 193 . 30.214 -10.03 3.671 1 15.56 ? N GLN A-3 173 1 
ATOM 3959 C CA . GLN A-3 1 193 . 30.963 -9.338 4.712 1 15.64 ? CA GLN A-3 173 1 
ATOM 3960 C C . GLN A-3 1 193 . 32.454 -9.375 4.42 1 15.47 ? C GLN A-3 173 1 
ATOM 3961 O O . GLN A-3 1 193 . 33.2 -8.64 5.044 1 15.85 ? O GLN A-3 173 1 
ATOM 3962 C CB . GLN A-3 1 193 . 30.694 -9.974 6.075 1 15.53 ? CB GLN A-3 173 1 
ATOM 3963 C CG . GLN A-3 1 193 . 29.253 -9.893 6.552 1 15.1 ? CG GLN A-3 173 1 
ATOM 3964 C CD . GLN A-3 1 193 . 29.051 -10.679 7.832 1 14.91 ? CD GLN A-3 173 1 
ATOM 3965 O OE1 . GLN A-3 1 193 . 29.572 -11.781 7.982 1 14.75 ? OE1 GLN A-3 173 1 
ATOM 3966 N NE2 . GLN A-3 1 193 . 28.305 -10.113 8.766 1 15.17 ? NE2 GLN A-3 173 1 
ATOM 3967 N N . HIS A-4 1 20 . -22.583 -10.104 21.041 1 48.34 ? N HIS A-4 0 1 
ATOM 3968 C CA . HIS A-4 1 20 . -22.545 -11.566 20.738 1 49.45 ? CA HIS A-4 0 1 
ATOM 3969 C C . HIS A-4 1 20 . -23.043 -11.876 19.326 1 46.41 ? C HIS A-4 0 1 
ATOM 3970 O O . HIS A-4 1 20 . -24.013 -11.283 18.851 1 45.94 ? O HIS A-4 0 1 
ATOM 3971 C CB . HIS A-4 1 20 . -23.348 -12.363 21.773 1 52.97 ? CB HIS A-4 0 1 
ATOM 3972 C CG . HIS A-4 1 20 . -23.221 -13.85 21.62 1 57.04 ? CG HIS A-4 0 1 
ATOM 3973 N ND1 . HIS A-4 1 20 . -23.991 -14.578 20.736 1 57.4 ? ND1 HIS A-4 0 1 
ATOM 3974 C CD2 . HIS A-4 1 20 . -22.406 -14.743 22.23 1 58.45 ? CD2 HIS A-4 0 1 
ATOM 3975 C CE1 . HIS A-4 1 20 . -23.662 -15.855 20.815 1 57.94 ? CE1 HIS A-4 0 1 
ATOM 3976 N NE2 . HIS A-4 1 20 . -22.705 -15.983 21.717 1 58.53 ? NE2 HIS A-4 0 1 
ATOM 3977 N N . MET A-4 1 21 . -22.389 -12.842 18.689 1 43.8 ? N MET A-4 1 1 
ATOM 3978 C CA . MET A-4 1 21 . -22.533 -13.091 17.256 1 42.39 ? CA MET A-4 1 1 
ATOM 3979 C C . MET A-4 1 21 . -23.865 -13.675 16.785 1 39.99 ? C MET A-4 1 1 
ATOM 3980 O O . MET A-4 1 21 . -24.257 -13.447 15.639 1 38.36 ? O MET A-4 1 1 
ATOM 3981 C CB . MET A-4 1 21 . -21.376 -13.956 16.754 1 44.52 ? CB MET A-4 1 1 
ATOM 3982 C CG . MET A-4 1 21 . -20.911 -13.616 15.345 1 47.55 ? CG MET A-4 1 1 
ATOM 3983 S SD . MET A-4 1 21 . -19.825 -12.177 15.271 1 50 ? SD MET A-4 1 1 
ATOM 3984 C CE . MET A-4 1 21 . -20.983 -10.855 14.925 1 49.59 ? CE MET A-4 1 1 
ATOM 3985 N N . ASN A-4 1 22 . -24.55 -14.436 17.644 1 38.82 ? N ASN A-4 2 1 
ATOM 3986 C CA . ASN A-4 1 22 . -25.84 -15.035 17.268 1 36.62 ? CA ASN A-4 2 1 
ATOM 3987 C C . ASN A-4 1 22 . -26.865 -13.997 16.82 1 35.42 ? C ASN A-4 2 1 
ATOM 3988 O O . ASN A-4 1 22 . -27.692 -14.267 15.942 1 33.97 ? O ASN A-4 2 1 
ATOM 3989 C CB . ASN A-4 1 22 . -26.427 -15.908 18.381 1 36.59 ? CB ASN A-4 2 1 
ATOM 3990 C CG . ASN A-4 1 22 . -27.68 -16.652 17.932 1 36.28 ? CG ASN A-4 2 1 
ATOM 3991 O OD1 . ASN A-4 1 22 . -27.716 -17.231 16.848 1 35.62 ? OD1 ASN A-4 2 1 
ATOM 3992 N ND2 . ASN A-4 1 22 . -28.712 -16.629 18.758 1 35.55 ? ND2 ASN A-4 2 1 
ATOM 3993 N N . GLU A-4 1 23 . -26.79 -12.811 17.419 1 35.48 ? N GLU A-4 3 1 
ATOM 3994 C CA . GLU A-4 1 23 . -27.619 -11.677 17.018 1 36.55 ? CA GLU A-4 3 1 
ATOM 3995 C C . GLU A-4 1 23 . -27.421 -11.352 15.538 1 34.33 ? C GLU A-4 3 1 
ATOM 3996 O O . GLU A-4 1 23 . -28.368 -11.007 14.84 1 34 ? O GLU A-4 3 1 
ATOM 3997 C CB . GLU A-4 1 23 . -27.302 -10.446 17.866 1 37.94 ? CB GLU A-4 3 1 
ATOM 3998 C CG . GLU A-4 1 23 . -27.483 -10.661 19.358 1 40.69 ? CG GLU A-4 3 1 
ATOM 3999 C CD . GLU A-4 1 23 . -27.796 -9.378 20.106 1 42.48 ? CD GLU A-4 3 1 
ATOM 4000 O OE1 . GLU A-4 1 23 . -26.98 -8.429 20.039 1 43.46 ? OE1 GLU A-4 3 1 
ATOM 4001 O OE2 . GLU A-4 1 23 . -28.867 -9.321 20.755 1 40.81 ? OE2 GLU A-4 3 1 
ATOM 4002 N N . ILE A-4 1 24 . -26.189 -11.489 15.066 1 32.57 ? N ILE A-4 4 1 
ATOM 4003 C CA . ILE A-4 1 24 . -25.869 -11.204 13.672 1 32.59 ? CA ILE A-4 4 1 
ATOM 4004 C C . ILE A-4 1 24 . -26.257 -12.382 12.766 1 32.45 ? C ILE A-4 4 1 
ATOM 4005 O O . ILE A-4 1 24 . -26.824 -12.181 11.682 1 31.49 ? O ILE A-4 4 1 
ATOM 4006 C CB . ILE A-4 1 24 . -24.394 -10.75 13.517 1 32.86 ? CB ILE A-4 4 1 
ATOM 4007 C CG1 . ILE A-4 1 24 . -24.255 -9.255 13.828 1 34.21 ? CG1 ILE A-4 4 1 
ATOM 4008 C CG2 . ILE A-4 1 24 . -23.893 -10.942 12.099 1 34.2 ? CG2 ILE A-4 4 1 
ATOM 4009 C CD1 . ILE A-4 1 24 . -24.244 -8.88 15.296 1 33.68 ? CD1 ILE A-4 4 1 
ATOM 4010 N N . TYR A-4 1 25 . -25.974 -13.605 13.225 1 32.58 ? N TYR A-4 5 1 
ATOM 4011 C CA . TYR A-4 1 25 . -26.395 -14.826 12.524 1 31.73 ? CA TYR A-4 5 1 
ATOM 4012 C C . TYR A-4 1 25 . -27.909 -14.867 12.315 1 30.44 ? C TYR A-4 5 1 
ATOM 4013 O O . TYR A-4 1 25 . -28.391 -15.382 11.302 1 29.2 ? O TYR A-4 5 1 
ATOM 4014 C CB . TYR A-4 1 25 . -25.951 -16.088 13.28 1 34.8 ? CB TYR A-4 5 1 
ATOM 4015 C CG . TYR A-4 1 25 . -24.453 -16.267 13.435 1 36.87 ? CG TYR A-4 5 1 
ATOM 4016 C CD1 . TYR A-4 1 25 . -23.6 -16.184 12.332 1 38.24 ? CD1 TYR A-4 5 1 
ATOM 4017 C CD2 . TYR A-4 1 25 . -23.888 -16.531 14.686 1 37.76 ? CD2 TYR A-4 5 1 
ATOM 4018 C CE1 . TYR A-4 1 25 . -22.231 -16.35 12.468 1 38.85 ? CE1 TYR A-4 5 1 
ATOM 4019 C CE2 . TYR A-4 1 25 . -22.52 -16.703 14.832 1 39.31 ? CE2 TYR A-4 5 1 
ATOM 4020 C CZ . TYR A-4 1 25 . -21.695 -16.605 13.715 1 39.98 ? CZ TYR A-4 5 1 
ATOM 4021 O OH . TYR A-4 1 25 . -20.332 -16.765 13.84 1 41.2 ? OH TYR A-4 5 1 
ATOM 4022 N N . GLN A-4 1 26 . -28.653 -14.323 13.279 1 29.41 ? N GLN A-4 6 1 
ATOM 4023 C CA . GLN A-4 1 26 . -30.104 -14.195 13.163 1 28.7 ? CA GLN A-4 6 1 
ATOM 4024 C C . GLN A-4 1 26 . -30.487 -13.365 11.942 1 28.69 ? C GLN A-4 6 1 
ATOM 4025 O O . GLN A-4 1 26 . -31.451 -13.691 11.248 1 29.35 ? O GLN A-4 6 1 
ATOM 4026 C CB . GLN A-4 1 26 . -30.712 -13.607 14.447 1 29.35 ? CB GLN A-4 6 1 
ATOM 4027 C CG . GLN A-4 1 26 . -30.847 -14.623 15.581 1 30.2 ? CG GLN A-4 6 1 
ATOM 4028 C CD . GLN A-4 1 26 . -31.078 -13.991 16.945 1 31.73 ? CD GLN A-4 6 1 
ATOM 4029 O OE1 . GLN A-4 1 26 . -30.915 -12.78 17.125 1 32.26 ? OE1 GLN A-4 6 1 
ATOM 4030 N NE2 . GLN A-4 1 26 . -31.458 -14.816 17.918 1 31.27 ? NE2 GLN A-4 6 1 
ATOM 4031 N N . LYS A-4 1 27 . -29.707 -12.32 11.665 1 27.82 ? N LYS A-4 7 1 
ATOM 4032 C CA . LYS A-4 1 27 . -29.954 -11.452 10.513 1 27.26 ? CA LYS A-4 7 1 
ATOM 4033 C C . LYS A-4 1 27 . -29.513 -12.048 9.171 1 26.8 ? C LYS A-4 7 1 
ATOM 4034 O O . LYS A-4 1 27 . -30.218 -11.901 8.175 1 26.55 ? O LYS A-4 7 1 
ATOM 4035 C CB . LYS A-4 1 27 . -29.325 -10.072 10.733 1 28.56 ? CB LYS A-4 7 1 
ATOM 4036 C CG . LYS A-4 1 27 . -30.146 -9.18 11.649 1 29.48 ? CG LYS A-4 7 1 
ATOM 4037 C CD . LYS A-4 1 27 . -29.329 -8.024 12.201 1 31.72 ? CD LYS A-4 7 1 
ATOM 4038 C CE . LYS A-4 1 27 . -30.156 -7.186 13.173 1 32.67 ? CE LYS A-4 7 1 
ATOM 4039 N NZ . LYS A-4 1 27 . -29.378 -6.056 13.763 1 33.56 ? NZ LYS A-4 7 1 
ATOM 4040 N N . ALA A-4 1 28 . -28.359 -12.717 9.15 1 25.43 ? N ALA A-4 8 1 
ATOM 4041 C CA . ALA A-4 1 28 . -27.823 -13.331 7.932 1 24.75 ? CA ALA A-4 8 1 
ATOM 4042 C C . ALA A-4 1 28 . -28.527 -14.643 7.557 1 25.42 ? C ALA A-4 8 1 
ATOM 4043 O O . ALA A-4 1 28 . -28.409 -15.129 6.421 1 23.42 ? O ALA A-4 8 1 
ATOM 4044 C CB . ALA A-4 1 28 . -26.324 -13.549 8.072 1 24.5 ? CB ALA A-4 8 1 
ATOM 4045 N N . LYS A-4 1 29 . -29.272 -15.187 8.523 1 26.88 ? N LYS A-4 9 1 
ATOM 4046 C CA . LYS A-4 1 29 . -29.95 -16.487 8.439 1 27.79 ? CA LYS A-4 9 1 
ATOM 4047 C C . LYS A-4 1 29 . -30.69 -16.761 7.125 1 27.72 ? C LYS A-4 9 1 
ATOM 4048 O O . LYS A-4 1 29 . -30.615 -17.873 6.594 1 27.16 ? O LYS A-4 9 1 
ATOM 4049 C CB . LYS A-4 1 29 . -30.946 -16.614 9.604 1 30.33 ? CB LYS A-4 9 1 
ATOM 4050 C CG . LYS A-4 1 29 . -31.21 -18.032 10.088 1 32.08 ? CG LYS A-4 9 1 
ATOM 4051 C CD . LYS A-4 1 29 . -30.548 -18.304 11.435 1 33.34 ? CD LYS A-4 9 1 
ATOM 4052 C CE . LYS A-4 1 29 . -29.135 -18.856 11.271 1 33.82 ? CE LYS A-4 9 1 
ATOM 4053 N NZ . LYS A-4 1 29 . -28.367 -19.043 12.536 1 31.73 ? NZ LYS A-4 9 1 
ATOM 4054 N N . HIS A-4 1 30 . -31.401 -15.752 6.619 1 26.59 ? N HIS A-4 10 1 
ATOM 4055 C CA . HIS A-4 1 30 . -32.302 -15.918 5.474 1 26.79 ? CA HIS A-4 10 1 
ATOM 4056 C C . HIS A-4 1 30 . -31.887 -15.14 4.214 1 25.03 ? C HIS A-4 10 1 
ATOM 4057 O O . HIS A-4 1 30 . -32.718 -14.878 3.329 1 24.31 ? O HIS A-4 10 1 
ATOM 4058 C CB . HIS A-4 1 30 . -33.751 -15.564 5.877 1 29.44 ? CB HIS A-4 10 1 
ATOM 4059 C CG . HIS A-4 1 30 . -34.347 -16.506 6.881 1 31 ? CG HIS A-4 10 1 
ATOM 4060 N ND1 . HIS A-4 1 30 . -34.536 -17.848 6.623 1 31.33 ? ND1 HIS A-4 10 1 
ATOM 4061 C CD2 . HIS A-4 1 30 . -34.787 -16.301 8.147 1 31.72 ? CD2 HIS A-4 10 1 
ATOM 4062 C CE1 . HIS A-4 1 30 . -35.064 -18.428 7.686 1 32.04 ? CE1 HIS A-4 10 1 
ATOM 4063 N NE2 . HIS A-4 1 30 . -35.229 -17.512 8.624 1 31.32 ? NE2 HIS A-4 10 1 
ATOM 4064 N N . ILE A-4 1 31 . -30.604 -14.784 4.127 1 22.28 ? N ILE A-4 11 1 
ATOM 4065 C CA . ILE A-4 1 31 . -30.087 -14.047 2.973 1 19.31 ? CA ILE A-4 11 1 
ATOM 4066 C C . ILE A-4 1 31 . -30.115 -14.924 1.729 1 18.66 ? C ILE A-4 11 1 
ATOM 4067 O O . ILE A-4 1 31 . -29.688 -16.07 1.764 1 18.14 ? O ILE A-4 11 1 
ATOM 4068 C CB . ILE A-4 1 31 . -28.65 -13.546 3.213 1 18.94 ? CB ILE A-4 11 1 
ATOM 4069 C CG1 . ILE A-4 1 31 . -28.575 -12.629 4.448 1 18.66 ? CG1 ILE A-4 11 1 
ATOM 4070 C CG2 . ILE A-4 1 31 . -28.088 -12.891 1.953 1 18.45 ? CG2 ILE A-4 11 1 
ATOM 4071 C CD1 . ILE A-4 1 31 . -29.638 -11.541 4.54 1 18.49 ? CD1 ILE A-4 11 1 
ATOM 4072 N N . LYS A-4 1 32 . -30.639 -14.375 0.643 1 17.82 ? N LYS A-4 12 1 
ATOM 4073 C CA . LYS A-4 1 32 . -30.69 -15.068 -0.639 1 17.54 ? CA LYS A-4 12 1 
ATOM 4074 C C . LYS A-4 1 32 . -29.826 -14.344 -1.648 1 16.42 ? C LYS A-4 12 1 
ATOM 4075 O O . LYS A-4 1 32 . -29.444 -14.902 -2.681 1 15.79 ? O LYS A-4 12 1 
ATOM 4076 C CB . LYS A-4 1 32 . -32.125 -15.115 -1.16 1 18.45 ? CB LYS A-4 12 1 
ATOM 4077 C CG . LYS A-4 1 32 . -33.017 -16.122 -0.452 1 19.81 ? CG LYS A-4 12 1 
ATOM 4078 C CD . LYS A-4 1 32 . -34.483 -15.755 -0.634 1 20.77 ? CD LYS A-4 12 1 
ATOM 4079 C CE . LYS A-4 1 32 . -35.382 -16.722 0.116 1 21.62 ? CE LYS A-4 12 1 
ATOM 4080 N NZ . LYS A-4 1 32 . -35.56 -17.995 -0.641 1 22.79 ? NZ LYS A-4 12 1 
ATOM 4081 N N . LEU A-4 1 33 . -29.521 -13.091 -1.34 1 15.68 ? N LEU A-4 13 1 
ATOM 4082 C CA . LEU A-4 1 33 . -28.759 -12.253 -2.248 1 15.06 ? CA LEU A-4 13 1 
ATOM 4083 C C . LEU A-4 1 33 . -27.784 -11.404 -1.474 1 14.26 ? C LEU A-4 13 1 
ATOM 4084 O O . LEU A-4 1 33 . -28.151 -10.768 -0.483 1 14.01 ? O LEU A-4 13 1 
ATOM 4085 C CB . LEU A-4 1 33 . -29.682 -11.345 -3.08 1 15.36 ? CB LEU A-4 13 1 
ATOM 4086 C CG . LEU A-4 1 33 . -28.987 -10.445 -4.119 1 15.27 ? CG LEU A-4 13 1 
ATOM 4087 C CD1 . LEU A-4 1 33 . -29.855 -10.215 -5.337 1 15.93 ? CD1 LEU A-4 13 1 
ATOM 4088 C CD2 . LEU A-4 1 33 . -28.582 -9.111 -3.523 1 15.65 ? CD2 LEU A-4 13 1 
ATOM 4089 N N . PHE A-4 1 34 . -26.548 -11.381 -1.962 1 13.55 ? N PHE A-4 14 1 
ATOM 4090 C CA . PHE A-4 1 34 . -25.509 -10.542 -1.395 1 13.45 ? CA PHE A-4 14 1 
ATOM 4091 C C . PHE A-4 1 34 . -25.073 -9.545 -2.453 1 13.27 ? C PHE A-4 14 1 
ATOM 4092 O O . PHE A-4 1 34 . -24.557 -9.929 -3.532 1 12.88 ? O PHE A-4 14 1 
ATOM 4093 C CB . PHE A-4 1 34 . -24.342 -11.403 -0.874 1 13.07 ? CB PHE A-4 14 1 
ATOM 4094 C CG . PHE A-4 1 34 . -23.207 -10.617 -0.268 1 13.24 ? CG PHE A-4 14 1 
ATOM 4095 C CD1 . PHE A-4 1 34 . -23.446 -9.538 0.588 1 13.53 ? CD1 PHE A-4 14 1 
ATOM 4096 C CD2 . PHE A-4 1 34 . -21.887 -10.987 -0.516 1 13.04 ? CD2 PHE A-4 14 1 
ATOM 4097 C CE1 . PHE A-4 1 34 . -22.391 -8.829 1.154 1 13.44 ? CE1 PHE A-4 14 1 
ATOM 4098 C CE2 . PHE A-4 1 34 . -20.832 -10.289 0.051 1 13.33 ? CE2 PHE A-4 14 1 
ATOM 4099 C CZ . PHE A-4 1 34 . -21.081 -9.208 0.883 1 13.4 ? CZ PHE A-4 14 1 
ATOM 4100 N N . ALA A-4 1 35 . -25.308 -8.269 -2.145 1 13.05 ? N ALA A-4 15 1 
ATOM 4101 C CA . ALA A-4 1 35 . -24.936 -7.157 -3.02 1 13.33 ? CA ALA A-4 15 1 
ATOM 4102 C C . ALA A-4 1 35 . -23.809 -6.328 -2.419 1 13.72 ? C ALA A-4 15 1 
ATOM 4103 O O . ALA A-4 1 35 . -23.741 -6.112 -1.193 1 13.4 ? O ALA A-4 15 1 
ATOM 4104 C CB . ALA A-4 1 35 . -26.137 -6.281 -3.317 1 13.07 ? CB ALA A-4 15 1 
ATOM 4105 N N . MET A-4 1 36 . -22.918 -5.864 -3.291 1 13.91 ? N MET A-4 16 1 
ATOM 4106 C CA . MET A-4 1 36 . -21.719 -5.184 -2.823 1 14.22 ? CA MET A-4 16 1 
ATOM 4107 C C . MET A-4 1 36 . -21.479 -3.891 -3.563 1 13.81 ? C MET A-4 16 1 
ATOM 4108 O O . MET A-4 1 36 . -21.633 -3.808 -4.783 1 13.75 ? O MET A-4 16 1 
ATOM 4109 C CB . MET A-4 1 36 . -20.479 -6.067 -2.99 1 15.07 ? CB MET A-4 16 1 
ATOM 4110 C CG . MET A-4 1 36 . -20.45 -7.365 -2.193 1 15.82 ? CG MET A-4 16 1 
ATOM 4111 S SD . MET A-4 1 36 . -19.387 -8.567 -3.028 1 16.38 ? SD MET A-4 16 1 
ATOM 4112 C CE . MET A-4 1 36 . -20.52 -9.234 -4.257 1 15.94 ? CE MET A-4 16 1 
ATOM 4113 N N . ASP A-4 1 37 . -21.08 -2.885 -2.807 1 13.77 ? N ASP A-4 17 1 
ATOM 4114 C CA . ASP A-4 1 37 . -20.418 -1.729 -3.374 1 13.6 ? CA ASP A-4 17 1 
ATOM 4115 C C . ASP A-4 1 37 . -19 -2.157 -3.763 1 13.13 ? C ASP A-4 17 1 
ATOM 4116 O O . ASP A-4 1 37 . -18.481 -3.121 -3.208 1 12.82 ? O ASP A-4 17 1 
ATOM 4117 C CB . ASP A-4 1 37 . -20.376 -0.623 -2.334 1 13.99 ? CB ASP A-4 17 1 
ATOM 4118 C CG . ASP A-4 1 37 . -19.67 0.604 -2.828 1 14.53 ? CG ASP A-4 17 1 
ATOM 4119 O OD1 . ASP A-4 1 37 . -19.888 1.005 -4 1 14.23 ? OD1 ASP A-4 17 1 
ATOM 4120 O OD2 . ASP A-4 1 37 . -18.882 1.158 -2.029 1 15.16 ? OD2 ASP A-4 17 1 
ATOM 4121 N N . VAL A-4 1 38 . -18.38 -1.466 -4.724 1 13.2 ? N VAL A-4 18 1 
ATOM 4122 C CA . VAL A-4 1 38 . -17.015 -1.81 -5.148 1 13.06 ? CA VAL A-4 18 1 
ATOM 4123 C C . VAL A-4 1 38 . -15.956 -0.985 -4.413 1 13.37 ? C VAL A-4 18 1 
ATOM 4124 O O . VAL A-4 1 38 . -15.213 -1.536 -3.594 1 13.15 ? O VAL A-4 18 1 
ATOM 4125 C CB . VAL A-4 1 38 . -16.805 -1.719 -6.675 1 12.96 ? CB VAL A-4 18 1 
ATOM 4126 C CG1 . VAL A-4 1 38 . -15.34 -1.943 -7.03 1 12.62 ? CG1 VAL A-4 18 1 
ATOM 4127 C CG2 . VAL A-4 1 38 . -17.674 -2.739 -7.386 1 12.87 ? CG2 VAL A-4 18 1 
ATOM 4128 N N . ASP A-4 1 39 . -15.905 0.323 -4.684 1 13.54 ? N ASP A-4 19 1 
ATOM 4129 C CA . ASP A-4 1 39 . -14.829 1.163 -4.16 1 13.96 ? CA ASP A-4 19 1 
ATOM 4130 C C . ASP A-4 1 39 . -14.91 1.335 -2.658 1 13.29 ? C ASP A-4 19 1 
ATOM 4131 O O . ASP A-4 1 39 . -15.897 1.835 -2.143 1 13.13 ? O ASP A-4 19 1 
ATOM 4132 C CB . ASP A-4 1 39 . -14.819 2.514 -4.855 1 14.64 ? CB ASP A-4 19 1 
ATOM 4133 C CG . ASP A-4 1 39 . -14.724 2.382 -6.345 1 15.7 ? CG ASP A-4 19 1 
ATOM 4134 O OD1 . ASP A-4 1 39 . -13.663 1.915 -6.832 1 16.7 ? OD1 ASP A-4 19 1 
ATOM 4135 O OD2 . ASP A-4 1 39 . -15.713 2.727 -7.034 1 16.23 ? OD2 ASP A-4 19 1 
ATOM 4136 N N . GLY A-4 1 40 . -13.867 0.903 -1.962 1 12.97 ? N GLY A-4 20 1 
ATOM 4137 C CA . GLY A-4 1 40 . -13.822 0.969 -0.507 1 12.66 ? CA GLY A-4 20 1 
ATOM 4138 C C . GLY A-4 1 40 . -14.286 -0.308 0.182 1 12.81 ? C GLY A-4 20 1 
ATOM 4139 O O . GLY A-4 1 40 . -14.17 -0.437 1.413 1 12.52 ? O GLY A-4 20 1 
ATOM 4140 N N . ILE A-4 1 41 . -14.829 -1.238 -0.609 1 12.55 ? N ILE A-4 21 1 
ATOM 4141 C CA . ILE A-4 1 41 . -15.341 -2.522 -0.112 1 12.77 ? CA ILE A-4 21 1 
ATOM 4142 C C . ILE A-4 1 41 . -14.561 -3.67 -0.795 1 13.32 ? C ILE A-4 21 1 
ATOM 4143 O O . ILE A-4 1 41 . -13.781 -4.392 -0.153 1 13.31 ? O ILE A-4 21 1 
ATOM 4144 C CB . ILE A-4 1 41 . -16.88 -2.662 -0.363 1 12.7 ? CB ILE A-4 21 1 
ATOM 4145 C CG1 . ILE A-4 1 41 . -17.674 -1.583 0.375 1 12.18 ? CG1 ILE A-4 21 1 
ATOM 4146 C CG2 . ILE A-4 1 41 . -17.399 -4.043 0.034 1 12.39 ? CG2 ILE A-4 21 1 
ATOM 4147 C CD1 . ILE A-4 1 41 . -17.504 -1.598 1.88 1 12.06 ? CD1 ILE A-4 21 1 
ATOM 4148 N N . LEU A-4 1 42 . -14.764 -3.813 -2.101 1 13 ? N LEU A-4 22 1 
ATOM 4149 C CA . LEU A-4 1 42 . -14.015 -4.767 -2.891 1 13.22 ? CA LEU A-4 22 1 
ATOM 4150 C C . LEU A-4 1 42 . -12.599 -4.274 -3.194 1 14.15 ? C LEU A-4 22 1 
ATOM 4151 O O . LEU A-4 1 42 . -11.702 -5.081 -3.423 1 14.6 ? O LEU A-4 22 1 
ATOM 4152 C CB . LEU A-4 1 42 . -14.774 -5.094 -4.171 1 12.5 ? CB LEU A-4 22 1 
ATOM 4153 C CG . LEU A-4 1 42 . -15.964 -6.04 -3.957 1 12.24 ? CG LEU A-4 22 1 
ATOM 4154 C CD1 . LEU A-4 1 42 . -16.789 -6.181 -5.224 1 12.28 ? CD1 LEU A-4 22 1 
ATOM 4155 C CD2 . LEU A-4 1 42 . -15.526 -7.412 -3.461 1 12.07 ? CD2 LEU A-4 22 1 
ATOM 4156 N N . SER A-4 1 43 . -12.403 -2.953 -3.215 1 15 ? N SER A-4 23 1 
ATOM 4157 C CA . SER A-4 1 43 . -11.057 -2.365 -3.287 1 15.51 ? CA SER A-4 23 1 
ATOM 4158 C C . SER A-4 1 43 . -10.824 -1.607 -1.998 1 15.8 ? C SER A-4 23 1 
ATOM 4159 O O . SER A-4 1 43 . -11.748 -1.477 -1.194 1 16.03 ? O SER A-4 23 1 
ATOM 4160 C CB . SER A-4 1 43 . -10.92 -1.423 -4.485 1 15.48 ? CB SER A-4 23 1 
ATOM 4161 O OG . SER A-4 1 43 . -11.733 -0.267 -4.33 1 16.16 ? OG SER A-4 23 1 
ATOM 4162 N N . ASP A-4 1 44 . -9.613 -1.084 -1.806 1 16.28 ? N ASP A-4 24 1 
ATOM 4163 C CA . ASP A-4 1 44 . -9.316 -0.236 -0.637 1 15.96 ? CA ASP A-4 24 1 
ATOM 4164 C C . ASP A-4 1 44 . -9.598 1.25 -0.869 1 15.36 ? C ASP A-4 24 1 
ATOM 4165 O O . ASP A-4 1 44 . -9.205 2.095 -0.058 1 15.54 ? O ASP A-4 24 1 
ATOM 4166 C CB . ASP A-4 1 44 . -7.875 -0.436 -0.158 1 16.63 ? CB ASP A-4 24 1 
ATOM 4167 C CG . ASP A-4 1 44 . -6.848 0.128 -1.125 1 17.53 ? CG ASP A-4 24 1 
ATOM 4168 O OD1 . ASP A-4 1 44 . -7.193 0.424 -2.298 1 17.63 ? OD1 ASP A-4 24 1 
ATOM 4169 O OD2 . ASP A-4 1 44 . -5.684 0.279 -0.696 1 18.16 ? OD2 ASP A-4 24 1 
ATOM 4170 N N . GLY A-4 1 45 . -10.285 1.567 -1.965 1 14.56 ? N GLY A-4 25 1 
ATOM 4171 C CA . GLY A-4 1 45 . -10.74 2.934 -2.221 1 13.96 ? CA GLY A-4 25 1 
ATOM 4172 C C . GLY A-4 1 45 . -9.823 3.731 -3.135 1 13.86 ? C GLY A-4 25 1 
ATOM 4173 O O . GLY A-4 1 45 . -10.134 4.854 -3.52 1 13.94 ? O GLY A-4 25 1 
ATOM 4174 N N . GLN A-4 1 46 . -8.683 3.162 -3.491 1 13.74 ? N GLN A-4 26 1 
ATOM 4175 C CA . GLN A-4 1 46 . -7.81 3.84 -4.426 1 13.8 ? CA GLN A-4 26 1 
ATOM 4176 C C . GLN A-4 1 46 . -8.447 3.922 -5.8 1 13.48 ? C GLN A-4 26 1 
ATOM 4177 O O . GLN A-4 1 46 . -8.986 2.937 -6.292 1 12.96 ? O GLN A-4 26 1 
ATOM 4178 C CB . GLN A-4 1 46 . -6.426 3.192 -4.474 1 14.55 ? CB GLN A-4 26 1 
ATOM 4179 C CG . GLN A-4 1 46 . -5.558 3.604 -3.3 1 15.53 ? CG GLN A-4 26 1 
ATOM 4180 C CD . GLN A-4 1 46 . -4.209 2.923 -3.306 1 16.79 ? CD GLN A-4 26 1 
ATOM 4181 O OE1 . GLN A-4 1 46 . -3.47 2.991 -4.281 1 17.39 ? OE1 GLN A-4 26 1 
ATOM 4182 N NE2 . GLN A-4 1 46 . -3.876 2.264 -2.207 1 17.7 ? NE2 GLN A-4 26 1 
ATOM 4183 N N . ILE A-4 1 47 . -8.426 5.126 -6.372 1 13.66 ? N ILE A-4 27 1 
ATOM 4184 C CA . ILE A-4 1 47 . -8.789 5.369 -7.773 1 13.9 ? CA ILE A-4 27 1 
ATOM 4185 C C . ILE A-4 1 47 . -7.502 5.781 -8.498 1 13.96 ? C ILE A-4 27 1 
ATOM 4186 O O . ILE A-4 1 47 . -6.871 6.803 -8.16 1 13.85 ? O ILE A-4 27 1 
ATOM 4187 C CB . ILE A-4 1 47 . -9.847 6.5 -7.932 1 13.92 ? CB ILE A-4 27 1 
ATOM 4188 C CG1 . ILE A-4 1 47 . -11.048 6.33 -6.972 1 13.73 ? CG1 ILE A-4 27 1 
ATOM 4189 C CG2 . ILE A-4 1 47 . -10.282 6.64 -9.39 1 13.82 ? CG2 ILE A-4 27 1 
ATOM 4190 C CD1 . ILE A-4 1 47 . -11.904 5.107 -7.213 1 13.61 ? CD1 ILE A-4 27 1 
ATOM 4191 N N . ILE A-4 1 48 . -7.122 4.979 -9.492 1 14.18 ? N ILE A-4 28 1 
ATOM 4192 C CA . ILE A-4 1 48 . -5.775 5 -10.048 1 13.98 ? CA ILE A-4 28 1 
ATOM 4193 C C . ILE A-4 1 48 . -5.803 5.279 -11.557 1 14.34 ? C ILE A-4 28 1 
ATOM 4194 O O . ILE A-4 1 48 . -6.411 4.535 -12.324 1 14.2 ? O ILE A-4 28 1 
ATOM 4195 C CB . ILE A-4 1 48 . -5.067 3.654 -9.778 1 13.96 ? CB ILE A-4 28 1 
ATOM 4196 C CG1 . ILE A-4 1 48 . -5.102 3.271 -8.287 1 13.75 ? CG1 ILE A-4 28 1 
ATOM 4197 C CG2 . ILE A-4 1 48 . -3.629 3.672 -10.278 1 13.87 ? CG2 ILE A-4 28 1 
ATOM 4198 C CD1 . ILE A-4 1 48 . -4.895 1.788 -8.041 1 12.91 ? CD1 ILE A-4 28 1 
ATOM 4199 N N . TYR A-4 1 49 . -5.126 6.35 -11.967 1 14.66 ? N TYR A-4 29 1 
ATOM 4200 C CA . TYR A-4 1 49 . -5.05 6.756 -13.376 1 14.52 ? CA TYR A-4 29 1 
ATOM 4201 C C . TYR A-4 1 49 . -3.606 6.781 -13.854 1 15.21 ? C TYR A-4 29 1 
ATOM 4202 O O . TYR A-4 1 49 . -2.686 7.004 -13.061 1 15.22 ? O TYR A-4 29 1 
ATOM 4203 C CB . TYR A-4 1 49 . -5.64 8.159 -13.575 1 14.22 ? CB TYR A-4 29 1 
ATOM 4204 C CG . TYR A-4 1 49 . -7.107 8.304 -13.247 1 13.91 ? CG TYR A-4 29 1 
ATOM 4205 C CD1 . TYR A-4 1 49 . -8.021 7.318 -13.617 1 14.34 ? CD1 TYR A-4 29 1 
ATOM 4206 C CD2 . TYR A-4 1 49 . -7.589 9.437 -12.597 1 13.73 ? CD2 TYR A-4 29 1 
ATOM 4207 C CE1 . TYR A-4 1 49 . -9.369 7.442 -13.325 1 14.14 ? CE1 TYR A-4 29 1 
ATOM 4208 C CE2 . TYR A-4 1 49 . -8.943 9.574 -12.303 1 13.66 ? CE2 TYR A-4 29 1 
ATOM 4209 C CZ . TYR A-4 1 49 . -9.825 8.57 -12.675 1 13.83 ? CZ TYR A-4 29 1 
ATOM 4210 O OH . TYR A-4 1 49 . -11.172 8.659 -12.409 1 13.82 ? OH TYR A-4 29 1 
ATOM 4211 N N . ASN A-4 1 50 . -3.399 6.566 -15.152 1 15.48 ? N ASN A-4 30 1 
ATOM 4212 C CA . ASN A-4 1 50 . -2.067 6.726 -15.705 1 15.71 ? CA ASN A-4 30 1 
ATOM 4213 C C . ASN A-4 1 50 . -2 7.658 -16.916 1 15.84 ? C ASN A-4 30 1 
ATOM 4214 O O . ASN A-4 1 50 . -3.037 8.084 -17.441 1 16.41 ? O ASN A-4 30 1 
ATOM 4215 C CB . ASN A-4 1 50 . -1.364 5.372 -15.916 1 15.37 ? CB ASN A-4 30 1 
ATOM 4216 C CG . ASN A-4 1 50 . -1.771 4.67 -17.196 1 15.88 ? CG ASN A-4 30 1 
ATOM 4217 O OD1 . ASN A-4 1 50 . -2.163 5.296 -18.186 1 15.52 ? OD1 ASN A-4 30 1 
ATOM 4218 N ND2 . ASN A-4 1 50 . -1.625 3.347 -17.195 1 15.99 ? ND2 ASN A-4 30 1 
ATOM 4219 N N . SER A-4 1 51 . -0.779 7.953 -17.359 1 16.07 ? N SER A-4 31 1 
ATOM 4220 C CA . SER A-4 1 51 . -0.537 9.006 -18.348 1 16.82 ? CA SER A-4 31 1 
ATOM 4221 C C . SER A-4 1 51 . -0.99 8.654 -19.752 1 17.87 ? C SER A-4 31 1 
ATOM 4222 O O . SER A-4 1 51 . -0.955 9.501 -20.633 1 17.94 ? O SER A-4 31 1 
ATOM 4223 C CB . SER A-4 1 51 . 0.939 9.422 -18.369 1 16.29 ? CB SER A-4 31 1 
ATOM 4224 O OG . SER A-4 1 51 . 1.785 8.357 -18.771 1 15.66 ? OG SER A-4 31 1 
ATOM 4225 N N . GLU A-4 1 52 . -1.411 7.407 -19.95 1 20.05 ? N GLU A-4 32 1 
ATOM 4226 C CA . GLU A-4 1 52 . -1.959 6.947 -21.231 1 21.43 ? CA GLU A-4 32 1 
ATOM 4227 C C . GLU A-4 1 52 . -3.483 6.931 -21.209 1 20.94 ? C GLU A-4 32 1 
ATOM 4228 O O . GLU A-4 1 52 . -4.115 6.474 -22.159 1 20.78 ? O GLU A-4 32 1 
ATOM 4229 C CB . GLU A-4 1 52 . -1.426 5.55 -21.575 1 23.92 ? CB GLU A-4 32 1 
ATOM 4230 C CG . GLU A-4 1 52 . 0.057 5.52 -21.931 1 27.66 ? CG GLU A-4 32 1 
ATOM 4231 C CD . GLU A-4 1 52 . 0.51 4.186 -22.505 1 30.86 ? CD GLU A-4 32 1 
ATOM 4232 O OE1 . GLU A-4 1 52 . 0.353 3.143 -21.832 1 32.19 ? OE1 GLU A-4 32 1 
ATOM 4233 O OE2 . GLU A-4 1 52 . 1.041 4.183 -23.637 1 33.9 ? OE2 GLU A-4 32 1 
ATOM 4234 N N . GLY A-4 1 53 . -4.069 7.429 -20.12 1 20.41 ? N GLY A-4 33 1 
ATOM 4235 C CA . GLY A-4 1 53 . -5.527 7.487 -19.974 1 18.51 ? CA GLY A-4 33 1 
ATOM 4236 C C . GLY A-4 1 53 . -6.128 6.218 -19.383 1 17.72 ? C GLY A-4 33 1 
ATOM 4237 O O . GLY A-4 1 53 . -7.344 6.03 -19.401 1 17.2 ? O GLY A-4 33 1 
ATOM 4238 N N . THR A-4 1 54 . -5.278 5.355 -18.845 1 16.94 ? N THR A-4 34 1 
ATOM 4239 C CA . THR A-4 1 54 . -5.704 4.042 -18.367 1 16.76 ? CA THR A-4 34 1 
ATOM 4240 C C . THR A-4 1 54 . -6.026 4.062 -16.871 1 16.02 ? C THR A-4 34 1 
ATOM 4241 O O . THR A-4 1 54 . -5.303 4.688 -16.088 1 15.53 ? O THR A-4 34 1 
ATOM 4242 C CB . THR A-4 1 54 . -4.622 2.998 -18.687 1 17 ? CB THR A-4 34 1 
ATOM 4243 O OG1 . THR A-4 1 54 . -4.455 2.917 -20.106 1 18.34 ? OG1 THR A-4 34 1 
ATOM 4244 C CG2 . THR A-4 1 54 . -5.001 1.641 -18.173 1 17.36 ? CG2 THR A-4 34 1 
ATOM 4245 N N . GLU A-4 1 55 . -7.103 3.376 -16.485 1 15.18 ? N GLU A-4 35 1 
ATOM 4246 C CA . GLU A-4 1 55 . -7.53 3.304 -15.077 1 14.56 ? CA GLU A-4 35 1 
ATOM 4247 C C . GLU A-4 1 55 . -7.24 1.936 -14.487 1 13.96 ? C GLU A-4 35 1 
ATOM 4248 O O . GLU A-4 1 55 . -7.333 0.928 -15.184 1 13.87 ? O GLU A-4 35 1 
ATOM 4249 C CB . GLU A-4 1 55 . -9.035 3.609 -14.918 1 14.67 ? CB GLU A-4 35 1 
ATOM 4250 C CG . GLU A-4 1 55 . -9.508 3.556 -13.46 1 15.31 ? CG GLU A-4 35 1 
ATOM 4251 C CD . GLU A-4 1 55 . -10.968 3.939 -13.241 1 15.89 ? CD GLU A-4 35 1 
ATOM 4252 O OE1 . GLU A-4 1 55 . -11.701 4.153 -14.227 1 16.64 ? OE1 GLU A-4 35 1 
ATOM 4253 O OE2 . GLU A-4 1 55 . -11.386 4.039 -12.065 1 16.37 ? OE2 GLU A-4 35 1 
ATOM 4254 N N . THR A-4 1 56 . -6.929 1.914 -13.194 1 13.21 ? N THR A-4 36 1 
ATOM 4255 C CA . THR A-4 1 56 . -6.56 0.695 -12.494 1 12.8 ? CA THR A-4 36 1 
ATOM 4256 C C . THR A-4 1 56 . -7.377 0.558 -11.201 1 12.78 ? C THR A-4 36 1 
ATOM 4257 O O . THR A-4 1 56 . -7.691 1.561 -10.537 1 13.06 ? O THR A-4 36 1 
ATOM 4258 C CB . THR A-4 1 56 . -5.032 0.675 -12.232 1 12.69 ? CB THR A-4 36 1 
ATOM 4259 O OG1 . THR A-4 1 56 . -4.339 0.562 -13.486 1 12.08 ? OG1 THR A-4 36 1 
ATOM 4260 C CG2 . THR A-4 1 56 . -4.592 -0.477 -11.308 1 12.34 ? CG2 THR A-4 36 1 
ATOM 4261 N N . LYS A-4 1 57 . -7.739 -0.679 -10.864 1 12.32 ? N LYS A-4 37 1 
ATOM 4262 C CA . LYS A-4 1 57 . -8.36 -0.975 -9.576 1 12.51 ? CA LYS A-4 37 1 
ATOM 4263 C C . LYS A-4 1 57 . -7.803 -2.292 -9.02 1 12.24 ? C LYS A-4 37 1 
ATOM 4264 O O . LYS A-4 1 57 . -7.551 -3.248 -9.77 1 12.04 ? O LYS A-4 37 1 
ATOM 4265 C CB . LYS A-4 1 57 . -9.89 -1.034 -9.691 1 12.69 ? CB LYS A-4 37 1 
ATOM 4266 C CG . LYS A-4 1 57 . -10.616 -0.516 -8.454 1 13.12 ? CG LYS A-4 37 1 
ATOM 4267 C CD . LYS A-4 1 57 . -12.13 -0.646 -8.583 1 13.42 ? CD LYS A-4 37 1 
ATOM 4268 C CE . LYS A-4 1 57 . -12.684 0.192 -9.736 1 13.51 ? CE LYS A-4 37 1 
ATOM 4269 N NZ . LYS A-4 1 57 . -12.569 1.649 -9.468 1 13.62 ? NZ LYS A-4 37 1 
ATOM 4270 N N . ALA A-4 1 58 . -7.597 -2.327 -7.709 1 11.72 ? N ALA A-4 38 1 
ATOM 4271 C CA . ALA A-4 1 58 . -7.023 -3.494 -7.058 1 11.68 ? CA ALA A-4 38 1 
ATOM 4272 C C . ALA A-4 1 58 . -8.066 -4.208 -6.201 1 11.97 ? C ALA A-4 38 1 
ATOM 4273 O O . ALA A-4 1 58 . -8.783 -3.581 -5.416 1 11.94 ? O ALA A-4 38 1 
ATOM 4274 C CB . ALA A-4 1 58 . -5.827 -3.087 -6.211 1 11.78 ? CB ALA A-4 38 1 
ATOM 4275 N N . PHE A-4 1 59 . -8.139 -5.526 -6.358 1 12.23 ? N PHE A-4 39 1 
ATOM 4276 C CA . PHE A-4 1 59 . -9.038 -6.364 -5.571 1 12.42 ? CA PHE A-4 39 1 
ATOM 4277 C C . PHE A-4 1 59 . -8.218 -7.274 -4.646 1 12.63 ? C PHE A-4 39 1 
ATOM 4278 O O . PHE A-4 1 59 . -6.995 -7.303 -4.743 1 12.86 ? O PHE A-4 39 1 
ATOM 4279 C CB . PHE A-4 1 59 . -9.952 -7.183 -6.498 1 12.17 ? CB PHE A-4 39 1 
ATOM 4280 C CG . PHE A-4 1 59 . -10.763 -6.348 -7.456 1 12.08 ? CG PHE A-4 39 1 
ATOM 4281 C CD1 . PHE A-4 1 59 . -11.981 -5.778 -7.06 1 12.27 ? CD1 PHE A-4 39 1 
ATOM 4282 C CD2 . PHE A-4 1 59 . -10.322 -6.136 -8.761 1 12.15 ? CD2 PHE A-4 39 1 
ATOM 4283 C CE1 . PHE A-4 1 59 . -12.727 -5.002 -7.944 1 12.03 ? CE1 PHE A-4 39 1 
ATOM 4284 C CE2 . PHE A-4 1 59 . -11.066 -5.368 -9.655 1 11.99 ? CE2 PHE A-4 39 1 
ATOM 4285 C CZ . PHE A-4 1 59 . -12.265 -4.798 -9.243 1 12.29 ? CZ PHE A-4 39 1 
ATOM 4286 N N . TYR A-4 1 60 . -8.892 -8.012 -3.76 1 12.96 ? N TYR A-4 40 1 
ATOM 4287 C CA . TYR A-4 1 60 . -8.231 -8.918 -2.825 1 13.11 ? CA TYR A-4 40 1 
ATOM 4288 C C . TYR A-4 1 60 . -8.568 -10.374 -3.094 1 13.31 ? C TYR A-4 40 1 
ATOM 4289 O O . TYR A-4 1 60 . -9.745 -10.749 -3.163 1 12.95 ? O TYR A-4 40 1 
ATOM 4290 C CB . TYR A-4 1 60 . -8.637 -8.568 -1.406 1 13.32 ? CB TYR A-4 40 1 
ATOM 4291 C CG . TYR A-4 1 60 . -7.86 -9.251 -0.311 1 13.32 ? CG TYR A-4 40 1 
ATOM 4292 C CD1 . TYR A-4 1 60 . -6.463 -9.298 -0.326 1 13.57 ? CD1 TYR A-4 40 1 
ATOM 4293 C CD2 . TYR A-4 1 60 . -8.523 -9.794 0.78 1 13.67 ? CD2 TYR A-4 40 1 
ATOM 4294 C CE1 . TYR A-4 1 60 . -5.752 -9.895 0.711 1 13.81 ? CE1 TYR A-4 40 1 
ATOM 4295 C CE2 . TYR A-4 1 60 . -7.826 -10.39 1.825 1 13.85 ? CE2 TYR A-4 40 1 
ATOM 4296 C CZ . TYR A-4 1 60 . -6.444 -10.437 1.789 1 14.18 ? CZ TYR A-4 40 1 
ATOM 4297 O OH . TYR A-4 1 60 . -5.768 -11.029 2.84 1 14.5 ? OH TYR A-4 40 1 
ATOM 4298 N N . VAL A-4 1 61 . -7.516 -11.185 -3.208 1 13.63 ? N VAL A-4 41 1 
ATOM 4299 C CA . VAL A-4 1 61 . -7.603 -12.621 -3.555 1 13.92 ? CA VAL A-4 41 1 
ATOM 4300 C C . VAL A-4 1 61 . -8.479 -13.479 -2.601 1 14.26 ? C VAL A-4 41 1 
ATOM 4301 O O . VAL A-4 1 61 . -9.21 -14.367 -3.049 1 14.57 ? O VAL A-4 41 1 
ATOM 4302 C CB . VAL A-4 1 61 . -6.178 -13.236 -3.734 1 13.31 ? CB VAL A-4 41 1 
ATOM 4303 C CG1 . VAL A-4 1 61 . -5.46 -13.415 -2.4 1 13.13 ? CG1 VAL A-4 41 1 
ATOM 4304 C CG2 . VAL A-4 1 61 . -6.25 -14.56 -4.47 1 13.58 ? CG2 VAL A-4 41 1 
ATOM 4305 N N . GLN A-4 1 62 . -8.421 -13.205 -1.303 1 14.41 ? N GLN A-4 42 1 
ATOM 4306 C CA . GLN A-4 1 62 . -9.225 -13.968 -0.337 1 15.2 ? CA GLN A-4 42 1 
ATOM 4307 C C . GLN A-4 1 62 . -10.719 -13.638 -0.406 1 14.9 ? C GLN A-4 42 1 
ATOM 4308 O O . GLN A-4 1 62 . -11.559 -14.459 -0.026 1 15.14 ? O GLN A-4 42 1 
ATOM 4309 C CB . GLN A-4 1 62 . -8.699 -13.775 1.073 1 15.38 ? CB GLN A-4 42 1 
ATOM 4310 C CG . GLN A-4 1 62 . -7.249 -14.19 1.23 1 16.73 ? CG GLN A-4 42 1 
ATOM 4311 C CD . GLN A-4 1 62 . -6.878 -14.446 2.672 1 17.67 ? CD GLN A-4 42 1 
ATOM 4312 O OE1 . GLN A-4 1 62 . -7.713 -14.299 3.567 1 18.87 ? OE1 GLN A-4 42 1 
ATOM 4313 N NE2 . GLN A-4 1 62 . -5.618 -14.829 2.913 1 17.95 ? NE2 GLN A-4 42 1 
ATOM 4314 N N . ASP A-4 1 63 . -11.043 -12.445 -0.904 1 14.54 ? N ASP A-4 43 1 
ATOM 4315 C CA . ASP A-4 1 63 . -12.439 -12.059 -1.143 1 14.12 ? CA ASP A-4 43 1 
ATOM 4316 C C . ASP A-4 1 63 . -13.054 -12.913 -2.229 1 14.45 ? C ASP A-4 43 1 
ATOM 4317 O O . ASP A-4 1 63 . -14.209 -13.34 -2.115 1 15.18 ? O ASP A-4 43 1 
ATOM 4318 C CB . ASP A-4 1 63 . -12.544 -10.575 -1.496 1 13.46 ? CB ASP A-4 43 1 
ATOM 4319 C CG . ASP A-4 1 63 . -12.211 -9.681 -0.32 1 13.42 ? CG ASP A-4 43 1 
ATOM 4320 O OD1 . ASP A-4 1 63 . -12.369 -10.134 0.843 1 13.27 ? OD1 ASP A-4 43 1 
ATOM 4321 O OD2 . ASP A-4 1 63 . -11.814 -8.526 -0.55 1 12.83 ? OD2 ASP A-4 43 1 
ATOM 4322 N N . GLY A-4 1 64 . -12.272 -13.189 -3.266 1 14.57 ? N GLY A-4 44 1 
ATOM 4323 C CA . GLY A-4 1 64 . -12.741 -13.991 -4.394 1 15.16 ? CA GLY A-4 44 1 
ATOM 4324 C C . GLY A-4 1 64 . -13.173 -15.383 -3.974 1 15.39 ? C GLY A-4 44 1 
ATOM 4325 O O . GLY A-4 1 64 . -14.196 -15.899 -4.429 1 15.57 ? O GLY A-4 44 1 
ATOM 4326 N N . LEU A-4 1 65 . -12.389 -15.988 -3.092 1 14.9 ? N LEU A-4 45 1 
ATOM 4327 C CA . LEU A-4 1 65 . -12.642 -17.347 -2.682 1 14.95 ? CA LEU A-4 45 1 
ATOM 4328 C C . LEU A-4 1 65 . -13.844 -17.39 -1.738 1 14.55 ? C LEU A-4 45 1 
ATOM 4329 O O . LEU A-4 1 65 . -14.654 -18.317 -1.794 1 14.46 ? O LEU A-4 45 1 
ATOM 4330 C CB . LEU A-4 1 65 . -11.376 -17.951 -2.072 1 14.9 ? CB LEU A-4 45 1 
ATOM 4331 C CG . LEU A-4 1 65 . -11.201 -19.466 -1.905 1 15.72 ? CG LEU A-4 45 1 
ATOM 4332 C CD1 . LEU A-4 1 65 . -11.282 -19.861 -0.435 1 15.61 ? CD1 LEU A-4 45 1 
ATOM 4333 C CD2 . LEU A-4 1 65 . -12.135 -20.314 -2.78 1 15.59 ? CD2 LEU A-4 45 1 
ATOM 4334 N N . GLY A-4 1 66 . -13.968 -16.37 -0.894 1 14.54 ? N GLY A-4 46 1 
ATOM 4335 C CA . GLY A-4 1 66 . -15.107 -16.26 0.011 1 15.24 ? CA GLY A-4 46 1 
ATOM 4336 C C . GLY A-4 1 66 . -16.403 -16.031 -0.74 1 15.57 ? C GLY A-4 46 1 
ATOM 4337 O O . GLY A-4 1 66 . -17.463 -16.479 -0.308 1 14.92 ? O GLY A-4 46 1 
ATOM 4338 N N . LEU A-4 1 67 . -16.306 -15.339 -1.876 1 16.24 ? N LEU A-4 47 1 
ATOM 4339 C CA . LEU A-4 1 67 . -17.478 -15.028 -2.683 1 16.57 ? CA LEU A-4 47 1 
ATOM 4340 C C . LEU A-4 1 67 . -17.937 -16.277 -3.42 1 16.96 ? C LEU A-4 47 1 
ATOM 4341 O O . LEU A-4 1 67 . -19.133 -16.524 -3.535 1 16.39 ? O LEU A-4 47 1 
ATOM 4342 C CB . LEU A-4 1 67 . -17.222 -13.858 -3.645 1 16.71 ? CB LEU A-4 47 1 
ATOM 4343 C CG . LEU A-4 1 67 . -17.307 -12.449 -3.019 1 17.09 ? CG LEU A-4 47 1 
ATOM 4344 C CD1 . LEU A-4 1 67 . -16.725 -11.379 -3.933 1 17.08 ? CD1 LEU A-4 47 1 
ATOM 4345 C CD2 . LEU A-4 1 67 . -18.729 -12.085 -2.62 1 17.07 ? CD2 LEU A-4 47 1 
ATOM 4346 N N . GLN A-4 1 68 . -16.989 -17.076 -3.894 1 17.46 ? N GLN A-4 48 1 
ATOM 4347 C CA . GLN A-4 1 68 . -17.344 -18.337 -4.531 1 18.32 ? CA GLN A-4 48 1 
ATOM 4348 C C . GLN A-4 1 68 . -18.002 -19.306 -3.546 1 17.41 ? C GLN A-4 48 1 
ATOM 4349 O O . GLN A-4 1 68 . -18.984 -19.95 -3.895 1 17.03 ? O GLN A-4 48 1 
ATOM 4350 C CB . GLN A-4 1 68 . -16.143 -18.965 -5.237 1 20.46 ? CB GLN A-4 48 1 
ATOM 4351 C CG . GLN A-4 1 68 . -15.909 -18.406 -6.635 1 23.55 ? CG GLN A-4 48 1 
ATOM 4352 C CD . GLN A-4 1 68 . -14.478 -18.592 -7.105 1 26.39 ? CD GLN A-4 48 1 
ATOM 4353 O OE1 . GLN A-4 1 68 . -13.59 -18.922 -6.314 1 28.63 ? OE1 GLN A-4 48 1 
ATOM 4354 N NE2 . GLN A-4 1 68 . -14.241 -18.365 -8.386 1 26.87 ? NE2 GLN A-4 48 1 
ATOM 4355 N N . ALA A-4 1 69 . -17.484 -19.37 -2.321 1 16.77 ? N ALA A-4 49 1 
ATOM 4356 C CA . ALA A-4 1 69 . -18.095 -20.152 -1.246 1 16.78 ? CA ALA A-4 49 1 
ATOM 4357 C C . ALA A-4 1 69 . -19.557 -19.765 -1.033 1 16.51 ? C ALA A-4 49 1 
ATOM 4358 O O . ALA A-4 1 69 . -20.452 -20.607 -1.147 1 16.17 ? O ALA A-4 49 1 
ATOM 4359 C CB . ALA A-4 1 69 . -17.311 -19.991 0.037 1 16.84 ? CB ALA A-4 49 1 
ATOM 4360 N N . LEU A-4 1 70 . -19.798 -18.493 -0.733 1 16.84 ? N LEU A-4 50 1 
ATOM 4361 C CA . LEU A-4 1 70 . -21.157 -17.965 -0.637 1 16.75 ? CA LEU A-4 50 1 
ATOM 4362 C C . LEU A-4 1 70 . -21.979 -18.373 -1.844 1 16.99 ? C LEU A-4 50 1 
ATOM 4363 O O . LEU A-4 1 70 . -23.03 -18.993 -1.699 1 16.65 ? O LEU A-4 50 1 
ATOM 4364 C CB . LEU A-4 1 70 . -21.149 -16.438 -0.571 1 16.75 ? CB LEU A-4 50 1 
ATOM 4365 C CG . LEU A-4 1 70 . -21.49 -15.702 0.715 1 16.49 ? CG LEU A-4 50 1 
ATOM 4366 C CD1 . LEU A-4 1 70 . -22.265 -14.452 0.322 1 16.57 ? CD1 LEU A-4 50 1 
ATOM 4367 C CD2 . LEU A-4 1 70 . -22.298 -16.546 1.688 1 15.91 ? CD2 LEU A-4 50 1 
ATOM 4368 N N . LYS A-4 1 71 . -21.478 -18.025 -3.028 1 17.72 ? N LYS A-4 51 1 
ATOM 4369 C CA . LYS A-4 1 71 . -22.155 -18.298 -4.297 1 18.88 ? CA LYS A-4 51 1 
ATOM 4370 C C . LYS A-4 1 71 . -22.5 -19.782 -4.435 1 19.43 ? C LYS A-4 51 1 
ATOM 4371 O O . LYS A-4 1 71 . -23.607 -20.134 -4.826 1 18.88 ? O LYS A-4 51 1 
ATOM 4372 C CB . LYS A-4 1 71 . -21.283 -17.822 -5.456 1 19.27 ? CB LYS A-4 51 1 
ATOM 4373 C CG . LYS A-4 1 71 . -21.901 -17.951 -6.845 1 20.27 ? CG LYS A-4 51 1 
ATOM 4374 C CD . LYS A-4 1 71 . -21.488 -19.239 -7.528 1 20.75 ? CD LYS A-4 51 1 
ATOM 4375 C CE . LYS A-4 1 71 . -20.081 -19.151 -8.109 1 20.99 ? CE LYS A-4 51 1 
ATOM 4376 N NZ . LYS A-4 1 71 . -19.94 -20.172 -9.186 1 20.05 ? NZ LYS A-4 51 1 
ATOM 4377 N N . GLN A-4 1 72 . -21.545 -20.637 -4.083 1 21.18 ? N GLN A-4 52 1 
ATOM 4378 C CA . GLN A-4 1 72 . -21.718 -22.091 -4.113 1 22.4 ? CA GLN A-4 52 1 
ATOM 4379 C C . GLN A-4 1 72 . -22.866 -22.574 -3.243 1 22.13 ? C GLN A-4 52 1 
ATOM 4380 O O . GLN A-4 1 72 . -23.506 -23.58 -3.558 1 21.46 ? O GLN A-4 52 1 
ATOM 4381 C CB . GLN A-4 1 72 . -20.462 -22.783 -3.601 1 24.02 ? CB GLN A-4 52 1 
ATOM 4382 C CG . GLN A-4 1 72 . -19.314 -22.843 -4.576 1 27.35 ? CG GLN A-4 52 1 
ATOM 4383 C CD . GLN A-4 1 72 . -18.22 -23.764 -4.084 1 29.94 ? CD GLN A-4 52 1 
ATOM 4384 O OE1 . GLN A-4 1 72 . -18.386 -24.46 -3.073 1 32.19 ? OE1 GLN A-4 52 1 
ATOM 4385 N NE2 . GLN A-4 1 72 . -17.093 -23.777 -4.79 1 30.54 ? NE2 GLN A-4 52 1 
ATOM 4386 N N . SER A-4 1 73 . -23.086 -21.889 -2.122 1 21.56 ? N SER A-4 53 1 
ATOM 4387 C CA . SER A-4 1 73 . -24.124 -22.292 -1.182 1 20.55 ? CA SER A-4 53 1 
ATOM 4388 C C . SER A-4 1 73 . -25.49 -21.829 -1.658 1 20.46 ? C SER A-4 53 1 
ATOM 4389 O O . SER A-4 1 73 . -26.48 -22.011 -0.963 1 21.04 ? O SER A-4 53 1 
ATOM 4390 C CB . SER A-4 1 73 . -23.834 -21.759 0.219 1 20.26 ? CB SER A-4 53 1 
ATOM 4391 O OG . SER A-4 1 73 . -24.093 -20.375 0.287 1 20.5 ? OG SER A-4 53 1 
ATOM 4392 N N . GLY A-4 1 74 . -25.534 -21.235 -2.847 1 20.43 ? N GLY A-4 54 1 
ATOM 4393 C CA . GLY A-4 1 74 . -26.786 -20.819 -3.461 1 20.23 ? CA GLY A-4 54 1 
ATOM 4394 C C . GLY A-4 1 74 . -27.211 -19.398 -3.144 1 20.15 ? C GLY A-4 54 1 
ATOM 4395 O O . GLY A-4 1 74 . -28.392 -19.104 -3.09 1 20.96 ? O GLY A-4 54 1 
ATOM 4396 N N . ILE A-4 1 75 . -26.251 -18.513 -2.922 1 19.8 ? N ILE A-4 55 1 
ATOM 4397 C CA . ILE A-4 1 75 . -26.563 -17.102 -2.764 1 18.63 ? CA ILE A-4 55 1 
ATOM 4398 C C . ILE A-4 1 75 . -26.183 -16.375 -4.054 1 18.4 ? C ILE A-4 55 1 
ATOM 4399 O O . ILE A-4 1 75 . -25.161 -16.672 -4.673 1 18.17 ? O ILE A-4 55 1 
ATOM 4400 C CB . ILE A-4 1 75 . -25.933 -16.516 -1.478 1 18.7 ? CB ILE A-4 55 1 
ATOM 4401 C CG1 . ILE A-4 1 75 . -26.663 -17.101 -0.255 1 18.5 ? CG1 ILE A-4 55 1 
ATOM 4402 C CG2 . ILE A-4 1 75 . -25.993 -14.989 -1.461 1 18.24 ? CG2 ILE A-4 55 1 
ATOM 4403 C CD1 . ILE A-4 1 75 . -25.95 -16.927 1.068 1 18.61 ? CD1 ILE A-4 55 1 
ATOM 4404 N N . ILE A-4 1 76 . -27.061 -15.478 -4.486 1 18.04 ? N ILE A-4 56 1 
ATOM 4405 C CA . ILE A-4 1 76 . -26.846 -14.677 -5.686 1 17.63 ? CA ILE A-4 56 1 
ATOM 4406 C C . ILE A-4 1 76 . -25.985 -13.466 -5.336 1 16.99 ? C ILE A-4 56 1 
ATOM 4407 O O . ILE A-4 1 76 . -26.198 -12.808 -4.309 1 16.43 ? O ILE A-4 56 1 
ATOM 4408 C CB . ILE A-4 1 76 . -28.195 -14.225 -6.292 1 17.96 ? CB ILE A-4 56 1 
ATOM 4409 C CG1 . ILE A-4 1 76 . -29.052 -15.458 -6.623 1 18.29 ? CG1 ILE A-4 56 1 
ATOM 4410 C CG2 . ILE A-4 1 76 . -27.982 -13.352 -7.53 1 17.55 ? CG2 ILE A-4 56 1 
ATOM 4411 C CD1 . ILE A-4 1 76 . -30.545 -15.219 -6.533 1 19.03 ? CD1 ILE A-4 56 1 
ATOM 4412 N N . LEU A-4 1 77 . -25.009 -13.194 -6.198 1 16.23 ? N LEU A-4 57 1 
ATOM 4413 C CA . LEU A-4 1 77 . -24.054 -12.122 -5.98 1 15.68 ? CA LEU A-4 57 1 
ATOM 4414 C C . LEU A-4 1 77 . -24.273 -10.979 -6.97 1 15.42 ? C LEU A-4 57 1 
ATOM 4415 O O . LEU A-4 1 77 . -24.468 -11.205 -8.167 1 14.95 ? O LEU A-4 57 1 
ATOM 4416 C CB . LEU A-4 1 77 . -22.622 -12.658 -6.086 1 15.58 ? CB LEU A-4 57 1 
ATOM 4417 C CG . LEU A-4 1 77 . -22.166 -13.84 -5.221 1 15.36 ? CG LEU A-4 57 1 
ATOM 4418 C CD1 . LEU A-4 1 77 . -20.689 -14.106 -5.481 1 15.71 ? CD1 LEU A-4 57 1 
ATOM 4419 C CD2 . LEU A-4 1 77 . -22.398 -13.629 -3.733 1 15.55 ? CD2 LEU A-4 57 1 
ATOM 4420 N N . ALA A-4 1 78 . -24.233 -9.756 -6.448 1 15.14 ? N ALA A-4 58 1 
ATOM 4421 C CA . ALA A-4 1 78 . -24.483 -8.551 -7.232 1 14.83 ? CA ALA A-4 58 1 
ATOM 4422 C C . ALA A-4 1 78 . -23.524 -7.441 -6.849 1 14.71 ? C ALA A-4 58 1 
ATOM 4423 O O . ALA A-4 1 78 . -23.048 -7.37 -5.704 1 14.64 ? O ALA A-4 58 1 
ATOM 4424 C CB . ALA A-4 1 78 . -25.915 -8.077 -7.051 1 14.86 ? CB ALA A-4 58 1 
ATOM 4425 N N . ILE A-4 1 79 . -23.241 -6.586 -7.825 1 14.09 ? N ILE A-4 59 1 
ATOM 4426 C CA . ILE A-4 1 79 . -22.482 -5.377 -7.603 1 13.69 ? CA ILE A-4 59 1 
ATOM 4427 C C . ILE A-4 1 79 . -23.373 -4.163 -7.883 1 14.01 ? C ILE A-4 59 1 
ATOM 4428 O O . ILE A-4 1 79 . -24.131 -4.139 -8.859 1 13.75 ? O ILE A-4 59 1 
ATOM 4429 C CB . ILE A-4 1 79 . -21.2 -5.362 -8.468 1 13.4 ? CB ILE A-4 59 1 
ATOM 4430 C CG1 . ILE A-4 1 79 . -20.059 -6.094 -7.735 1 13.06 ? CG1 ILE A-4 59 1 
ATOM 4431 C CG2 . ILE A-4 1 79 . -20.778 -3.94 -8.798 1 12.97 ? CG2 ILE A-4 59 1 
ATOM 4432 C CD1 . ILE A-4 1 79 . -18.824 -6.34 -8.581 1 13.35 ? CD1 ILE A-4 59 1 
ATOM 4433 N N . ILE A-4 1 80 . -23.312 -3.176 -6.989 1 14.04 ? N ILE A-4 60 1 
ATOM 4434 C CA . ILE A-4 1 80 . -23.959 -1.889 -7.217 1 14.07 ? CA ILE A-4 60 1 
ATOM 4435 C C . ILE A-4 1 80 . -22.944 -0.794 -6.904 1 14.34 ? C ILE A-4 60 1 
ATOM 4436 O O . ILE A-4 1 80 . -22.569 -0.587 -5.747 1 14.12 ? O ILE A-4 60 1 
ATOM 4437 C CB . ILE A-4 1 80 . -25.276 -1.711 -6.41 1 14.01 ? CB ILE A-4 60 1 
ATOM 4438 C CG1 . ILE A-4 1 80 . -26.148 -2.978 -6.475 1 14.14 ? CG1 ILE A-4 60 1 
ATOM 4439 C CG2 . ILE A-4 1 80 . -26.059 -0.514 -6.95 1 14.07 ? CG2 ILE A-4 60 1 
ATOM 4440 C CD1 . ILE A-4 1 80 . -27.459 -2.885 -5.721 1 14.39 ? CD1 ILE A-4 60 1 
ATOM 4441 N N . THR A-4 1 81 . -22.474 -0.117 -7.942 1 14.77 ? N THR A-4 61 1 
ATOM 4442 C CA . THR A-4 1 81 . -21.397 0.848 -7.767 1 15.62 ? CA THR A-4 61 1 
ATOM 4443 C C . THR A-4 1 81 . -21.686 2.145 -8.5 1 15.96 ? C THR A-4 61 1 
ATOM 4444 O O . THR A-4 1 81 . -22.301 2.15 -9.574 1 15.86 ? O THR A-4 61 1 
ATOM 4445 C CB . THR A-4 1 81 . -20.001 0.287 -8.157 1 15.79 ? CB THR A-4 61 1 
ATOM 4446 O OG1 . THR A-4 1 81 . -19.014 1.318 -8.016 1 16.99 ? OG1 THR A-4 61 1 
ATOM 4447 C CG2 . THR A-4 1 81 . -19.965 -0.214 -9.599 1 16.03 ? CG2 THR A-4 61 1 
ATOM 4448 N N . GLY A-4 1 82 . -21.253 3.24 -7.887 1 16.22 ? N GLY A-4 62 1 
ATOM 4449 C CA . GLY A-4 1 82 . -21.466 4.567 -8.42 1 16.82 ? CA GLY A-4 62 1 
ATOM 4450 C C . GLY A-4 1 82 . -20.626 4.829 -9.642 1 17.26 ? C GLY A-4 62 1 
ATOM 4451 O O . GLY A-4 1 82 . -21.039 5.574 -10.521 1 18.49 ? O GLY A-4 62 1 
ATOM 4452 N N . ARG A-4 1 83 . -19.447 4.219 -9.707 1 17.83 ? N ARG A-4 63 1 
ATOM 4453 C CA . ARG A-4 1 83 . -18.565 4.401 -10.853 1 18.36 ? CA ARG A-4 63 1 
ATOM 4454 C C . ARG A-4 1 83 . -18.801 3.313 -11.886 1 19.33 ? C ARG A-4 63 1 
ATOM 4455 O O . ARG A-4 1 83 . -19.71 2.502 -11.739 1 20.52 ? O ARG A-4 63 1 
ATOM 4456 C CB . ARG A-4 1 83 . -17.1 4.458 -10.411 1 17.96 ? CB ARG A-4 63 1 
ATOM 4457 C CG . ARG A-4 1 83 . -16.74 5.759 -9.696 1 17.91 ? CG ARG A-4 63 1 
ATOM 4458 C CD . ARG A-4 1 83 . -15.329 5.741 -9.123 1 18.01 ? CD ARG A-4 63 1 
ATOM 4459 N NE . ARG A-4 1 83 . -14.323 5.688 -10.185 1 17.34 ? NE ARG A-4 63 1 
ATOM 4460 C CZ . ARG A-4 1 83 . -13.854 6.751 -10.826 1 16.87 ? CZ ARG A-4 63 1 
ATOM 4461 N NH1 . ARG A-4 1 83 . -14.27 7.969 -10.504 1 16.57 ? NH1 ARG A-4 63 1 
ATOM 4462 N NH2 . ARG A-4 1 83 . -12.952 6.592 -11.781 1 16.23 ? NH2 ARG A-4 63 1 
ATOM 4463 N N . SER A-4 1 84 . -17.991 3.296 -12.938 1 19.47 ? N SER A-4 64 1 
ATOM 4464 C CA . SER A-4 1 84 . -18.162 2.312 -14.003 1 19.07 ? CA SER A-4 64 1 
ATOM 4465 C C . SER A-4 1 84 . -16.846 1.999 -14.722 1 18.38 ? C SER A-4 64 1 
ATOM 4466 O O . SER A-4 1 84 . -16.167 2.913 -15.185 1 18.82 ? O SER A-4 64 1 
ATOM 4467 C CB . SER A-4 1 84 . -19.194 2.829 -15.002 1 19.47 ? CB SER A-4 64 1 
ATOM 4468 O OG . SER A-4 1 84 . -19.211 2.004 -16.139 1 20.11 ? OG SER A-4 64 1 
ATOM 4469 N N . SER A-4 1 85 . -16.498 0.713 -14.832 1 17.75 ? N SER A-4 65 1 
ATOM 4470 C CA . SER A-4 1 85 . -15.238 0.299 -15.477 1 17.13 ? CA SER A-4 65 1 
ATOM 4471 C C . SER A-4 1 85 . -15.229 -1.153 -15.972 1 16.95 ? C SER A-4 65 1 
ATOM 4472 O O . SER A-4 1 85 . -15.99 -1.994 -15.48 1 16.64 ? O SER A-4 65 1 
ATOM 4473 C CB . SER A-4 1 85 . -14.044 0.529 -14.537 1 16.56 ? CB SER A-4 65 1 
ATOM 4474 O OG . SER A-4 1 85 . -14.014 -0.428 -13.48 1 15.94 ? OG SER A-4 65 1 
ATOM 4475 N N . ALA A-4 1 86 . -14.353 -1.443 -16.939 1 16.55 ? N ALA A-4 66 1 
ATOM 4476 C CA . ALA A-4 1 86 . -14.139 -2.824 -17.397 1 16.96 ? CA ALA A-4 66 1 
ATOM 4477 C C . ALA A-4 1 86 . -13.502 -3.688 -16.297 1 17.43 ? C ALA A-4 66 1 
ATOM 4478 O O . ALA A-4 1 86 . -13.663 -4.904 -16.296 1 17.65 ? O ALA A-4 66 1 
ATOM 4479 C CB . ALA A-4 1 86 . -13.292 -2.864 -18.659 1 16.4 ? CB ALA A-4 66 1 
ATOM 4480 N N . MET A-4 1 87 . -12.795 -3.066 -15.358 1 17.5 ? N MET A-4 67 1 
ATOM 4481 C CA . MET A-4 1 87 . -12.182 -3.835 -14.277 1 18.4 ? CA MET A-4 67 1 
ATOM 4482 C C . MET A-4 1 87 . -13.235 -4.519 -13.427 1 18.15 ? C MET A-4 67 1 
ATOM 4483 O O . MET A-4 1 87 . -13.099 -5.695 -13.095 1 18.63 ? O MET A-4 67 1 
ATOM 4484 C CB . MET A-4 1 87 . -11.268 -2.969 -13.41 1 18.33 ? CB MET A-4 67 1 
ATOM 4485 C CG . MET A-4 1 87 . -10.105 -2.369 -14.171 1 19.02 ? CG MET A-4 67 1 
ATOM 4486 S SD . MET A-4 1 87 . -10.539 -0.836 -14.998 1 19.97 ? SD MET A-4 67 1 
ATOM 4487 C CE . MET A-4 1 87 . -10.467 0.263 -13.586 1 18.94 ? CE MET A-4 67 1 
ATOM 4488 N N . VAL A-4 1 88 . -14.283 -3.777 -13.082 1 18.83 ? N VAL A-4 68 1 
ATOM 4489 C CA . VAL A-4 1 88 . -15.382 -4.312 -12.286 1 19.55 ? CA VAL A-4 68 1 
ATOM 4490 C C . VAL A-4 1 88 . -16.055 -5.487 -12.991 1 20.71 ? C VAL A-4 68 1 
ATOM 4491 O O . VAL A-4 1 88 . -16.286 -6.533 -12.368 1 20.54 ? O VAL A-4 68 1 
ATOM 4492 C CB . VAL A-4 1 88 . -16.425 -3.225 -11.964 1 19.61 ? CB VAL A-4 68 1 
ATOM 4493 C CG1 . VAL A-4 1 88 . -17.696 -3.843 -11.397 1 19.41 ? CG1 VAL A-4 68 1 
ATOM 4494 C CG2 . VAL A-4 1 88 . -15.837 -2.192 -11.007 1 19.06 ? CG2 VAL A-4 68 1 
ATOM 4495 N N . ASP A-4 1 89 . -16.357 -5.302 -14.281 1 21.17 ? N ASP A-4 69 1 
ATOM 4496 C CA . ASP A-4 1 89 . -16.987 -6.331 -15.107 1 22.32 ? CA ASP A-4 69 1 
ATOM 4497 C C . ASP A-4 1 89 . -16.158 -7.612 -15.146 1 21.73 ? C ASP A-4 69 1 
ATOM 4498 O O . ASP A-4 1 89 . -16.695 -8.716 -14.982 1 21.9 ? O ASP A-4 69 1 
ATOM 4499 C CB . ASP A-4 1 89 . -17.217 -5.817 -16.535 1 23.24 ? CB ASP A-4 69 1 
ATOM 4500 C CG . ASP A-4 1 89 . -18.498 -5.011 -16.667 1 24.4 ? CG ASP A-4 69 1 
ATOM 4501 O OD1 . ASP A-4 1 89 . -19.607 -5.599 -16.613 1 24.83 ? OD1 ASP A-4 69 1 
ATOM 4502 O OD2 . ASP A-4 1 89 . -18.401 -3.777 -16.823 1 25.73 ? OD2 ASP A-4 69 1 
ATOM 4503 N N . ARG A-4 1 90 . -14.852 -7.45 -15.35 1 20.4 ? N ARG A-4 70 1 
ATOM 4504 C CA . ARG A-4 1 90 . -13.928 -8.571 -15.388 1 19.78 ? CA ARG A-4 70 1 
ATOM 4505 C C . ARG A-4 1 90 . -13.858 -9.295 -14.038 1 18.52 ? C ARG A-4 70 1 
ATOM 4506 O O . ARG A-4 1 90 . -13.973 -10.52 -13.995 1 18.15 ? O ARG A-4 70 1 
ATOM 4507 C CB . ARG A-4 1 90 . -12.538 -8.119 -15.862 1 20.63 ? CB ARG A-4 70 1 
ATOM 4508 C CG . ARG A-4 1 90 . -11.482 -9.216 -15.888 1 21.38 ? CG ARG A-4 70 1 
ATOM 4509 C CD . ARG A-4 1 90 . -10.099 -8.656 -16.206 1 22.58 ? CD ARG A-4 70 1 
ATOM 4510 N NE . ARG A-4 1 90 . -9.097 -9.717 -16.302 1 23.77 ? NE ARG A-4 70 1 
ATOM 4511 C CZ . ARG A-4 1 90 . -7.851 -9.574 -16.763 1 24.7 ? CZ ARG A-4 70 1 
ATOM 4512 N NH1 . ARG A-4 1 90 . -7.394 -8.391 -17.187 1 24.1 ? NH1 ARG A-4 70 1 
ATOM 4513 N NH2 . ARG A-4 1 90 . -7.054 -10.636 -16.796 1 23.65 ? NH2 ARG A-4 70 1 
ATOM 4514 N N . ARG A-4 1 91 . -13.688 -8.551 -12.945 1 17.53 ? N ARG A-4 71 1 
ATOM 4515 C CA . ARG A-4 1 91 . -13.63 -9.168 -11.632 1 16.72 ? CA ARG A-4 71 1 
ATOM 4516 C C . ARG A-4 1 91 . -14.938 -9.883 -11.324 1 17.14 ? C ARG A-4 71 1 
ATOM 4517 O O . ARG A-4 1 91 . -14.935 -11.01 -10.824 1 16.74 ? O ARG A-4 71 1 
ATOM 4518 C CB . ARG A-4 1 91 . -13.3 -8.144 -10.551 1 16.24 ? CB ARG A-4 71 1 
ATOM 4519 C CG . ARG A-4 1 91 . -13.113 -8.73 -9.158 1 16.1 ? CG ARG A-4 71 1 
ATOM 4520 C CD . ARG A-4 1 91 . -11.906 -9.662 -9.054 1 16.25 ? CD ARG A-4 71 1 
ATOM 4521 N NE . ARG A-4 1 91 . -11.66 -10.115 -7.676 1 16.08 ? NE ARG A-4 71 1 
ATOM 4522 C CZ . ARG A-4 1 91 . -10.889 -11.146 -7.323 1 16.47 ? CZ ARG A-4 71 1 
ATOM 4523 N NH1 . ARG A-4 1 91 . -10.261 -11.881 -8.237 1 16.45 ? NH1 ARG A-4 71 1 
ATOM 4524 N NH2 . ARG A-4 1 91 . -10.747 -11.449 -6.036 1 16.48 ? NH2 ARG A-4 71 1 
ATOM 4525 N N . ALA A-4 1 92 . -16.056 -9.235 -11.647 1 17.78 ? N ALA A-4 72 1 
ATOM 4526 C CA . ALA A-4 1 92 . -17.372 -9.821 -11.422 1 18.13 ? CA ALA A-4 72 1 
ATOM 4527 C C . ALA A-4 1 92 . -17.54 -11.123 -12.213 1 18.69 ? C ALA A-4 72 1 
ATOM 4528 O O . ALA A-4 1 92 . -17.955 -12.137 -11.658 1 18.36 ? O ALA A-4 72 1 
ATOM 4529 C CB . ALA A-4 1 92 . -18.466 -8.825 -11.776 1 17.69 ? CB ALA A-4 72 1 
ATOM 4530 N N . LYS A-4 1 93 . -17.197 -11.09 -13.5 1 19.88 ? N LYS A-4 73 1 
ATOM 4531 C CA . LYS A-4 1 93 . -17.299 -12.269 -14.364 1 20.32 ? CA LYS A-4 73 1 
ATOM 4532 C C . LYS A-4 1 93 . -16.535 -13.497 -13.863 1 20 ? C LYS A-4 73 1 
ATOM 4533 O O . LYS A-4 1 93 . -17.071 -14.604 -13.885 1 20.82 ? O LYS A-4 73 1 
ATOM 4534 C CB . LYS A-4 1 93 . -16.9 -11.919 -15.799 1 22.04 ? CB LYS A-4 73 1 
ATOM 4535 C CG . LYS A-4 1 93 . -18.036 -11.25 -16.561 1 24.21 ? CG LYS A-4 73 1 
ATOM 4536 C CD . LYS A-4 1 93 . -17.585 -10.635 -17.873 1 26.69 ? CD LYS A-4 73 1 
ATOM 4537 C CE . LYS A-4 1 93 . -18.723 -9.833 -18.49 1 28.37 ? CE LYS A-4 73 1 
ATOM 4538 N NZ . LYS A-4 1 93 . -18.466 -9.522 -19.92 1 30.02 ? NZ LYS A-4 73 1 
ATOM 4539 N N . GLU A-4 1 94 . -15.306 -13.315 -13.385 1 18.9 ? N GLU A-4 74 1 
ATOM 4540 C CA . GLU A-4 1 94 . -14.499 -14.471 -12.933 1 17.97 ? CA GLU A-4 74 1 
ATOM 4541 C C . GLU A-4 1 94 . -14.983 -15.087 -11.615 1 17 ? C GLU A-4 74 1 
ATOM 4542 O O . GLU A-4 1 94 . -14.722 -16.26 -11.34 1 16.98 ? O GLU A-4 74 1 
ATOM 4543 C CB . GLU A-4 1 94 . -13.009 -14.107 -12.842 1 18.21 ? CB GLU A-4 74 1 
ATOM 4544 C CG . GLU A-4 1 94 . -12.657 -13.251 -11.637 1 17.42 ? CG GLU A-4 74 1 
ATOM 4545 C CD . GLU A-4 1 94 . -11.204 -12.847 -11.59 1 17.32 ? CD GLU A-4 74 1 
ATOM 4546 O OE1 . GLU A-4 1 94 . -10.347 -13.614 -12.059 1 17.27 ? OE1 GLU A-4 74 1 
ATOM 4547 O OE2 . GLU A-4 1 94 . -10.918 -11.76 -11.047 1 17.13 ? OE2 GLU A-4 74 1 
ATOM 4548 N N . LEU A-4 1 95 . -15.677 -14.302 -10.796 1 16.3 ? N LEU A-4 75 1 
ATOM 4549 C CA . LEU A-4 1 95 . -16.194 -14.807 -9.521 1 15.89 ? CA LEU A-4 75 1 
ATOM 4550 C C . LEU A-4 1 95 . -17.66 -15.233 -9.615 1 15.82 ? C LEU A-4 75 1 
ATOM 4551 O O . LEU A-4 1 95 . -18.213 -15.795 -8.666 1 15.61 ? O LEU A-4 75 1 
ATOM 4552 C CB . LEU A-4 1 95 . -16.004 -13.762 -8.407 1 15.63 ? CB LEU A-4 75 1 
ATOM 4553 C CG . LEU A-4 1 95 . -14.556 -13.334 -8.13 1 15.53 ? CG LEU A-4 75 1 
ATOM 4554 C CD1 . LEU A-4 1 95 . -14.503 -12.212 -7.104 1 15.56 ? CD1 LEU A-4 75 1 
ATOM 4555 C CD2 . LEU A-4 1 95 . -13.712 -14.516 -7.67 1 15.59 ? CD2 LEU A-4 75 1 
ATOM 4556 N N . GLY A-4 1 96 . -18.289 -14.955 -10.757 1 15.49 ? N GLY A-4 76 1 
ATOM 4557 C CA . GLY A-4 1 96 . -19.71 -15.222 -10.925 1 15.56 ? CA GLY A-4 76 1 
ATOM 4558 C C . GLY A-4 1 96 . -20.585 -14.309 -10.074 1 15.67 ? C GLY A-4 76 1 
ATOM 4559 O O . GLY A-4 1 96 . -21.601 -14.749 -9.514 1 15.34 ? O GLY A-4 76 1 
ATOM 4560 N N . ILE A-4 1 97 . -20.179 -13.044 -9.952 1 15.16 ? N ILE A-4 77 1 
ATOM 4561 C CA . ILE A-4 1 97 . -21.087 -11.995 -9.499 1 15.1 ? CA ILE A-4 77 1 
ATOM 4562 C C . ILE A-4 1 97 . -21.961 -11.718 -10.71 1 15.34 ? C ILE A-4 77 1 
ATOM 4563 O O . ILE A-4 1 97 . -21.467 -11.237 -11.731 1 15.63 ? O ILE A-4 77 1 
ATOM 4564 C CB . ILE A-4 1 97 . -20.345 -10.72 -9.079 1 14.89 ? CB ILE A-4 77 1 
ATOM 4565 C CG1 . ILE A-4 1 97 . -19.56 -10.962 -7.783 1 14.5 ? CG1 ILE A-4 77 1 
ATOM 4566 C CG2 . ILE A-4 1 97 . -21.327 -9.564 -8.918 1 14.81 ? CG2 ILE A-4 77 1 
ATOM 4567 C CD1 . ILE A-4 1 97 . -18.462 -9.955 -7.541 1 14.32 ? CD1 ILE A-4 77 1 
ATOM 4568 N N . SER A-4 1 98 . -23.245 -12.05 -10.606 1 15.42 ? N SER A-4 78 1 
ATOM 4569 C CA . SER A-4 1 98 . -24.08 -12.216 -11.799 1 15.5 ? CA SER A-4 78 1 
ATOM 4570 C C . SER A-4 1 98 . -24.933 -11.015 -12.198 1 15.45 ? C SER A-4 78 1 
ATOM 4571 O O . SER A-4 1 98 . -25.437 -10.968 -13.334 1 15.25 ? O SER A-4 78 1 
ATOM 4572 C CB . SER A-4 1 98 . -24.962 -13.459 -11.655 1 15.58 ? CB SER A-4 78 1 
ATOM 4573 O OG . SER A-4 1 98 . -25.591 -13.494 -10.382 1 16.15 ? OG SER A-4 78 1 
ATOM 4574 N N . HIS A-4 1 99 . -25.12 -10.07 -11.274 1 15.26 ? N HIS A-4 79 1 
ATOM 4575 C CA . HIS A-4 1 99 . -25.838 -8.83 -11.576 1 15.57 ? CA HIS A-4 79 1 
ATOM 4576 C C . HIS A-4 1 99 . -24.913 -7.659 -11.313 1 16.2 ? C HIS A-4 79 1 
ATOM 4577 O O . HIS A-4 1 99 . -24.524 -7.392 -10.163 1 16.09 ? O HIS A-4 79 1 
ATOM 4578 C CB . HIS A-4 1 99 . -27.149 -8.712 -10.778 1 15.49 ? CB HIS A-4 79 1 
ATOM 4579 C CG . HIS A-4 1 99 . -28.14 -9.789 -11.096 1 15.79 ? CG HIS A-4 79 1 
ATOM 4580 N ND1 . HIS A-4 1 99 . -28.149 -11.009 -10.449 1 16.42 ? ND1 HIS A-4 79 1 
ATOM 4581 C CD2 . HIS A-4 1 99 . -29.13 -9.849 -12.019 1 15.66 ? CD2 HIS A-4 79 1 
ATOM 4582 C CE1 . HIS A-4 1 99 . -29.107 -11.768 -10.955 1 15.81 ? CE1 HIS A-4 79 1 
ATOM 4583 N NE2 . HIS A-4 1 99 . -29.719 -11.086 -11.904 1 15.36 ? NE2 HIS A-4 79 1 
ATOM 4584 N N . ILE A-4 1 100 . -24.526 -6.981 -12.389 1 16.22 ? N ILE A-4 80 1 
ATOM 4585 C CA . ILE A-4 1 100 . -23.525 -5.947 -12.263 1 16.88 ? CA ILE A-4 80 1 
ATOM 4586 C C . ILE A-4 1 100 . -24.112 -4.584 -12.587 1 17 ? C ILE A-4 80 1 
ATOM 4587 O O . ILE A-4 1 100 . -24.273 -4.223 -13.75 1 17.44 ? O ILE A-4 80 1 
ATOM 4588 C CB . ILE A-4 1 100 . -22.275 -6.25 -13.109 1 16.45 ? CB ILE A-4 80 1 
ATOM 4589 C CG1 . ILE A-4 1 100 . -21.857 -7.717 -12.934 1 16.28 ? CG1 ILE A-4 80 1 
ATOM 4590 C CG2 . ILE A-4 1 100 . -21.138 -5.315 -12.72 1 16.62 ? CG2 ILE A-4 80 1 
ATOM 4591 C CD1 . ILE A-4 1 100 . -21.344 -8.36 -14.204 1 16.11 ? CD1 ILE A-4 80 1 
ATOM 4592 N N . ILE A-4 1 101 . -24.438 -3.833 -11.542 1 16.48 ? N ILE A-4 81 1 
ATOM 4593 C CA . ILE A-4 1 101 . -24.999 -2.513 -11.74 1 16.23 ? CA ILE A-4 81 1 
ATOM 4594 C C . ILE A-4 1 101 . -23.92 -1.478 -11.449 1 16.13 ? C ILE A-4 81 1 
ATOM 4595 O O . ILE A-4 1 101 . -23.401 -1.399 -10.328 1 15.79 ? O ILE A-4 81 1 
ATOM 4596 C CB . ILE A-4 1 101 . -26.27 -2.292 -10.9 1 16.21 ? CB ILE A-4 81 1 
ATOM 4597 C CG1 . ILE A-4 1 101 . -27.293 -3.399 -11.192 1 16.1 ? CG1 ILE A-4 81 1 
ATOM 4598 C CG2 . ILE A-4 1 101 . -26.85 -0.914 -11.188 1 15.89 ? CG2 ILE A-4 81 1 
ATOM 4599 C CD1 . ILE A-4 1 101 . -28.551 -3.338 -10.342 1 15.74 ? CD1 ILE A-4 81 1 
ATOM 4600 N N . GLN A-4 1 102 . -23.573 -0.721 -12.49 1 16.1 ? N GLN A-4 82 1 
ATOM 4601 C CA . GLN A-4 1 102 . -22.511 0.288 -12.451 1 16.51 ? CA GLN A-4 82 1 
ATOM 4602 C C . GLN A-4 1 102 . -23.074 1.638 -12.87 1 16.72 ? C GLN A-4 82 1 
ATOM 4603 O O . GLN A-4 1 102 . -24.136 1.703 -13.492 1 16.02 ? O GLN A-4 82 1 
ATOM 4604 C CB . GLN A-4 1 102 . -21.369 -0.089 -13.403 1 16.49 ? CB GLN A-4 82 1 
ATOM 4605 C CG . GLN A-4 1 102 . -20.656 -1.39 -13.074 1 16.03 ? CG GLN A-4 82 1 
ATOM 4606 C CD . GLN A-4 1 102 . -19.279 -1.492 -13.718 1 16.37 ? CD GLN A-4 82 1 
ATOM 4607 O OE1 . GLN A-4 1 102 . -18.322 -0.867 -13.265 1 16.2 ? OE1 GLN A-4 82 1 
ATOM 4608 N NE2 . GLN A-4 1 102 . -19.169 -2.31 -14.754 1 15.74 ? NE2 GLN A-4 82 1 
ATOM 4609 N N . GLY A-4 1 103 . -22.354 2.712 -12.544 1 16.7 ? N GLY A-4 83 1 
ATOM 4610 C CA . GLY A-4 1 103 . -22.817 4.058 -12.847 1 16.68 ? CA GLY A-4 83 1 
ATOM 4611 C C . GLY A-4 1 103 . -24.108 4.382 -12.111 1 17.66 ? C GLY A-4 83 1 
ATOM 4612 O O . GLY A-4 1 103 . -24.918 5.186 -12.588 1 17.17 ? O GLY A-4 83 1 
ATOM 4613 N N . GLN A-4 1 104 . -24.3 3.745 -10.953 1 17.8 ? N GLN A-4 84 1 
ATOM 4614 C CA . GLN A-4 1 104 . -25.503 3.919 -10.148 1 18.62 ? CA GLN A-4 84 1 
ATOM 4615 C C . GLN A-4 1 104 . -25.158 4.166 -8.682 1 18.69 ? C GLN A-4 84 1 
ATOM 4616 O O . GLN A-4 1 104 . -24.662 3.263 -7.993 1 18.14 ? O GLN A-4 84 1 
ATOM 4617 C CB . GLN A-4 1 104 . -26.407 2.684 -10.286 1 19.67 ? CB GLN A-4 84 1 
ATOM 4618 C CG . GLN A-4 1 104 . -27.618 2.631 -9.355 1 20.38 ? CG GLN A-4 84 1 
ATOM 4619 C CD . GLN A-4 1 104 . -28.608 3.763 -9.592 1 20.97 ? CD GLN A-4 84 1 
ATOM 4620 O OE1 . GLN A-4 1 104 . -28.373 4.913 -9.198 1 20.68 ? OE1 GLN A-4 84 1 
ATOM 4621 N NE2 . GLN A-4 1 104 . -29.73 3.439 -10.235 1 20.37 ? NE2 GLN A-4 84 1 
ATOM 4622 N N . ASP A-4 1 105 . -25.43 5.383 -8.213 1 19.17 ? N ASP A-4 85 1 
ATOM 4623 C CA . ASP A-4 1 105 . -25.208 5.748 -6.809 1 19.67 ? CA ASP A-4 85 1 
ATOM 4624 C C . ASP A-4 1 105 . -26.461 5.621 -5.925 1 19.34 ? C ASP A-4 85 1 
ATOM 4625 O O . ASP A-4 1 105 . -26.352 5.597 -4.702 1 19.07 ? O ASP A-4 85 1 
ATOM 4626 C CB . ASP A-4 1 105 . -24.583 7.153 -6.689 1 21.59 ? CB ASP A-4 85 1 
ATOM 4627 C CG . ASP A-4 1 105 . -23.055 7.113 -6.501 1 23.09 ? CG ASP A-4 85 1 
ATOM 4628 O OD1 . ASP A-4 1 105 . -22.552 6.249 -5.755 1 24.65 ? OD1 ASP A-4 85 1 
ATOM 4629 O OD2 . ASP A-4 1 105 . -22.348 7.953 -7.091 1 25.05 ? OD2 ASP A-4 85 1 
ATOM 4630 N N . ASP A-4 1 106 . -27.64 5.532 -6.544 1 18.8 ? N ASP A-4 86 1 
ATOM 4631 C CA . ASP A-4 1 106 . -28.889 5.279 -5.818 1 18.66 ? CA ASP A-4 86 1 
ATOM 4632 C C . ASP A-4 1 106 . -29.004 3.78 -5.532 1 17.49 ? C ASP A-4 86 1 
ATOM 4633 O O . ASP A-4 1 106 . -29.721 3.049 -6.218 1 16.96 ? O ASP A-4 86 1 
ATOM 4634 C CB . ASP A-4 1 106 . -30.092 5.809 -6.623 1 20.16 ? CB ASP A-4 86 1 
ATOM 4635 C CG . ASP A-4 1 106 . -31.403 5.843 -5.817 1 21.4 ? CG ASP A-4 86 1 
ATOM 4636 O OD1 . ASP A-4 1 106 . -31.424 5.556 -4.591 1 22.53 ? OD1 ASP A-4 86 1 
ATOM 4637 O OD2 . ASP A-4 1 106 . -32.443 6.156 -6.437 1 22.1 ? OD2 ASP A-4 86 1 
ATOM 4638 N N . LYS A-4 1 107 . -28.273 3.343 -4.509 1 16.78 ? N LYS A-4 87 1 
ATOM 4639 C CA . LYS A-4 1 107 . -28.072 1.927 -4.214 1 16.54 ? CA LYS A-4 87 1 
ATOM 4640 C C . LYS A-4 1 107 . -29.349 1.197 -3.793 1 16.69 ? C LYS A-4 87 1 
ATOM 4641 O O . LYS A-4 1 107 . -29.607 0.103 -4.274 1 16.07 ? O LYS A-4 87 1 
ATOM 4642 C CB . LYS A-4 1 107 . -26.968 1.733 -3.149 1 16.58 ? CB LYS A-4 87 1 
ATOM 4643 C CG . LYS A-4 1 107 . -25.617 2.41 -3.442 1 15.91 ? CG LYS A-4 87 1 
ATOM 4644 C CD . LYS A-4 1 107 . -24.933 1.869 -4.688 1 15.22 ? CD LYS A-4 87 1 
ATOM 4645 C CE . LYS A-4 1 107 . -23.534 2.448 -4.879 1 14.69 ? CE LYS A-4 87 1 
ATOM 4646 N NZ . LYS A-4 1 107 . -22.499 1.741 -4.086 1 13.84 ? NZ LYS A-4 87 1 
ATOM 4647 N N . LEU A-4 1 108 . -30.139 1.793 -2.893 1 16.92 ? N LEU A-4 88 1 
ATOM 4648 C CA . LEU A-4 1 108 . -31.4 1.172 -2.447 1 16.45 ? CA LEU A-4 88 1 
ATOM 4649 C C . LEU A-4 1 108 . -32.357 0.947 -3.622 1 16.66 ? C LEU A-4 88 1 
ATOM 4650 O O . LEU A-4 1 108 . -32.931 -0.133 -3.773 1 16.6 ? O LEU A-4 88 1 
ATOM 4651 C CB . LEU A-4 1 108 . -32.081 2.025 -1.379 1 16.74 ? CB LEU A-4 88 1 
ATOM 4652 C CG . LEU A-4 1 108 . -32.752 1.358 -0.161 1 17.27 ? CG LEU A-4 88 1 
ATOM 4653 C CD1 . LEU A-4 1 108 . -33.85 2.257 0.405 1 16.93 ? CD1 LEU A-4 88 1 
ATOM 4654 C CD2 . LEU A-4 1 108 . -33.289 -0.024 -0.462 1 17.03 ? CD2 LEU A-4 88 1 
ATOM 4655 N N . THR A-4 1 109 . -32.518 1.965 -4.462 1 16.29 ? N THR A-4 89 1 
ATOM 4656 C CA . THR A-4 1 109 . -33.372 1.836 -5.635 1 16.15 ? CA THR A-4 89 1 
ATOM 4657 C C . THR A-4 1 109 . -32.889 0.667 -6.467 1 15.69 ? C THR A-4 89 1 
ATOM 4658 O O . THR A-4 1 109 . -33.684 -0.187 -6.84 1 14.92 ? O THR A-4 89 1 
ATOM 4659 C CB . THR A-4 1 109 . -33.378 3.114 -6.486 1 16.43 ? CB THR A-4 89 1 
ATOM 4660 O OG1 . THR A-4 1 109 . -33.931 4.186 -5.716 1 16.78 ? OG1 THR A-4 89 1 
ATOM 4661 C CG2 . THR A-4 1 109 . -34.202 2.924 -7.778 1 16.59 ? CG2 THR A-4 89 1 
ATOM 4662 N N . ALA A-4 1 110 . -31.583 0.62 -6.73 1 15.88 ? N ALA A-4 90 1 
ATOM 4663 C CA . ALA A-4 1 110 . -31.006 -0.467 -7.522 1 16.26 ? CA ALA A-4 90 1 
ATOM 4664 C C . ALA A-4 1 110 . -31.244 -1.845 -6.866 1 16.62 ? C ALA A-4 90 1 
ATOM 4665 O O . ALA A-4 1 110 . -31.618 -2.809 -7.542 1 16.81 ? O ALA A-4 90 1 
ATOM 4666 C CB . ALA A-4 1 110 . -29.528 -0.218 -7.763 1 16.71 ? CB ALA A-4 90 1 
ATOM 4667 N N . LEU A-4 1 111 . -31.07 -1.912 -5.547 1 16.29 ? N LEU A-4 91 1 
ATOM 4668 C CA . LEU A-4 1 111 . -31.301 -3.138 -4.798 1 16.4 ? CA LEU A-4 91 1 
ATOM 4669 C C . LEU A-4 1 111 . -32.763 -3.592 -4.913 1 17.38 ? C LEU A-4 91 1 
ATOM 4670 O O . LEU A-4 1 111 . -33.046 -4.731 -5.318 1 17.67 ? O LEU A-4 91 1 
ATOM 4671 C CB . LEU A-4 1 111 . -30.869 -2.951 -3.345 1 15.98 ? CB LEU A-4 91 1 
ATOM 4672 C CG . LEU A-4 1 111 . -30.938 -4.13 -2.368 1 15.93 ? CG LEU A-4 91 1 
ATOM 4673 C CD1 . LEU A-4 1 111 . -30.199 -5.357 -2.887 1 15.96 ? CD1 LEU A-4 91 1 
ATOM 4674 C CD2 . LEU A-4 1 111 . -30.395 -3.715 -1.015 1 15.67 ? CD2 LEU A-4 91 1 
ATOM 4675 N N . VAL A-4 1 112 . -33.681 -2.683 -4.588 1 17.31 ? N VAL A-4 92 1 
ATOM 4676 C CA . VAL A-4 1 112 . -35.115 -2.909 -4.753 1 17.06 ? CA VAL A-4 92 1 
ATOM 4677 C C . VAL A-4 1 112 . -35.471 -3.406 -6.173 1 17.59 ? C VAL A-4 92 1 
ATOM 4678 O O . VAL A-4 1 112 . -36.262 -4.33 -6.324 1 18.66 ? O VAL A-4 92 1 
ATOM 4679 C CB . VAL A-4 1 112 . -35.912 -1.639 -4.353 1 16.66 ? CB VAL A-4 92 1 
ATOM 4680 C CG1 . VAL A-4 1 112 . -37.349 -1.689 -4.853 1 16.45 ? CG1 VAL A-4 92 1 
ATOM 4681 C CG2 . VAL A-4 1 112 . -35.884 -1.456 -2.839 1 16.28 ? CG2 VAL A-4 92 1 
ATOM 4682 N N . GLY A-4 1 113 . -34.887 -2.797 -7.203 1 17.61 ? N GLY A-4 93 1 
ATOM 4683 C CA . GLY A-4 1 113 . -35.058 -3.247 -8.586 1 17.97 ? CA GLY A-4 93 1 
ATOM 4684 C C . GLY A-4 1 113 . -34.645 -4.695 -8.793 1 18.52 ? C GLY A-4 93 1 
ATOM 4685 O O . GLY A-4 1 113 . -35.346 -5.449 -9.458 1 18.59 ? O GLY A-4 93 1 
ATOM 4686 N N . LEU A-4 1 114 . -33.507 -5.086 -8.219 1 19.3 ? N LEU A-4 94 1 
ATOM 4687 C CA . LEU A-4 1 114 . -33.053 -6.477 -8.254 1 20.52 ? CA LEU A-4 94 1 
ATOM 4688 C C . LEU A-4 1 114 . -34.012 -7.423 -7.531 1 20.68 ? C LEU A-4 94 1 
ATOM 4689 O O . LEU A-4 1 114 . -34.277 -8.535 -7.987 1 20.38 ? O LEU A-4 94 1 
ATOM 4690 C CB . LEU A-4 1 114 . -31.656 -6.605 -7.631 1 21.02 ? CB LEU A-4 94 1 
ATOM 4691 C CG . LEU A-4 1 114 . -30.444 -6.44 -8.545 1 21.73 ? CG LEU A-4 94 1 
ATOM 4692 C CD1 . LEU A-4 1 114 . -29.188 -6.717 -7.743 1 21.48 ? CD1 LEU A-4 94 1 
ATOM 4693 C CD2 . LEU A-4 1 114 . -30.515 -7.336 -9.78 1 21.35 ? CD2 LEU A-4 94 1 
ATOM 4694 N N . THR A-4 1 115 . -34.517 -6.952 -6.399 1 22.1 ? N THR A-4 95 1 
ATOM 4695 C CA . THR A-4 1 115 . -35.433 -7.69 -5.554 1 23.61 ? CA THR A-4 95 1 
ATOM 4696 C C . THR A-4 1 115 . -36.682 -8.055 -6.36 1 24.5 ? C THR A-4 95 1 
ATOM 4697 O O . THR A-4 1 115 . -37.218 -9.157 -6.243 1 25.41 ? O THR A-4 95 1 
ATOM 4698 C CB . THR A-4 1 115 . -35.744 -6.843 -4.3 1 24.5 ? CB THR A-4 95 1 
ATOM 4699 O OG1 . THR A-4 1 115 . -35.521 -7.616 -3.117 1 27.66 ? OG1 THR A-4 95 1 
ATOM 4700 C CG2 . THR A-4 1 115 . -37.144 -6.277 -4.308 1 23.73 ? CG2 THR A-4 95 1 
ATOM 4701 N N . LYS A-4 1 116 . -37.098 -7.133 -7.22 1 25.75 ? N LYS A-4 96 1 
ATOM 4702 C CA . LYS A-4 1 116 . -38.261 -7.31 -8.07 1 26.71 ? CA LYS A-4 96 1 
ATOM 4703 C C . LYS A-4 1 116 . -38.021 -8.268 -9.236 1 26.25 ? C LYS A-4 96 1 
ATOM 4704 O O . LYS A-4 1 116 . -38.904 -9.047 -9.574 1 26.25 ? O LYS A-4 96 1 
ATOM 4705 C CB . LYS A-4 1 116 . -38.753 -5.953 -8.59 1 27.77 ? CB LYS A-4 96 1 
ATOM 4706 C CG . LYS A-4 1 116 . -39.338 -5.052 -7.513 1 29.03 ? CG LYS A-4 96 1 
ATOM 4707 C CD . LYS A-4 1 116 . -39.857 -3.766 -8.13 1 31.43 ? CD LYS A-4 96 1 
ATOM 4708 C CE . LYS A-4 1 116 . -40.32 -2.78 -7.069 1 34.11 ? CE LYS A-4 96 1 
ATOM 4709 N NZ . LYS A-4 1 116 . -40.782 -1.505 -7.693 1 35.29 ? NZ LYS A-4 96 1 
ATOM 4710 N N . LYS A-4 1 117 . -36.844 -8.225 -9.855 1 26.62 ? N LYS A-4 97 1 
ATOM 4711 C CA . LYS A-4 1 117 . -36.612 -9.096 -11.013 1 27.8 ? CA LYS A-4 97 1 
ATOM 4712 C C . LYS A-4 1 117 . -36.227 -10.538 -10.641 1 27.53 ? C LYS A-4 97 1 
ATOM 4713 O O . LYS A-4 1 117 . -36.21 -11.435 -11.497 1 26.52 ? O LYS A-4 97 1 
ATOM 4714 C CB . LYS A-4 1 117 . -35.653 -8.451 -12.031 1 29.12 ? CB LYS A-4 97 1 
ATOM 4715 C CG . LYS A-4 1 117 . -34.179 -8.757 -11.871 1 30.7 ? CG LYS A-4 97 1 
ATOM 4716 C CD . LYS A-4 1 117 . -33.402 -8.14 -13.027 1 32.61 ? CD LYS A-4 97 1 
ATOM 4717 C CE . LYS A-4 1 117 . -32.133 -8.928 -13.319 1 33.52 ? CE LYS A-4 97 1 
ATOM 4718 N NZ . LYS A-4 1 117 . -31.434 -8.484 -14.558 1 34.78 ? NZ LYS A-4 97 1 
ATOM 4719 N N . LEU A-4 1 118 . -35.929 -10.751 -9.359 1 27.51 ? N LEU A-4 98 1 
ATOM 4720 C CA . LEU A-4 1 118 . -35.598 -12.076 -8.863 1 27.89 ? CA LEU A-4 98 1 
ATOM 4721 C C . LEU A-4 1 118 . -36.71 -12.659 -8.009 1 28.46 ? C LEU A-4 98 1 
ATOM 4722 O O . LEU A-4 1 118 . -36.679 -13.843 -7.688 1 28.14 ? O LEU A-4 98 1 
ATOM 4723 C CB . LEU A-4 1 118 . -34.29 -12.064 -8.063 1 27.73 ? CB LEU A-4 98 1 
ATOM 4724 C CG . LEU A-4 1 118 . -33.026 -11.491 -8.705 1 28.2 ? CG LEU A-4 98 1 
ATOM 4725 C CD1 . LEU A-4 1 118 . -31.842 -11.663 -7.771 1 28.06 ? CD1 LEU A-4 98 1 
ATOM 4726 C CD2 . LEU A-4 1 118 . -32.731 -12.122 -10.054 1 28.69 ? CD2 LEU A-4 98 1 
ATOM 4727 N N . GLY A-4 1 119 . -37.681 -11.827 -7.637 1 29.03 ? N GLY A-4 99 1 
ATOM 4728 C CA . GLY A-4 1 119 . -38.778 -12.264 -6.778 1 30.77 ? CA GLY A-4 99 1 
ATOM 4729 C C . GLY A-4 1 119 . -38.276 -12.543 -5.373 1 32.8 ? C GLY A-4 99 1 
ATOM 4730 O O . GLY A-4 1 119 . -38.424 -13.648 -4.853 1 34.03 ? O GLY A-4 99 1 
ATOM 4731 N N . ILE A-4 1 120 . -37.693 -11.518 -4.761 1 32.92 ? N ILE A-4 100 1 
ATOM 4732 C CA . ILE A-4 1 120 . -36.98 -11.644 -3.5 1 31.96 ? CA ILE A-4 100 1 
ATOM 4733 C C . ILE A-4 1 120 . -37.312 -10.425 -2.642 1 31.43 ? C ILE A-4 100 1 
ATOM 4734 O O . ILE A-4 1 120 . -37.532 -9.34 -3.165 1 31.3 ? O ILE A-4 100 1 
ATOM 4735 C CB . ILE A-4 1 120 . -35.461 -11.806 -3.784 1 32.3 ? CB ILE A-4 100 1 
ATOM 4736 C CG1 . ILE A-4 1 120 . -35.101 -13.29 -3.8 1 32.81 ? CG1 ILE A-4 100 1 
ATOM 4737 C CG2 . ILE A-4 1 120 . -34.582 -11.071 -2.786 1 33.71 ? CG2 ILE A-4 100 1 
ATOM 4738 C CD1 . ILE A-4 1 120 . -33.907 -13.625 -4.665 1 34 ? CD1 ILE A-4 100 1 
ATOM 4739 N N . GLU A-4 1 121 . -37.379 -10.61 -1.331 1 30.37 ? N GLU A-4 101 1 
ATOM 4740 C CA . GLU A-4 1 121 . -37.623 -9.492 -0.44 1 30.68 ? CA GLU A-4 101 1 
ATOM 4741 C C . GLU A-4 1 121 . -36.306 -8.87 -0.008 1 28.71 ? C GLU A-4 101 1 
ATOM 4742 O O . GLU A-4 1 121 . -35.28 -9.545 0.02 1 27.7 ? O GLU A-4 101 1 
ATOM 4743 C CB . GLU A-4 1 121 . -38.405 -9.944 0.793 1 33.65 ? CB GLU A-4 101 1 
ATOM 4744 C CG . GLU A-4 1 121 . -39.748 -10.599 0.513 1 36.59 ? CG GLU A-4 101 1 
ATOM 4745 C CD . GLU A-4 1 121 . -40.252 -11.378 1.712 1 40.07 ? CD GLU A-4 101 1 
ATOM 4746 O OE1 . GLU A-4 1 121 . -40.321 -10.791 2.822 1 41.68 ? OE1 GLU A-4 101 1 
ATOM 4747 O OE2 . GLU A-4 1 121 . -40.57 -12.579 1.553 1 41.16 ? OE2 GLU A-4 101 1 
ATOM 4748 N N . LEU A-4 1 122 . -36.357 -7.58 0.33 1 28.09 ? N LEU A-4 102 1 
ATOM 4749 C CA . LEU A-4 1 122 . -35.233 -6.859 0.945 1 26.46 ? CA LEU A-4 102 1 
ATOM 4750 C C . LEU A-4 1 122 . -34.66 -7.529 2.19 1 25.23 ? C LEU A-4 102 1 
ATOM 4751 O O . LEU A-4 1 122 . -33.442 -7.521 2.404 1 24.02 ? O LEU A-4 102 1 
ATOM 4752 C CB . LEU A-4 1 122 . -35.643 -5.43 1.313 1 25.91 ? CB LEU A-4 102 1 
ATOM 4753 C CG . LEU A-4 1 122 . -35.182 -4.292 0.41 1 26.5 ? CG LEU A-4 102 1 
ATOM 4754 C CD1 . LEU A-4 1 122 . -35.472 -2.957 1.087 1 26.35 ? CD1 LEU A-4 102 1 
ATOM 4755 C CD2 . LEU A-4 1 122 . -33.701 -4.405 0.069 1 25.16 ? CD2 LEU A-4 102 1 
ATOM 4756 N N . SER A-4 1 123 . -35.546 -8.077 3.022 1 24.71 ? N SER A-4 103 1 
ATOM 4757 C CA . SER A-4 1 123 . -35.136 -8.813 4.212 1 24.28 ? CA SER A-4 103 1 
ATOM 4758 C C . SER A-4 1 123 . -34.23 -9.991 3.846 1 23.75 ? C SER A-4 103 1 
ATOM 4759 O O . SER A-4 1 123 . -33.441 -10.453 4.67 1 23.83 ? O SER A-4 103 1 
ATOM 4760 C CB . SER A-4 1 123 . -36.358 -9.283 5.005 1 25.39 ? CB SER A-4 103 1 
ATOM 4761 O OG . SER A-4 1 123 . -37.298 -9.949 4.171 1 25.63 ? OG SER A-4 103 1 
ATOM 4762 N N . HIS A-4 1 124 . -34.329 -10.448 2.599 1 23.78 ? N HIS A-4 104 1 
ATOM 4763 C CA . HIS A-4 1 124 . -33.468 -11.518 2.091 1 23.95 ? CA HIS A-4 104 1 
ATOM 4764 C C . HIS A-4 1 124 . -32.225 -11.011 1.346 1 22.23 ? C HIS A-4 104 1 
ATOM 4765 O O . HIS A-4 1 124 . -31.482 -11.799 0.754 1 20.57 ? O HIS A-4 104 1 
ATOM 4766 C CB . HIS A-4 1 124 . -34.274 -12.493 1.219 1 26.83 ? CB HIS A-4 104 1 
ATOM 4767 C CG . HIS A-4 1 124 . -35.392 -13.17 1.957 1 30.15 ? CG HIS A-4 104 1 
ATOM 4768 N ND1 . HIS A-4 1 124 . -36.595 -13.488 1.361 1 31.63 ? ND1 HIS A-4 104 1 
ATOM 4769 C CD2 . HIS A-4 1 124 . -35.499 -13.555 3.253 1 30.02 ? CD2 HIS A-4 104 1 
ATOM 4770 C CE1 . HIS A-4 1 124 . -37.383 -14.06 2.255 1 33.55 ? CE1 HIS A-4 104 1 
ATOM 4771 N NE2 . HIS A-4 1 124 . -36.742 -14.112 3.41 1 32.09 ? NE2 HIS A-4 104 1 
ATOM 4772 N N . CYS A-4 1 125 . -32.015 -9.696 1.377 1 20.24 ? N CYS A-4 105 1 
ATOM 4773 C CA . CYS A-4 1 125 . -30.827 -9.095 0.789 1 19.06 ? CA CYS A-4 105 1 
ATOM 4774 C C . CYS A-4 1 125 . -29.829 -8.681 1.859 1 17.46 ? C CYS A-4 105 1 
ATOM 4775 O O . CYS A-4 1 125 . -30.201 -8.116 2.888 1 17.08 ? O CYS A-4 105 1 
ATOM 4776 C CB . CYS A-4 1 125 . -31.198 -7.895 -0.071 1 19.1 ? CB CYS A-4 105 1 
ATOM 4777 S SG . CYS A-4 1 125 . -32.2 -8.356 -1.494 1 21.6 ? SG CYS A-4 105 1 
ATOM 4778 N N . ALA A-4 1 126 . -28.563 -8.993 1.613 1 16.01 ? N ALA A-4 106 1 
ATOM 4779 C CA . ALA A-4 1 126 . -27.48 -8.46 2.414 1 15.1 ? CA ALA A-4 106 1 
ATOM 4780 C C . ALA A-4 1 126 . -26.792 -7.417 1.55 1 14.64 ? C ALA A-4 106 1 
ATOM 4781 O O . ALA A-4 1 126 . -26.674 -7.591 0.328 1 13.74 ? O ALA A-4 106 1 
ATOM 4782 C CB . ALA A-4 1 126 . -26.516 -9.56 2.83 1 14.83 ? CB ALA A-4 106 1 
ATOM 4783 N N . TYR A-4 1 127 . -26.363 -6.323 2.175 1 14.19 ? N TYR A-4 107 1 
ATOM 4784 C CA . TYR A-4 1 127 . -25.669 -5.258 1.448 1 14.08 ? CA TYR A-4 107 1 
ATOM 4785 C C . TYR A-4 1 127 . -24.518 -4.696 2.271 1 14.03 ? C TYR A-4 107 1 
ATOM 4786 O O . TYR A-4 1 127 . -24.654 -4.467 3.482 1 13.38 ? O TYR A-4 107 1 
ATOM 4787 C CB . TYR A-4 1 127 . -26.631 -4.12 1.017 1 13.7 ? CB TYR A-4 107 1 
ATOM 4788 C CG . TYR A-4 1 127 . -25.966 -3.076 0.118 1 13.33 ? CG TYR A-4 107 1 
ATOM 4789 C CD1 . TYR A-4 1 127 . -25.895 -3.263 -1.258 1 13.24 ? CD1 TYR A-4 107 1 
ATOM 4790 C CD2 . TYR A-4 1 127 . -25.383 -1.925 0.657 1 13.15 ? CD2 TYR A-4 107 1 
ATOM 4791 C CE1 . TYR A-4 1 127 . -25.266 -2.338 -2.079 1 13.28 ? CE1 TYR A-4 107 1 
ATOM 4792 C CE2 . TYR A-4 1 127 . -24.752 -0.996 -0.153 1 12.98 ? CE2 TYR A-4 107 1 
ATOM 4793 C CZ . TYR A-4 1 127 . -24.703 -1.203 -1.518 1 12.96 ? CZ TYR A-4 107 1 
ATOM 4794 O OH . TYR A-4 1 127 . -24.069 -0.291 -2.338 1 12.95 ? OH TYR A-4 107 1 
ATOM 4795 N N . ILE A-4 1 128 . -23.405 -4.459 1.578 1 13.62 ? N ILE A-4 108 1 
ATOM 4796 C CA . ILE A-4 1 128 . -22.213 -3.874 2.168 1 13.4 ? CA ILE A-4 108 1 
ATOM 4797 C C . ILE A-4 1 128 . -21.719 -2.646 1.386 1 13.46 ? C ILE A-4 108 1 
ATOM 4798 O O . ILE A-4 1 128 . -21.561 -2.682 0.148 1 12.85 ? O ILE A-4 108 1 
ATOM 4799 C CB . ILE A-4 1 128 . -21.088 -4.924 2.318 1 13.2 ? CB ILE A-4 108 1 
ATOM 4800 C CG1 . ILE A-4 1 128 . -19.855 -4.302 2.988 1 13.18 ? CG1 ILE A-4 108 1 
ATOM 4801 C CG2 . ILE A-4 1 128 . -20.753 -5.552 0.963 1 12.96 ? CG2 ILE A-4 108 1 
ATOM 4802 C CD1 . ILE A-4 1 128 . -18.843 -5.315 3.499 1 13.27 ? CD1 ILE A-4 108 1 
ATOM 4803 N N . GLY A-4 1 129 . -21.475 -1.566 2.131 1 13.43 ? N GLY A-4 109 1 
ATOM 4804 C CA . GLY A-4 1 129 . -20.99 -0.307 1.555 1 13.68 ? CA GLY A-4 109 1 
ATOM 4805 C C . GLY A-4 1 129 . -20.199 0.517 2.551 1 13.92 ? C GLY A-4 109 1 
ATOM 4806 O O . GLY A-4 1 129 . -20.332 0.34 3.776 1 13.7 ? O GLY A-4 109 1 
ATOM 4807 N N . ASP A-4 1 130 . -19.389 1.432 2.028 1 14.3 ? N ASP A-4 110 1 
ATOM 4808 C CA . ASP A-4 1 130 . -18.475 2.229 2.854 1 15.09 ? CA ASP A-4 110 1 
ATOM 4809 C C . ASP A-4 1 130 . -18.862 3.706 3.028 1 15.55 ? C ASP A-4 110 1 
ATOM 4810 O O . ASP A-4 1 130 . -18.336 4.365 3.923 1 16.37 ? O ASP A-4 110 1 
ATOM 4811 C CB . ASP A-4 1 130 . -17.042 2.152 2.304 1 14.94 ? CB ASP A-4 110 1 
ATOM 4812 C CG . ASP A-4 1 130 . -16.884 2.908 0.979 1 15.16 ? CG ASP A-4 110 1 
ATOM 4813 O OD1 . ASP A-4 1 130 . -17.685 2.648 0.05 1 14.79 ? OD1 ASP A-4 110 1 
ATOM 4814 O OD2 . ASP A-4 1 130 . -15.978 3.768 0.876 1 14.6 ? OD2 ASP A-4 110 1 
ATOM 4815 N N . ASP A-4 1 131 . -19.748 4.239 2.186 1 15.6 ? N ASP A-4 111 1 
ATOM 4816 C CA . ASP A-4 1 131 . -19.958 5.693 2.154 1 15.57 ? CA ASP A-4 111 1 
ATOM 4817 C C . ASP A-4 1 131 . -21.437 6.107 2.088 1 15.87 ? C ASP A-4 111 1 
ATOM 4818 O O . ASP A-4 1 131 . -22.341 5.282 2.231 1 16.4 ? O ASP A-4 111 1 
ATOM 4819 C CB . ASP A-4 1 131 . -19.148 6.335 1.001 1 15.26 ? CB ASP A-4 111 1 
ATOM 4820 C CG . ASP A-4 1 131 . -18.572 7.712 1.37 1 15.54 ? CG ASP A-4 111 1 
ATOM 4821 O OD1 . ASP A-4 1 131 . -19.11 8.352 2.298 1 16.1 ? OD1 ASP A-4 111 1 
ATOM 4822 O OD2 . ASP A-4 1 131 . -17.589 8.167 0.736 1 14.83 ? OD2 ASP A-4 111 1 
ATOM 4823 N N . LEU A-4 1 132 . -21.671 7.395 1.871 1 15.47 ? N LEU A-4 112 1 
ATOM 4824 C CA . LEU A-4 1 132 . -23.021 7.956 1.922 1 15.2 ? CA LEU A-4 112 1 
ATOM 4825 C C . LEU A-4 1 132 . -24.058 7.4 0.935 1 14.69 ? C LEU A-4 112 1 
ATOM 4826 O O . LEU A-4 1 132 . -25.196 7.191 1.344 1 15.12 ? O LEU A-4 112 1 
ATOM 4827 C CB . LEU A-4 1 132 . -22.988 9.492 1.909 1 14.69 ? CB LEU A-4 112 1 
ATOM 4828 C CG . LEU A-4 1 132 . -22.326 10.083 3.162 1 14.8 ? CG LEU A-4 112 1 
ATOM 4829 C CD1 . LEU A-4 1 132 . -22.02 11.562 2.968 1 14.33 ? CD1 LEU A-4 112 1 
ATOM 4830 C CD2 . LEU A-4 1 132 . -23.119 9.828 4.447 1 14.51 ? CD2 LEU A-4 112 1 
ATOM 4831 N N . PRO A-4 1 133 . -23.691 7.159 -0.349 1 14.46 ? N PRO A-4 113 1 
ATOM 4832 C CA . PRO A-4 1 133 . -24.716 6.559 -1.233 1 14.26 ? CA PRO A-4 113 1 
ATOM 4833 C C . PRO A-4 1 133 . -25.231 5.158 -0.805 1 13.89 ? C PRO A-4 113 1 
ATOM 4834 O O . PRO A-4 1 133 . -26.297 4.724 -1.263 1 13.33 ? O PRO A-4 113 1 
ATOM 4835 C CB . PRO A-4 1 133 . -24.025 6.498 -2.6 1 14.35 ? CB PRO A-4 113 1 
ATOM 4836 C CG . PRO A-4 1 133 . -22.975 7.55 -2.54 1 14.6 ? CG PRO A-4 113 1 
ATOM 4837 C CD . PRO A-4 1 133 . -22.508 7.602 -1.113 1 14.47 ? CD PRO A-4 113 1 
ATOM 4838 N N . ASP A-4 1 134 . -24.497 4.491 0.079 1 13.25 ? N ASP A-4 114 1 
ATOM 4839 C CA . ASP A-4 1 134 . -24.821 3.131 0.497 1 13.78 ? CA ASP A-4 114 1 
ATOM 4840 C C . ASP A-4 1 134 . -25.649 3.087 1.79 1 14.4 ? C ASP A-4 114 1 
ATOM 4841 O O . ASP A-4 1 134 . -26.172 2.035 2.154 1 14.78 ? O ASP A-4 114 1 
ATOM 4842 C CB . ASP A-4 1 134 . -23.526 2.337 0.748 1 12.95 ? CB ASP A-4 114 1 
ATOM 4843 C CG . ASP A-4 1 134 . -22.586 2.333 -0.433 1 12.65 ? CG ASP A-4 114 1 
ATOM 4844 O OD1 . ASP A-4 1 134 . -22.949 1.761 -1.486 1 12.08 ? OD1 ASP A-4 114 1 
ATOM 4845 O OD2 . ASP A-4 1 134 . -21.461 2.869 -0.283 1 12.39 ? OD2 ASP A-4 114 1 
ATOM 4846 N N . LEU A-4 1 135 . -25.72 4.208 2.508 1 14.61 ? N LEU A-4 115 1 
ATOM 4847 C CA . LEU A-4 1 135 . -26.329 4.239 3.848 1 14.96 ? CA LEU A-4 115 1 
ATOM 4848 C C . LEU A-4 1 135 . -27.763 3.694 3.897 1 15.17 ? C LEU A-4 115 1 
ATOM 4849 O O . LEU A-4 1 135 . -28.073 2.834 4.729 1 15.45 ? O LEU A-4 115 1 
ATOM 4850 C CB . LEU A-4 1 135 . -26.156 5.637 4.489 1 14.67 ? CB LEU A-4 115 1 
ATOM 4851 C CG . LEU A-4 1 135 . -27.127 6.57 5.236 1 15.18 ? CG LEU A-4 115 1 
ATOM 4852 C CD1 . LEU A-4 1 135 . -28.263 5.937 6.049 1 14.6 ? CD1 LEU A-4 115 1 
ATOM 4853 C CD2 . LEU A-4 1 135 . -26.312 7.517 6.109 1 14.31 ? CD2 LEU A-4 115 1 
ATOM 4854 N N . LYS A-4 1 136 . -28.613 4.139 2.982 1 15.3 ? N LYS A-4 116 1 
ATOM 4855 C CA . LYS A-4 1 136 . -29.99 3.643 2.935 1 15.66 ? CA LYS A-4 116 1 
ATOM 4856 C C . LYS A-4 1 136 . -30.113 2.164 2.557 1 15.36 ? C LYS A-4 116 1 
ATOM 4857 O O . LYS A-4 1 136 . -30.963 1.459 3.105 1 15.32 ? O LYS A-4 116 1 
ATOM 4858 C CB . LYS A-4 1 136 . -30.864 4.519 2.033 1 16.52 ? CB LYS A-4 116 1 
ATOM 4859 C CG . LYS A-4 1 136 . -31.212 5.85 2.68 1 17.36 ? CG LYS A-4 116 1 
ATOM 4860 C CD . LYS A-4 1 136 . -32.551 6.39 2.209 1 18.69 ? CD LYS A-4 116 1 
ATOM 4861 C CE . LYS A-4 1 136 . -32.448 7.002 0.826 1 19.05 ? CE LYS A-4 116 1 
ATOM 4862 N NZ . LYS A-4 1 136 . -33.441 8.099 0.687 1 19.87 ? NZ LYS A-4 116 1 
ATOM 4863 N N . ALA A-4 1 137 . -29.278 1.693 1.627 1 14.85 ? N ALA A-4 117 1 
ATOM 4864 C CA . ALA A-4 1 137 . -29.271 0.272 1.279 1 14.38 ? CA ALA A-4 117 1 
ATOM 4865 C C . ALA A-4 1 137 . -28.779 -0.541 2.47 1 14.32 ? C ALA A-4 117 1 
ATOM 4866 O O . ALA A-4 1 137 . -29.319 -1.608 2.774 1 14.47 ? O ALA A-4 117 1 
ATOM 4867 C CB . ALA A-4 1 137 . -28.419 0.002 0.041 1 13.78 ? CB ALA A-4 117 1 
ATOM 4868 N N . VAL A-4 1 138 . -27.759 -0.025 3.146 1 14.39 ? N VAL A-4 118 1 
ATOM 4869 C CA . VAL A-4 1 138 . -27.23 -0.656 4.36 1 14.69 ? CA VAL A-4 118 1 
ATOM 4870 C C . VAL A-4 1 138 . -28.288 -0.696 5.466 1 15.44 ? C VAL A-4 118 1 
ATOM 4871 O O . VAL A-4 1 138 . -28.443 -1.706 6.162 1 15.19 ? O VAL A-4 118 1 
ATOM 4872 C CB . VAL A-4 1 138 . -25.949 0.054 4.861 1 14.37 ? CB VAL A-4 118 1 
ATOM 4873 C CG1 . VAL A-4 1 138 . -25.632 -0.328 6.312 1 13.98 ? CG1 VAL A-4 118 1 
ATOM 4874 C CG2 . VAL A-4 1 138 . -24.779 -0.268 3.948 1 13.61 ? CG2 VAL A-4 118 1 
ATOM 4875 N N . ARG A-4 1 139 . -29.012 0.408 5.618 1 16.5 ? N ARG A-4 119 1 
ATOM 4876 C CA . ARG A-4 1 139 . -30.038 0.51 6.646 1 17.7 ? CA ARG A-4 119 1 
ATOM 4877 C C . ARG A-4 1 139 . -31.212 -0.403 6.325 1 17.95 ? C ARG A-4 119 1 
ATOM 4878 O O . ARG A-4 1 139 . -31.704 -1.105 7.198 1 17.1 ? O ARG A-4 119 1 
ATOM 4879 C CB . ARG A-4 1 139 . -30.538 1.947 6.769 1 17.89 ? CB ARG A-4 119 1 
ATOM 4880 C CG . ARG A-4 1 139 . -31.607 2.147 7.837 1 18.68 ? CG ARG A-4 119 1 
ATOM 4881 C CD . ARG A-4 1 139 . -32.709 3.059 7.305 1 18.6 ? CD ARG A-4 119 1 
ATOM 4882 N NE . ARG A-4 1 139 . -32.312 4.452 7.305 1 18.82 ? NE ARG A-4 119 1 
ATOM 4883 C CZ . ARG A-4 1 139 . -32.693 5.368 6.414 1 18.93 ? CZ ARG A-4 119 1 
ATOM 4884 N NH1 . ARG A-4 1 139 . -33.49 5.051 5.395 1 18.17 ? NH1 ARG A-4 119 1 
ATOM 4885 N NH2 . ARG A-4 1 139 . -32.25 6.615 6.546 1 18.61 ? NH2 ARG A-4 119 1 
ATOM 4886 N N . GLU A-4 1 140 . -31.651 -0.392 5.068 1 18.47 ? N GLU A-4 120 1 
ATOM 4887 C CA . GLU A-4 1 140 . -32.925 -1.008 4.74 1 19.56 ? CA GLU A-4 120 1 
ATOM 4888 C C . GLU A-4 1 140 . -32.86 -2.504 4.425 1 19.69 ? C GLU A-4 120 1 
ATOM 4889 O O . GLU A-4 1 140 . -33.878 -3.192 4.533 1 19.68 ? O GLU A-4 120 1 
ATOM 4890 C CB . GLU A-4 1 140 . -33.661 -0.237 3.636 1 19.98 ? CB GLU A-4 120 1 
ATOM 4891 C CG . GLU A-4 1 140 . -34.149 1.156 4.033 1 21.37 ? CG GLU A-4 120 1 
ATOM 4892 C CD . GLU A-4 1 140 . -35.066 1.175 5.255 1 21.63 ? CD GLU A-4 120 1 
ATOM 4893 O OE1 . GLU A-4 1 140 . -35.905 0.266 5.433 1 21.14 ? OE1 GLU A-4 120 1 
ATOM 4894 O OE2 . GLU A-4 1 140 . -34.947 2.121 6.054 1 22.98 ? OE2 GLU A-4 120 1 
ATOM 4895 N N . ALA A-4 1 141 . -31.68 -3.002 4.053 1 19.33 ? N ALA A-4 121 1 
ATOM 4896 C CA . ALA A-4 1 141 . -31.515 -4.439 3.753 1 19.43 ? CA ALA A-4 121 1 
ATOM 4897 C C . ALA A-4 1 141 . -31.67 -5.301 5.001 1 19.01 ? C ALA A-4 121 1 
ATOM 4898 O O . ALA A-4 1 141 . -31.436 -4.84 6.125 1 19.32 ? O ALA A-4 121 1 
ATOM 4899 C CB . ALA A-4 1 141 . -30.166 -4.71 3.092 1 19.22 ? CB ALA A-4 121 1 
ATOM 4900 N N . GLY A-4 1 142 . -32.053 -6.557 4.806 1 18.69 ? N GLY A-4 122 1 
ATOM 4901 C CA . GLY A-4 1 142 . -32.144 -7.495 5.922 1 18.09 ? CA GLY A-4 122 1 
ATOM 4902 C C . GLY A-4 1 142 . -30.859 -7.57 6.73 1 17.68 ? C GLY A-4 122 1 
ATOM 4903 O O . GLY A-4 1 142 . -30.886 -7.61 7.961 1 17.79 ? O GLY A-4 122 1 
ATOM 4904 N N . PHE A-4 1 143 . -29.731 -7.605 6.031 1 16.62 ? N PHE A-4 123 1 
ATOM 4905 C CA . PHE A-4 1 143 . -28.431 -7.611 6.683 1 16 ? CA PHE A-4 123 1 
ATOM 4906 C C . PHE A-4 1 143 . -27.55 -6.511 6.081 1 15.84 ? C PHE A-4 123 1 
ATOM 4907 O O . PHE A-4 1 143 . -27.143 -6.59 4.918 1 15.69 ? O PHE A-4 123 1 
ATOM 4908 C CB . PHE A-4 1 143 . -27.784 -8.993 6.568 1 15.52 ? CB PHE A-4 123 1 
ATOM 4909 C CG . PHE A-4 1 143 . -26.48 -9.132 7.315 1 15.59 ? CG PHE A-4 123 1 
ATOM 4910 C CD1 . PHE A-4 1 143 . -26.273 -8.49 8.535 1 15.92 ? CD1 PHE A-4 123 1 
ATOM 4911 C CD2 . PHE A-4 1 143 . -25.472 -9.959 6.819 1 15.28 ? CD2 PHE A-4 123 1 
ATOM 4912 C CE1 . PHE A-4 1 143 . -25.077 -8.65 9.226 1 15.54 ? CE1 PHE A-4 123 1 
ATOM 4913 C CE2 . PHE A-4 1 143 . -24.279 -10.119 7.507 1 15.31 ? CE2 PHE A-4 123 1 
ATOM 4914 C CZ . PHE A-4 1 143 . -24.077 -9.456 8.704 1 15.09 ? CZ PHE A-4 123 1 
ATOM 4915 N N . GLY A-4 1 144 . -27.298 -5.469 6.871 1 15.28 ? N GLY A-4 124 1 
ATOM 4916 C CA . GLY A-4 1 144 . -26.513 -4.341 6.404 1 14.72 ? CA GLY A-4 124 1 
ATOM 4917 C C . GLY A-4 1 144 . -25.137 -4.324 7.025 1 14.31 ? C GLY A-4 124 1 
ATOM 4918 O O . GLY A-4 1 144 . -25.001 -4.42 8.257 1 14.49 ? O GLY A-4 124 1 
ATOM 4919 N N . ILE A-4 1 145 . -24.122 -4.175 6.174 1 13.68 ? N ILE A-4 125 1 
ATOM 4920 C CA . ILE A-4 1 145 . -22.731 -4.2 6.612 1 13.74 ? CA ILE A-4 125 1 
ATOM 4921 C C . ILE A-4 1 145 . -21.95 -2.959 6.16 1 13.99 ? C ILE A-4 125 1 
ATOM 4922 O O . ILE A-4 1 145 . -22.124 -2.477 5.031 1 12.96 ? O ILE A-4 125 1 
ATOM 4923 C CB . ILE A-4 1 145 . -21.974 -5.46 6.104 1 13.67 ? CB ILE A-4 125 1 
ATOM 4924 C CG1 . ILE A-4 1 145 . -22.781 -6.752 6.305 1 13.88 ? CG1 ILE A-4 125 1 
ATOM 4925 C CG2 . ILE A-4 1 145 . -20.638 -5.605 6.805 1 13.68 ? CG2 ILE A-4 125 1 
ATOM 4926 C CD1 . ILE A-4 1 145 . -23.506 -7.247 5.068 1 13.51 ? CD1 ILE A-4 125 1 
ATOM 4927 N N . SER A-4 1 146 . -21.089 -2.454 7.047 1 13.95 ? N SER A-4 126 1 
ATOM 4928 C CA . SER A-4 1 146 . -20.075 -1.491 6.637 1 15.07 ? CA SER A-4 126 1 
ATOM 4929 C C . SER A-4 1 146 . -18.682 -1.91 7.122 1 16.25 ? C SER A-4 126 1 
ATOM 4930 O O . SER A-4 1 146 . -18.49 -3.025 7.608 1 16.99 ? O SER A-4 126 1 
ATOM 4931 C CB . SER A-4 1 146 . -20.427 -0.065 7.077 1 14.58 ? CB SER A-4 126 1 
ATOM 4932 O OG . SER A-4 1 146 . -19.587 0.863 6.431 1 14.11 ? OG SER A-4 126 1 
ATOM 4933 N N . VAL A-4 1 147 . -17.711 -1.018 6.969 1 17.53 ? N VAL A-4 127 1 
ATOM 4934 C CA . VAL A-4 1 147 . -16.304 -1.356 7.193 1 17.63 ? CA VAL A-4 127 1 
ATOM 4935 C C . VAL A-4 1 147 . -15.655 -0.324 8.118 1 18.45 ? C VAL A-4 127 1 
ATOM 4936 O O . VAL A-4 1 147 . -16.219 0.759 8.315 1 18.27 ? O VAL A-4 127 1 
ATOM 4937 C CB . VAL A-4 1 147 . -15.539 -1.472 5.855 1 17.54 ? CB VAL A-4 127 1 
ATOM 4938 C CG1 . VAL A-4 1 147 . -16.005 -2.707 5.09 1 17.49 ? CG1 VAL A-4 127 1 
ATOM 4939 C CG2 . VAL A-4 1 147 . -15.692 -0.21 5.002 1 17.29 ? CG2 VAL A-4 127 1 
ATOM 4940 N N . PRO A-4 1 148 . -14.471 -0.643 8.693 1 19.28 ? N PRO A-4 128 1 
ATOM 4941 C CA . PRO A-4 1 148 . -13.898 0.279 9.683 1 19.62 ? CA PRO A-4 128 1 
ATOM 4942 C C . PRO A-4 1 148 . -13.607 1.672 9.109 1 20.72 ? C PRO A-4 128 1 
ATOM 4943 O O . PRO A-4 1 148 . -13.744 2.674 9.815 1 21.54 ? O PRO A-4 128 1 
ATOM 4944 C CB . PRO A-4 1 148 . -12.607 -0.43 10.119 1 19.59 ? CB PRO A-4 128 1 
ATOM 4945 C CG . PRO A-4 1 148 . -12.818 -1.869 9.757 1 19.39 ? CG PRO A-4 128 1 
ATOM 4946 C CD . PRO A-4 1 148 . -13.605 -1.821 8.488 1 18.9 ? CD PRO A-4 128 1 
ATOM 4947 N N . ASN A-4 1 149 . -13.241 1.744 7.835 1 21.28 ? N ASN A-4 129 1 
ATOM 4948 C CA . ASN A-4 1 149 . -13.031 3.036 7.213 1 21.65 ? CA ASN A-4 129 1 
ATOM 4949 C C . ASN A-4 1 149 . -14.266 3.572 6.484 1 20.9 ? C ASN A-4 129 1 
ATOM 4950 O O . ASN A-4 1 149 . -14.178 4.483 5.661 1 21.13 ? O ASN A-4 129 1 
ATOM 4951 C CB . ASN A-4 1 149 . -11.781 3.012 6.333 1 23.02 ? CB ASN A-4 129 1 
ATOM 4952 C CG . ASN A-4 1 149 . -10.503 2.971 7.157 1 24.49 ? CG ASN A-4 129 1 
ATOM 4953 O OD1 . ASN A-4 1 149 . -9.998 4.01 7.59 1 25.85 ? OD1 ASN A-4 129 1 
ATOM 4954 N ND2 . ASN A-4 1 149 . -9.98 1.768 7.391 1 24.95 ? ND2 ASN A-4 129 1 
ATOM 4955 N N . GLY A-4 1 150 . -15.419 3.008 6.813 1 20.04 ? N GLY A-4 130 1 
ATOM 4956 C CA . GLY A-4 1 150 . -16.688 3.526 6.321 1 18.92 ? CA GLY A-4 130 1 
ATOM 4957 C C . GLY A-4 1 150 . -16.988 4.853 6.999 1 18.3 ? C GLY A-4 130 1 
ATOM 4958 O O . GLY A-4 1 150 . -16.523 5.095 8.119 1 17.27 ? O GLY A-4 130 1 
ATOM 4959 N N . CYS A-4 1 151 . -17.749 5.719 6.321 1 17.58 ? N CYS A-4 131 1 
ATOM 4960 C CA . CYS A-4 1 151 . -18.153 6.987 6.911 1 17.7 ? CA CYS A-4 131 1 
ATOM 4961 C C . CYS A-4 1 151 . -19.051 6.674 8.097 1 18.02 ? C CYS A-4 131 1 
ATOM 4962 O O . CYS A-4 1 151 . -19.748 5.661 8.099 1 17.48 ? O CYS A-4 131 1 
ATOM 4963 C CB . CYS A-4 1 151 . -18.863 7.878 5.894 1 17.55 ? CB CYS A-4 131 1 
ATOM 4964 S SG . CYS A-4 1 151 . -20.48 7.269 5.384 1 17.89 ? SG CYS A-4 131 1 
ATOM 4965 N N . GLU A-4 1 152 . -19.007 7.53 9.108 1 18.51 ? N GLU A-4 132 1 
ATOM 4966 C CA . GLU A-4 1 152 . -19.675 7.28 10.38 1 19.81 ? CA GLU A-4 132 1 
ATOM 4967 C C . GLU A-4 1 152 . -21.165 7.02 10.222 1 19.14 ? C GLU A-4 132 1 
ATOM 4968 O O . GLU A-4 1 152 . -21.729 6.147 10.89 1 18.8 ? O GLU A-4 132 1 
ATOM 4969 C CB . GLU A-4 1 152 . -19.455 8.477 11.31 1 22.35 ? CB GLU A-4 132 1 
ATOM 4970 C CG . GLU A-4 1 152 . -19.916 8.287 12.741 1 25.22 ? CG GLU A-4 132 1 
ATOM 4971 C CD . GLU A-4 1 152 . -19.486 9.438 13.64 1 28.66 ? CD GLU A-4 132 1 
ATOM 4972 O OE1 . GLU A-4 1 152 . -18.824 10.369 13.119 1 29.4 ? OE1 GLU A-4 132 1 
ATOM 4973 O OE2 . GLU A-4 1 152 . -19.796 9.408 14.864 1 27.9 ? OE2 GLU A-4 132 1 
ATOM 4974 N N . GLN A-4 1 153 . -21.787 7.784 9.327 1 18.59 ? N GLN A-4 133 1 
ATOM 4975 C CA . GLN A-4 1 153 . -23.238 7.759 9.11 1 17.9 ? CA GLN A-4 133 1 
ATOM 4976 C C . GLN A-4 1 153 . -23.726 6.401 8.607 1 17.61 ? C GLN A-4 133 1 
ATOM 4977 O O . GLN A-4 1 153 . -24.77 5.913 9.054 1 17.1 ? O GLN A-4 133 1 
ATOM 4978 C CB . GLN A-4 1 153 . -23.655 8.864 8.132 1 17.94 ? CB GLN A-4 133 1 
ATOM 4979 C CG . GLN A-4 1 153 . -23.397 10.283 8.614 1 17.73 ? CG GLN A-4 133 1 
ATOM 4980 C CD . GLN A-4 1 153 . -21.942 10.702 8.523 1 17.56 ? CD GLN A-4 133 1 
ATOM 4981 O OE1 . GLN A-4 1 153 . -21.53 11.656 9.181 1 18.59 ? OE1 GLN A-4 133 1 
ATOM 4982 N NE2 . GLN A-4 1 153 . -21.153 9.99 7.728 1 17.33 ? NE2 GLN A-4 133 1 
ATOM 4983 N N . THR A-4 1 154 . -22.967 5.799 7.688 1 16.84 ? N THR A-4 134 1 
ATOM 4984 C CA . THR A-4 1 154 . -23.269 4.46 7.205 1 16.75 ? CA THR A-4 134 1 
ATOM 4985 C C . THR A-4 1 154 . -22.984 3.381 8.267 1 17.29 ? C THR A-4 134 1 
ATOM 4986 O O . THR A-4 1 154 . -23.73 2.404 8.387 1 16.7 ? O THR A-4 134 1 
ATOM 4987 C CB . THR A-4 1 154 . -22.502 4.142 5.918 1 16.56 ? CB THR A-4 134 1 
ATOM 4988 O OG1 . THR A-4 1 154 . -22.866 5.082 4.896 1 16.04 ? OG1 THR A-4 134 1 
ATOM 4989 C CG2 . THR A-4 1 154 . -22.838 2.735 5.441 1 16.22 ? CG2 THR A-4 134 1 
ATOM 4990 N N . ARG A-4 1 155 . -21.906 3.561 9.026 1 17.69 ? N ARG A-4 135 1 
ATOM 4991 C CA . ARG A-4 1 155 . -21.564 2.631 10.107 1 18.7 ? CA ARG A-4 135 1 
ATOM 4992 C C . ARG A-4 1 155 . -22.621 2.656 11.2 1 19.2 ? C ARG A-4 135 1 
ATOM 4993 O O . ARG A-4 1 155 . -22.955 1.611 11.768 1 19.98 ? O ARG A-4 135 1 
ATOM 4994 C CB . ARG A-4 1 155 . -20.187 2.95 10.708 1 18.16 ? CB ARG A-4 135 1 
ATOM 4995 C CG . ARG A-4 1 155 . -19.009 2.462 9.885 1 17.69 ? CG ARG A-4 135 1 
ATOM 4996 C CD . ARG A-4 1 155 . -17.694 2.669 10.622 1 18.28 ? CD ARG A-4 135 1 
ATOM 4997 N NE . ARG A-4 1 155 . -17.192 4.047 10.521 1 19.03 ? NE ARG A-4 135 1 
ATOM 4998 C CZ . ARG A-4 1 155 . -16.994 4.858 11.56 1 19.04 ? CZ ARG A-4 135 1 
ATOM 4999 N NH1 . ARG A-4 1 155 . -17.239 4.448 12.794 1 19.95 ? NH1 ARG A-4 135 1 
ATOM 5000 N NH2 . ARG A-4 1 155 . -16.537 6.081 11.373 1 19.38 ? NH2 ARG A-4 135 1 
ATOM 5001 N N . ALA A-4 1 156 . -23.151 3.851 11.47 1 19.27 ? N ALA A-4 136 1 
ATOM 5002 C CA . ALA A-4 1 156 . -24.174 4.065 12.494 1 19.11 ? CA ALA A-4 136 1 
ATOM 5003 C C . ALA A-4 1 156 . -25.428 3.235 12.242 1 19.33 ? C ALA A-4 136 1 
ATOM 5004 O O . ALA A-4 1 156 . -26.139 2.846 13.183 1 18.93 ? O ALA A-4 136 1 
ATOM 5005 C CB . ALA A-4 1 156 . -24.54 5.539 12.563 1 18.82 ? CB ALA A-4 136 1 
ATOM 5006 N N . VAL A-4 1 157 . -25.664 2.955 10.963 1 18.78 ? N VAL A-4 137 1 
ATOM 5007 C CA . VAL A-4 1 157 . -26.915 2.397 10.479 1 18.77 ? CA VAL A-4 137 1 
ATOM 5008 C C . VAL A-4 1 157 . -26.77 0.906 10.071 1 19.06 ? C VAL A-4 137 1 
ATOM 5009 O O . VAL A-4 1 157 . -27.705 0.274 9.566 1 18.69 ? O VAL A-4 137 1 
ATOM 5010 C CB . VAL A-4 1 157 . -27.442 3.334 9.353 1 18.86 ? CB VAL A-4 137 1 
ATOM 5011 C CG1 . VAL A-4 1 157 . -27.128 2.846 7.941 1 17.9 ? CG1 VAL A-4 137 1 
ATOM 5012 C CG2 . VAL A-4 1 157 . -28.895 3.713 9.575 1 18.89 ? CG2 VAL A-4 137 1 
ATOM 5013 N N . SER A-4 1 158 . -25.598 0.333 10.325 1 19.15 ? N SER A-4 138 1 
ATOM 5014 C CA . SER A-4 1 158 . -25.327 -1.018 9.869 1 19.13 ? CA SER A-4 138 1 
ATOM 5015 C C . SER A-4 1 158 . -25.6 -2.03 10.979 1 19.24 ? C SER A-4 138 1 
ATOM 5016 O O . SER A-4 1 158 . -25.64 -1.669 12.159 1 20.2 ? O SER A-4 138 1 
ATOM 5017 C CB . SER A-4 1 158 . -23.897 -1.12 9.377 1 19.43 ? CB SER A-4 138 1 
ATOM 5018 O OG . SER A-4 1 158 . -23.007 -1.081 10.468 1 20.38 ? OG SER A-4 138 1 
ATOM 5019 N N . ASP A-4 1 159 . -25.804 -3.29 10.597 1 18.68 ? N ASP A-4 139 1 
ATOM 5020 C CA . ASP A-4 1 159 . -25.994 -4.378 11.564 1 18.23 ? CA ASP A-4 139 1 
ATOM 5021 C C . ASP A-4 1 159 . -24.654 -4.927 11.996 1 18.55 ? C ASP A-4 139 1 
ATOM 5022 O O . ASP A-4 1 159 . -24.528 -5.533 13.065 1 19.79 ? O ASP A-4 139 1 
ATOM 5023 C CB . ASP A-4 1 159 . -26.802 -5.508 10.939 1 17.52 ? CB ASP A-4 139 1 
ATOM 5024 C CG . ASP A-4 1 159 . -28.174 -5.066 10.531 1 17.32 ? CG ASP A-4 139 1 
ATOM 5025 O OD1 . ASP A-4 1 159 . -28.922 -4.589 11.414 1 17.21 ? OD1 ASP A-4 139 1 
ATOM 5026 O OD2 . ASP A-4 1 159 . -28.497 -5.178 9.33 1 17.28 ? OD2 ASP A-4 139 1 
ATOM 5027 N N . TYR A-4 1 160 . -23.657 -4.738 11.147 1 17.88 ? N TYR A-4 140 1 
ATOM 5028 C CA . TYR A-4 1 160 . -22.346 -5.29 11.391 1 17.61 ? CA TYR A-4 140 1 
ATOM 5029 C C . TYR A-4 1 160 . -21.294 -4.428 10.714 1 17.45 ? C TYR A-4 140 1 
ATOM 5030 O O . TYR A-4 1 160 . -21.514 -3.895 9.621 1 17.17 ? O TYR A-4 140 1 
ATOM 5031 C CB . TYR A-4 1 160 . -22.292 -6.732 10.875 1 18.2 ? CB TYR A-4 140 1 
ATOM 5032 C CG . TYR A-4 1 160 . -20.969 -7.42 11.098 1 18.6 ? CG TYR A-4 140 1 
ATOM 5033 C CD1 . TYR A-4 1 160 . -20.541 -7.753 12.386 1 18.62 ? CD1 TYR A-4 140 1 
ATOM 5034 C CD2 . TYR A-4 1 160 . -20.143 -7.742 10.018 1 18.49 ? CD2 TYR A-4 140 1 
ATOM 5035 C CE1 . TYR A-4 1 160 . -19.319 -8.38 12.594 1 19.03 ? CE1 TYR A-4 140 1 
ATOM 5036 C CE2 . TYR A-4 1 160 . -18.922 -8.369 10.216 1 18.49 ? CE2 TYR A-4 140 1 
ATOM 5037 C CZ . TYR A-4 1 160 . -18.512 -8.686 11.501 1 18.94 ? CZ TYR A-4 140 1 
ATOM 5038 O OH . TYR A-4 1 160 . -17.298 -9.315 11.701 1 18.32 ? OH TYR A-4 140 1 
ATOM 5039 N N . ILE A-4 1 161 . -20.172 -4.268 11.404 1 17.7 ? N ILE A-4 141 1 
ATOM 5040 C CA . ILE A-4 1 161 . -18.981 -3.621 10.878 1 17.79 ? CA ILE A-4 141 1 
ATOM 5041 C C . ILE A-4 1 161 . -17.885 -4.669 10.862 1 17.15 ? C ILE A-4 141 1 
ATOM 5042 O O . ILE A-4 1 161 . -17.558 -5.252 11.901 1 16.48 ? O ILE A-4 141 1 
ATOM 5043 C CB . ILE A-4 1 161 . -18.494 -2.467 11.78 1 18.08 ? CB ILE A-4 141 1 
ATOM 5044 C CG1 . ILE A-4 1 161 . -19.595 -1.43 11.987 1 18.54 ? CG1 ILE A-4 141 1 
ATOM 5045 C CG2 . ILE A-4 1 161 . -17.253 -1.812 11.176 1 18.54 ? CG2 ILE A-4 141 1 
ATOM 5046 C CD1 . ILE A-4 1 161 . -20.191 -0.925 10.693 1 19.29 ? CD1 ILE A-4 141 1 
ATOM 5047 N N . THR A-4 1 162 . -17.305 -4.903 9.693 1 16.75 ? N THR A-4 142 1 
ATOM 5048 C CA . THR A-4 1 162 . -16.269 -5.921 9.583 1 16.91 ? CA THR A-4 142 1 
ATOM 5049 C C . THR A-4 1 162 . -15.071 -5.534 10.438 1 17.29 ? C THR A-4 142 1 
ATOM 5050 O O . THR A-4 1 162 . -14.91 -4.357 10.794 1 16.57 ? O THR A-4 142 1 
ATOM 5051 C CB . THR A-4 1 162 . -15.839 -6.119 8.123 1 16.94 ? CB THR A-4 142 1 
ATOM 5052 O OG1 . THR A-4 1 162 . -15.27 -4.905 7.625 1 16.47 ? OG1 THR A-4 142 1 
ATOM 5053 C CG2 . THR A-4 1 162 . -17.044 -6.492 7.285 1 16.74 ? CG2 THR A-4 142 1 
ATOM 5054 N N . THR A-4 1 163 . -14.263 -6.529 10.798 1 18.12 ? N THR A-4 143 1 
ATOM 5055 C CA . THR A-4 1 163 . -12.961 -6.291 11.43 1 19.09 ? CA THR A-4 143 1 
ATOM 5056 C C . THR A-4 1 163 . -11.916 -5.929 10.366 1 19.4 ? C THR A-4 143 1 
ATOM 5057 O O . THR A-4 1 163 . -11.201 -4.939 10.513 1 19.66 ? O THR A-4 143 1 
ATOM 5058 C CB . THR A-4 1 163 . -12.489 -7.518 12.234 1 19.69 ? CB THR A-4 143 1 
ATOM 5059 O OG1 . THR A-4 1 163 . -13.452 -7.811 13.257 1 21.18 ? OG1 THR A-4 143 1 
ATOM 5060 C CG2 . THR A-4 1 163 . -11.123 -7.271 12.885 1 19.48 ? CG2 THR A-4 143 1 
ATOM 5061 N N . LYS A-4 1 164 . -11.83 -6.73 9.307 1 19.26 ? N LYS A-4 144 1 
ATOM 5062 C CA . LYS A-4 1 164 . -10.915 -6.443 8.203 1 19.44 ? CA LYS A-4 144 1 
ATOM 5063 C C . LYS A-4 1 164 . -11.459 -5.297 7.368 1 18.38 ? C LYS A-4 144 1 
ATOM 5064 O O . LYS A-4 1 164 . -12.663 -5.089 7.304 1 18.28 ? O LYS A-4 144 1 
ATOM 5065 C CB . LYS A-4 1 164 . -10.685 -7.686 7.339 1 20.89 ? CB LYS A-4 144 1 
ATOM 5066 C CG . LYS A-4 1 164 . -9.859 -8.77 8.022 1 22.85 ? CG LYS A-4 144 1 
ATOM 5067 C CD . LYS A-4 1 164 . -10.263 -10.147 7.517 1 24.29 ? CD LYS A-4 144 1 
ATOM 5068 C CE . LYS A-4 1 164 . -9.651 -11.267 8.347 1 24.89 ? CE LYS A-4 144 1 
ATOM 5069 N NZ . LYS A-4 1 164 . -8.75 -12.146 7.542 1 25.78 ? NZ LYS A-4 144 1 
ATOM 5070 N N . THR A-4 1 165 . -10.561 -4.552 6.744 1 17.34 ? N THR A-4 145 1 
ATOM 5071 C CA . THR A-4 1 165 . -10.92 -3.368 5.993 1 17.01 ? CA THR A-4 145 1 
ATOM 5072 C C . THR A-4 1 165 . -11.168 -3.712 4.521 1 16.55 ? C THR A-4 145 1 
ATOM 5073 O O . THR A-4 1 165 . -10.859 -4.818 4.083 1 15.78 ? O THR A-4 145 1 
ATOM 5074 C CB . THR A-4 1 165 . -9.793 -2.336 6.07 1 17.5 ? CB THR A-4 145 1 
ATOM 5075 O OG1 . THR A-4 1 165 . -8.6 -2.91 5.523 1 18.86 ? OG1 THR A-4 145 1 
ATOM 5076 C CG2 . THR A-4 1 165 . -9.527 -1.935 7.508 1 18.1 ? CG2 THR A-4 145 1 
ATOM 5077 N N . GLY A-4 1 166 . -11.693 -2.74 3.765 1 16.04 ? N GLY A-4 146 1 
ATOM 5078 C CA . GLY A-4 1 166 . -12.052 -2.92 2.351 1 15.23 ? CA GLY A-4 146 1 
ATOM 5079 C C . GLY A-4 1 166 . -10.857 -3.223 1.478 1 14.95 ? C GLY A-4 146 1 
ATOM 5080 O O . GLY A-4 1 166 . -9.807 -2.605 1.621 1 14.38 ? O GLY A-4 146 1 
ATOM 5081 N N . GLY A-4 1 167 . -11.008 -4.194 0.587 1 14.78 ? N GLY A-4 147 1 
ATOM 5082 C CA . GLY A-4 1 167 . -9.886 -4.655 -0.237 1 16.36 ? CA GLY A-4 147 1 
ATOM 5083 C C . GLY A-4 1 167 . -8.827 -5.367 0.59 1 16.82 ? C GLY A-4 147 1 
ATOM 5084 O O . GLY A-4 1 167 . -7.701 -5.537 0.155 1 17.3 ? O GLY A-4 147 1 
ATOM 5085 N N . ASN A-4 1 168 . -9.198 -5.786 1.791 1 17.27 ? N ASN A-4 148 1 
ATOM 5086 C CA . ASN A-4 1 168 . -8.283 -6.492 2.67 1 18.24 ? CA ASN A-4 148 1 
ATOM 5087 C C . ASN A-4 1 168 . -8.976 -7.625 3.415 1 17.4 ? C ASN A-4 148 1 
ATOM 5088 O O . ASN A-4 1 168 . -8.482 -8.112 4.428 1 17.12 ? O ASN A-4 148 1 
ATOM 5089 C CB . ASN A-4 1 168 . -7.632 -5.513 3.652 1 19.85 ? CB ASN A-4 148 1 
ATOM 5090 C CG . ASN A-4 1 168 . -6.431 -4.816 3.055 1 21.28 ? CG ASN A-4 148 1 
ATOM 5091 O OD1 . ASN A-4 1 168 . -6.456 -3.607 2.802 1 22.45 ? OD1 ASN A-4 148 1 
ATOM 5092 N ND2 . ASN A-4 1 168 . -5.374 -5.585 2.796 1 22.05 ? ND2 ASN A-4 148 1 
ATOM 5093 N N . GLY A-4 1 169 . -10.131 -8.036 2.905 1 17.22 ? N GLY A-4 149 1 
ATOM 5094 C CA . GLY A-4 1 169 . -10.819 -9.204 3.448 1 16.81 ? CA GLY A-4 149 1 
ATOM 5095 C C . GLY A-4 1 169 . -12.065 -8.89 4.244 1 16.21 ? C GLY A-4 149 1 
ATOM 5096 O O . GLY A-4 1 169 . -12.573 -9.758 4.964 1 16.33 ? O GLY A-4 149 1 
ATOM 5097 N N . ALA A-4 1 170 . -12.561 -7.657 4.125 1 15.22 ? N ALA A-4 150 1 
ATOM 5098 C CA . ALA A-4 1 170 . -13.883 -7.325 4.653 1 14.62 ? CA ALA A-4 150 1 
ATOM 5099 C C . ALA A-4 1 170 . -14.947 -8.235 4.032 1 14.36 ? C ALA A-4 150 1 
ATOM 5100 O O . ALA A-4 1 170 . -15.81 -8.765 4.737 1 14.23 ? O ALA A-4 150 1 
ATOM 5101 C CB . ALA A-4 1 170 . -14.213 -5.864 4.394 1 14.39 ? CB ALA A-4 150 1 
ATOM 5102 N N . VAL A-4 1 171 . -14.871 -8.415 2.714 1 13.91 ? N VAL A-4 151 1 
ATOM 5103 C CA . VAL A-4 1 171 . -15.814 -9.264 1.978 1 13.98 ? CA VAL A-4 151 1 
ATOM 5104 C C . VAL A-4 1 171 . -15.669 -10.739 2.366 1 13.92 ? C VAL A-4 151 1 
ATOM 5105 O O . VAL A-4 1 171 . -16.651 -11.41 2.708 1 14.03 ? O VAL A-4 151 1 
ATOM 5106 C CB . VAL A-4 1 171 . -15.683 -9.068 0.45 1 13.88 ? CB VAL A-4 151 1 
ATOM 5107 C CG1 . VAL A-4 1 171 . -16.508 -10.095 -0.302 1 13.69 ? CG1 VAL A-4 151 1 
ATOM 5108 C CG2 . VAL A-4 1 171 . -16.109 -7.66 0.069 1 13.97 ? CG2 VAL A-4 151 1 
ATOM 5109 N N . ARG A-4 1 172 . -14.442 -11.242 2.324 1 14.07 ? N ARG A-4 152 1 
ATOM 5110 C CA . ARG A-4 1 172 . -14.172 -12.595 2.788 1 13.88 ? CA ARG A-4 152 1 
ATOM 5111 C C . ARG A-4 1 172 . -14.845 -12.808 4.136 1 13.89 ? C ARG A-4 152 1 
ATOM 5112 O O . ARG A-4 1 172 . -15.554 -13.787 4.325 1 13.82 ? O ARG A-4 152 1 
ATOM 5113 C CB . ARG A-4 1 172 . -12.661 -12.855 2.867 1 13.6 ? CB ARG A-4 152 1 
ATOM 5114 C CG . ARG A-4 1 172 . -12.265 -14.204 3.463 1 13.54 ? CG ARG A-4 152 1 
ATOM 5115 C CD . ARG A-4 1 172 . -12.993 -15.394 2.835 1 13.41 ? CD ARG A-4 152 1 
ATOM 5116 N NE . ARG A-4 1 172 . -12.333 -16.642 3.224 1 13.48 ? NE ARG A-4 152 1 
ATOM 5117 C CZ . ARG A-4 1 172 . -11.293 -17.168 2.571 1 13.33 ? CZ ARG A-4 152 1 
ATOM 5118 N NH1 . ARG A-4 1 172 . -10.822 -16.569 1.485 1 12.91 ? NH1 ARG A-4 152 1 
ATOM 5119 N NH2 . ARG A-4 1 172 . -10.726 -18.288 3.003 1 13.23 ? NH2 ARG A-4 152 1 
ATOM 5120 N N . GLU A-4 1 173 . -14.641 -11.864 5.052 1 14.35 ? N GLU A-4 153 1 
ATOM 5121 C CA . GLU A-4 1 173 . -15.158 -11.957 6.408 1 15 ? CA GLU A-4 153 1 
ATOM 5122 C C . GLU A-4 1 173 . -16.687 -12.076 6.454 1 15.04 ? C GLU A-4 153 1 
ATOM 5123 O O . GLU A-4 1 173 . -17.232 -12.904 7.194 1 15.05 ? O GLU A-4 153 1 
ATOM 5124 C CB . GLU A-4 1 173 . -14.685 -10.745 7.211 1 15.62 ? CB GLU A-4 153 1 
ATOM 5125 C CG . GLU A-4 1 173 . -15.11 -10.743 8.661 1 16.6 ? CG GLU A-4 153 1 
ATOM 5126 C CD . GLU A-4 1 173 . -14.571 -9.538 9.405 1 17.36 ? CD GLU A-4 153 1 
ATOM 5127 O OE1 . GLU A-4 1 173 . -13.484 -9.043 9.046 1 18.11 ? OE1 GLU A-4 153 1 
ATOM 5128 O OE2 . GLU A-4 1 173 . -15.24 -9.073 10.344 1 18 ? OE2 GLU A-4 153 1 
ATOM 5129 N N . VAL A-4 1 174 . -17.375 -11.255 5.661 1 14.75 ? N VAL A-4 154 1 
ATOM 5130 C CA . VAL A-4 1 174 . -18.835 -11.288 5.622 1 14.57 ? CA VAL A-4 154 1 
ATOM 5131 C C . VAL A-4 1 174 . -19.351 -12.56 4.932 1 14.4 ? C VAL A-4 154 1 
ATOM 5132 O O . VAL A-4 1 174 . -20.411 -13.095 5.295 1 14.56 ? O VAL A-4 154 1 
ATOM 5133 C CB . VAL A-4 1 174 . -19.447 -9.973 5.055 1 14.48 ? CB VAL A-4 154 1 
ATOM 5134 C CG1 . VAL A-4 1 174 . -18.887 -9.635 3.689 1 15.07 ? CG1 VAL A-4 154 1 
ATOM 5135 C CG2 . VAL A-4 1 174 . -20.958 -10.052 4.989 1 14.45 ? CG2 VAL A-4 154 1 
ATOM 5136 N N . CYS A-4 1 175 . -18.583 -13.073 3.975 1 14.19 ? N CYS A-4 155 1 
ATOM 5137 C CA . CYS A-4 1 175 . -18.95 -14.31 3.314 1 14.16 ? CA CYS A-4 155 1 
ATOM 5138 C C . CYS A-4 1 175 . -18.954 -15.453 4.305 1 14.11 ? C CYS A-4 155 1 
ATOM 5139 O O . CYS A-4 1 175 . -19.877 -16.272 4.348 1 13.74 ? O CYS A-4 155 1 
ATOM 5140 C CB . CYS A-4 1 175 . -17.973 -14.606 2.196 1 14.48 ? CB CYS A-4 155 1 
ATOM 5141 S SG . CYS A-4 1 175 . -18.212 -13.51 0.801 1 14.49 ? SG CYS A-4 155 1 
ATOM 5142 N N . GLU A-4 1 176 . -17.909 -15.487 5.112 1 14.1 ? N GLU A-4 156 1 
ATOM 5143 C CA . GLU A-4 1 176 . -17.771 -16.496 6.138 1 14.71 ? CA GLU A-4 156 1 
ATOM 5144 C C . GLU A-4 1 176 . -18.878 -16.396 7.166 1 14.72 ? C GLU A-4 156 1 
ATOM 5145 O O . GLU A-4 1 176 . -19.4 -17.407 7.6 1 14.97 ? O GLU A-4 156 1 
ATOM 5146 C CB . GLU A-4 1 176 . -16.402 -16.393 6.781 1 14.89 ? CB GLU A-4 156 1 
ATOM 5147 C CG . GLU A-4 1 176 . -15.311 -16.762 5.795 1 15.33 ? CG GLU A-4 156 1 
ATOM 5148 C CD . GLU A-4 1 176 . -13.971 -16.975 6.455 1 16.36 ? CD GLU A-4 156 1 
ATOM 5149 O OE1 . GLU A-4 1 176 . -13.878 -16.82 7.699 1 15.29 ? OE1 GLU A-4 156 1 
ATOM 5150 O OE2 . GLU A-4 1 176 . -13.015 -17.298 5.707 1 16.6 ? OE2 GLU A-4 156 1 
ATOM 5151 N N . LEU A-4 1 177 . -19.258 -15.169 7.499 1 14.73 ? N LEU A-4 157 1 
ATOM 5152 C CA . LEU A-4 1 177 . -20.327 -14.907 8.446 1 15.05 ? CA LEU A-4 157 1 
ATOM 5153 C C . LEU A-4 1 177 . -21.698 -15.409 7.967 1 14.6 ? C LEU A-4 157 1 
ATOM 5154 O O . LEU A-4 1 177 . -22.432 -16.058 8.716 1 13.99 ? O LEU A-4 157 1 
ATOM 5155 C CB . LEU A-4 1 177 . -20.391 -13.409 8.717 1 15.82 ? CB LEU A-4 157 1 
ATOM 5156 C CG . LEU A-4 1 177 . -20.503 -12.981 10.177 1 16.57 ? CG LEU A-4 157 1 
ATOM 5157 C CD1 . LEU A-4 1 177 . -20.231 -11.491 10.304 1 16.82 ? CD1 LEU A-4 157 1 
ATOM 5158 C CD2 . LEU A-4 1 177 . -21.872 -13.312 10.746 1 17.01 ? CD2 LEU A-4 157 1 
ATOM 5159 N N . ILE A-4 1 178 . -22.044 -15.099 6.717 1 14.9 ? N ILE A-4 158 1 
ATOM 5160 C CA . ILE A-4 1 178 . -23.299 -15.569 6.144 1 14.88 ? CA ILE A-4 158 1 
ATOM 5161 C C . ILE A-4 1 178 . -23.297 -17.1 6.055 1 14.75 ? C ILE A-4 158 1 
ATOM 5162 O O . ILE A-4 1 178 . -24.279 -17.758 6.426 1 14.37 ? O ILE A-4 158 1 
ATOM 5163 C CB . ILE A-4 1 178 . -23.595 -14.915 4.78 1 14.84 ? CB ILE A-4 158 1 
ATOM 5164 C CG1 . ILE A-4 1 178 . -23.775 -13.398 4.951 1 15.13 ? CG1 ILE A-4 158 1 
ATOM 5165 C CG2 . ILE A-4 1 178 . -24.853 -15.515 4.193 1 15.13 ? CG2 ILE A-4 158 1 
ATOM 5166 C CD1 . ILE A-4 1 178 . -23.626 -12.586 3.683 1 14.73 ? CD1 ILE A-4 158 1 
ATOM 5167 N N . LEU A-4 1 179 . -22.184 -17.663 5.596 1 14.65 ? N LEU A-4 159 1 
ATOM 5168 C CA . LEU A-4 1 179 . -22.048 -19.117 5.536 1 14.98 ? CA LEU A-4 159 1 
ATOM 5169 C C . LEU A-4 1 179 . -22.32 -19.779 6.895 1 15.03 ? C LEU A-4 159 1 
ATOM 5170 O O . LEU A-4 1 179 . -23.081 -20.746 6.955 1 14.71 ? O LEU A-4 159 1 
ATOM 5171 C CB . LEU A-4 1 179 . -20.68 -19.521 4.983 1 14.97 ? CB LEU A-4 159 1 
ATOM 5172 C CG . LEU A-4 1 179 . -20.446 -19.308 3.477 1 15.14 ? CG LEU A-4 159 1 
ATOM 5173 C CD1 . LEU A-4 1 179 . -18.979 -19.539 3.129 1 14.66 ? CD1 LEU A-4 159 1 
ATOM 5174 C CD2 . LEU A-4 1 179 . -21.337 -20.223 2.64 1 15.17 ? CD2 LEU A-4 159 1 
ATOM 5175 N N . LYS A-4 1 180 . -21.729 -19.238 7.968 1 15.33 ? N LYS A-4 160 1 
ATOM 5176 C CA . LYS A-4 1 180 . -21.885 -19.777 9.34 1 16.14 ? CA LYS A-4 160 1 
ATOM 5177 C C . LYS A-4 1 180 . -23.326 -19.664 9.848 1 16.41 ? C LYS A-4 160 1 
ATOM 5178 O O . LYS A-4 1 180 . -23.843 -20.57 10.519 1 16.11 ? O LYS A-4 160 1 
ATOM 5179 C CB . LYS A-4 1 180 . -20.957 -19.056 10.315 1 16.9 ? CB LYS A-4 160 1 
ATOM 5180 C CG . LYS A-4 1 180 . -19.491 -19.429 10.172 1 18.32 ? CG LYS A-4 160 1 
ATOM 5181 C CD . LYS A-4 1 180 . -18.591 -18.367 10.78 1 19.7 ? CD LYS A-4 160 1 
ATOM 5182 C CE . LYS A-4 1 180 . -17.174 -18.877 11 1 20.33 ? CE LYS A-4 160 1 
ATOM 5183 N NZ . LYS A-4 1 180 . -16.332 -17.828 11.65 1 21.36 ? NZ LYS A-4 160 1 
ATOM 5184 N N . ALA A-4 1 181 . -23.972 -18.549 9.512 1 16.19 ? N ALA A-4 161 1 
ATOM 5185 C CA . ALA A-4 1 181 . -25.365 -18.354 9.865 1 16.45 ? CA ALA A-4 161 1 
ATOM 5186 C C . ALA A-4 1 181 . -26.262 -19.377 9.166 1 16.61 ? C ALA A-4 161 1 
ATOM 5187 O O . ALA A-4 1 181 . -27.245 -19.826 9.739 1 16.19 ? O ALA A-4 161 1 
ATOM 5188 C CB . ALA A-4 1 181 . -25.794 -16.941 9.543 1 16.06 ? CB ALA A-4 161 1 
ATOM 5189 N N . GLN A-4 1 182 . -25.888 -19.773 7.948 1 17.15 ? N GLN A-4 162 1 
ATOM 5190 C CA . GLN A-4 1 182 . -26.686 -20.709 7.146 1 16.75 ? CA GLN A-4 162 1 
ATOM 5191 C C . GLN A-4 1 182 . -26.216 -22.18 7.254 1 17.22 ? C GLN A-4 162 1 
ATOM 5192 O O . GLN A-4 1 182 . -26.672 -23.055 6.499 1 16.43 ? O GLN A-4 162 1 
ATOM 5193 C CB . GLN A-4 1 182 . -26.759 -20.23 5.69 1 16.81 ? CB GLN A-4 162 1 
ATOM 5194 C CG . GLN A-4 1 182 . -27.201 -18.767 5.576 1 16.78 ? CG GLN A-4 162 1 
ATOM 5195 C CD . GLN A-4 1 182 . -27.676 -18.361 4.186 1 17.15 ? CD GLN A-4 162 1 
ATOM 5196 O OE1 . GLN A-4 1 182 . -27.565 -19.124 3.224 1 17.04 ? OE1 GLN A-4 162 1 
ATOM 5197 N NE2 . GLN A-4 1 182 . -28.228 -17.149 4.081 1 16.82 ? NE2 GLN A-4 162 1 
ATOM 5198 N N . ASN A-4 1 183 . -25.335 -22.44 8.222 1 17.32 ? N ASN A-4 163 1 
ATOM 5199 C CA . ASN A-4 1 183 . -24.765 -23.766 8.456 1 18.21 ? CA ASN A-4 163 1 
ATOM 5200 C C . ASN A-4 1 183 . -24.091 -24.359 7.217 1 18.33 ? C ASN A-4 163 1 
ATOM 5201 O O . ASN A-4 1 183 . -24.265 -25.548 6.926 1 18.06 ? O ASN A-4 163 1 
ATOM 5202 C CB . ASN A-4 1 183 . -25.839 -24.735 8.986 1 18.73 ? CB ASN A-4 163 1 
ATOM 5203 C CG . ASN A-4 1 183 . -26.554 -24.203 10.205 1 18.52 ? CG ASN A-4 163 1 
ATOM 5204 O OD1 . ASN A-4 1 183 . -25.956 -23.58 11.077 1 18.59 ? OD1 ASN A-4 163 1 
ATOM 5205 N ND2 . ASN A-4 1 183 . -27.848 -24.457 10.273 1 19.45 ? ND2 ASN A-4 163 1 
ATOM 5206 N N . ASN A-4 1 184 . -23.333 -23.529 6.498 1 17.61 ? N ASN A-4 164 1 
ATOM 5207 C CA . ASN A-4 1 184 . -22.663 -23.958 5.275 1 18.08 ? CA ASN A-4 164 1 
ATOM 5208 C C . ASN A-4 1 184 . -21.143 -23.794 5.303 1 17.8 ? C ASN A-4 164 1 
ATOM 5209 O O . ASN A-4 1 184 . -20.441 -24.254 4.403 1 18.16 ? O ASN A-4 164 1 
ATOM 5210 C CB . ASN A-4 1 184 . -23.275 -23.237 4.067 1 18.87 ? CB ASN A-4 164 1 
ATOM 5211 C CG . ASN A-4 1 184 . -24.699 -23.689 3.792 1 19.63 ? CG ASN A-4 164 1 
ATOM 5212 O OD1 . ASN A-4 1 184 . -24.983 -24.883 3.81 1 20.05 ? OD1 ASN A-4 164 1 
ATOM 5213 N ND2 . ASN A-4 1 184 . -25.602 -22.739 3.544 1 19.64 ? ND2 ASN A-4 164 1 
ATOM 5214 N N . PHE A-4 1 185 . -20.638 -23.168 6.359 1 17.97 ? N PHE A-4 165 1 
ATOM 5215 C CA . PHE A-4 1 185 . -19.224 -22.821 6.442 1 17.41 ? CA PHE A-4 165 1 
ATOM 5216 C C . PHE A-4 1 185 . -18.346 -24.028 6.745 1 17.35 ? C PHE A-4 165 1 
ATOM 5217 O O . PHE A-4 1 185 . -17.439 -24.346 5.96 1 16.96 ? O PHE A-4 165 1 
ATOM 5218 C CB . PHE A-4 1 185 . -18.993 -21.716 7.483 1 17.71 ? CB PHE A-4 165 1 
ATOM 5219 C CG . PHE A-4 1 185 . -17.542 -21.298 7.618 1 18.07 ? CG PHE A-4 165 1 
ATOM 5220 C CD1 . PHE A-4 1 185 . -16.902 -20.592 6.592 1 17.97 ? CD1 PHE A-4 165 1 
ATOM 5221 C CD2 . PHE A-4 1 185 . -16.809 -21.631 8.756 1 17.77 ? CD2 PHE A-4 165 1 
ATOM 5222 C CE1 . PHE A-4 1 185 . -15.566 -20.223 6.707 1 18.13 ? CE1 PHE A-4 165 1 
ATOM 5223 C CE2 . PHE A-4 1 185 . -15.475 -21.254 8.875 1 17.85 ? CE2 PHE A-4 165 1 
ATOM 5224 C CZ . PHE A-4 1 185 . -14.853 -20.552 7.85 1 17.97 ? CZ PHE A-4 165 1 
ATOM 5225 N N . ASP A-4 1 186 . -18.61 -24.687 7.882 1 17 ? N ASP A-4 166 1 
ATOM 5226 C CA . ASP A-4 1 186 . -17.828 -25.853 8.303 1 16.78 ? CA ASP A-4 166 1 
ATOM 5227 C C . ASP A-4 1 186 . -17.746 -26.92 7.215 1 16.59 ? C ASP A-4 166 1 
ATOM 5228 O O . ASP A-4 1 186 . -16.672 -27.477 6.972 1 16.65 ? O ASP A-4 166 1 
ATOM 5229 C CB . ASP A-4 1 186 . -18.354 -26.444 9.619 1 17.3 ? CB ASP A-4 166 1 
ATOM 5230 C CG . ASP A-4 1 186 . -18.063 -25.554 10.821 1 17.79 ? CG ASP A-4 166 1 
ATOM 5231 O OD1 . ASP A-4 1 186 . -17.567 -24.421 10.62 1 17.29 ? OD1 ASP A-4 166 1 
ATOM 5232 O OD2 . ASP A-4 1 186 . -18.347 -25.982 11.967 1 18.04 ? OD2 ASP A-4 166 1 
ATOM 5233 N N . ALA A-4 1 187 . -18.866 -27.189 6.548 1 16.16 ? N ALA A-4 167 1 
ATOM 5234 C CA . ALA A-4 1 187 . -18.879 -28.146 5.432 1 15.87 ? CA ALA A-4 167 1 
ATOM 5235 C C . ALA A-4 1 187 . -17.953 -27.718 4.289 1 15.59 ? C ALA A-4 167 1 
ATOM 5236 O O . ALA A-4 1 187 . -17.211 -28.539 3.743 1 15.56 ? O ALA A-4 167 1 
ATOM 5237 C CB . ALA A-4 1 187 . -20.298 -28.364 4.918 1 15.66 ? CB ALA A-4 167 1 
ATOM 5238 N N . PHE A-4 1 188 . -18.002 -26.436 3.936 1 15.68 ? N PHE A-4 168 1 
ATOM 5239 C CA . PHE A-4 1 188 . -17.147 -25.888 2.883 1 15.98 ? CA PHE A-4 168 1 
ATOM 5240 C C . PHE A-4 1 188 . -15.666 -26.082 3.239 1 16.15 ? C PHE A-4 168 1 
ATOM 5241 O O . PHE A-4 1 188 . -14.87 -26.606 2.44 1 15.8 ? O PHE A-4 168 1 
ATOM 5242 C CB . PHE A-4 1 188 . -17.48 -24.405 2.641 1 15.76 ? CB PHE A-4 168 1 
ATOM 5243 C CG . PHE A-4 1 188 . -16.596 -23.738 1.616 1 15.66 ? CG PHE A-4 168 1 
ATOM 5244 C CD1 . PHE A-4 1 188 . -16.702 -24.065 0.259 1 15.22 ? CD1 PHE A-4 168 1 
ATOM 5245 C CD2 . PHE A-4 1 188 . -15.661 -22.774 2.004 1 15.35 ? CD2 PHE A-4 168 1 
ATOM 5246 C CE1 . PHE A-4 1 188 . -15.882 -23.456 -0.691 1 15.41 ? CE1 PHE A-4 168 1 
ATOM 5247 C CE2 . PHE A-4 1 188 . -14.835 -22.168 1.054 1 15.46 ? CE2 PHE A-4 168 1 
ATOM 5248 C CZ . PHE A-4 1 188 . -14.95 -22.507 -0.294 1 14.69 ? CZ PHE A-4 168 1 
ATOM 5249 N N . ILE A-4 1 189 . -15.323 -25.67 4.454 1 16.29 ? N ILE A-4 169 1 
ATOM 5250 C CA . ILE A-4 1 189 . -13.988 -25.852 5.007 1 16.63 ? CA ILE A-4 169 1 
ATOM 5251 C C . ILE A-4 1 189 . -13.571 -27.3 4.862 1 16.7 ? C ILE A-4 169 1 
ATOM 5252 O O . ILE A-4 1 189 . -12.501 -27.581 4.337 1 16.66 ? O ILE A-4 169 1 
ATOM 5253 C CB . ILE A-4 1 189 . -13.941 -25.466 6.501 1 16.9 ? CB ILE A-4 169 1 
ATOM 5254 C CG1 . ILE A-4 1 189 . -14.099 -23.954 6.684 1 17.11 ? CG1 ILE A-4 169 1 
ATOM 5255 C CG2 . ILE A-4 1 189 . -12.668 -25.971 7.166 1 16.84 ? CG2 ILE A-4 169 1 
ATOM 5256 C CD1 . ILE A-4 1 189 . -13.479 -23.127 5.575 1 17.67 ? CD1 ILE A-4 169 1 
ATOM 5257 N N . ALA A-4 1 190 . -14.432 -28.211 5.322 1 16.88 ? N ALA A-4 170 1 
ATOM 5258 C CA . ALA A-4 1 190 . -14.154 -29.653 5.273 1 16.31 ? CA ALA A-4 170 1 
ATOM 5259 C C . ALA A-4 1 190 . -13.722 -30.167 3.895 1 16.06 ? C ALA A-4 170 1 
ATOM 5260 O O . ALA A-4 1 190 . -12.958 -31.126 3.823 1 15.46 ? O ALA A-4 170 1 
ATOM 5261 C CB . ALA A-4 1 190 . -15.339 -30.458 5.809 1 16.06 ? CB ALA A-4 170 1 
ATOM 5262 N N . THR A-4 1 191 . -14.194 -29.544 2.809 1 16.17 ? N THR A-4 171 1 
ATOM 5263 C CA . THR A-4 1 191 . -13.792 -29.987 1.454 1 15.78 ? CA THR A-4 171 1 
ATOM 5264 C C . THR A-4 1 191 . -12.31 -29.718 1.146 1 15.75 ? C THR A-4 171 1 
ATOM 5265 O O . THR A-4 1 191 . -11.78 -30.181 0.128 1 15.23 ? O THR A-4 171 1 
ATOM 5266 C CB . THR A-4 1 191 . -14.651 -29.376 0.321 1 16.3 ? CB THR A-4 171 1 
ATOM 5267 O OG1 . THR A-4 1 191 . -14.339 -27.984 0.166 1 16.33 ? OG1 THR A-4 171 1 
ATOM 5268 C CG2 . THR A-4 1 191 . -16.144 -29.567 0.584 1 16.51 ? CG2 THR A-4 171 1 
ATOM 5269 N N . PHE A-4 1 192 . -11.651 -28.977 2.037 1 15.41 ? N PHE A-4 172 1 
ATOM 5270 C CA . PHE A-4 1 192 . -10.248 -28.619 1.863 1 15.37 ? CA PHE A-4 172 1 
ATOM 5271 C C . PHE A-4 1 192 . -9.392 -29.351 2.882 1 15.83 ? C PHE A-4 172 1 
ATOM 5272 O O . PHE A-4 1 192 . -8.184 -29.126 2.96 1 16.04 ? O PHE A-4 172 1 
ATOM 5273 C CB . PHE A-4 1 192 . -10.057 -27.102 1.989 1 14.9 ? CB PHE A-4 172 1 
ATOM 5274 C CG . PHE A-4 1 192 . -10.676 -26.318 0.857 1 14.81 ? CG PHE A-4 172 1 
ATOM 5275 C CD1 . PHE A-4 1 192 . -10.03 -26.224 -0.386 1 14.76 ? CD1 PHE A-4 172 1 
ATOM 5276 C CD2 . PHE A-4 1 192 . -11.902 -25.691 1.021 1 14.46 ? CD2 PHE A-4 172 1 
ATOM 5277 C CE1 . PHE A-4 1 192 . -10.599 -25.522 -1.444 1 14.52 ? CE1 PHE A-4 172 1 
ATOM 5278 C CE2 . PHE A-4 1 192 . -12.478 -24.981 -0.029 1 15.22 ? CE2 PHE A-4 172 1 
ATOM 5279 C CZ . PHE A-4 1 192 . -11.824 -24.887 -1.263 1 14.79 ? CZ PHE A-4 172 1 
ATOM 5280 N N . GLN A-4 1 193 . -10.03 -30.214 3.671 1 15.56 ? N GLN A-4 173 1 
ATOM 5281 C CA . GLN A-4 1 193 . -9.338 -30.963 4.712 1 15.64 ? CA GLN A-4 173 1 
ATOM 5282 C C . GLN A-4 1 193 . -9.375 -32.454 4.42 1 15.47 ? C GLN A-4 173 1 
ATOM 5283 O O . GLN A-4 1 193 . -8.64 -33.2 5.044 1 15.85 ? O GLN A-4 173 1 
ATOM 5284 C CB . GLN A-4 1 193 . -9.974 -30.694 6.075 1 15.53 ? CB GLN A-4 173 1 
ATOM 5285 C CG . GLN A-4 1 193 . -9.893 -29.253 6.552 1 15.1 ? CG GLN A-4 173 1 
ATOM 5286 C CD . GLN A-4 1 193 . -10.679 -29.051 7.832 1 14.91 ? CD GLN A-4 173 1 
ATOM 5287 O OE1 . GLN A-4 1 193 . -11.781 -29.572 7.982 1 14.75 ? OE1 GLN A-4 173 1 
ATOM 5288 N NE2 . GLN A-4 1 193 . -10.113 -28.305 8.766 1 15.17 ? NE2 GLN A-4 173 1 
HETATM 5289 C C1 . KDO B 2 . . 15.041 -9.491 -6.798 1 31.31 ? C1 KDO A 1174 1 
HETATM 5290 O O1A . KDO B 2 . . 14.011 -9.395 -6.107 1 30.05 ? O1A KDO A 1174 1 
HETATM 5291 O O1B . KDO B 2 . . 15.003 -9.562 -8.047 1 30.44 ? O1B KDO A 1174 1 
HETATM 5292 C C2 . KDO B 2 . . 16.385 -9.476 -6.095 1 32.87 ? C2 KDO A 1174 1 
HETATM 5293 O O2 . KDO B 2 . . 16.205 -9.539 -4.669 1 31.42 ? O2 KDO A 1174 1 
HETATM 5294 C C3 . KDO B 2 . . 17.261 -10.665 -6.522 1 34.15 ? C3 KDO A 1174 1 
HETATM 5295 C C4 . KDO B 2 . . 18.724 -10.482 -6.088 1 35.34 ? C4 KDO A 1174 1 
HETATM 5296 O O4 . KDO B 2 . . 19.562 -11.466 -6.702 1 36.55 ? O4 KDO A 1174 1 
HETATM 5297 C C5 . KDO B 2 . . 19.26 -9.102 -6.457 1 34.96 ? C5 KDO A 1174 1 
HETATM 5298 O O5 . KDO B 2 . . 19.397 -9.021 -7.885 1 34.98 ? O5 KDO A 1174 1 
HETATM 5299 C C6 . KDO B 2 . . 18.307 -8.037 -5.899 1 34.55 ? C6 KDO A 1174 1 
HETATM 5300 O O6 . KDO B 2 . . 17.009 -8.239 -6.47 1 33.11 ? O6 KDO A 1174 1 
HETATM 5301 C C7 . KDO B 2 . . 18.773 -6.603 -6.125 1 34.2 ? C7 KDO A 1174 1 
HETATM 5302 O O7 . KDO B 2 . . 19.989 -6.396 -5.397 1 35.76 ? O7 KDO A 1174 1 
HETATM 5303 C C8 . KDO B 2 . . 17.727 -5.603 -5.648 1 33.21 ? C8 KDO A 1174 1 
HETATM 5304 O O8 . KDO B 2 . . 17.97 -4.314 -6.227 1 33.05 ? O8 KDO A 1174 1 
HETATM 5305 C C1 . KDO B-2 2 . . 9.491 15.041 -6.798 1 31.31 ? C1 KDO A-2 1174 1 
HETATM 5306 O O1A . KDO B-2 2 . . 9.395 14.011 -6.107 1 30.05 ? O1A KDO A-2 1174 1 
HETATM 5307 O O1B . KDO B-2 2 . . 9.562 15.003 -8.047 1 30.44 ? O1B KDO A-2 1174 1 
HETATM 5308 C C2 . KDO B-2 2 . . 9.476 16.385 -6.095 1 32.87 ? C2 KDO A-2 1174 1 
HETATM 5309 O O2 . KDO B-2 2 . . 9.539 16.205 -4.669 1 31.42 ? O2 KDO A-2 1174 1 
HETATM 5310 C C3 . KDO B-2 2 . . 10.665 17.261 -6.522 1 34.15 ? C3 KDO A-2 1174 1 
HETATM 5311 C C4 . KDO B-2 2 . . 10.482 18.724 -6.088 1 35.34 ? C4 KDO A-2 1174 1 
HETATM 5312 O O4 . KDO B-2 2 . . 11.466 19.562 -6.702 1 36.55 ? O4 KDO A-2 1174 1 
HETATM 5313 C C5 . KDO B-2 2 . . 9.102 19.26 -6.457 1 34.96 ? C5 KDO A-2 1174 1 
HETATM 5314 O O5 . KDO B-2 2 . . 9.021 19.397 -7.885 1 34.98 ? O5 KDO A-2 1174 1 
HETATM 5315 C C6 . KDO B-2 2 . . 8.037 18.307 -5.899 1 34.55 ? C6 KDO A-2 1174 1 
HETATM 5316 O O6 . KDO B-2 2 . . 8.239 17.009 -6.47 1 33.11 ? O6 KDO A-2 1174 1 
HETATM 5317 C C7 . KDO B-2 2 . . 6.603 18.773 -6.125 1 34.2 ? C7 KDO A-2 1174 1 
HETATM 5318 O O7 . KDO B-2 2 . . 6.396 19.989 -5.397 1 35.76 ? O7 KDO A-2 1174 1 
HETATM 5319 C C8 . KDO B-2 2 . . 5.603 17.727 -5.648 1 33.21 ? C8 KDO A-2 1174 1 
HETATM 5320 O O8 . KDO B-2 2 . . 4.314 17.97 -6.227 1 33.05 ? O8 KDO A-2 1174 1 
HETATM 5321 C C1 . KDO B-3 2 . . -9.491 -15.041 -6.798 1 31.31 ? C1 KDO A-3 1174 1 
HETATM 5322 O O1A . KDO B-3 2 . . -9.395 -14.011 -6.107 1 30.05 ? O1A KDO A-3 1174 1 
HETATM 5323 O O1B . KDO B-3 2 . . -9.562 -15.003 -8.047 1 30.44 ? O1B KDO A-3 1174 1 
HETATM 5324 C C2 . KDO B-3 2 . . -9.476 -16.385 -6.095 1 32.87 ? C2 KDO A-3 1174 1 
HETATM 5325 O O2 . KDO B-3 2 . . -9.539 -16.205 -4.669 1 31.42 ? O2 KDO A-3 1174 1 
HETATM 5326 C C3 . KDO B-3 2 . . -10.665 -17.261 -6.522 1 34.15 ? C3 KDO A-3 1174 1 
HETATM 5327 C C4 . KDO B-3 2 . . -10.482 -18.724 -6.088 1 35.34 ? C4 KDO A-3 1174 1 
HETATM 5328 O O4 . KDO B-3 2 . . -11.466 -19.562 -6.702 1 36.55 ? O4 KDO A-3 1174 1 
HETATM 5329 C C5 . KDO B-3 2 . . -9.102 -19.26 -6.457 1 34.96 ? C5 KDO A-3 1174 1 
HETATM 5330 O O5 . KDO B-3 2 . . -9.021 -19.397 -7.885 1 34.98 ? O5 KDO A-3 1174 1 
HETATM 5331 C C6 . KDO B-3 2 . . -8.037 -18.307 -5.899 1 34.55 ? C6 KDO A-3 1174 1 
HETATM 5332 O O6 . KDO B-3 2 . . -8.239 -17.009 -6.47 1 33.11 ? O6 KDO A-3 1174 1 
HETATM 5333 C C7 . KDO B-3 2 . . -6.603 -18.773 -6.125 1 34.2 ? C7 KDO A-3 1174 1 
HETATM 5334 O O7 . KDO B-3 2 . . -6.396 -19.989 -5.397 1 35.76 ? O7 KDO A-3 1174 1 
HETATM 5335 C C8 . KDO B-3 2 . . -5.603 -17.727 -5.648 1 33.21 ? C8 KDO A-3 1174 1 
HETATM 5336 O O8 . KDO B-3 2 . . -4.314 -17.97 -6.227 1 33.05 ? O8 KDO A-3 1174 1 
HETATM 5337 C C1 . KDO B-4 2 . . -15.041 9.491 -6.798 1 31.31 ? C1 KDO A-4 1174 1 
HETATM 5338 O O1A . KDO B-4 2 . . -14.011 9.395 -6.107 1 30.05 ? O1A KDO A-4 1174 1 
HETATM 5339 O O1B . KDO B-4 2 . . -15.003 9.562 -8.047 1 30.44 ? O1B KDO A-4 1174 1 
HETATM 5340 C C2 . KDO B-4 2 . . -16.385 9.476 -6.095 1 32.87 ? C2 KDO A-4 1174 1 
HETATM 5341 O O2 . KDO B-4 2 . . -16.205 9.539 -4.669 1 31.42 ? O2 KDO A-4 1174 1 
HETATM 5342 C C3 . KDO B-4 2 . . -17.261 10.665 -6.522 1 34.15 ? C3 KDO A-4 1174 1 
HETATM 5343 C C4 . KDO B-4 2 . . -18.724 10.482 -6.088 1 35.34 ? C4 KDO A-4 1174 1 
HETATM 5344 O O4 . KDO B-4 2 . . -19.562 11.466 -6.702 1 36.55 ? O4 KDO A-4 1174 1 
HETATM 5345 C C5 . KDO B-4 2 . . -19.26 9.102 -6.457 1 34.96 ? C5 KDO A-4 1174 1 
HETATM 5346 O O5 . KDO B-4 2 . . -19.397 9.021 -7.885 1 34.98 ? O5 KDO A-4 1174 1 
HETATM 5347 C C6 . KDO B-4 2 . . -18.307 8.037 -5.899 1 34.55 ? C6 KDO A-4 1174 1 
HETATM 5348 O O6 . KDO B-4 2 . . -17.009 8.239 -6.47 1 33.11 ? O6 KDO A-4 1174 1 
HETATM 5349 C C7 . KDO B-4 2 . . -18.773 6.603 -6.125 1 34.2 ? C7 KDO A-4 1174 1 
HETATM 5350 O O7 . KDO B-4 2 . . -19.989 6.396 -5.397 1 35.76 ? O7 KDO A-4 1174 1 
HETATM 5351 C C8 . KDO B-4 2 . . -17.727 5.603 -5.648 1 33.21 ? C8 KDO A-4 1174 1 
HETATM 5352 O O8 . KDO B-4 2 . . -17.97 4.314 -6.227 1 33.05 ? O8 KDO A-4 1174 1 
HETATM 5353 MG MG . MG C 3 . . 17.828 -2.808 -1.956 1 17.55 ? MG MG A 1175 1 
HETATM 5354 MG MG . MG D 3 . . 0 0 -4.28 0.25 16.25 ? MG MG A 1176 1 
HETATM 5355 MG MG . MG E 3 . . 0 0 -9.461 0.25 85.28 ? MG MG A 1177 1 
HETATM 5356 MG MG . MG F 3 . . 0 0 -12.587 0.25 25.76 ? MG MG A 1178 1 
HETATM 5357 MG MG . MG C-2 3 . . 2.808 17.828 -1.956 1 17.55 ? MG MG A-2 1175 1 
HETATM 5358 MG MG . MG D-2 3 . . 0 0 -4.28 0.25 16.25 ? MG MG A-2 1176 1 
HETATM 5359 MG MG . MG E-2 3 . . 0 0 -9.461 0.25 85.28 ? MG MG A-2 1177 1 
HETATM 5360 MG MG . MG F-2 3 . . 0 0 -12.587 0.25 25.76 ? MG MG A-2 1178 1 
HETATM 5361 MG MG . MG C-3 3 . . -2.808 -17.828 -1.956 1 17.55 ? MG MG A-3 1175 1 
HETATM 5362 MG MG . MG D-3 3 . . 0 0 -4.28 0.25 16.25 ? MG MG A-3 1176 1 
HETATM 5363 MG MG . MG E-3 3 . . 0 0 -9.461 0.25 85.28 ? MG MG A-3 1177 1 
HETATM 5364 MG MG . MG F-3 3 . . 0 0 -12.587 0.25 25.76 ? MG MG A-3 1178 1 
HETATM 5365 MG MG . MG C-4 3 . . -17.828 2.808 -1.956 1 17.55 ? MG MG A-4 1175 1 
HETATM 5366 MG MG . MG D-4 3 . . 0 0 -4.28 0.25 16.25 ? MG MG A-4 1176 1 
HETATM 5367 MG MG . MG E-4 3 . . 0 0 -9.461 0.25 85.28 ? MG MG A-4 1177 1 
HETATM 5368 MG MG . MG F-4 3 . . 0 0 -12.587 0.25 25.76 ? MG MG A-4 1178 1 
HETATM 5369 O O . HOH G 4 . . 20.104 14.031 19.892 1 35.3 ? O HOH A 2001 1 
HETATM 5370 O O . HOH G 4 . . 30.482 9.73 15.892 1 35.69 ? O HOH A 2002 1 
HETATM 5371 O O . HOH G 4 . . 28.017 9.66 23.427 1 38.01 ? O HOH A 2003 1 
HETATM 5372 O O . HOH G 4 . . 33.373 15.938 12.476 1 34.07 ? O HOH A 2004 1 
HETATM 5373 O O . HOH G 4 . . 29.651 19.256 0.986 1 29.79 ? O HOH A 2005 1 
HETATM 5374 O O . HOH G 4 . . 17.828 -2.796 -4.039 1 17.06 ? O HOH A 2006 1 
HETATM 5375 O O . HOH G 4 . . 19.523 -3.917 -1.633 1 14.92 ? O HOH A 2007 1 
HETATM 5376 O O . HOH G 4 . . 20.617 -3.715 -5.446 1 6.22 ? O HOH A 2008 1 
HETATM 5377 O O . HOH G 4 . . 16.627 -4.48 -1.703 1 12.78 ? O HOH A 2009 1 
HETATM 5378 O O . HOH G 4 . . 11.226 -2.004 -5.288 1 13.21 ? O HOH A 2010 1 
HETATM 5379 O O . HOH G 4 . . 16.415 -1.094 -9.097 1 23.69 ? O HOH A 2011 1 
HETATM 5380 O O . HOH G 4 . . 13.101 -1.285 3.533 1 20.17 ? O HOH A 2012 1 
HETATM 5381 O O . HOH G 4 . . 12.918 6.665 1.295 1 5.35 ? O HOH A 2013 1 
HETATM 5382 O O . HOH G 4 . . 11.827 7.802 -3.116 1 10.11 ? O HOH A 2014 1 
HETATM 5383 O O . HOH G 4 . . 6.072 0.248 -4.243 1 13.5 ? O HOH A 2015 1 
HETATM 5384 O O . HOH G 4 . . 4.945 -0.319 2.032 1 29.56 ? O HOH A 2016 1 
HETATM 5385 O O . HOH G 4 . . 4.827 2.242 0.466 1 28.4 ? O HOH A 2017 1 
HETATM 5386 O O . HOH G 4 . . 7.994 0.008 -6.09 1 4.69 ? O HOH A 2018 1 
HETATM 5387 O O . HOH G 4 . . 10.017 -2.939 -9.982 1 18.51 ? O HOH A 2019 1 
HETATM 5388 O O . HOH G 4 . . 3.711 -3.281 -14.093 1 10.18 ? O HOH A 2020 1 
HETATM 5389 O O . HOH G 4 . . 1.005 -2.446 -14.357 1 11.69 ? O HOH A 2021 1 
HETATM 5390 O O . HOH G 4 . . 1.543 -1.902 -20.227 1 28.67 ? O HOH A 2022 1 
HETATM 5391 O O . HOH G 4 . . 5.57 -10.729 -19.014 1 23.41 ? O HOH A 2023 1 
HETATM 5392 O O . HOH G 4 . . -4.544 -10.117 -18.729 1 21.2 ? O HOH A 2024 1 
HETATM 5393 O O . HOH G 4 . . 0 0 -22.584 0.25 29.08 ? O HOH A 2025 1 
HETATM 5394 O O . HOH G 4 . . 11.814 -3.131 -16.785 1 27.87 ? O HOH A 2026 1 
HETATM 5395 O O . HOH G 4 . . 14.396 -4.735 -14.345 1 25.43 ? O HOH A 2027 1 
HETATM 5396 O O . HOH G 4 . . 14.867 -1.658 -11.564 1 16.6 ? O HOH A 2028 1 
HETATM 5397 O O . HOH G 4 . . 12.517 9.514 -4.856 1 13.82 ? O HOH A 2029 1 
HETATM 5398 O O . HOH G 4 . . 9.584 12.064 4.732 1 33.63 ? O HOH A 2030 1 
HETATM 5399 O O . HOH G 4 . . 8.206 15.158 5.978 1 15.42 ? O HOH A 2031 1 
HETATM 5400 O O . HOH G 4 . . 34.812 2.98 12.273 1 29.25 ? O HOH A 2032 1 
HETATM 5401 O O . HOH G 4 . . 20.072 21.131 12.824 1 26.42 ? O HOH A 2033 1 
HETATM 5402 O O . HOH G 4 . . 16.717 -6.038 -13.749 1 19.38 ? O HOH A 2034 1 
HETATM 5403 O O . HOH G 4 . . 13.006 -1.057 -18.13 1 13.27 ? O HOH A 2035 1 
HETATM 5404 O O . HOH G 4 . . 13.214 12.58 -15.733 1 30.29 ? O HOH A 2036 1 
HETATM 5405 O O . HOH G 4 . . 19.932 14.818 -14.219 1 20.47 ? O HOH A 2037 1 
HETATM 5406 O O . HOH G 4 . . 20.88 12.082 -14.141 1 21.44 ? O HOH A 2038 1 
HETATM 5407 O O . HOH G 4 . . 25.53 7.803 -14.961 1 26.57 ? O HOH A 2039 1 
HETATM 5408 O O . HOH G 4 . . 30.377 -5.03 -2.026 1 15.49 ? O HOH A 2040 1 
HETATM 5409 O O . HOH G 4 . . 28.616 -3.523 -0.393 1 22.55 ? O HOH A 2041 1 
HETATM 5410 O O . HOH G 4 . . 31.593 2.674 -10.15 1 25.53 ? O HOH A 2042 1 
HETATM 5411 O O . HOH G 4 . . 35.551 4.562 -12.071 1 31.19 ? O HOH A 2043 1 
HETATM 5412 O O . HOH G 4 . . 40.149 9.585 -5.268 1 33.97 ? O HOH A 2044 1 
HETATM 5413 O O . HOH G 4 . . 40.977 12.34 4.938 1 41.92 ? O HOH A 2045 1 
HETATM 5414 O O . HOH G 4 . . 39.094 6.344 -0.467 1 33.42 ? O HOH A 2046 1 
HETATM 5415 O O . HOH G 4 . . 22.929 -2.841 2.91 1 38.37 ? O HOH A 2047 1 
HETATM 5416 O O . HOH G 4 . . 17.117 -7.241 -1.895 1 12.86 ? O HOH A 2048 1 
HETATM 5417 O O . HOH G 4 . . 27.93 -6.497 0.996 1 17.43 ? O HOH A 2049 1 
HETATM 5418 O O . HOH G 4 . . 31.647 1.491 9.381 1 20.33 ? O HOH A 2050 1 
HETATM 5419 O O . HOH G 4 . . 12.25 0.226 5.444 1 4.95 ? O HOH A 2051 1 
HETATM 5420 O O . HOH G 4 . . 9.375 -6.057 5.624 1 28.35 ? O HOH A 2052 1 
HETATM 5421 O O . HOH G 4 . . 8.093 -0.65 9.631 1 31.24 ? O HOH A 2053 1 
HETATM 5422 O O . HOH G 4 . . 17.527 -9.776 9.242 1 27.39 ? O HOH A 2054 1 
HETATM 5423 O O . HOH G 4 . . 19.699 -13.948 14.835 1 35.66 ? O HOH A 2055 1 
HETATM 5424 O O . HOH G 4 . . 26.895 -7.439 9.672 1 16.98 ? O HOH A 2056 1 
HETATM 5425 O O . HOH G 4 . . 18.551 -12.27 9.083 1 26.06 ? O HOH A 2057 1 
HETATM 5426 O O . HOH G 4 . . 23.472 -12.542 11.446 1 18.17 ? O HOH A 2058 1 
HETATM 5427 O O . HOH G 4 . . 19.752 -11.384 5.941 1 20.66 ? O HOH A 2059 1 
HETATM 5428 O O . HOH G 4 . . 19.368 -2.773 14.036 1 32.64 ? O HOH A 2060 1 
HETATM 5429 O O . HOH G 4 . . 31.076 -1.424 11.75 1 23.63 ? O HOH A 2061 1 
HETATM 5430 O O . HOH G 4 . . 31.375 3.353 10.991 1 17.22 ? O HOH A 2062 1 
HETATM 5431 O O . HOH G 4 . . 16.006 6.771 13.8 1 29.34 ? O HOH A 2063 1 
HETATM 5432 O O . HOH G 4 . . 11.726 13.331 6.563 1 22.94 ? O HOH A 2064 1 
HETATM 5433 O O . HOH G 4 . . 7.454 5.247 7.673 1 27.74 ? O HOH A 2065 1 
HETATM 5434 O O . HOH G 4 . . 3.487 6.465 0.923 1 45.82 ? O HOH A 2066 1 
HETATM 5435 O O . HOH G 4 . . 3.565 8.015 4.196 1 52.26 ? O HOH A 2067 1 
HETATM 5436 O O . HOH G 4 . . 12.003 11.026 10.698 1 29.18 ? O HOH A 2068 1 
HETATM 5437 O O . HOH G 4 . . 10.669 16.195 6.786 1 32.76 ? O HOH A 2069 1 
HETATM 5438 O O . HOH G 4 . . 15.151 16.004 10.014 1 21.64 ? O HOH A 2070 1 
HETATM 5439 O O . HOH G 4 . . 24.537 20.353 13.323 1 31.94 ? O HOH A 2071 1 
HETATM 5440 O O . HOH G 4 . . 30.829 20.248 3.35 1 34.47 ? O HOH A 2072 1 
HETATM 5441 O O . HOH G 4 . . 28.497 21.858 2.616 1 28.97 ? O HOH A 2073 1 
HETATM 5442 O O . HOH G 4 . . 21.189 26.356 7.596 1 15.65 ? O HOH A 2074 1 
HETATM 5443 O O . HOH G 4 . . 21.431 23.97 9.569 1 2 ? O HOH A 2075 1 
HETATM 5444 O O . HOH G 4 . . 23.754 27.571 3.519 1 23.6 ? O HOH A 2076 1 
HETATM 5445 O O . HOH G 4 . . 27.359 26.197 3.47 1 34.93 ? O HOH A 2077 1 
HETATM 5446 O O . HOH G 4 . . 15.11 28.348 9.203 1 24.75 ? O HOH A 2078 1 
HETATM 5447 O O . HOH G 4 . . 17.536 24.447 14.136 1 18.34 ? O HOH A 2079 1 
HETATM 5448 O O . HOH G 4 . . 16.79 22.259 12.415 1 40.81 ? O HOH A 2080 1 
HETATM 5449 O O . HOH G 4 . . 19.066 28.725 12.103 1 21.56 ? O HOH A 2081 1 
HETATM 5450 O O . HOH G 4 . . 19.814 -6.508 -2.687 1 23.57 ? O HOH A 2082 1 
HETATM 5451 O O . HOH G 4 . . 18.969 -11.371 -9.397 1 38.16 ? O HOH A 2083 1 
HETATM 5452 O O . HOH G 4 . . 0.833 -1.416 -7.169 1 30.59 ? O HOH A 2084 1 
HETATM 5453 O O . HOH G 4 . . -1.905 -1.254 -4.68 1 18.95 ? O HOH A 2085 1 
HETATM 5454 O O . HOH G 4 . . 0.045 -1.625 -2.384 1 42.87 ? O HOH A 2086 1 
HETATM 5455 O O . HOH G-2 4 . . -14.031 20.104 19.892 1 35.3 ? O HOH A-2 2001 1 
HETATM 5456 O O . HOH G-2 4 . . -9.73 30.482 15.892 1 35.69 ? O HOH A-2 2002 1 
HETATM 5457 O O . HOH G-2 4 . . -9.66 28.017 23.427 1 38.01 ? O HOH A-2 2003 1 
HETATM 5458 O O . HOH G-2 4 . . -15.938 33.373 12.476 1 34.07 ? O HOH A-2 2004 1 
HETATM 5459 O O . HOH G-2 4 . . -19.256 29.651 0.986 1 29.79 ? O HOH A-2 2005 1 
HETATM 5460 O O . HOH G-2 4 . . 2.796 17.828 -4.039 1 17.06 ? O HOH A-2 2006 1 
HETATM 5461 O O . HOH G-2 4 . . 3.917 19.523 -1.633 1 14.92 ? O HOH A-2 2007 1 
HETATM 5462 O O . HOH G-2 4 . . 3.715 20.617 -5.446 1 6.22 ? O HOH A-2 2008 1 
HETATM 5463 O O . HOH G-2 4 . . 4.48 16.627 -1.703 1 12.78 ? O HOH A-2 2009 1 
HETATM 5464 O O . HOH G-2 4 . . 2.004 11.226 -5.288 1 13.21 ? O HOH A-2 2010 1 
HETATM 5465 O O . HOH G-2 4 . . 1.094 16.415 -9.097 1 23.69 ? O HOH A-2 2011 1 
HETATM 5466 O O . HOH G-2 4 . . 1.285 13.101 3.533 1 20.17 ? O HOH A-2 2012 1 
HETATM 5467 O O . HOH G-2 4 . . -6.665 12.918 1.295 1 5.35 ? O HOH A-2 2013 1 
HETATM 5468 O O . HOH G-2 4 . . -7.802 11.827 -3.116 1 10.11 ? O HOH A-2 2014 1 
HETATM 5469 O O . HOH G-2 4 . . -0.248 6.072 -4.243 1 13.5 ? O HOH A-2 2015 1 
HETATM 5470 O O . HOH G-2 4 . . 0.319 4.945 2.032 1 29.56 ? O HOH A-2 2016 1 
HETATM 5471 O O . HOH G-2 4 . . -2.242 4.827 0.466 1 28.4 ? O HOH A-2 2017 1 
HETATM 5472 O O . HOH G-2 4 . . -0.008 7.994 -6.09 1 4.69 ? O HOH A-2 2018 1 
HETATM 5473 O O . HOH G-2 4 . . 2.939 10.017 -9.982 1 18.51 ? O HOH A-2 2019 1 
HETATM 5474 O O . HOH G-2 4 . . 3.281 3.711 -14.093 1 10.18 ? O HOH A-2 2020 1 
HETATM 5475 O O . HOH G-2 4 . . 2.446 1.005 -14.357 1 11.69 ? O HOH A-2 2021 1 
HETATM 5476 O O . HOH G-2 4 . . 1.902 1.543 -20.227 1 28.67 ? O HOH A-2 2022 1 
HETATM 5477 O O . HOH G-2 4 . . 10.729 5.57 -19.014 1 23.41 ? O HOH A-2 2023 1 
HETATM 5478 O O . HOH G-2 4 . . 10.117 -4.544 -18.729 1 21.2 ? O HOH A-2 2024 1 
HETATM 5479 O O . HOH G-2 4 . . 0 0 -22.584 0.25 29.08 ? O HOH A-2 2025 1 
HETATM 5480 O O . HOH G-2 4 . . 3.131 11.814 -16.785 1 27.87 ? O HOH A-2 2026 1 
HETATM 5481 O O . HOH G-2 4 . . 4.735 14.396 -14.345 1 25.43 ? O HOH A-2 2027 1 
HETATM 5482 O O . HOH G-2 4 . . 1.658 14.867 -11.564 1 16.6 ? O HOH A-2 2028 1 
HETATM 5483 O O . HOH G-2 4 . . -9.514 12.517 -4.856 1 13.82 ? O HOH A-2 2029 1 
HETATM 5484 O O . HOH G-2 4 . . -12.064 9.584 4.732 1 33.63 ? O HOH A-2 2030 1 
HETATM 5485 O O . HOH G-2 4 . . -15.158 8.206 5.978 1 15.42 ? O HOH A-2 2031 1 
HETATM 5486 O O . HOH G-2 4 . . -2.98 34.812 12.273 1 29.25 ? O HOH A-2 2032 1 
HETATM 5487 O O . HOH G-2 4 . . -21.131 20.072 12.824 1 26.42 ? O HOH A-2 2033 1 
HETATM 5488 O O . HOH G-2 4 . . 6.038 16.717 -13.749 1 19.38 ? O HOH A-2 2034 1 
HETATM 5489 O O . HOH G-2 4 . . 1.057 13.006 -18.13 1 13.27 ? O HOH A-2 2035 1 
HETATM 5490 O O . HOH G-2 4 . . -12.58 13.214 -15.733 1 30.29 ? O HOH A-2 2036 1 
HETATM 5491 O O . HOH G-2 4 . . -14.818 19.932 -14.219 1 20.47 ? O HOH A-2 2037 1 
HETATM 5492 O O . HOH G-2 4 . . -12.082 20.88 -14.141 1 21.44 ? O HOH A-2 2038 1 
HETATM 5493 O O . HOH G-2 4 . . -7.803 25.53 -14.961 1 26.57 ? O HOH A-2 2039 1 
HETATM 5494 O O . HOH G-2 4 . . 5.03 30.377 -2.026 1 15.49 ? O HOH A-2 2040 1 
HETATM 5495 O O . HOH G-2 4 . . 3.523 28.616 -0.393 1 22.55 ? O HOH A-2 2041 1 
HETATM 5496 O O . HOH G-2 4 . . -2.674 31.593 -10.15 1 25.53 ? O HOH A-2 2042 1 
HETATM 5497 O O . HOH G-2 4 . . -4.562 35.551 -12.071 1 31.19 ? O HOH A-2 2043 1 
HETATM 5498 O O . HOH G-2 4 . . -9.585 40.149 -5.268 1 33.97 ? O HOH A-2 2044 1 
HETATM 5499 O O . HOH G-2 4 . . -12.34 40.977 4.938 1 41.92 ? O HOH A-2 2045 1 
HETATM 5500 O O . HOH G-2 4 . . -6.344 39.094 -0.467 1 33.42 ? O HOH A-2 2046 1 
HETATM 5501 O O . HOH G-2 4 . . 2.841 22.929 2.91 1 38.37 ? O HOH A-2 2047 1 
HETATM 5502 O O . HOH G-2 4 . . 7.241 17.117 -1.895 1 12.86 ? O HOH A-2 2048 1 
HETATM 5503 O O . HOH G-2 4 . . 6.497 27.93 0.996 1 17.43 ? O HOH A-2 2049 1 
HETATM 5504 O O . HOH G-2 4 . . -1.491 31.647 9.381 1 20.33 ? O HOH A-2 2050 1 
HETATM 5505 O O . HOH G-2 4 . . -0.226 12.25 5.444 1 4.95 ? O HOH A-2 2051 1 
HETATM 5506 O O . HOH G-2 4 . . 6.057 9.375 5.624 1 28.35 ? O HOH A-2 2052 1 
HETATM 5507 O O . HOH G-2 4 . . 0.65 8.093 9.631 1 31.24 ? O HOH A-2 2053 1 
HETATM 5508 O O . HOH G-2 4 . . 9.776 17.527 9.242 1 27.39 ? O HOH A-2 2054 1 
HETATM 5509 O O . HOH G-2 4 . . 13.948 19.699 14.835 1 35.66 ? O HOH A-2 2055 1 
HETATM 5510 O O . HOH G-2 4 . . 7.439 26.895 9.672 1 16.98 ? O HOH A-2 2056 1 
HETATM 5511 O O . HOH G-2 4 . . 12.27 18.551 9.083 1 26.06 ? O HOH A-2 2057 1 
HETATM 5512 O O . HOH G-2 4 . . 12.542 23.472 11.446 1 18.17 ? O HOH A-2 2058 1 
HETATM 5513 O O . HOH G-2 4 . . 11.384 19.752 5.941 1 20.66 ? O HOH A-2 2059 1 
HETATM 5514 O O . HOH G-2 4 . . 2.773 19.368 14.036 1 32.64 ? O HOH A-2 2060 1 
HETATM 5515 O O . HOH G-2 4 . . 1.424 31.076 11.75 1 23.63 ? O HOH A-2 2061 1 
HETATM 5516 O O . HOH G-2 4 . . -3.353 31.375 10.991 1 17.22 ? O HOH A-2 2062 1 
HETATM 5517 O O . HOH G-2 4 . . -6.771 16.006 13.8 1 29.34 ? O HOH A-2 2063 1 
HETATM 5518 O O . HOH G-2 4 . . -13.331 11.726 6.563 1 22.94 ? O HOH A-2 2064 1 
HETATM 5519 O O . HOH G-2 4 . . -5.247 7.454 7.673 1 27.74 ? O HOH A-2 2065 1 
HETATM 5520 O O . HOH G-2 4 . . -6.465 3.487 0.923 1 45.82 ? O HOH A-2 2066 1 
HETATM 5521 O O . HOH G-2 4 . . -8.015 3.565 4.196 1 52.26 ? O HOH A-2 2067 1 
HETATM 5522 O O . HOH G-2 4 . . -11.026 12.003 10.698 1 29.18 ? O HOH A-2 2068 1 
HETATM 5523 O O . HOH G-2 4 . . -16.195 10.669 6.786 1 32.76 ? O HOH A-2 2069 1 
HETATM 5524 O O . HOH G-2 4 . . -16.004 15.151 10.014 1 21.64 ? O HOH A-2 2070 1 
HETATM 5525 O O . HOH G-2 4 . . -20.353 24.537 13.323 1 31.94 ? O HOH A-2 2071 1 
HETATM 5526 O O . HOH G-2 4 . . -20.248 30.829 3.35 1 34.47 ? O HOH A-2 2072 1 
HETATM 5527 O O . HOH G-2 4 . . -21.858 28.497 2.616 1 28.97 ? O HOH A-2 2073 1 
HETATM 5528 O O . HOH G-2 4 . . -26.356 21.189 7.596 1 15.65 ? O HOH A-2 2074 1 
HETATM 5529 O O . HOH G-2 4 . . -23.97 21.431 9.569 1 2 ? O HOH A-2 2075 1 
HETATM 5530 O O . HOH G-2 4 . . -27.571 23.754 3.519 1 23.6 ? O HOH A-2 2076 1 
HETATM 5531 O O . HOH G-2 4 . . -26.197 27.359 3.47 1 34.93 ? O HOH A-2 2077 1 
HETATM 5532 O O . HOH G-2 4 . . -28.348 15.11 9.203 1 24.75 ? O HOH A-2 2078 1 
HETATM 5533 O O . HOH G-2 4 . . -24.447 17.536 14.136 1 18.34 ? O HOH A-2 2079 1 
HETATM 5534 O O . HOH G-2 4 . . -22.259 16.79 12.415 1 40.81 ? O HOH A-2 2080 1 
HETATM 5535 O O . HOH G-2 4 . . -28.725 19.066 12.103 1 21.56 ? O HOH A-2 2081 1 
HETATM 5536 O O . HOH G-2 4 . . 6.508 19.814 -2.687 1 23.57 ? O HOH A-2 2082 1 
HETATM 5537 O O . HOH G-2 4 . . 11.371 18.969 -9.397 1 38.16 ? O HOH A-2 2083 1 
HETATM 5538 O O . HOH G-2 4 . . 1.416 0.833 -7.169 1 30.59 ? O HOH A-2 2084 1 
HETATM 5539 O O . HOH G-2 4 . . 1.254 -1.905 -4.68 1 18.95 ? O HOH A-2 2085 1 
HETATM 5540 O O . HOH G-2 4 . . 1.625 0.045 -2.384 1 42.87 ? O HOH A-2 2086 1 
HETATM 5541 O O . HOH G-3 4 . . 14.031 -20.104 19.892 1 35.3 ? O HOH A-3 2001 1 
HETATM 5542 O O . HOH G-3 4 . . 9.73 -30.482 15.892 1 35.69 ? O HOH A-3 2002 1 
HETATM 5543 O O . HOH G-3 4 . . 9.66 -28.017 23.427 1 38.01 ? O HOH A-3 2003 1 
HETATM 5544 O O . HOH G-3 4 . . 15.938 -33.373 12.476 1 34.07 ? O HOH A-3 2004 1 
HETATM 5545 O O . HOH G-3 4 . . 19.256 -29.651 0.986 1 29.79 ? O HOH A-3 2005 1 
HETATM 5546 O O . HOH G-3 4 . . -2.796 -17.828 -4.039 1 17.06 ? O HOH A-3 2006 1 
HETATM 5547 O O . HOH G-3 4 . . -3.917 -19.523 -1.633 1 14.92 ? O HOH A-3 2007 1 
HETATM 5548 O O . HOH G-3 4 . . -3.715 -20.617 -5.446 1 6.22 ? O HOH A-3 2008 1 
HETATM 5549 O O . HOH G-3 4 . . -4.48 -16.627 -1.703 1 12.78 ? O HOH A-3 2009 1 
HETATM 5550 O O . HOH G-3 4 . . -2.004 -11.226 -5.288 1 13.21 ? O HOH A-3 2010 1 
HETATM 5551 O O . HOH G-3 4 . . -1.094 -16.415 -9.097 1 23.69 ? O HOH A-3 2011 1 
HETATM 5552 O O . HOH G-3 4 . . -1.285 -13.101 3.533 1 20.17 ? O HOH A-3 2012 1 
HETATM 5553 O O . HOH G-3 4 . . 6.665 -12.918 1.295 1 5.35 ? O HOH A-3 2013 1 
HETATM 5554 O O . HOH G-3 4 . . 7.802 -11.827 -3.116 1 10.11 ? O HOH A-3 2014 1 
HETATM 5555 O O . HOH G-3 4 . . 0.248 -6.072 -4.243 1 13.5 ? O HOH A-3 2015 1 
HETATM 5556 O O . HOH G-3 4 . . -0.319 -4.945 2.032 1 29.56 ? O HOH A-3 2016 1 
HETATM 5557 O O . HOH G-3 4 . . 2.242 -4.827 0.466 1 28.4 ? O HOH A-3 2017 1 
HETATM 5558 O O . HOH G-3 4 . . 0.008 -7.994 -6.09 1 4.69 ? O HOH A-3 2018 1 
HETATM 5559 O O . HOH G-3 4 . . -2.939 -10.017 -9.982 1 18.51 ? O HOH A-3 2019 1 
HETATM 5560 O O . HOH G-3 4 . . -3.281 -3.711 -14.093 1 10.18 ? O HOH A-3 2020 1 
HETATM 5561 O O . HOH G-3 4 . . -2.446 -1.005 -14.357 1 11.69 ? O HOH A-3 2021 1 
HETATM 5562 O O . HOH G-3 4 . . -1.902 -1.543 -20.227 1 28.67 ? O HOH A-3 2022 1 
HETATM 5563 O O . HOH G-3 4 . . -10.729 -5.57 -19.014 1 23.41 ? O HOH A-3 2023 1 
HETATM 5564 O O . HOH G-3 4 . . -10.117 4.544 -18.729 1 21.2 ? O HOH A-3 2024 1 
HETATM 5565 O O . HOH G-3 4 . . 0 0 -22.584 0.25 29.08 ? O HOH A-3 2025 1 
HETATM 5566 O O . HOH G-3 4 . . -3.131 -11.814 -16.785 1 27.87 ? O HOH A-3 2026 1 
HETATM 5567 O O . HOH G-3 4 . . -4.735 -14.396 -14.345 1 25.43 ? O HOH A-3 2027 1 
HETATM 5568 O O . HOH G-3 4 . . -1.658 -14.867 -11.564 1 16.6 ? O HOH A-3 2028 1 
HETATM 5569 O O . HOH G-3 4 . . 9.514 -12.517 -4.856 1 13.82 ? O HOH A-3 2029 1 
HETATM 5570 O O . HOH G-3 4 . . 12.064 -9.584 4.732 1 33.63 ? O HOH A-3 2030 1 
HETATM 5571 O O . HOH G-3 4 . . 15.158 -8.206 5.978 1 15.42 ? O HOH A-3 2031 1 
HETATM 5572 O O . HOH G-3 4 . . 2.98 -34.812 12.273 1 29.25 ? O HOH A-3 2032 1 
HETATM 5573 O O . HOH G-3 4 . . 21.131 -20.072 12.824 1 26.42 ? O HOH A-3 2033 1 
HETATM 5574 O O . HOH G-3 4 . . -6.038 -16.717 -13.749 1 19.38 ? O HOH A-3 2034 1 
HETATM 5575 O O . HOH G-3 4 . . -1.057 -13.006 -18.13 1 13.27 ? O HOH A-3 2035 1 
HETATM 5576 O O . HOH G-3 4 . . 12.58 -13.214 -15.733 1 30.29 ? O HOH A-3 2036 1 
HETATM 5577 O O . HOH G-3 4 . . 14.818 -19.932 -14.219 1 20.47 ? O HOH A-3 2037 1 
HETATM 5578 O O . HOH G-3 4 . . 12.082 -20.88 -14.141 1 21.44 ? O HOH A-3 2038 1 
HETATM 5579 O O . HOH G-3 4 . . 7.803 -25.53 -14.961 1 26.57 ? O HOH A-3 2039 1 
HETATM 5580 O O . HOH G-3 4 . . -5.03 -30.377 -2.026 1 15.49 ? O HOH A-3 2040 1 
HETATM 5581 O O . HOH G-3 4 . . -3.523 -28.616 -0.393 1 22.55 ? O HOH A-3 2041 1 
HETATM 5582 O O . HOH G-3 4 . . 2.674 -31.593 -10.15 1 25.53 ? O HOH A-3 2042 1 
HETATM 5583 O O . HOH G-3 4 . . 4.562 -35.551 -12.071 1 31.19 ? O HOH A-3 2043 1 
HETATM 5584 O O . HOH G-3 4 . . 9.585 -40.149 -5.268 1 33.97 ? O HOH A-3 2044 1 
HETATM 5585 O O . HOH G-3 4 . . 12.34 -40.977 4.938 1 41.92 ? O HOH A-3 2045 1 
HETATM 5586 O O . HOH G-3 4 . . 6.344 -39.094 -0.467 1 33.42 ? O HOH A-3 2046 1 
HETATM 5587 O O . HOH G-3 4 . . -2.841 -22.929 2.91 1 38.37 ? O HOH A-3 2047 1 
HETATM 5588 O O . HOH G-3 4 . . -7.241 -17.117 -1.895 1 12.86 ? O HOH A-3 2048 1 
HETATM 5589 O O . HOH G-3 4 . . -6.497 -27.93 0.996 1 17.43 ? O HOH A-3 2049 1 
HETATM 5590 O O . HOH G-3 4 . . 1.491 -31.647 9.381 1 20.33 ? O HOH A-3 2050 1 
HETATM 5591 O O . HOH G-3 4 . . 0.226 -12.25 5.444 1 4.95 ? O HOH A-3 2051 1 
HETATM 5592 O O . HOH G-3 4 . . -6.057 -9.375 5.624 1 28.35 ? O HOH A-3 2052 1 
HETATM 5593 O O . HOH G-3 4 . . -0.65 -8.093 9.631 1 31.24 ? O HOH A-3 2053 1 
HETATM 5594 O O . HOH G-3 4 . . -9.776 -17.527 9.242 1 27.39 ? O HOH A-3 2054 1 
HETATM 5595 O O . HOH G-3 4 . . -13.948 -19.699 14.835 1 35.66 ? O HOH A-3 2055 1 
HETATM 5596 O O . HOH G-3 4 . . -7.439 -26.895 9.672 1 16.98 ? O HOH A-3 2056 1 
HETATM 5597 O O . HOH G-3 4 . . -12.27 -18.551 9.083 1 26.06 ? O HOH A-3 2057 1 
HETATM 5598 O O . HOH G-3 4 . . -12.542 -23.472 11.446 1 18.17 ? O HOH A-3 2058 1 
HETATM 5599 O O . HOH G-3 4 . . -11.384 -19.752 5.941 1 20.66 ? O HOH A-3 2059 1 
HETATM 5600 O O . HOH G-3 4 . . -2.773 -19.368 14.036 1 32.64 ? O HOH A-3 2060 1 
HETATM 5601 O O . HOH G-3 4 . . -1.424 -31.076 11.75 1 23.63 ? O HOH A-3 2061 1 
HETATM 5602 O O . HOH G-3 4 . . 3.353 -31.375 10.991 1 17.22 ? O HOH A-3 2062 1 
HETATM 5603 O O . HOH G-3 4 . . 6.771 -16.006 13.8 1 29.34 ? O HOH A-3 2063 1 
HETATM 5604 O O . HOH G-3 4 . . 13.331 -11.726 6.563 1 22.94 ? O HOH A-3 2064 1 
HETATM 5605 O O . HOH G-3 4 . . 5.247 -7.454 7.673 1 27.74 ? O HOH A-3 2065 1 
HETATM 5606 O O . HOH G-3 4 . . 6.465 -3.487 0.923 1 45.82 ? O HOH A-3 2066 1 
HETATM 5607 O O . HOH G-3 4 . . 8.015 -3.565 4.196 1 52.26 ? O HOH A-3 2067 1 
HETATM 5608 O O . HOH G-3 4 . . 11.026 -12.003 10.698 1 29.18 ? O HOH A-3 2068 1 
HETATM 5609 O O . HOH G-3 4 . . 16.195 -10.669 6.786 1 32.76 ? O HOH A-3 2069 1 
HETATM 5610 O O . HOH G-3 4 . . 16.004 -15.151 10.014 1 21.64 ? O HOH A-3 2070 1 
HETATM 5611 O O . HOH G-3 4 . . 20.353 -24.537 13.323 1 31.94 ? O HOH A-3 2071 1 
HETATM 5612 O O . HOH G-3 4 . . 20.248 -30.829 3.35 1 34.47 ? O HOH A-3 2072 1 
HETATM 5613 O O . HOH G-3 4 . . 21.858 -28.497 2.616 1 28.97 ? O HOH A-3 2073 1 
HETATM 5614 O O . HOH G-3 4 . . 26.356 -21.189 7.596 1 15.65 ? O HOH A-3 2074 1 
HETATM 5615 O O . HOH G-3 4 . . 23.97 -21.431 9.569 1 2 ? O HOH A-3 2075 1 
HETATM 5616 O O . HOH G-3 4 . . 27.571 -23.754 3.519 1 23.6 ? O HOH A-3 2076 1 
HETATM 5617 O O . HOH G-3 4 . . 26.197 -27.359 3.47 1 34.93 ? O HOH A-3 2077 1 
HETATM 5618 O O . HOH G-3 4 . . 28.348 -15.11 9.203 1 24.75 ? O HOH A-3 2078 1 
HETATM 5619 O O . HOH G-3 4 . . 24.447 -17.536 14.136 1 18.34 ? O HOH A-3 2079 1 
HETATM 5620 O O . HOH G-3 4 . . 22.259 -16.79 12.415 1 40.81 ? O HOH A-3 2080 1 
HETATM 5621 O O . HOH G-3 4 . . 28.725 -19.066 12.103 1 21.56 ? O HOH A-3 2081 1 
HETATM 5622 O O . HOH G-3 4 . . -6.508 -19.814 -2.687 1 23.57 ? O HOH A-3 2082 1 
HETATM 5623 O O . HOH G-3 4 . . -11.371 -18.969 -9.397 1 38.16 ? O HOH A-3 2083 1 
HETATM 5624 O O . HOH G-3 4 . . -1.416 -0.833 -7.169 1 30.59 ? O HOH A-3 2084 1 
HETATM 5625 O O . HOH G-3 4 . . -1.254 1.905 -4.68 1 18.95 ? O HOH A-3 2085 1 
HETATM 5626 O O . HOH G-3 4 . . -1.625 -0.045 -2.384 1 42.87 ? O HOH A-3 2086 1 
HETATM 5627 O O . HOH G-4 4 . . -20.104 -14.031 19.892 1 35.3 ? O HOH A-4 2001 1 
HETATM 5628 O O . HOH G-4 4 . . -30.482 -9.73 15.892 1 35.69 ? O HOH A-4 2002 1 
HETATM 5629 O O . HOH G-4 4 . . -28.017 -9.66 23.427 1 38.01 ? O HOH A-4 2003 1 
HETATM 5630 O O . HOH G-4 4 . . -33.373 -15.938 12.476 1 34.07 ? O HOH A-4 2004 1 
HETATM 5631 O O . HOH G-4 4 . . -29.651 -19.256 0.986 1 29.79 ? O HOH A-4 2005 1 
HETATM 5632 O O . HOH G-4 4 . . -17.828 2.796 -4.039 1 17.06 ? O HOH A-4 2006 1 
HETATM 5633 O O . HOH G-4 4 . . -19.523 3.917 -1.633 1 14.92 ? O HOH A-4 2007 1 
HETATM 5634 O O . HOH G-4 4 . . -20.617 3.715 -5.446 1 6.22 ? O HOH A-4 2008 1 
HETATM 5635 O O . HOH G-4 4 . . -16.627 4.48 -1.703 1 12.78 ? O HOH A-4 2009 1 
HETATM 5636 O O . HOH G-4 4 . . -11.226 2.004 -5.288 1 13.21 ? O HOH A-4 2010 1 
HETATM 5637 O O . HOH G-4 4 . . -16.415 1.094 -9.097 1 23.69 ? O HOH A-4 2011 1 
HETATM 5638 O O . HOH G-4 4 . . -13.101 1.285 3.533 1 20.17 ? O HOH A-4 2012 1 
HETATM 5639 O O . HOH G-4 4 . . -12.918 -6.665 1.295 1 5.35 ? O HOH A-4 2013 1 
HETATM 5640 O O . HOH G-4 4 . . -11.827 -7.802 -3.116 1 10.11 ? O HOH A-4 2014 1 
HETATM 5641 O O . HOH G-4 4 . . -6.072 -0.248 -4.243 1 13.5 ? O HOH A-4 2015 1 
HETATM 5642 O O . HOH G-4 4 . . -4.945 0.319 2.032 1 29.56 ? O HOH A-4 2016 1 
HETATM 5643 O O . HOH G-4 4 . . -4.827 -2.242 0.466 1 28.4 ? O HOH A-4 2017 1 
HETATM 5644 O O . HOH G-4 4 . . -7.994 -0.008 -6.09 1 4.69 ? O HOH A-4 2018 1 
HETATM 5645 O O . HOH G-4 4 . . -10.017 2.939 -9.982 1 18.51 ? O HOH A-4 2019 1 
HETATM 5646 O O . HOH G-4 4 . . -3.711 3.281 -14.093 1 10.18 ? O HOH A-4 2020 1 
HETATM 5647 O O . HOH G-4 4 . . -1.005 2.446 -14.357 1 11.69 ? O HOH A-4 2021 1 
HETATM 5648 O O . HOH G-4 4 . . -1.543 1.902 -20.227 1 28.67 ? O HOH A-4 2022 1 
HETATM 5649 O O . HOH G-4 4 . . -5.57 10.729 -19.014 1 23.41 ? O HOH A-4 2023 1 
HETATM 5650 O O . HOH G-4 4 . . 4.544 10.117 -18.729 1 21.2 ? O HOH A-4 2024 1 
HETATM 5651 O O . HOH G-4 4 . . 0 0 -22.584 0.25 29.08 ? O HOH A-4 2025 1 
HETATM 5652 O O . HOH G-4 4 . . -11.814 3.131 -16.785 1 27.87 ? O HOH A-4 2026 1 
HETATM 5653 O O . HOH G-4 4 . . -14.396 4.735 -14.345 1 25.43 ? O HOH A-4 2027 1 
HETATM 5654 O O . HOH G-4 4 . . -14.867 1.658 -11.564 1 16.6 ? O HOH A-4 2028 1 
HETATM 5655 O O . HOH G-4 4 . . -12.517 -9.514 -4.856 1 13.82 ? O HOH A-4 2029 1 
HETATM 5656 O O . HOH G-4 4 . . -9.584 -12.064 4.732 1 33.63 ? O HOH A-4 2030 1 
HETATM 5657 O O . HOH G-4 4 . . -8.206 -15.158 5.978 1 15.42 ? O HOH A-4 2031 1 
HETATM 5658 O O . HOH G-4 4 . . -34.812 -2.98 12.273 1 29.25 ? O HOH A-4 2032 1 
HETATM 5659 O O . HOH G-4 4 . . -20.072 -21.131 12.824 1 26.42 ? O HOH A-4 2033 1 
HETATM 5660 O O . HOH G-4 4 . . -16.717 6.038 -13.749 1 19.38 ? O HOH A-4 2034 1 
HETATM 5661 O O . HOH G-4 4 . . -13.006 1.057 -18.13 1 13.27 ? O HOH A-4 2035 1 
HETATM 5662 O O . HOH G-4 4 . . -13.214 -12.58 -15.733 1 30.29 ? O HOH A-4 2036 1 
HETATM 5663 O O . HOH G-4 4 . . -19.932 -14.818 -14.219 1 20.47 ? O HOH A-4 2037 1 
HETATM 5664 O O . HOH G-4 4 . . -20.88 -12.082 -14.141 1 21.44 ? O HOH A-4 2038 1 
HETATM 5665 O O . HOH G-4 4 . . -25.53 -7.803 -14.961 1 26.57 ? O HOH A-4 2039 1 
HETATM 5666 O O . HOH G-4 4 . . -30.377 5.03 -2.026 1 15.49 ? O HOH A-4 2040 1 
HETATM 5667 O O . HOH G-4 4 . . -28.616 3.523 -0.393 1 22.55 ? O HOH A-4 2041 1 
HETATM 5668 O O . HOH G-4 4 . . -31.593 -2.674 -10.15 1 25.53 ? O HOH A-4 2042 1 
HETATM 5669 O O . HOH G-4 4 . . -35.551 -4.562 -12.071 1 31.19 ? O HOH A-4 2043 1 
HETATM 5670 O O . HOH G-4 4 . . -40.149 -9.585 -5.268 1 33.97 ? O HOH A-4 2044 1 
HETATM 5671 O O . HOH G-4 4 . . -40.977 -12.34 4.938 1 41.92 ? O HOH A-4 2045 1 
HETATM 5672 O O . HOH G-4 4 . . -39.094 -6.344 -0.467 1 33.42 ? O HOH A-4 2046 1 
HETATM 5673 O O . HOH G-4 4 . . -22.929 2.841 2.91 1 38.37 ? O HOH A-4 2047 1 
HETATM 5674 O O . HOH G-4 4 . . -17.117 7.241 -1.895 1 12.86 ? O HOH A-4 2048 1 
HETATM 5675 O O . HOH G-4 4 . . -27.93 6.497 0.996 1 17.43 ? O HOH A-4 2049 1 
HETATM 5676 O O . HOH G-4 4 . . -31.647 -1.491 9.381 1 20.33 ? O HOH A-4 2050 1 
HETATM 5677 O O . HOH G-4 4 . . -12.25 -0.226 5.444 1 4.95 ? O HOH A-4 2051 1 
HETATM 5678 O O . HOH G-4 4 . . -9.375 6.057 5.624 1 28.35 ? O HOH A-4 2052 1 
HETATM 5679 O O . HOH G-4 4 . . -8.093 0.65 9.631 1 31.24 ? O HOH A-4 2053 1 
HETATM 5680 O O . HOH G-4 4 . . -17.527 9.776 9.242 1 27.39 ? O HOH A-4 2054 1 
HETATM 5681 O O . HOH G-4 4 . . -19.699 13.948 14.835 1 35.66 ? O HOH A-4 2055 1 
HETATM 5682 O O . HOH G-4 4 . . -26.895 7.439 9.672 1 16.98 ? O HOH A-4 2056 1 
HETATM 5683 O O . HOH G-4 4 . . -18.551 12.27 9.083 1 26.06 ? O HOH A-4 2057 1 
HETATM 5684 O O . HOH G-4 4 . . -23.472 12.542 11.446 1 18.17 ? O HOH A-4 2058 1 
HETATM 5685 O O . HOH G-4 4 . . -19.752 11.384 5.941 1 20.66 ? O HOH A-4 2059 1 
HETATM 5686 O O . HOH G-4 4 . . -19.368 2.773 14.036 1 32.64 ? O HOH A-4 2060 1 
HETATM 5687 O O . HOH G-4 4 . . -31.076 1.424 11.75 1 23.63 ? O HOH A-4 2061 1 
HETATM 5688 O O . HOH G-4 4 . . -31.375 -3.353 10.991 1 17.22 ? O HOH A-4 2062 1 
HETATM 5689 O O . HOH G-4 4 . . -16.006 -6.771 13.8 1 29.34 ? O HOH A-4 2063 1 
HETATM 5690 O O . HOH G-4 4 . . -11.726 -13.331 6.563 1 22.94 ? O HOH A-4 2064 1 
HETATM 5691 O O . HOH G-4 4 . . -7.454 -5.247 7.673 1 27.74 ? O HOH A-4 2065 1 
HETATM 5692 O O . HOH G-4 4 . . -3.487 -6.465 0.923 1 45.82 ? O HOH A-4 2066 1 
HETATM 5693 O O . HOH G-4 4 . . -3.565 -8.015 4.196 1 52.26 ? O HOH A-4 2067 1 
HETATM 5694 O O . HOH G-4 4 . . -12.003 -11.026 10.698 1 29.18 ? O HOH A-4 2068 1 
HETATM 5695 O O . HOH G-4 4 . . -10.669 -16.195 6.786 1 32.76 ? O HOH A-4 2069 1 
HETATM 5696 O O . HOH G-4 4 . . -15.151 -16.004 10.014 1 21.64 ? O HOH A-4 2070 1 
HETATM 5697 O O . HOH G-4 4 . . -24.537 -20.353 13.323 1 31.94 ? O HOH A-4 2071 1 
HETATM 5698 O O . HOH G-4 4 . . -30.829 -20.248 3.35 1 34.47 ? O HOH A-4 2072 1 
HETATM 5699 O O . HOH G-4 4 . . -28.497 -21.858 2.616 1 28.97 ? O HOH A-4 2073 1 
HETATM 5700 O O . HOH G-4 4 . . -21.189 -26.356 7.596 1 15.65 ? O HOH A-4 2074 1 
HETATM 5701 O O . HOH G-4 4 . . -21.431 -23.97 9.569 1 2 ? O HOH A-4 2075 1 
HETATM 5702 O O . HOH G-4 4 . . -23.754 -27.571 3.519 1 23.6 ? O HOH A-4 2076 1 
HETATM 5703 O O . HOH G-4 4 . . -27.359 -26.197 3.47 1 34.93 ? O HOH A-4 2077 1 
HETATM 5704 O O . HOH G-4 4 . . -15.11 -28.348 9.203 1 24.75 ? O HOH A-4 2078 1 
HETATM 5705 O O . HOH G-4 4 . . -17.536 -24.447 14.136 1 18.34 ? O HOH A-4 2079 1 
HETATM 5706 O O . HOH G-4 4 . . -16.79 -22.259 12.415 1 40.81 ? O HOH A-4 2080 1 
HETATM 5707 O O . HOH G-4 4 . . -19.066 -28.725 12.103 1 21.56 ? O HOH A-4 2081 1 
HETATM 5708 O O . HOH G-4 4 . . -19.814 6.508 -2.687 1 23.57 ? O HOH A-4 2082 1 
HETATM 5709 O O . HOH G-4 4 . . -18.969 11.371 -9.397 1 38.16 ? O HOH A-4 2083 1 
HETATM 5710 O O . HOH G-4 4 . . -0.833 1.416 -7.169 1 30.59 ? O HOH A-4 2084 1 
HETATM 5711 O O . HOH G-4 4 . . 1.905 1.254 -4.68 1 18.95 ? O HOH A-4 2085 1 
HETATM 5712 O O . HOH G-4 4 . . -0.045 1.625 -2.384 1 42.87 ? O HOH A-4 2086 1 
#
_coordinate_server_stats.molecule_cached    no 
_coordinate_server_stats.io_time_ms         67 
_coordinate_server_stats.parse_time_ms      36 
_coordinate_server_stats.query_time_ms      38 
_coordinate_server_stats.format_time_ms     60 
#