data_2JO4
#
_entry.id 2JO4
#
_citation.id primary
_citation.title 'Getting specificity from simplicity in putative proteins from the prebiotic earth.'
_citation.journal_abbrev 'Proc. Natl. Acad. Sci. U.S.A.'
_citation.journal_volume 104
_citation.page_first 14941
_citation.page_last 14946
_citation.year 2007
_citation.journal_id_ASTM PNASA6
_citation.country US
_citation.journal_id_ISSN 0027-8424
_citation.journal_id_CSD 0040
_citation.book_publisher ?
_citation.pdbx_database_id_PubMed 17855563
_citation.pdbx_database_id_DOI 10.1073/pnas.0706876104
#
loop_
_citation_author.citation_id
_citation_author.name
_citation_author.ordinal
primary 'Lopez de la Osa, J.' 1
primary 'Bateman, D.A.' 2
primary 'Ho, S.' 3
primary 'Gonzalez, C.' 4
primary 'Chakrabartty, A.' 5
primary 'Laurents, D.V.' 6
#
_cell.entry_id 2JO4
_cell.length_a 1.000
_cell.length_b 1.000
_cell.length_c 1.000
_cell.angle_alpha 90.00
_cell.angle_beta 90.00
_cell.angle_gamma 90.00
_cell.Z_PDB 1
_cell.pdbx_unique_axis ?
#
_symmetry.entry_id 2JO4
_symmetry.space_group_name_H-M 'P 1'
_symmetry.pdbx_full_space_group_name_H-M ?
_symmetry.cell_setting ?
_symmetry.Int_Tables_number 1
#
_entity.id 1
_entity.type polymer
_entity.src_method syn
_entity.pdbx_description KIA7
_entity.formula_weight 1870.286
_entity.pdbx_number_of_molecules 4
_entity.pdbx_ec ?
_entity.pdbx_mutation ?
_entity.pdbx_fragment ?
_entity.details ?
#
_entity_poly.entity_id 1
_entity_poly.type 'polypeptide(L)'
_entity_poly.nstd_linkage no
_entity_poly.nstd_monomer yes
_entity_poly.pdbx_seq_one_letter_code '(ACE)AKAAAAAIKAIAAIIKAGGY(NH2)'
_entity_poly.pdbx_seq_one_letter_code_can XAKAAAAAIKAIAAIIKAGGYX
_entity_poly.pdbx_strand_id A,B,C,D
_entity_poly.pdbx_target_identifier ?
#
loop_
_entity_poly_seq.entity_id
_entity_poly_seq.num
_entity_poly_seq.mon_id
_entity_poly_seq.hetero
1 1 ACE n
1 2 ALA n
1 3 LYS n
1 4 ALA n
1 5 ALA n
1 6 ALA n
1 7 ALA n
1 8 ALA n
1 9 ILE n
1 10 LYS n
1 11 ALA n
1 12 ILE n
1 13 ALA n
1 14 ALA n
1 15 ILE n
1 16 ILE n
1 17 LYS n
1 18 ALA n
1 19 GLY n
1 20 GLY n
1 21 TYR n
1 22 NH2 n
#
_struct_ref.id 1
_struct_ref.entity_id 1
_struct_ref.db_name PDB
_struct_ref.db_code 2JO4
_struct_ref.pdbx_db_accession 2JO4
_struct_ref.pdbx_db_isoform ?
_struct_ref.pdbx_seq_one_letter_code ?
_struct_ref.pdbx_align_begin ?
#
loop_
_struct_ref_seq.align_id
_struct_ref_seq.ref_id
_struct_ref_seq.pdbx_PDB_id_code
_struct_ref_seq.pdbx_strand_id
_struct_ref_seq.seq_align_beg
_struct_ref_seq.pdbx_seq_align_beg_ins_code
_struct_ref_seq.seq_align_end
_struct_ref_seq.pdbx_seq_align_end_ins_code
_struct_ref_seq.pdbx_db_accession
_struct_ref_seq.db_align_beg
_struct_ref_seq.pdbx_db_align_beg_ins_code
_struct_ref_seq.db_align_end
_struct_ref_seq.pdbx_db_align_end_ins_code
_struct_ref_seq.pdbx_auth_seq_align_beg
_struct_ref_seq.pdbx_auth_seq_align_end
1 1 2JO4 A 1 ? 22 ? 2JO4 1 ? 22 ? 1 22
2 1 2JO4 B 1 ? 22 ? 2JO4 23 ? 44 ? 23 44
3 1 2JO4 C 1 ? 22 ? 2JO4 45 ? 66 ? 45 66
4 1 2JO4 D 1 ? 22 ? 2JO4 67 ? 88 ? 67 88
#
loop_
_chem_comp.id
_chem_comp.type
_chem_comp.mon_nstd_flag
_chem_comp.name
_chem_comp.pdbx_synonyms
_chem_comp.formula
_chem_comp.formula_weight
ACE non-polymer . 'ACETYL GROUP' ? 'C2 H4 O' 44.053
ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093
GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067
ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173
LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195
NH2 non-polymer . 'AMINO GROUP' ? 'H2 N' 16.023
TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189
#
loop_
_pdbx_nmr_exptl.conditions_id
_pdbx_nmr_exptl.experiment_id
_pdbx_nmr_exptl.solution_id
_pdbx_nmr_exptl.type
1 1 1 '2D 1H-1H NOESY'
1 2 1 '2D 1H-1H TOCSY'
1 3 1 '2D DQF-COSY'
#
_pdbx_nmr_exptl_sample_conditions.conditions_id 1
_pdbx_nmr_exptl_sample_conditions.ionic_strength ?
_pdbx_nmr_exptl_sample_conditions.pH 5.0
_pdbx_nmr_exptl_sample_conditions.pressure ambient
_pdbx_nmr_exptl_sample_conditions.pressure_units ?
_pdbx_nmr_exptl_sample_conditions.temperature 278
_pdbx_nmr_exptl_sample_conditions.temperature_units K
#
_pdbx_nmr_sample_details.contents
'1mM protein, 10 mM sodium acetate, 200 mM sodium chloride, 0.005 mM DSS, 90% H2O/10% D2O'
_pdbx_nmr_sample_details.solution_id 1
_pdbx_nmr_sample_details.solvent_system '90% H2O/10% D2O'
#
loop_
_pdbx_nmr_spectrometer.field_strength
_pdbx_nmr_spectrometer.manufacturer
_pdbx_nmr_spectrometer.model
_pdbx_nmr_spectrometer.spectrometer_id
_pdbx_nmr_spectrometer.type
600 Bruker 'AVANCE DMX' 1 'Bruker DMX'
800 Bruker AVANCE 2 'Bruker Avance'
#
_pdbx_nmr_refine.details ?
_pdbx_nmr_refine.entry_id 2JO4
_pdbx_nmr_refine.method 'molecular dynamics'
_pdbx_nmr_refine.software_ordinal 1
#
_pdbx_nmr_ensemble.average_constraint_violations_per_residue ?
_pdbx_nmr_ensemble.average_constraints_per_residue ?
_pdbx_nmr_ensemble.average_distance_constraint_violation ?
_pdbx_nmr_ensemble.average_torsion_angle_constraint_violation ?
_pdbx_nmr_ensemble.conformer_selection_criteria 'structures with the lowest energy'
_pdbx_nmr_ensemble.conformers_calculated_total_number 250
_pdbx_nmr_ensemble.conformers_submitted_total_number 10
_pdbx_nmr_ensemble.distance_constraint_violation_method ?
_pdbx_nmr_ensemble.entry_id 2JO4
_pdbx_nmr_ensemble.maximum_distance_constraint_violation ?
_pdbx_nmr_ensemble.maximum_lower_distance_constraint_violation ?
_pdbx_nmr_ensemble.maximum_torsion_angle_constraint_violation ?
_pdbx_nmr_ensemble.maximum_upper_distance_constraint_violation ?
_pdbx_nmr_ensemble.torsion_angle_constraint_violation_method ?
#
_pdbx_nmr_representative.conformer_id 1
_pdbx_nmr_representative.entry_id 2JO4
_pdbx_nmr_representative.selection_criteria 'lowest energy'
#
loop_
_pdbx_nmr_software.authors
_pdbx_nmr_software.classification
_pdbx_nmr_software.name
_pdbx_nmr_software.version
_pdbx_nmr_software.ordinal
'Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, and Koll' refinement Amber 7.0 1
'Guntert, Braun and Wuthrich' 'structure solution' DYANA 1.5 2
#
_exptl.absorpt_coefficient_mu ?
_exptl.absorpt_correction_T_max ?
_exptl.absorpt_correction_T_min ?
_exptl.absorpt_correction_type ?
_exptl.absorpt_process_details ?
_exptl.crystals_number ?
_exptl.details ?
_exptl.entry_id 2JO4
_exptl.method 'Solution NMR'
_exptl.method_details ?
#
_exptl_crystal.id 1
_exptl_crystal.density_meas ?
_exptl_crystal.density_Matthews ?
_exptl_crystal.density_percent_sol ?
_exptl_crystal.description ?
#
_diffrn.id 1
_diffrn.ambient_temp ?
_diffrn.ambient_temp_details ?
_diffrn.crystal_id 1
#
_diffrn_radiation.diffrn_id 1
_diffrn_radiation.wavelength_id 1
_diffrn_radiation.monochromator ?
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M
_diffrn_radiation.pdbx_diffrn_protocol 'Single wavelength'
_diffrn_radiation.pdbx_scattering_type ?
#
_diffrn_radiation_wavelength.id 1
_diffrn_radiation_wavelength.wavelength .
_diffrn_radiation_wavelength.wt 1.0
#
_struct.entry_id 2JO4
_struct.title 'Tetrameric structure of KIA7 peptide'
_struct.pdbx_descriptor KIA7
_struct.pdbx_model_details ?
_struct.pdbx_CASP_flag ?
_struct.pdbx_model_type_details ?
#
_struct_keywords.entry_id 2JO4
_struct_keywords.pdbx_keywords 'DE NOVO PROTEIN'
_struct_keywords.text 'oligomer, prebiotic, DE NOVO PROTEIN'
#
loop_
_struct_asym.id
_struct_asym.pdbx_blank_PDB_chainid_flag
_struct_asym.pdbx_modified
_struct_asym.entity_id
_struct_asym.details
A N N 1 ?
B N N 1 ?
C N N 1 ?
D N N 1 ?
#
_struct_biol.id 1
_struct_biol.details ?
#
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 ALA A 4 ? GLY A 20 ? ALA A 4 GLY A 20 1 ? 17
HELX_P HELX_P2 2 ALA B 4 ? GLY B 20 ? ALA B 26 GLY B 42 1 ? 17
HELX_P HELX_P3 3 ALA C 4 ? ILE C 9 ? ALA C 48 ILE C 53 1 ? 6
HELX_P HELX_P4 4 ILE C 9 ? GLY C 20 ? ILE C 53 GLY C 64 1 ? 12
HELX_P HELX_P5 5 LYS D 3 ? GLY D 20 ? LYS D 69 GLY D 86 1 ? 18
#
_struct_conf_type.id HELX_P
_struct_conf_type.criteria ?
_struct_conf_type.reference ?
#
loop_
_struct_conn.id
_struct_conn.conn_type_id
_struct_conn.pdbx_leaving_atom_flag
_struct_conn.pdbx_PDB_id
_struct_conn.ptnr1_label_asym_id
_struct_conn.ptnr1_label_comp_id
_struct_conn.ptnr1_label_seq_id
_struct_conn.ptnr1_label_atom_id
_struct_conn.pdbx_ptnr1_label_alt_id
_struct_conn.pdbx_ptnr1_PDB_ins_code
_struct_conn.pdbx_ptnr1_standard_comp_id
_struct_conn.ptnr1_symmetry
_struct_conn.ptnr2_label_asym_id
_struct_conn.ptnr2_label_comp_id
_struct_conn.ptnr2_label_seq_id
_struct_conn.ptnr2_label_atom_id
_struct_conn.pdbx_ptnr2_label_alt_id
_struct_conn.pdbx_ptnr2_PDB_ins_code
_struct_conn.ptnr1_auth_asym_id
_struct_conn.ptnr1_auth_comp_id
_struct_conn.ptnr1_auth_seq_id
_struct_conn.ptnr2_auth_asym_id
_struct_conn.ptnr2_auth_comp_id
_struct_conn.ptnr2_auth_seq_id
_struct_conn.ptnr2_symmetry
_struct_conn.pdbx_ptnr3_label_atom_id
_struct_conn.pdbx_ptnr3_label_seq_id
_struct_conn.pdbx_ptnr3_label_comp_id
_struct_conn.pdbx_ptnr3_label_asym_id
_struct_conn.pdbx_ptnr3_label_alt_id
_struct_conn.pdbx_ptnr3_PDB_ins_code
_struct_conn.details
_struct_conn.pdbx_dist_value
_struct_conn.pdbx_value_order
covale1 covale ? ? A ALA 2 N ? ? ? 1_555 A ACE 1 C ? ? A ALA 2 A ACE 1 1_555 ? ? ? ? ? ? ? 1.312 ?
covale2 covale ? ? B ALA 2 N ? ? ? 1_555 B ACE 1 C ? ? B ALA 24 B ACE 23 1_555 ? ? ? ? ? ? ? 1.307 ?
covale3 covale ? ? C ALA 2 N ? ? ? 1_555 C ACE 1 C ? ? C ALA 46 C ACE 45 1_555 ? ? ? ? ? ? ? 1.290 ?
covale4 covale ? ? D ALA 2 N ? ? ? 1_555 D ACE 1 C ? ? D ALA 68 D ACE 67 1_555 ? ? ? ? ? ? ? 1.281 ?
covale5 covale ? ? A TYR 21 C ? ? ? 1_555 A NH2 22 N ? ? A TYR 21 A NH2 22 1_555 ? ? ? ? ? ? ? 1.294 ?
covale6 covale ? ? B TYR 21 C ? ? ? 1_555 B NH2 22 N ? ? B TYR 43 B NH2 44 1_555 ? ? ? ? ? ? ? 1.293 ?
covale7 covale ? ? C TYR 21 C ? ? ? 1_555 C NH2 22 N ? ? C TYR 65 C NH2 66 1_555 ? ? ? ? ? ? ? 1.267 ?
covale8 covale ? ? D TYR 21 C ? ? ? 1_555 D NH2 22 N ? ? D TYR 87 D NH2 88 1_555 ? ? ? ? ? ? ? 1.256 ?
#
_struct_conn_type.id covale
_struct_conn_type.criteria ?
_struct_conn_type.reference ?
#
loop_
_struct_site.id
_struct_site.pdbx_evidence_code
_struct_site.pdbx_auth_asym_id
_struct_site.pdbx_auth_comp_id
_struct_site.pdbx_auth_seq_id
_struct_site.pdbx_auth_ins_code
_struct_site.pdbx_num_residues
_struct_site.details
AC1 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE ACE A 1'
AC2 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NH2 A 22'
AC3 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE ACE B 23'
AC4 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NH2 B 44'
AC5 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE ACE C 45'
AC6 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NH2 C 66'
AC7 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE ACE D 67'
AC8 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE NH2 D 88'
#
loop_
_struct_site_gen.id
_struct_site_gen.site_id
_struct_site_gen.pdbx_num_res
_struct_site_gen.label_comp_id
_struct_site_gen.label_asym_id
_struct_site_gen.label_seq_id
_struct_site_gen.pdbx_auth_ins_code
_struct_site_gen.auth_comp_id
_struct_site_gen.auth_asym_id
_struct_site_gen.auth_seq_id
_struct_site_gen.label_atom_id
_struct_site_gen.label_alt_id
_struct_site_gen.symmetry
_struct_site_gen.details
1 AC1 3 ALA A 2 ? ALA A 2 . ? 1_555 ?
2 AC1 3 LYS A 3 ? LYS A 3 . ? 1_555 ?
3 AC1 3 GLY B 20 ? GLY B 42 . ? 1_555 ?
4 AC2 3 ILE A 16 ? ILE A 16 . ? 1_555 ?
5 AC2 3 GLY A 19 ? GLY A 19 . ? 1_555 ?
6 AC2 3 GLY A 20 ? GLY A 20 . ? 1_555 ?
7 AC3 4 GLY A 20 ? GLY A 20 . ? 1_555 ?
8 AC3 4 TYR A 21 ? TYR A 21 . ? 1_555 ?
9 AC3 4 ALA B 2 ? ALA B 24 . ? 1_555 ?
10 AC3 4 LYS B 3 ? LYS B 25 . ? 1_555 ?
11 AC4 4 ACE A 1 ? ACE A 1 . ? 1_555 ?
12 AC4 4 ILE B 16 ? ILE B 38 . ? 1_555 ?
13 AC4 4 GLY B 20 ? GLY B 42 . ? 1_555 ?
14 AC4 4 TYR B 21 ? TYR B 43 . ? 1_555 ?
15 AC5 5 ALA C 2 ? ALA C 46 . ? 1_555 ?
16 AC5 5 LYS C 3 ? LYS C 47 . ? 1_555 ?
17 AC5 5 ALA C 4 ? ALA C 48 . ? 1_555 ?
18 AC5 5 GLY D 20 ? GLY D 86 . ? 1_555 ?
19 AC5 5 TYR D 21 ? TYR D 87 . ? 1_555 ?
20 AC6 2 ALA B 6 ? ALA B 28 . ? 1_555 ?
21 AC6 2 GLY C 20 ? GLY C 64 . ? 1_555 ?
22 AC7 4 GLY C 19 ? GLY C 63 . ? 1_555 ?
23 AC7 4 GLY C 20 ? GLY C 64 . ? 1_555 ?
24 AC7 4 ALA D 2 ? ALA D 68 . ? 1_555 ?
25 AC7 4 LYS D 3 ? LYS D 69 . ? 1_555 ?
26 AC8 6 ILE A 9 ? ILE A 9 . ? 1_555 ?
27 AC8 6 LYS A 10 ? LYS A 10 . ? 1_555 ?
28 AC8 6 ACE C 1 ? ACE C 45 . ? 1_555 ?
29 AC8 6 ILE D 16 ? ILE D 82 . ? 1_555 ?
30 AC8 6 GLY D 20 ? GLY D 86 . ? 1_555 ?
31 AC8 6 TYR D 21 ? TYR D 87 . ? 1_555 ?
#
_atom_sites.entry_id 2JO4
_atom_sites.fract_transf_matrix[1][1] 1.000000
_atom_sites.fract_transf_matrix[1][2] 0.000000
_atom_sites.fract_transf_matrix[1][3] 0.000000
_atom_sites.fract_transf_matrix[2][1] 0.000000
_atom_sites.fract_transf_matrix[2][2] 1.000000
_atom_sites.fract_transf_matrix[2][3] 0.000000
_atom_sites.fract_transf_matrix[3][1] 0.000000
_atom_sites.fract_transf_matrix[3][2] 0.000000
_atom_sites.fract_transf_matrix[3][3] 1.000000
_atom_sites.fract_transf_vector[1] 0.00000
_atom_sites.fract_transf_vector[2] 0.00000
_atom_sites.fract_transf_vector[3] 0.00000
#
loop_
_atom_type.symbol
C
H
N
O
#
loop_
_atom_site.group_PDB
_atom_site.id
_atom_site.type_symbol
_atom_site.label_atom_id
_atom_site.label_alt_id
_atom_site.label_comp_id
_atom_site.label_asym_id
_atom_site.label_entity_id
_atom_site.label_seq_id
_atom_site.pdbx_PDB_ins_code
_atom_site.Cartn_x
_atom_site.Cartn_y
_atom_site.Cartn_z
_atom_site.occupancy
_atom_site.B_iso_or_equiv
_atom_site.pdbx_formal_charge
_atom_site.auth_seq_id
_atom_site.auth_comp_id
_atom_site.auth_asym_id
_atom_site.auth_atom_id
_atom_site.pdbx_PDB_model_num
_atom_site.pdbe_label_seq_id
HETATM 1 C C . ACE A 1 1 ? 2.032 14.176 2.180 1.00 0.00 ? 1 ACE A C 1 1
HETATM 2 O O . ACE A 1 1 ? 2.527 13.386 1.412 1.00 0.00 ? 1 ACE A O 1 1
HETATM 3 C CH3 . ACE A 1 1 ? 2.852 15.192 2.906 1.00 0.00 ? 1 ACE A CH3 1 1
HETATM 4 H H1 . ACE A 1 1 ? 3.000 15.466 3.198 1.00 0.00 ? 1 ACE A H1 1 1
HETATM 5 H H2 . ACE A 1 1 ? 3.172 15.313 3.091 1.00 0.00 ? 1 ACE A H2 1 1
HETATM 6 H H3 . ACE A 1 1 ? 3.032 15.549 2.921 1.00 0.00 ? 1 ACE A H3 1 1
ATOM 7 N N . ALA A 1 2 ? 0.734 14.234 2.362 1.00 0.00 ? 2 ALA A N 1 2
ATOM 8 C CA . ALA A 1 2 ? -0.221 13.344 1.782 1.00 0.00 ? 2 ALA A CA 1 2
ATOM 9 C C . ALA A 1 2 ? -0.287 13.329 0.281 1.00 0.00 ? 2 ALA A C 1 2
ATOM 10 O O . ALA A 1 2 ? -0.751 12.365 -0.274 1.00 0.00 ? 2 ALA A O 1 2
ATOM 11 C CB . ALA A 1 2 ? -1.560 13.649 2.378 1.00 0.00 ? 2 ALA A CB 1 2
ATOM 12 H H . ALA A 1 2 ? 0.368 14.948 2.958 1.00 0.00 ? 2 ALA A H 1 2
ATOM 13 H HA . ALA A 1 2 ? 0.035 12.358 2.085 1.00 0.00 ? 2 ALA A HA 1 2
ATOM 14 H HB1 . ALA A 1 2 ? -1.542 13.491 3.409 1.00 0.00 ? 2 ALA A HB1 1 2
ATOM 15 H HB2 . ALA A 1 2 ? -1.856 14.636 2.188 1.00 0.00 ? 2 ALA A HB2 1 2
ATOM 16 H HB3 . ALA A 1 2 ? -2.256 12.987 1.975 1.00 0.00 ? 2 ALA A HB3 1 2
ATOM 17 N N . LYS A 1 3 ? 0.278 14.306 -0.403 1.00 0.00 ? 3 LYS A N 1 3
ATOM 18 C CA . LYS A 1 3 ? 0.514 14.370 -1.826 1.00 0.00 ? 3 LYS A CA 1 3
ATOM 19 C C . LYS A 1 3 ? 1.380 13.245 -2.357 1.00 0.00 ? 3 LYS A C 1 3
ATOM 20 O O . LYS A 1 3 ? 1.368 12.987 -3.551 1.00 0.00 ? 3 LYS A O 1 3
ATOM 21 C CB . LYS A 1 3 ? 1.206 15.657 -2.225 1.00 0.00 ? 3 LYS A CB 1 3
ATOM 22 C CG . LYS A 1 3 ? 0.394 16.853 -2.035 1.00 0.00 ? 3 LYS A CG 1 3
ATOM 23 C CD . LYS A 1 3 ? 1.062 18.184 -2.281 1.00 0.00 ? 3 LYS A CD 1 3
ATOM 24 C CE . LYS A 1 3 ? 1.430 18.387 -3.629 1.00 0.00 ? 3 LYS A CE 1 3
ATOM 25 N NZ . LYS A 1 3 ? 2.010 19.670 -3.902 1.00 0.00 ? 3 LYS A NZ 1 3
ATOM 26 H H . LYS A 1 3 ? 0.623 15.077 0.121 1.00 0.00 ? 3 LYS A H 1 3
ATOM 27 H HA . LYS A 1 3 ? -0.425 14.319 -2.349 1.00 0.00 ? 3 LYS A HA 1 3
ATOM 28 H HB2 . LYS A 1 3 ? 2.122 15.757 -1.643 1.00 0.00 ? 3 LYS A HB2 1 3
ATOM 29 H HB3 . LYS A 1 3 ? 1.491 15.612 -3.230 1.00 0.00 ? 3 LYS A HB3 1 3
ATOM 30 H HG2 . LYS A 1 3 ? -0.482 16.780 -2.680 1.00 0.00 ? 3 LYS A HG2 1 3
ATOM 31 H HG3 . LYS A 1 3 ? 0.075 16.856 -1.076 1.00 0.00 ? 3 LYS A HG3 1 3
ATOM 32 H HD2 . LYS A 1 3 ? 0.379 18.979 -1.983 1.00 0.00 ? 3 LYS A HD2 1 3
ATOM 33 H HD3 . LYS A 1 3 ? 1.867 18.271 -1.688 1.00 0.00 ? 3 LYS A HD3 1 3
ATOM 34 H HE2 . LYS A 1 3 ? 2.124 17.606 -3.939 1.00 0.00 ? 3 LYS A HE2 1 3
ATOM 35 H HE3 . LYS A 1 3 ? 0.608 18.296 -4.144 1.00 0.00 ? 3 LYS A HE3 1 3
ATOM 36 H HZ1 . LYS A 1 3 ? 1.993 19.978 -4.496 1.00 0.00 ? 3 LYS A HZ1 1 3
ATOM 37 H HZ2 . LYS A 1 3 ? 1.845 20.210 -3.609 1.00 0.00 ? 3 LYS A HZ2 1 3
ATOM 38 H HZ3 . LYS A 1 3 ? 2.605 19.779 -3.842 1.00 0.00 ? 3 LYS A HZ3 1 3
ATOM 39 N N . ALA A 1 4 ? 2.041 12.472 -1.501 1.00 0.00 ? 4 ALA A N 1 4
ATOM 40 C CA . ALA A 1 4 ? 2.628 11.190 -1.804 1.00 0.00 ? 4 ALA A CA 1 4
ATOM 41 C C . ALA A 1 4 ? 1.653 10.204 -2.415 1.00 0.00 ? 4 ALA A C 1 4
ATOM 42 O O . ALA A 1 4 ? 2.064 9.156 -2.876 1.00 0.00 ? 4 ALA A O 1 4
ATOM 43 C CB . ALA A 1 4 ? 3.229 10.668 -0.514 1.00 0.00 ? 4 ALA A CB 1 4
ATOM 44 H H . ALA A 1 4 ? 2.074 12.817 -0.564 1.00 0.00 ? 4 ALA A H 1 4
ATOM 45 H HA . ALA A 1 4 ? 3.435 11.333 -2.510 1.00 0.00 ? 4 ALA A HA 1 4
ATOM 46 H HB1 . ALA A 1 4 ? 3.983 11.336 -0.144 1.00 0.00 ? 4 ALA A HB1 1 4
ATOM 47 H HB2 . ALA A 1 4 ? 2.507 10.546 0.259 1.00 0.00 ? 4 ALA A HB2 1 4
ATOM 48 H HB3 . ALA A 1 4 ? 3.720 9.717 -0.652 1.00 0.00 ? 4 ALA A HB3 1 4
ATOM 49 N N . ALA A 1 5 ? 0.357 10.500 -2.414 1.00 0.00 ? 5 ALA A N 1 5
ATOM 50 C CA . ALA A 1 5 ? -0.736 9.613 -2.742 1.00 0.00 ? 5 ALA A CA 1 5
ATOM 51 C C . ALA A 1 5 ? -0.722 9.125 -4.179 1.00 0.00 ? 5 ALA A C 1 5
ATOM 52 O O . ALA A 1 5 ? -0.292 8.015 -4.433 1.00 0.00 ? 5 ALA A O 1 5
ATOM 53 C CB . ALA A 1 5 ? -2.042 10.234 -2.283 1.00 0.00 ? 5 ALA A CB 1 5
ATOM 54 H H . ALA A 1 5 ? 0.153 11.429 -2.096 1.00 0.00 ? 5 ALA A H 1 5
ATOM 55 H HA . ALA A 1 5 ? -0.644 8.728 -2.123 1.00 0.00 ? 5 ALA A HA 1 5
ATOM 56 H HB1 . ALA A 1 5 ? -2.828 9.552 -2.491 1.00 0.00 ? 5 ALA A HB1 1 5
ATOM 57 H HB2 . ALA A 1 5 ? -1.977 10.418 -1.235 1.00 0.00 ? 5 ALA A HB2 1 5
ATOM 58 H HB3 . ALA A 1 5 ? -2.231 11.172 -2.759 1.00 0.00 ? 5 ALA A HB3 1 5
ATOM 59 N N . ALA A 1 6 ? -1.216 9.955 -5.089 1.00 0.00 ? 6 ALA A N 1 6
ATOM 60 C CA . ALA A 1 6 ? -1.490 9.593 -6.455 1.00 0.00 ? 6 ALA A CA 1 6
ATOM 61 C C . ALA A 1 6 ? -0.279 9.323 -7.316 1.00 0.00 ? 6 ALA A C 1 6
ATOM 62 O O . ALA A 1 6 ? -0.442 8.969 -8.469 1.00 0.00 ? 6 ALA A O 1 6
ATOM 63 C CB . ALA A 1 6 ? -2.388 10.646 -7.058 1.00 0.00 ? 6 ALA A CB 1 6
ATOM 64 H H . ALA A 1 6 ? -1.392 10.896 -4.819 1.00 0.00 ? 6 ALA A H 1 6
ATOM 65 H HA . ALA A 1 6 ? -2.021 8.663 -6.421 1.00 0.00 ? 6 ALA A HA 1 6
ATOM 66 H HB1 . ALA A 1 6 ? -3.221 10.783 -6.445 1.00 0.00 ? 6 ALA A HB1 1 6
ATOM 67 H HB2 . ALA A 1 6 ? -1.907 11.560 -7.153 1.00 0.00 ? 6 ALA A HB2 1 6
ATOM 68 H HB3 . ALA A 1 6 ? -2.741 10.335 -7.989 1.00 0.00 ? 6 ALA A HB3 1 6
ATOM 69 N N . ALA A 1 7 ? 0.924 9.377 -6.762 1.00 0.00 ? 7 ALA A N 1 7
ATOM 70 C CA . ALA A 1 7 ? 2.111 8.784 -7.325 1.00 0.00 ? 7 ALA A CA 1 7
ATOM 71 C C . ALA A 1 7 ? 2.322 7.352 -6.882 1.00 0.00 ? 7 ALA A C 1 7
ATOM 72 O O . ALA A 1 7 ? 2.543 6.498 -7.703 1.00 0.00 ? 7 ALA A O 1 7
ATOM 73 C CB . ALA A 1 7 ? 3.307 9.643 -6.972 1.00 0.00 ? 7 ALA A CB 1 7
ATOM 74 H H . ALA A 1 7 ? 0.972 9.761 -5.846 1.00 0.00 ? 7 ALA A H 1 7
ATOM 75 H HA . ALA A 1 7 ? 2.034 8.760 -8.405 1.00 0.00 ? 7 ALA A HA 1 7
ATOM 76 H HB1 . ALA A 1 7 ? 3.212 10.586 -7.415 1.00 0.00 ? 7 ALA A HB1 1 7
ATOM 77 H HB2 . ALA A 1 7 ? 3.373 9.788 -5.945 1.00 0.00 ? 7 ALA A HB2 1 7
ATOM 78 H HB3 . ALA A 1 7 ? 4.201 9.199 -7.266 1.00 0.00 ? 7 ALA A HB3 1 7
ATOM 79 N N . ALA A 1 8 ? 2.282 7.075 -5.598 1.00 0.00 ? 8 ALA A N 1 8
ATOM 80 C CA . ALA A 1 8 ? 2.555 5.775 -5.033 1.00 0.00 ? 8 ALA A CA 1 8
ATOM 81 C C . ALA A 1 8 ? 1.509 4.737 -5.375 1.00 0.00 ? 8 ALA A C 1 8
ATOM 82 O O . ALA A 1 8 ? 1.798 3.790 -6.091 1.00 0.00 ? 8 ALA A O 1 8
ATOM 83 C CB . ALA A 1 8 ? 2.659 5.901 -3.528 1.00 0.00 ? 8 ALA A CB 1 8
ATOM 84 H H . ALA A 1 8 ? 2.045 7.808 -4.979 1.00 0.00 ? 8 ALA A H 1 8
ATOM 85 H HA . ALA A 1 8 ? 3.501 5.437 -5.446 1.00 0.00 ? 8 ALA A HA 1 8
ATOM 86 H HB1 . ALA A 1 8 ? 1.702 6.102 -3.130 1.00 0.00 ? 8 ALA A HB1 1 8
ATOM 87 H HB2 . ALA A 1 8 ? 3.024 4.998 -3.108 1.00 0.00 ? 8 ALA A HB2 1 8
ATOM 88 H HB3 . ALA A 1 8 ? 3.299 6.710 -3.264 1.00 0.00 ? 8 ALA A HB3 1 8
ATOM 89 N N . ILE A 1 9 ? 0.281 4.906 -4.886 1.00 0.00 ? 9 ILE A N 1 9
ATOM 90 C CA . ILE A 1 9 ? -0.737 3.881 -4.934 1.00 0.00 ? 9 ILE A CA 1 9
ATOM 91 C C . ILE A 1 9 ? -1.137 3.524 -6.353 1.00 0.00 ? 9 ILE A C 1 9
ATOM 92 O O . ILE A 1 9 ? -1.630 2.443 -6.617 1.00 0.00 ? 9 ILE A O 1 9
ATOM 93 C CB . ILE A 1 9 ? -1.910 4.201 -4.022 1.00 0.00 ? 9 ILE A CB 1 9
ATOM 94 C CG1 . ILE A 1 9 ? -3.112 4.817 -4.720 1.00 0.00 ? 9 ILE A CG1 1 9
ATOM 95 C CG2 . ILE A 1 9 ? -1.568 5.047 -2.807 1.00 0.00 ? 9 ILE A CG2 1 9
ATOM 96 C CD1 . ILE A 1 9 ? -2.822 6.149 -5.395 1.00 0.00 ? 9 ILE A CD1 1 9
ATOM 97 H H . ILE A 1 9 ? -0.012 5.774 -4.489 1.00 0.00 ? 9 ILE A H 1 9
ATOM 98 H HA . ILE A 1 9 ? -0.271 2.985 -4.541 1.00 0.00 ? 9 ILE A HA 1 9
ATOM 99 H HB . ILE A 1 9 ? -2.260 3.235 -3.673 1.00 0.00 ? 9 ILE A HB 1 9
ATOM 100 H HG12 . ILE A 1 9 ? -3.490 4.117 -5.466 1.00 0.00 ? 9 ILE A HG12 1 9
ATOM 101 H HG13 . ILE A 1 9 ? -3.894 4.958 -3.982 1.00 0.00 ? 9 ILE A HG13 1 9
ATOM 102 H HG21 . ILE A 1 9 ? -1.370 6.075 -3.057 1.00 0.00 ? 9 ILE A HG21 1 9
ATOM 103 H HG22 . ILE A 1 9 ? -2.374 5.004 -2.099 1.00 0.00 ? 9 ILE A HG22 1 9
ATOM 104 H HG23 . ILE A 1 9 ? -0.697 4.632 -2.333 1.00 0.00 ? 9 ILE A HG23 1 9
ATOM 105 H HD11 . ILE A 1 9 ? -3.009 6.953 -4.709 1.00 0.00 ? 9 ILE A HD11 1 9
ATOM 106 H HD12 . ILE A 1 9 ? -1.777 6.174 -5.634 1.00 0.00 ? 9 ILE A HD12 1 9
ATOM 107 H HD13 . ILE A 1 9 ? -3.383 6.256 -6.280 1.00 0.00 ? 9 ILE A HD13 1 9
ATOM 108 N N . LYS A 1 10 ? -0.928 4.466 -7.261 1.00 0.00 ? 10 LYS A N 1 10
ATOM 109 C CA . LYS A 1 10 ? -1.399 4.508 -8.626 1.00 0.00 ? 10 LYS A CA 1 10
ATOM 110 C C . LYS A 1 10 ? -0.572 3.563 -9.481 1.00 0.00 ? 10 LYS A C 1 10
ATOM 111 O O . LYS A 1 10 ? -1.110 2.739 -10.202 1.00 0.00 ? 10 LYS A O 1 10
ATOM 112 C CB . LYS A 1 10 ? -1.304 5.966 -9.050 1.00 0.00 ? 10 LYS A CB 1 10
ATOM 113 C CG . LYS A 1 10 ? -2.520 6.478 -9.785 1.00 0.00 ? 10 LYS A CG 1 10
ATOM 114 C CD . LYS A 1 10 ? -2.684 5.852 -11.135 1.00 0.00 ? 10 LYS A CD 1 10
ATOM 115 C CE . LYS A 1 10 ? -3.793 6.500 -11.925 1.00 0.00 ? 10 LYS A CE 1 10
ATOM 116 N NZ . LYS A 1 10 ? -4.240 5.686 -12.922 1.00 0.00 ? 10 LYS A NZ 1 10
ATOM 117 H H . LYS A 1 10 ? -0.468 5.266 -6.890 1.00 0.00 ? 10 LYS A H 1 10
ATOM 118 H HA . LYS A 1 10 ? -2.412 4.123 -8.641 1.00 0.00 ? 10 LYS A HA 1 10
ATOM 119 H HB2 . LYS A 1 10 ? -1.167 6.573 -8.154 1.00 0.00 ? 10 LYS A HB2 1 10
ATOM 120 H HB3 . LYS A 1 10 ? -0.422 6.136 -9.646 1.00 0.00 ? 10 LYS A HB3 1 10
ATOM 121 H HG2 . LYS A 1 10 ? -3.415 6.298 -9.189 1.00 0.00 ? 10 LYS A HG2 1 10
ATOM 122 H HG3 . LYS A 1 10 ? -2.402 7.538 -9.895 1.00 0.00 ? 10 LYS A HG3 1 10
ATOM 123 H HD2 . LYS A 1 10 ? -1.750 5.918 -11.693 1.00 0.00 ? 10 LYS A HD2 1 10
ATOM 124 H HD3 . LYS A 1 10 ? -2.895 4.826 -10.974 1.00 0.00 ? 10 LYS A HD3 1 10
ATOM 125 H HE2 . LYS A 1 10 ? -4.618 6.751 -11.258 1.00 0.00 ? 10 LYS A HE2 1 10
ATOM 126 H HE3 . LYS A 1 10 ? -3.476 7.340 -12.324 1.00 0.00 ? 10 LYS A HE3 1 10
ATOM 127 H HZ1 . LYS A 1 10 ? -3.713 5.516 -13.515 1.00 0.00 ? 10 LYS A HZ1 1 10
ATOM 128 H HZ2 . LYS A 1 10 ? -4.496 4.864 -12.744 1.00 0.00 ? 10 LYS A HZ2 1 10
ATOM 129 H HZ3 . LYS A 1 10 ? -4.881 6.087 -13.212 1.00 0.00 ? 10 LYS A HZ3 1 10
ATOM 130 N N . ALA A 1 11 ? 0.745 3.582 -9.324 1.00 0.00 ? 11 ALA A N 1 11
ATOM 131 C CA . ALA A 1 11 ? 1.632 2.529 -9.761 1.00 0.00 ? 11 ALA A CA 1 11
ATOM 132 C C . ALA A 1 11 ? 1.344 1.205 -9.079 1.00 0.00 ? 11 ALA A C 1 11
ATOM 133 O O . ALA A 1 11 ? 1.216 0.180 -9.729 1.00 0.00 ? 11 ALA A O 1 11
ATOM 134 C CB . ALA A 1 11 ? 3.057 2.974 -9.525 1.00 0.00 ? 11 ALA A CB 1 11
ATOM 135 H H . ALA A 1 11 ? 1.109 4.260 -8.692 1.00 0.00 ? 11 ALA A H 1 11
ATOM 136 H HA . ALA A 1 11 ? 1.455 2.402 -10.823 1.00 0.00 ? 11 ALA A HA 1 11
ATOM 137 H HB1 . ALA A 1 11 ? 3.714 2.258 -9.917 1.00 0.00 ? 11 ALA A HB1 1 11
ATOM 138 H HB2 . ALA A 1 11 ? 3.248 3.862 -10.036 1.00 0.00 ? 11 ALA A HB2 1 11
ATOM 139 H HB3 . ALA A 1 11 ? 3.261 3.069 -8.511 1.00 0.00 ? 11 ALA A HB3 1 11
ATOM 140 N N . ILE A 1 12 ? 1.224 1.204 -7.758 1.00 0.00 ? 12 ILE A N 1 12
ATOM 141 C CA . ILE A 1 12 ? 1.116 0.017 -6.940 1.00 0.00 ? 12 ILE A CA 1 12
ATOM 142 C C . ILE A 1 12 ? -0.164 -0.726 -7.277 1.00 0.00 ? 12 ILE A C 1 12
ATOM 143 O O . ILE A 1 12 ? -0.089 -1.938 -7.387 1.00 0.00 ? 12 ILE A O 1 12
ATOM 144 C CB . ILE A 1 12 ? 1.311 0.312 -5.462 1.00 0.00 ? 12 ILE A CB 1 12
ATOM 145 C CG1 . ILE A 1 12 ? 2.716 0.778 -5.149 1.00 0.00 ? 12 ILE A CG1 1 12
ATOM 146 C CG2 . ILE A 1 12 ? 0.926 -0.825 -4.552 1.00 0.00 ? 12 ILE A CG2 1 12
ATOM 147 C CD1 . ILE A 1 12 ? 3.809 -0.245 -5.276 1.00 0.00 ? 12 ILE A CD1 1 12
ATOM 148 H H . ILE A 1 12 ? 1.121 2.090 -7.305 1.00 0.00 ? 12 ILE A H 1 12
ATOM 149 H HA . ILE A 1 12 ? 1.884 -0.692 -7.215 1.00 0.00 ? 12 ILE A HA 1 12
ATOM 150 H HB . ILE A 1 12 ? 0.663 1.136 -5.218 1.00 0.00 ? 12 ILE A HB 1 12
ATOM 151 H HG12 . ILE A 1 12 ? 2.949 1.611 -5.812 1.00 0.00 ? 12 ILE A HG12 1 12
ATOM 152 H HG13 . ILE A 1 12 ? 2.760 1.160 -4.143 1.00 0.00 ? 12 ILE A HG13 1 12
ATOM 153 H HG21 . ILE A 1 12 ? -0.132 -0.971 -4.572 1.00 0.00 ? 12 ILE A HG21 1 12
ATOM 154 H HG22 . ILE A 1 12 ? 1.373 -1.748 -4.823 1.00 0.00 ? 12 ILE A HG22 1 12
ATOM 155 H HG23 . ILE A 1 12 ? 1.209 -0.619 -3.541 1.00 0.00 ? 12 ILE A HG23 1 12
ATOM 156 H HD11 . ILE A 1 12 ? 3.753 -0.839 -5.360 1.00 0.00 ? 12 ILE A HD11 1 12
ATOM 157 H HD12 . ILE A 1 12 ? 4.207 -0.253 -5.696 1.00 0.00 ? 12 ILE A HD12 1 12
ATOM 158 H HD13 . ILE A 1 12 ? 4.290 -0.353 -4.870 1.00 0.00 ? 12 ILE A HD13 1 12
ATOM 159 N N . ALA A 1 13 ? -1.277 -0.077 -7.601 1.00 0.00 ? 13 ALA A N 1 13
ATOM 160 C CA . ALA A 1 13 ? -2.478 -0.786 -7.968 1.00 0.00 ? 13 ALA A CA 1 13
ATOM 161 C C . ALA A 1 13 ? -2.430 -1.555 -9.271 1.00 0.00 ? 13 ALA A C 1 13
ATOM 162 O O . ALA A 1 13 ? -3.172 -2.496 -9.478 1.00 0.00 ? 13 ALA A O 1 13
ATOM 163 C CB . ALA A 1 13 ? -3.637 0.187 -7.951 1.00 0.00 ? 13 ALA A CB 1 13
ATOM 164 H H . ALA A 1 13 ? -1.249 0.921 -7.534 1.00 0.00 ? 13 ALA A H 1 13
ATOM 165 H HA . ALA A 1 13 ? -2.643 -1.509 -7.183 1.00 0.00 ? 13 ALA A HA 1 13
ATOM 166 H HB1 . ALA A 1 13 ? -3.557 0.874 -8.770 1.00 0.00 ? 13 ALA A HB1 1 13
ATOM 167 H HB2 . ALA A 1 13 ? -4.541 -0.383 -8.045 1.00 0.00 ? 13 ALA A HB2 1 13
ATOM 168 H HB3 . ALA A 1 13 ? -3.675 0.732 -7.027 1.00 0.00 ? 13 ALA A HB3 1 13
ATOM 169 N N . ALA A 1 14 ? -1.497 -1.190 -10.143 1.00 0.00 ? 14 ALA A N 1 14
ATOM 170 C CA . ALA A 1 14 ? -1.191 -1.904 -11.361 1.00 0.00 ? 14 ALA A CA 1 14
ATOM 171 C C . ALA A 1 14 ? -0.172 -3.005 -11.166 1.00 0.00 ? 14 ALA A C 1 14
ATOM 172 O O . ALA A 1 14 ? -0.365 -4.123 -11.592 1.00 0.00 ? 14 ALA A O 1 14
ATOM 173 C CB . ALA A 1 14 ? -0.798 -0.909 -12.439 1.00 0.00 ? 14 ALA A CB 1 14
ATOM 174 H H . ALA A 1 14 ? -0.877 -0.492 -9.773 1.00 0.00 ? 14 ALA A H 1 14
ATOM 175 H HA . ALA A 1 14 ? -2.081 -2.405 -11.714 1.00 0.00 ? 14 ALA A HA 1 14
ATOM 176 H HB1 . ALA A 1 14 ? -0.349 -0.949 -12.808 1.00 0.00 ? 14 ALA A HB1 1 14
ATOM 177 H HB2 . ALA A 1 14 ? -1.108 -0.756 -12.920 1.00 0.00 ? 14 ALA A HB2 1 14
ATOM 178 H HB3 . ALA A 1 14 ? -0.625 -0.304 -12.447 1.00 0.00 ? 14 ALA A HB3 1 14
ATOM 179 N N . ILE A 1 15 ? 0.869 -2.731 -10.382 1.00 0.00 ? 15 ILE A N 1 15
ATOM 180 C CA . ILE A 1 15 ? 1.894 -3.615 -9.875 1.00 0.00 ? 15 ILE A CA 1 15
ATOM 181 C C . ILE A 1 15 ? 1.241 -4.727 -9.071 1.00 0.00 ? 15 ILE A C 1 15
ATOM 182 O O . ILE A 1 15 ? 1.719 -5.851 -9.129 1.00 0.00 ? 15 ILE A O 1 15
ATOM 183 C CB . ILE A 1 15 ? 2.931 -2.840 -9.077 1.00 0.00 ? 15 ILE A CB 1 15
ATOM 184 C CG1 . ILE A 1 15 ? 3.765 -1.923 -9.946 1.00 0.00 ? 15 ILE A CG1 1 15
ATOM 185 C CG2 . ILE A 1 15 ? 3.828 -3.693 -8.199 1.00 0.00 ? 15 ILE A CG2 1 15
ATOM 186 C CD1 . ILE A 1 15 ? 4.503 -0.818 -9.210 1.00 0.00 ? 15 ILE A CD1 1 15
ATOM 187 H H . ILE A 1 15 ? 0.866 -1.816 -9.978 1.00 0.00 ? 15 ILE A H 1 15
ATOM 188 H HA . ILE A 1 15 ? 2.384 -4.069 -10.727 1.00 0.00 ? 15 ILE A HA 1 15
ATOM 189 H HB . ILE A 1 15 ? 2.400 -2.180 -8.406 1.00 0.00 ? 15 ILE A HB 1 15
ATOM 190 H HG12 . ILE A 1 15 ? 4.487 -2.528 -10.493 1.00 0.00 ? 15 ILE A HG12 1 15
ATOM 191 H HG13 . ILE A 1 15 ? 3.136 -1.430 -10.671 1.00 0.00 ? 15 ILE A HG13 1 15
ATOM 192 H HG21 . ILE A 1 15 ? 4.464 -4.275 -8.806 1.00 0.00 ? 15 ILE A HG21 1 15
ATOM 193 H HG22 . ILE A 1 15 ? 4.437 -3.114 -7.538 1.00 0.00 ? 15 ILE A HG22 1 15
ATOM 194 H HG23 . ILE A 1 15 ? 3.253 -4.311 -7.552 1.00 0.00 ? 15 ILE A HG23 1 15
ATOM 195 H HD11 . ILE A 1 15 ? 4.777 -0.177 -9.671 1.00 0.00 ? 15 ILE A HD11 1 15
ATOM 196 H HD12 . ILE A 1 15 ? 4.077 -0.411 -8.642 1.00 0.00 ? 15 ILE A HD12 1 15
ATOM 197 H HD13 . ILE A 1 15 ? 5.189 -1.042 -8.817 1.00 0.00 ? 15 ILE A HD13 1 15
ATOM 198 N N . ILE A 1 16 ? 0.137 -4.483 -8.369 1.00 0.00 ? 16 ILE A N 1 16
ATOM 199 C CA . ILE A 1 16 ? -0.685 -5.475 -7.721 1.00 0.00 ? 16 ILE A CA 1 16
ATOM 200 C C . ILE A 1 16 ? -1.251 -6.471 -8.715 1.00 0.00 ? 16 ILE A C 1 16
ATOM 201 O O . ILE A 1 16 ? -1.001 -7.661 -8.588 1.00 0.00 ? 16 ILE A O 1 16
ATOM 202 C CB . ILE A 1 16 ? -1.758 -4.828 -6.860 1.00 0.00 ? 16 ILE A CB 1 16
ATOM 203 C CG1 . ILE A 1 16 ? -1.040 -4.391 -5.595 1.00 0.00 ? 16 ILE A CG1 1 16
ATOM 204 C CG2 . ILE A 1 16 ? -2.907 -5.753 -6.512 1.00 0.00 ? 16 ILE A CG2 1 16
ATOM 205 C CD1 . ILE A 1 16 ? -1.859 -3.778 -4.492 1.00 0.00 ? 16 ILE A CD1 1 16
ATOM 206 H H . ILE A 1 16 ? -0.087 -3.511 -8.280 1.00 0.00 ? 16 ILE A H 1 16
ATOM 207 H HA . ILE A 1 16 ? -0.034 -6.073 -7.100 1.00 0.00 ? 16 ILE A HA 1 16
ATOM 208 H HB . ILE A 1 16 ? -2.113 -3.940 -7.371 1.00 0.00 ? 16 ILE A HB 1 16
ATOM 209 H HG12 . ILE A 1 16 ? -0.536 -5.266 -5.184 1.00 0.00 ? 16 ILE A HG12 1 16
ATOM 210 H HG13 . ILE A 1 16 ? -0.270 -3.694 -5.863 1.00 0.00 ? 16 ILE A HG13 1 16
ATOM 211 H HG21 . ILE A 1 16 ? -3.452 -6.045 -7.396 1.00 0.00 ? 16 ILE A HG21 1 16
ATOM 212 H HG22 . ILE A 1 16 ? -2.536 -6.646 -6.031 1.00 0.00 ? 16 ILE A HG22 1 16
ATOM 213 H HG23 . ILE A 1 16 ? -3.618 -5.257 -5.863 1.00 0.00 ? 16 ILE A HG23 1 16
ATOM 214 H HD11 . ILE A 1 16 ? -2.470 -3.020 -4.880 1.00 0.00 ? 16 ILE A HD11 1 16
ATOM 215 H HD12 . ILE A 1 16 ? -2.460 -4.535 -4.060 1.00 0.00 ? 16 ILE A HD12 1 16
ATOM 216 H HD13 . ILE A 1 16 ? -1.210 -3.391 -3.728 1.00 0.00 ? 16 ILE A HD13 1 16
ATOM 217 N N . LYS A 1 17 ? -2.001 -5.978 -9.694 1.00 0.00 ? 17 LYS A N 1 17
ATOM 218 C CA . LYS A 1 17 ? -2.587 -6.788 -10.737 1.00 0.00 ? 17 LYS A CA 1 17
ATOM 219 C C . LYS A 1 17 ? -1.560 -7.601 -11.499 1.00 0.00 ? 17 LYS A C 1 17
ATOM 220 O O . LYS A 1 17 ? -1.765 -8.783 -11.709 1.00 0.00 ? 17 LYS A O 1 17
ATOM 221 C CB . LYS A 1 17 ? -3.380 -5.889 -11.663 1.00 0.00 ? 17 LYS A CB 1 17
ATOM 222 C CG . LYS A 1 17 ? -4.421 -6.674 -12.419 1.00 0.00 ? 17 LYS A CG 1 17
ATOM 223 C CD . LYS A 1 17 ? -5.311 -5.789 -13.231 1.00 0.00 ? 17 LYS A CD 1 17
ATOM 224 C CE . LYS A 1 17 ? -4.654 -5.301 -14.473 1.00 0.00 ? 17 LYS A CE 1 17
ATOM 225 N NZ . LYS A 1 17 ? -5.534 -4.526 -15.287 1.00 0.00 ? 17 LYS A NZ 1 17
ATOM 226 H H . LYS A 1 17 ? -2.119 -4.988 -9.676 1.00 0.00 ? 17 LYS A H 1 17
ATOM 227 H HA . LYS A 1 17 ? -3.249 -7.500 -10.256 1.00 0.00 ? 17 LYS A HA 1 17
ATOM 228 H HB2 . LYS A 1 17 ? -3.876 -5.116 -11.078 1.00 0.00 ? 17 LYS A HB2 1 17
ATOM 229 H HB3 . LYS A 1 17 ? -2.706 -5.367 -12.315 1.00 0.00 ? 17 LYS A HB3 1 17
ATOM 230 H HG2 . LYS A 1 17 ? -3.943 -7.414 -13.061 1.00 0.00 ? 17 LYS A HG2 1 17
ATOM 231 H HG3 . LYS A 1 17 ? -5.008 -7.177 -11.696 1.00 0.00 ? 17 LYS A HG3 1 17
ATOM 232 H HD2 . LYS A 1 17 ? -6.227 -6.322 -13.486 1.00 0.00 ? 17 LYS A HD2 1 17
ATOM 233 H HD3 . LYS A 1 17 ? -5.570 -4.956 -12.641 1.00 0.00 ? 17 LYS A HD3 1 17
ATOM 234 H HE2 . LYS A 1 17 ? -3.796 -4.688 -14.198 1.00 0.00 ? 17 LYS A HE2 1 17
ATOM 235 H HE3 . LYS A 1 17 ? -4.270 -6.085 -15.036 1.00 0.00 ? 17 LYS A HE3 1 17
ATOM 236 H HZ1 . LYS A 1 17 ? -6.329 -5.004 -15.528 1.00 0.00 ? 17 LYS A HZ1 1 17
ATOM 237 H HZ2 . LYS A 1 17 ? -5.818 -3.731 -14.813 1.00 0.00 ? 17 LYS A HZ2 1 17
ATOM 238 H HZ3 . LYS A 1 17 ? -5.140 -4.219 -16.135 1.00 0.00 ? 17 LYS A HZ3 1 17
ATOM 239 N N . ALA A 1 18 ? -0.391 -7.041 -11.796 1.00 0.00 ? 18 ALA A N 1 18
ATOM 240 C CA . ALA A 1 18 ? 0.723 -7.701 -12.431 1.00 0.00 ? 18 ALA A CA 1 18
ATOM 241 C C . ALA A 1 18 ? 1.490 -8.643 -11.526 1.00 0.00 ? 18 ALA A C 1 18
ATOM 242 O O . ALA A 1 18 ? 2.047 -9.613 -11.967 1.00 0.00 ? 18 ALA A O 1 18
ATOM 243 C CB . ALA A 1 18 ? 1.662 -6.669 -13.016 1.00 0.00 ? 18 ALA A CB 1 18
ATOM 244 H H . ALA A 1 18 ? -0.287 -6.087 -11.511 1.00 0.00 ? 18 ALA A H 1 18
ATOM 245 H HA . ALA A 1 18 ? 0.345 -8.284 -13.255 1.00 0.00 ? 18 ALA A HA 1 18
ATOM 246 H HB1 . ALA A 1 18 ? 2.500 -7.145 -13.461 1.00 0.00 ? 18 ALA A HB1 1 18
ATOM 247 H HB2 . ALA A 1 18 ? 1.157 -6.122 -13.767 1.00 0.00 ? 18 ALA A HB2 1 18
ATOM 248 H HB3 . ALA A 1 18 ? 2.006 -6.008 -12.257 1.00 0.00 ? 18 ALA A HB3 1 18
ATOM 249 N N . GLY A 1 19 ? 1.503 -8.372 -10.238 1.00 0.00 ? 19 GLY A N 1 19
ATOM 250 C CA . GLY A 1 19 ? 2.128 -9.151 -9.200 1.00 0.00 ? 19 GLY A CA 1 19
ATOM 251 C C . GLY A 1 19 ? 1.369 -10.419 -8.882 1.00 0.00 ? 19 GLY A C 1 19
ATOM 252 O O . GLY A 1 19 ? 1.960 -11.339 -8.382 1.00 0.00 ? 19 GLY A O 1 19
ATOM 253 H H . GLY A 1 19 ? 1.031 -7.544 -9.988 1.00 0.00 ? 19 GLY A H 1 19
ATOM 254 H HA2 . GLY A 1 19 ? 3.123 -9.420 -9.485 1.00 0.00 ? 19 GLY A HA2 1 19
ATOM 255 H HA3 . GLY A 1 19 ? 2.168 -8.564 -8.311 1.00 0.00 ? 19 GLY A HA3 1 19
ATOM 256 N N . GLY A 1 20 ? 0.088 -10.484 -9.190 1.00 0.00 ? 20 GLY A N 1 20
ATOM 257 C CA . GLY A 1 20 ? -0.756 -11.602 -8.892 1.00 0.00 ? 20 GLY A CA 1 20
ATOM 258 C C . GLY A 1 20 ? -1.038 -11.809 -7.420 1.00 0.00 ? 20 GLY A C 1 20
ATOM 259 O O . GLY A 1 20 ? -1.203 -12.933 -6.976 1.00 0.00 ? 20 GLY A O 1 20
ATOM 260 H H . GLY A 1 20 ? -0.290 -9.693 -9.654 1.00 0.00 ? 20 GLY A H 1 20
ATOM 261 H HA2 . GLY A 1 20 ? -1.689 -11.470 -9.389 1.00 0.00 ? 20 GLY A HA2 1 20
ATOM 262 H HA3 . GLY A 1 20 ? -0.291 -12.493 -9.254 1.00 0.00 ? 20 GLY A HA3 1 20
ATOM 263 N N . TYR A 1 21 ? -1.043 -10.753 -6.623 1.00 0.00 ? 21 TYR A N 1 21
ATOM 264 C CA . TYR A 1 21 ? -1.106 -10.773 -5.192 1.00 0.00 ? 21 TYR A CA 1 21
ATOM 265 C C . TYR A 1 21 ? -2.215 -11.588 -4.573 1.00 0.00 ? 21 TYR A C 1 21
ATOM 266 O O . TYR A 1 21 ? -2.037 -12.154 -3.556 1.00 0.00 ? 21 TYR A O 1 21
ATOM 267 C CB . TYR A 1 21 ? -1.238 -9.339 -4.714 1.00 0.00 ? 21 TYR A CB 1 21
ATOM 268 C CG . TYR A 1 21 ? 0.032 -8.699 -4.219 1.00 0.00 ? 21 TYR A CG 1 21
ATOM 269 C CD1 . TYR A 1 21 ? 0.630 -8.994 -2.999 1.00 0.00 ? 21 TYR A CD1 1 21
ATOM 270 C CD2 . TYR A 1 21 ? 0.518 -7.656 -4.996 1.00 0.00 ? 21 TYR A CD2 1 21
ATOM 271 C CE1 . TYR A 1 21 ? 1.665 -8.187 -2.531 1.00 0.00 ? 21 TYR A CE1 1 21
ATOM 272 C CE2 . TYR A 1 21 ? 1.545 -6.836 -4.531 1.00 0.00 ? 21 TYR A CE2 1 21
ATOM 273 C CZ . TYR A 1 21 ? 2.119 -7.098 -3.284 1.00 0.00 ? 21 TYR A CZ 1 21
ATOM 274 O OH . TYR A 1 21 ? 3.135 -6.301 -2.861 1.00 0.00 ? 21 TYR A OH 1 21
ATOM 275 H H . TYR A 1 21 ? -0.909 -9.861 -7.037 1.00 0.00 ? 21 TYR A H 1 21
ATOM 276 H HA . TYR A 1 21 ? -0.170 -11.161 -4.821 1.00 0.00 ? 21 TYR A HA 1 21
ATOM 277 H HB2 . TYR A 1 21 ? -1.641 -8.742 -5.532 1.00 0.00 ? 21 TYR A HB2 1 21
ATOM 278 H HB3 . TYR A 1 21 ? -1.925 -9.259 -3.890 1.00 0.00 ? 21 TYR A HB3 1 21
ATOM 279 H HD1 . TYR A 1 21 ? 0.301 -9.801 -2.379 1.00 0.00 ? 21 TYR A HD1 1 21
ATOM 280 H HD2 . TYR A 1 21 ? 0.012 -7.455 -5.913 1.00 0.00 ? 21 TYR A HD2 1 21
ATOM 281 H HE1 . TYR A 1 21 ? 2.099 -8.351 -1.569 1.00 0.00 ? 21 TYR A HE1 1 21
ATOM 282 H HE2 . TYR A 1 21 ? 1.855 -6.007 -5.125 1.00 0.00 ? 21 TYR A HE2 1 21
ATOM 283 H HH . TYR A 1 21 ? 3.880 -6.569 -3.380 1.00 0.00 ? 21 TYR A HH 1 21
HETATM 284 N N . NH2 A 1 22 ? -3.347 -11.707 -5.189 1.00 0.00 ? 22 NH2 A N 1 22
HETATM 285 H HN1 . NH2 A 1 22 ? -4.100 -12.248 -4.869 1.00 0.00 ? 22 NH2 A HN1 1 22
HETATM 286 H HN2 . NH2 A 1 22 ? -3.381 -11.311 -6.051 1.00 0.00 ? 22 NH2 A HN2 1 22
HETATM 287 C C . ACE B 1 1 ? 2.247 -15.865 -3.173 1.00 0.00 ? 23 ACE B C 1 1
HETATM 288 O O . ACE B 1 1 ? 3.095 -16.020 -2.339 1.00 0.00 ? 23 ACE B O 1 1
HETATM 289 C CH3 . ACE B 1 1 ? 1.816 -17.024 -4.006 1.00 0.00 ? 23 ACE B CH3 1 1
HETATM 290 H H1 . ACE B 1 1 ? 2.135 -17.517 -4.147 1.00 0.00 ? 23 ACE B H1 1 1
HETATM 291 H H2 . ACE B 1 1 ? 1.325 -17.355 -3.875 1.00 0.00 ? 23 ACE B H2 1 1
HETATM 292 H H3 . ACE B 1 1 ? 1.680 -16.998 -4.562 1.00 0.00 ? 23 ACE B H3 1 1
ATOM 293 N N . ALA B 1 2 ? 1.682 -14.718 -3.442 1.00 0.00 ? 24 ALA B N 1 2
ATOM 294 C CA . ALA B 1 2 ? 1.908 -13.440 -2.842 1.00 0.00 ? 24 ALA B CA 1 2
ATOM 295 C C . ALA B 1 2 ? 3.337 -12.941 -2.806 1.00 0.00 ? 24 ALA B C 1 2
ATOM 296 O O . ALA B 1 2 ? 3.647 -12.038 -2.065 1.00 0.00 ? 24 ALA B O 1 2
ATOM 297 C CB . ALA B 1 2 ? 1.207 -13.409 -1.522 1.00 0.00 ? 24 ALA B CB 1 2
ATOM 298 H H . ALA B 1 2 ? 1.005 -14.730 -4.168 1.00 0.00 ? 24 ALA B H 1 2
ATOM 299 H HA . ALA B 1 2 ? 1.406 -12.716 -3.441 1.00 0.00 ? 24 ALA B HA 1 2
ATOM 300 H HB1 . ALA B 1 2 ? 1.385 -13.340 -0.909 1.00 0.00 ? 24 ALA B HB1 1 2
ATOM 301 H HB2 . ALA B 1 2 ? 0.812 -13.038 -1.369 1.00 0.00 ? 24 ALA B HB2 1 2
ATOM 302 H HB3 . ALA B 1 2 ? 0.886 -13.785 -1.325 1.00 0.00 ? 24 ALA B HB3 1 2
ATOM 303 N N . LYS B 1 3 ? 4.215 -13.519 -3.606 1.00 0.00 ? 25 LYS B N 1 3
ATOM 304 C CA . LYS B 1 3 ? 5.611 -13.170 -3.697 1.00 0.00 ? 25 LYS B CA 1 3
ATOM 305 C C . LYS B 1 3 ? 5.887 -11.810 -4.286 1.00 0.00 ? 25 LYS B C 1 3
ATOM 306 O O . LYS B 1 3 ? 6.960 -11.286 -4.123 1.00 0.00 ? 25 LYS B O 1 3
ATOM 307 C CB . LYS B 1 3 ? 6.315 -14.193 -4.560 1.00 0.00 ? 25 LYS B CB 1 3
ATOM 308 C CG . LYS B 1 3 ? 6.305 -15.591 -3.998 1.00 0.00 ? 25 LYS B CG 1 3
ATOM 309 C CD . LYS B 1 3 ? 7.032 -16.637 -4.770 1.00 0.00 ? 25 LYS B CD 1 3
ATOM 310 C CE . LYS B 1 3 ? 6.428 -16.894 -6.029 1.00 0.00 ? 25 LYS B CE 1 3
ATOM 311 N NZ . LYS B 1 3 ? 6.976 -17.988 -6.629 1.00 0.00 ? 25 LYS B NZ 1 3
ATOM 312 H H . LYS B 1 3 ? 3.860 -14.243 -4.171 1.00 0.00 ? 25 LYS B H 1 3
ATOM 313 H HA . LYS B 1 3 ? 6.085 -13.205 -2.727 1.00 0.00 ? 25 LYS B HA 1 3
ATOM 314 H HB2 . LYS B 1 3 ? 5.861 -14.201 -5.551 1.00 0.00 ? 25 LYS B HB2 1 3
ATOM 315 H HB3 . LYS B 1 3 ? 7.341 -13.889 -4.667 1.00 0.00 ? 25 LYS B HB3 1 3
ATOM 316 H HG2 . LYS B 1 3 ? 6.719 -15.552 -2.991 1.00 0.00 ? 25 LYS B HG2 1 3
ATOM 317 H HG3 . LYS B 1 3 ? 5.337 -15.945 -3.922 1.00 0.00 ? 25 LYS B HG3 1 3
ATOM 318 H HD2 . LYS B 1 3 ? 8.057 -16.302 -4.929 1.00 0.00 ? 25 LYS B HD2 1 3
ATOM 319 H HD3 . LYS B 1 3 ? 7.109 -17.538 -4.251 1.00 0.00 ? 25 LYS B HD3 1 3
ATOM 320 H HE2 . LYS B 1 3 ? 5.362 -17.069 -5.884 1.00 0.00 ? 25 LYS B HE2 1 3
ATOM 321 H HE3 . LYS B 1 3 ? 6.486 -16.095 -6.609 1.00 0.00 ? 25 LYS B HE3 1 3
ATOM 322 H HZ1 . LYS B 1 3 ? 6.840 -18.749 -6.150 1.00 0.00 ? 25 LYS B HZ1 1 3
ATOM 323 H HZ2 . LYS B 1 3 ? 6.595 -18.058 -7.460 1.00 0.00 ? 25 LYS B HZ2 1 3
ATOM 324 H HZ3 . LYS B 1 3 ? 7.869 -17.876 -6.681 1.00 0.00 ? 25 LYS B HZ3 1 3
ATOM 325 N N . ALA B 1 4 ? 4.880 -11.165 -4.860 1.00 0.00 ? 26 ALA B N 1 4
ATOM 326 C CA . ALA B 1 4 ? 4.812 -9.761 -5.179 1.00 0.00 ? 26 ALA B CA 1 4
ATOM 327 C C . ALA B 1 4 ? 5.058 -8.830 -4.006 1.00 0.00 ? 26 ALA B C 1 4
ATOM 328 O O . ALA B 1 4 ? 5.146 -7.621 -4.172 1.00 0.00 ? 26 ALA B O 1 4
ATOM 329 C CB . ALA B 1 4 ? 3.469 -9.492 -5.828 1.00 0.00 ? 26 ALA B CB 1 4
ATOM 330 H H . ALA B 1 4 ? 4.055 -11.711 -4.976 1.00 0.00 ? 26 ALA B H 1 4
ATOM 331 H HA . ALA B 1 4 ? 5.605 -9.526 -5.864 1.00 0.00 ? 26 ALA B HA 1 4
ATOM 332 H HB1 . ALA B 1 4 ? 3.330 -10.046 -6.729 1.00 0.00 ? 26 ALA B HB1 1 4
ATOM 333 H HB2 . ALA B 1 4 ? 2.701 -9.777 -5.168 1.00 0.00 ? 26 ALA B HB2 1 4
ATOM 334 H HB3 . ALA B 1 4 ? 3.348 -8.457 -6.033 1.00 0.00 ? 26 ALA B HB3 1 4
ATOM 335 N N . ALA B 1 5 ? 5.149 -9.370 -2.794 1.00 0.00 ? 27 ALA B N 1 5
ATOM 336 C CA . ALA B 1 5 ? 5.169 -8.612 -1.572 1.00 0.00 ? 27 ALA B CA 1 5
ATOM 337 C C . ALA B 1 5 ? 6.406 -7.742 -1.444 1.00 0.00 ? 27 ALA B C 1 5
ATOM 338 O O . ALA B 1 5 ? 6.344 -6.554 -1.741 1.00 0.00 ? 27 ALA B O 1 5
ATOM 339 C CB . ALA B 1 5 ? 4.961 -9.628 -0.467 1.00 0.00 ? 27 ALA B CB 1 5
ATOM 340 H H . ALA B 1 5 ? 5.150 -10.373 -2.737 1.00 0.00 ? 27 ALA B H 1 5
ATOM 341 H HA . ALA B 1 5 ? 4.334 -7.932 -1.548 1.00 0.00 ? 27 ALA B HA 1 5
ATOM 342 H HB1 . ALA B 1 5 ? 3.980 -10.040 -0.517 1.00 0.00 ? 27 ALA B HB1 1 5
ATOM 343 H HB2 . ALA B 1 5 ? 5.661 -10.416 -0.522 1.00 0.00 ? 27 ALA B HB2 1 5
ATOM 344 H HB3 . ALA B 1 5 ? 5.041 -9.163 0.471 1.00 0.00 ? 27 ALA B HB3 1 5
ATOM 345 N N . ALA B 1 6 ? 7.536 -8.305 -1.026 1.00 0.00 ? 28 ALA B N 1 6
ATOM 346 C CA . ALA B 1 6 ? 8.729 -7.550 -0.718 1.00 0.00 ? 28 ALA B CA 1 6
ATOM 347 C C . ALA B 1 6 ? 9.459 -6.995 -1.922 1.00 0.00 ? 28 ALA B C 1 6
ATOM 348 O O . ALA B 1 6 ? 10.551 -6.468 -1.783 1.00 0.00 ? 28 ALA B O 1 6
ATOM 349 C CB . ALA B 1 6 ? 9.623 -8.345 0.209 1.00 0.00 ? 28 ALA B CB 1 6
ATOM 350 H H . ALA B 1 6 ? 7.510 -9.281 -0.822 1.00 0.00 ? 28 ALA B H 1 6
ATOM 351 H HA . ALA B 1 6 ? 8.352 -6.702 -0.161 1.00 0.00 ? 28 ALA B HA 1 6
ATOM 352 H HB1 . ALA B 1 6 ? 9.093 -8.711 1.047 1.00 0.00 ? 28 ALA B HB1 1 6
ATOM 353 H HB2 . ALA B 1 6 ? 10.007 -9.214 -0.262 1.00 0.00 ? 28 ALA B HB2 1 6
ATOM 354 H HB3 . ALA B 1 6 ? 10.440 -7.752 0.553 1.00 0.00 ? 28 ALA B HB3 1 6
ATOM 355 N N . ALA B 1 7 ? 8.869 -6.970 -3.109 1.00 0.00 ? 29 ALA B N 1 7
ATOM 356 C CA . ALA B 1 7 ? 9.165 -6.048 -4.174 1.00 0.00 ? 29 ALA B CA 1 7
ATOM 357 C C . ALA B 1 7 ? 8.384 -4.758 -4.053 1.00 0.00 ? 29 ALA B C 1 7
ATOM 358 O O . ALA B 1 7 ? 8.986 -3.716 -3.886 1.00 0.00 ? 29 ALA B O 1 7
ATOM 359 C CB . ALA B 1 7 ? 8.905 -6.705 -5.505 1.00 0.00 ? 29 ALA B CB 1 7
ATOM 360 H H . ALA B 1 7 ? 7.986 -7.430 -3.115 1.00 0.00 ? 29 ALA B H 1 7
ATOM 361 H HA . ALA B 1 7 ? 10.215 -5.815 -4.173 1.00 0.00 ? 29 ALA B HA 1 7
ATOM 362 H HB1 . ALA B 1 7 ? 8.924 -5.972 -6.258 1.00 0.00 ? 29 ALA B HB1 1 7
ATOM 363 H HB2 . ALA B 1 7 ? 9.599 -7.479 -5.687 1.00 0.00 ? 29 ALA B HB2 1 7
ATOM 364 H HB3 . ALA B 1 7 ? 7.952 -7.131 -5.507 1.00 0.00 ? 29 ALA B HB3 1 7
ATOM 365 N N . ALA B 1 8 ? 7.059 -4.816 -4.125 1.00 0.00 ? 30 ALA B N 1 8
ATOM 366 C CA . ALA B 1 8 ? 6.229 -3.640 -4.248 1.00 0.00 ? 30 ALA B CA 1 8
ATOM 367 C C . ALA B 1 8 ? 6.062 -2.932 -2.917 1.00 0.00 ? 30 ALA B C 1 8
ATOM 368 O O . ALA B 1 8 ? 6.033 -1.720 -2.829 1.00 0.00 ? 30 ALA B O 1 8
ATOM 369 C CB . ALA B 1 8 ? 4.884 -4.062 -4.790 1.00 0.00 ? 30 ALA B CB 1 8
ATOM 370 H H . ALA B 1 8 ? 6.601 -5.696 -4.022 1.00 0.00 ? 30 ALA B H 1 8
ATOM 371 H HA . ALA B 1 8 ? 6.711 -2.951 -4.928 1.00 0.00 ? 30 ALA B HA 1 8
ATOM 372 H HB1 . ALA B 1 8 ? 4.266 -3.210 -4.959 1.00 0.00 ? 30 ALA B HB1 1 8
ATOM 373 H HB2 . ALA B 1 8 ? 4.959 -4.646 -5.672 1.00 0.00 ? 30 ALA B HB2 1 8
ATOM 374 H HB3 . ALA B 1 8 ? 4.405 -4.620 -4.028 1.00 0.00 ? 30 ALA B HB3 1 8
ATOM 375 N N . ILE B 1 9 ? 5.999 -3.690 -1.835 1.00 0.00 ? 31 ILE B N 1 9
ATOM 376 C CA . ILE B 1 9 ? 5.961 -3.214 -0.474 1.00 0.00 ? 31 ILE B CA 1 9
ATOM 377 C C . ILE B 1 9 ? 7.235 -2.485 -0.093 1.00 0.00 ? 31 ILE B C 1 9
ATOM 378 O O . ILE B 1 9 ? 7.176 -1.468 0.580 1.00 0.00 ? 31 ILE B O 1 9
ATOM 379 C CB . ILE B 1 9 ? 5.720 -4.370 0.488 1.00 0.00 ? 31 ILE B CB 1 9
ATOM 380 C CG1 . ILE B 1 9 ? 4.432 -5.138 0.225 1.00 0.00 ? 31 ILE B CG1 1 9
ATOM 381 C CG2 . ILE B 1 9 ? 5.781 -3.935 1.930 1.00 0.00 ? 31 ILE B CG2 1 9
ATOM 382 C CD1 . ILE B 1 9 ? 3.192 -4.284 0.325 1.00 0.00 ? 31 ILE B CD1 1 9
ATOM 383 H H . ILE B 1 9 ? 5.945 -4.678 -1.955 1.00 0.00 ? 31 ILE B H 1 9
ATOM 384 H HA . ILE B 1 9 ? 5.155 -2.495 -0.366 1.00 0.00 ? 31 ILE B HA 1 9
ATOM 385 H HB . ILE B 1 9 ? 6.593 -4.996 0.354 1.00 0.00 ? 31 ILE B HB 1 9
ATOM 386 H HG12 . ILE B 1 9 ? 4.480 -5.557 -0.780 1.00 0.00 ? 31 ILE B HG12 1 9
ATOM 387 H HG13 . ILE B 1 9 ? 4.370 -5.986 0.881 1.00 0.00 ? 31 ILE B HG13 1 9
ATOM 388 H HG21 . ILE B 1 9 ? 5.631 -3.240 2.066 1.00 0.00 ? 31 ILE B HG21 1 9
ATOM 389 H HG22 . ILE B 1 9 ? 5.349 -4.270 2.446 1.00 0.00 ? 31 ILE B HG22 1 9
ATOM 390 H HG23 . ILE B 1 9 ? 6.443 -4.021 2.265 1.00 0.00 ? 31 ILE B HG23 1 9
ATOM 391 H HD11 . ILE B 1 9 ? 3.112 -3.786 0.506 1.00 0.00 ? 31 ILE B HD11 1 9
ATOM 392 H HD12 . ILE B 1 9 ? 2.853 -4.127 -0.070 1.00 0.00 ? 31 ILE B HD12 1 9
ATOM 393 H HD13 . ILE B 1 9 ? 2.740 -4.357 0.570 1.00 0.00 ? 31 ILE B HD13 1 9
ATOM 394 N N . LYS B 1 10 ? 8.389 -3.007 -0.501 1.00 0.00 ? 32 LYS B N 1 10
ATOM 395 C CA . LYS B 1 10 ? 9.676 -2.399 -0.253 1.00 0.00 ? 32 LYS B CA 1 10
ATOM 396 C C . LYS B 1 10 ? 9.830 -1.055 -0.935 1.00 0.00 ? 32 LYS B C 1 10
ATOM 397 O O . LYS B 1 10 ? 10.309 -0.122 -0.331 1.00 0.00 ? 32 LYS B O 1 10
ATOM 398 C CB . LYS B 1 10 ? 10.788 -3.342 -0.681 1.00 0.00 ? 32 LYS B CB 1 10
ATOM 399 C CG . LYS B 1 10 ? 11.278 -4.232 0.435 1.00 0.00 ? 32 LYS B CG 1 10
ATOM 400 C CD . LYS B 1 10 ? 12.645 -4.808 0.209 1.00 0.00 ? 32 LYS B CD 1 10
ATOM 401 C CE . LYS B 1 10 ? 13.154 -5.519 1.384 1.00 0.00 ? 32 LYS B CE 1 10
ATOM 402 N NZ . LYS B 1 10 ? 14.372 -6.171 1.159 1.00 0.00 ? 32 LYS B NZ 1 10
ATOM 403 H H . LYS B 1 10 ? 8.314 -3.765 -1.144 1.00 0.00 ? 32 LYS B H 1 10
ATOM 404 H HA . LYS B 1 10 ? 9.754 -2.180 0.809 1.00 0.00 ? 32 LYS B HA 1 10
ATOM 405 H HB2 . LYS B 1 10 ? 10.427 -3.964 -1.500 1.00 0.00 ? 32 LYS B HB2 1 10
ATOM 406 H HB3 . LYS B 1 10 ? 11.623 -2.791 -1.062 1.00 0.00 ? 32 LYS B HB3 1 10
ATOM 407 H HG2 . LYS B 1 10 ? 11.307 -3.646 1.354 1.00 0.00 ? 32 LYS B HG2 1 10
ATOM 408 H HG3 . LYS B 1 10 ? 10.551 -4.988 0.611 1.00 0.00 ? 32 LYS B HG3 1 10
ATOM 409 H HD2 . LYS B 1 10 ? 12.622 -5.478 -0.650 1.00 0.00 ? 32 LYS B HD2 1 10
ATOM 410 H HD3 . LYS B 1 10 ? 13.314 -4.057 0.011 1.00 0.00 ? 32 LYS B HD3 1 10
ATOM 411 H HE2 . LYS B 1 10 ? 13.294 -4.801 2.193 1.00 0.00 ? 32 LYS B HE2 1 10
ATOM 412 H HE3 . LYS B 1 10 ? 12.468 -6.136 1.698 1.00 0.00 ? 32 LYS B HE3 1 10
ATOM 413 H HZ1 . LYS B 1 10 ? 14.269 -6.760 0.520 1.00 0.00 ? 32 LYS B HZ1 1 10
ATOM 414 H HZ2 . LYS B 1 10 ? 15.032 -5.622 0.927 1.00 0.00 ? 32 LYS B HZ2 1 10
ATOM 415 H HZ3 . LYS B 1 10 ? 14.699 -6.601 1.905 1.00 0.00 ? 32 LYS B HZ3 1 10
ATOM 416 N N . ALA B 1 11 ? 9.309 -0.922 -2.149 1.00 0.00 ? 33 ALA B N 1 11
ATOM 417 C CA . ALA B 1 11 ? 9.097 0.372 -2.753 1.00 0.00 ? 33 ALA B CA 1 11
ATOM 418 C C . ALA B 1 11 ? 8.168 1.235 -1.920 1.00 0.00 ? 33 ALA B C 1 11
ATOM 419 O O . ALA B 1 11 ? 8.568 2.331 -1.556 1.00 0.00 ? 33 ALA B O 1 11
ATOM 420 C CB . ALA B 1 11 ? 8.609 0.158 -4.175 1.00 0.00 ? 33 ALA B CB 1 11
ATOM 421 H H . ALA B 1 11 ? 8.948 -1.746 -2.580 1.00 0.00 ? 33 ALA B H 1 11
ATOM 422 H HA . ALA B 1 11 ? 10.045 0.892 -2.812 1.00 0.00 ? 33 ALA B HA 1 11
ATOM 423 H HB1 . ALA B 1 11 ? 9.162 -0.337 -4.691 1.00 0.00 ? 33 ALA B HB1 1 11
ATOM 424 H HB2 . ALA B 1 11 ? 7.796 -0.240 -4.264 1.00 0.00 ? 33 ALA B HB2 1 11
ATOM 425 H HB3 . ALA B 1 11 ? 8.530 0.922 -4.657 1.00 0.00 ? 33 ALA B HB3 1 11
ATOM 426 N N . ILE B 1 12 ? 6.978 0.768 -1.545 1.00 0.00 ? 34 ILE B N 1 12
ATOM 427 C CA . ILE B 1 12 ? 5.981 1.569 -0.873 1.00 0.00 ? 34 ILE B CA 1 12
ATOM 428 C C . ILE B 1 12 ? 6.441 2.041 0.496 1.00 0.00 ? 34 ILE B C 1 12
ATOM 429 O O . ILE B 1 12 ? 6.331 3.223 0.789 1.00 0.00 ? 34 ILE B O 1 12
ATOM 430 C CB . ILE B 1 12 ? 4.573 0.994 -0.891 1.00 0.00 ? 34 ILE B CB 1 12
ATOM 431 C CG1 . ILE B 1 12 ? 3.633 2.102 -1.332 1.00 0.00 ? 34 ILE B CG1 1 12
ATOM 432 C CG2 . ILE B 1 12 ? 4.117 0.310 0.384 1.00 0.00 ? 34 ILE B CG2 1 12
ATOM 433 C CD1 . ILE B 1 12 ? 2.158 1.766 -1.335 1.00 0.00 ? 34 ILE B CD1 1 12
ATOM 434 H H . ILE B 1 12 ? 6.780 -0.202 -1.689 1.00 0.00 ? 34 ILE B H 1 12
ATOM 435 H HA . ILE B 1 12 ? 5.939 2.530 -1.375 1.00 0.00 ? 34 ILE B HA 1 12
ATOM 436 H HB . ILE B 1 12 ? 4.510 0.277 -1.697 1.00 0.00 ? 34 ILE B HB 1 12
ATOM 437 H HG12 . ILE B 1 12 ? 3.782 2.961 -0.677 1.00 0.00 ? 34 ILE B HG12 1 12
ATOM 438 H HG13 . ILE B 1 12 ? 3.951 2.408 -2.323 1.00 0.00 ? 34 ILE B HG13 1 12
ATOM 439 H HG21 . ILE B 1 12 ? 3.951 1.041 1.153 1.00 0.00 ? 34 ILE B HG21 1 12
ATOM 440 H HG22 . ILE B 1 12 ? 3.183 -0.209 0.210 1.00 0.00 ? 34 ILE B HG22 1 12
ATOM 441 H HG23 . ILE B 1 12 ? 4.847 -0.416 0.714 1.00 0.00 ? 34 ILE B HG23 1 12
ATOM 442 H HD11 . ILE B 1 12 ? 1.805 1.635 -0.336 1.00 0.00 ? 34 ILE B HD11 1 12
ATOM 443 H HD12 . ILE B 1 12 ? 1.626 2.571 -1.765 1.00 0.00 ? 34 ILE B HD12 1 12
ATOM 444 H HD13 . ILE B 1 12 ? 1.963 0.887 -1.886 1.00 0.00 ? 34 ILE B HD13 1 12
ATOM 445 N N . ALA B 1 13 ? 7.040 1.165 1.300 1.00 0.00 ? 35 ALA B N 1 13
ATOM 446 C CA . ALA B 1 13 ? 7.513 1.569 2.599 1.00 0.00 ? 35 ALA B CA 1 13
ATOM 447 C C . ALA B 1 13 ? 8.671 2.546 2.560 1.00 0.00 ? 35 ALA B C 1 13
ATOM 448 O O . ALA B 1 13 ? 8.905 3.232 3.541 1.00 0.00 ? 35 ALA B O 1 13
ATOM 449 C CB . ALA B 1 13 ? 7.887 0.329 3.390 1.00 0.00 ? 35 ALA B CB 1 13
ATOM 450 H H . ALA B 1 13 ? 7.112 0.228 0.938 1.00 0.00 ? 35 ALA B H 1 13
ATOM 451 H HA . ALA B 1 13 ? 6.716 2.058 3.131 1.00 0.00 ? 35 ALA B HA 1 13
ATOM 452 H HB1 . ALA B 1 13 ? 8.720 -0.146 2.920 1.00 0.00 ? 35 ALA B HB1 1 13
ATOM 453 H HB2 . ALA B 1 13 ? 8.196 0.613 4.373 1.00 0.00 ? 35 ALA B HB2 1 13
ATOM 454 H HB3 . ALA B 1 13 ? 7.034 -0.323 3.448 1.00 0.00 ? 35 ALA B HB3 1 13
ATOM 455 N N . ALA B 1 14 ? 9.360 2.700 1.432 1.00 0.00 ? 36 ALA B N 1 14
ATOM 456 C CA . ALA B 1 14 ? 10.370 3.699 1.175 1.00 0.00 ? 36 ALA B CA 1 14
ATOM 457 C C . ALA B 1 14 ? 9.782 4.953 0.556 1.00 0.00 ? 36 ALA B C 1 14
ATOM 458 O O . ALA B 1 14 ? 10.211 6.044 0.879 1.00 0.00 ? 36 ALA B O 1 14
ATOM 459 C CB . ALA B 1 14 ? 11.449 3.100 0.290 1.00 0.00 ? 36 ALA B CB 1 14
ATOM 460 H H . ALA B 1 14 ? 8.988 2.149 0.689 1.00 0.00 ? 36 ALA B H 1 14
ATOM 461 H HA . ALA B 1 14 ? 10.837 3.990 2.108 1.00 0.00 ? 36 ALA B HA 1 14
ATOM 462 H HB1 . ALA B 1 14 ? 11.033 2.806 -0.654 1.00 0.00 ? 36 ALA B HB1 1 14
ATOM 463 H HB2 . ALA B 1 14 ? 12.252 3.797 0.170 1.00 0.00 ? 36 ALA B HB2 1 14
ATOM 464 H HB3 . ALA B 1 14 ? 11.835 2.208 0.740 1.00 0.00 ? 36 ALA B HB3 1 14
ATOM 465 N N . ILE B 1 15 ? 8.749 4.827 -0.271 1.00 0.00 ? 37 ILE B N 1 15
ATOM 466 C CA . ILE B 1 15 ? 7.994 5.914 -0.855 1.00 0.00 ? 37 ILE B CA 1 15
ATOM 467 C C . ILE B 1 15 ? 7.174 6.603 0.223 1.00 0.00 ? 37 ILE B C 1 15
ATOM 468 O O . ILE B 1 15 ? 7.049 7.814 0.207 1.00 0.00 ? 37 ILE B O 1 15
ATOM 469 C CB . ILE B 1 15 ? 7.138 5.373 -1.990 1.00 0.00 ? 37 ILE B CB 1 15
ATOM 470 C CG1 . ILE B 1 15 ? 7.965 4.941 -3.186 1.00 0.00 ? 37 ILE B CG1 1 15
ATOM 471 C CG2 . ILE B 1 15 ? 6.064 6.325 -2.465 1.00 0.00 ? 37 ILE B CG2 1 15
ATOM 472 C CD1 . ILE B 1 15 ? 7.299 3.961 -4.136 1.00 0.00 ? 37 ILE B CD1 1 15
ATOM 473 H H . ILE B 1 15 ? 8.455 3.891 -0.459 1.00 0.00 ? 37 ILE B H 1 15
ATOM 474 H HA . ILE B 1 15 ? 8.665 6.643 -1.297 1.00 0.00 ? 37 ILE B HA 1 15
ATOM 475 H HB . ILE B 1 15 ? 6.652 4.485 -1.613 1.00 0.00 ? 37 ILE B HB 1 15
ATOM 476 H HG12 . ILE B 1 15 ? 8.245 5.832 -3.747 1.00 0.00 ? 37 ILE B HG12 1 15
ATOM 477 H HG13 . ILE B 1 15 ? 8.881 4.476 -2.848 1.00 0.00 ? 37 ILE B HG13 1 15
ATOM 478 H HG21 . ILE B 1 15 ? 5.372 6.524 -1.676 1.00 0.00 ? 37 ILE B HG21 1 15
ATOM 479 H HG22 . ILE B 1 15 ? 6.484 7.254 -2.760 1.00 0.00 ? 37 ILE B HG22 1 15
ATOM 480 H HG23 . ILE B 1 15 ? 5.501 5.869 -3.257 1.00 0.00 ? 37 ILE B HG23 1 15
ATOM 481 H HD11 . ILE B 1 15 ? 7.698 3.396 -4.407 1.00 0.00 ? 37 ILE B HD11 1 15
ATOM 482 H HD12 . ILE B 1 15 ? 6.747 3.546 -3.915 1.00 0.00 ? 37 ILE B HD12 1 15
ATOM 483 H HD13 . ILE B 1 15 ? 6.977 4.159 -4.772 1.00 0.00 ? 37 ILE B HD13 1 15
ATOM 484 N N . ILE B 1 16 ? 6.709 5.889 1.243 1.00 0.00 ? 38 ILE B N 1 16
ATOM 485 C CA . ILE B 1 16 ? 6.081 6.447 2.416 1.00 0.00 ? 38 ILE B CA 1 16
ATOM 486 C C . ILE B 1 16 ? 7.015 7.395 3.136 1.00 0.00 ? 38 ILE B C 1 16
ATOM 487 O O . ILE B 1 16 ? 6.691 8.552 3.340 1.00 0.00 ? 38 ILE B O 1 16
ATOM 488 C CB . ILE B 1 16 ? 5.543 5.334 3.299 1.00 0.00 ? 38 ILE B CB 1 16
ATOM 489 C CG1 . ILE B 1 16 ? 4.320 4.756 2.614 1.00 0.00 ? 38 ILE B CG1 1 16
ATOM 490 C CG2 . ILE B 1 16 ? 5.173 5.832 4.684 1.00 0.00 ? 38 ILE B CG2 1 16
ATOM 491 C CD1 . ILE B 1 16 ? 3.642 3.587 3.269 1.00 0.00 ? 38 ILE B CD1 1 16
ATOM 492 H H . ILE B 1 16 ? 6.823 4.893 1.165 1.00 0.00 ? 38 ILE B H 1 16
ATOM 493 H HA . ILE B 1 16 ? 5.266 7.076 2.085 1.00 0.00 ? 38 ILE B HA 1 16
ATOM 494 H HB . ILE B 1 16 ? 6.338 4.604 3.390 1.00 0.00 ? 38 ILE B HB 1 16
ATOM 495 H HG12 . ILE B 1 16 ? 3.586 5.556 2.521 1.00 0.00 ? 38 ILE B HG12 1 16
ATOM 496 H HG13 . ILE B 1 16 ? 4.572 4.466 1.623 1.00 0.00 ? 38 ILE B HG13 1 16
ATOM 497 H HG21 . ILE B 1 16 ? 4.781 5.048 5.301 1.00 0.00 ? 38 ILE B HG21 1 16
ATOM 498 H HG22 . ILE B 1 16 ? 6.029 6.201 5.221 1.00 0.00 ? 38 ILE B HG22 1 16
ATOM 499 H HG23 . ILE B 1 16 ? 4.456 6.627 4.619 1.00 0.00 ? 38 ILE B HG23 1 16
ATOM 500 H HD11 . ILE B 1 16 ? 3.182 3.858 4.176 1.00 0.00 ? 38 ILE B HD11 1 16
ATOM 501 H HD12 . ILE B 1 16 ? 2.888 3.232 2.626 1.00 0.00 ? 38 ILE B HD12 1 16
ATOM 502 H HD13 . ILE B 1 16 ? 4.354 2.850 3.421 1.00 0.00 ? 38 ILE B HD13 1 16
ATOM 503 N N . LYS B 1 17 ? 8.175 6.881 3.525 1.00 0.00 ? 39 LYS B N 1 17
ATOM 504 C CA . LYS B 1 17 ? 9.253 7.615 4.149 1.00 0.00 ? 39 LYS B CA 1 17
ATOM 505 C C . LYS B 1 17 ? 9.714 8.850 3.394 1.00 0.00 ? 39 LYS B C 1 17
ATOM 506 O O . LYS B 1 17 ? 9.848 9.899 3.987 1.00 0.00 ? 39 LYS B O 1 17
ATOM 507 C CB . LYS B 1 17 ? 10.399 6.650 4.400 1.00 0.00 ? 39 LYS B CB 1 17
ATOM 508 C CG . LYS B 1 17 ? 10.169 5.719 5.578 1.00 0.00 ? 39 LYS B CG 1 17
ATOM 509 C CD . LYS B 1 17 ? 11.316 4.743 5.716 1.00 0.00 ? 39 LYS B CD 1 17
ATOM 510 C CE . LYS B 1 17 ? 11.024 3.658 6.727 1.00 0.00 ? 39 LYS B CE 1 17
ATOM 511 N NZ . LYS B 1 17 ? 10.024 2.721 6.280 1.00 0.00 ? 39 LYS B NZ 1 17
ATOM 512 H H . LYS B 1 17 ? 8.277 5.921 3.354 1.00 0.00 ? 39 LYS B H 1 17
ATOM 513 H HA . LYS B 1 17 ? 8.895 7.971 5.109 1.00 0.00 ? 39 LYS B HA 1 17
ATOM 514 H HB2 . LYS B 1 17 ? 10.550 6.048 3.504 1.00 0.00 ? 39 LYS B HB2 1 17
ATOM 515 H HB3 . LYS B 1 17 ? 11.315 7.200 4.550 1.00 0.00 ? 39 LYS B HB3 1 17
ATOM 516 H HG2 . LYS B 1 17 ? 10.063 6.297 6.497 1.00 0.00 ? 39 LYS B HG2 1 17
ATOM 517 H HG3 . LYS B 1 17 ? 9.239 5.197 5.416 1.00 0.00 ? 39 LYS B HG3 1 17
ATOM 518 H HD2 . LYS B 1 17 ? 11.542 4.295 4.748 1.00 0.00 ? 39 LYS B HD2 1 17
ATOM 519 H HD3 . LYS B 1 17 ? 12.177 5.296 6.041 1.00 0.00 ? 39 LYS B HD3 1 17
ATOM 520 H HE2 . LYS B 1 17 ? 11.944 3.114 6.938 1.00 0.00 ? 39 LYS B HE2 1 17
ATOM 521 H HE3 . LYS B 1 17 ? 10.725 4.095 7.636 1.00 0.00 ? 39 LYS B HE3 1 17
ATOM 522 H HZ1 . LYS B 1 17 ? 10.125 2.198 5.837 1.00 0.00 ? 39 LYS B HZ1 1 17
ATOM 523 H HZ2 . LYS B 1 17 ? 9.685 2.337 6.666 1.00 0.00 ? 39 LYS B HZ2 1 17
ATOM 524 H HZ3 . LYS B 1 17 ? 9.482 2.904 5.942 1.00 0.00 ? 39 LYS B HZ3 1 17
ATOM 525 N N . ALA B 1 18 ? 9.883 8.752 2.088 1.00 0.00 ? 40 ALA B N 1 18
ATOM 526 C CA . ALA B 1 18 ? 10.250 9.825 1.197 1.00 0.00 ? 40 ALA B CA 1 18
ATOM 527 C C . ALA B 1 18 ? 9.118 10.788 0.905 1.00 0.00 ? 40 ALA B C 1 18
ATOM 528 O O . ALA B 1 18 ? 9.368 11.952 0.655 1.00 0.00 ? 40 ALA B O 1 18
ATOM 529 C CB . ALA B 1 18 ? 10.754 9.208 -0.087 1.00 0.00 ? 40 ALA B CB 1 18
ATOM 530 H H . ALA B 1 18 ? 9.702 7.857 1.677 1.00 0.00 ? 40 ALA B H 1 18
ATOM 531 H HA . ALA B 1 18 ? 11.050 10.390 1.649 1.00 0.00 ? 40 ALA B HA 1 18
ATOM 532 H HB1 . ALA B 1 18 ? 10.017 8.581 -0.499 1.00 0.00 ? 40 ALA B HB1 1 18
ATOM 533 H HB2 . ALA B 1 18 ? 11.019 9.965 -0.793 1.00 0.00 ? 40 ALA B HB2 1 18
ATOM 534 H HB3 . ALA B 1 18 ? 11.584 8.604 0.101 1.00 0.00 ? 40 ALA B HB3 1 18
ATOM 535 N N . GLY B 1 19 ? 7.879 10.320 0.918 1.00 0.00 ? 41 GLY B N 1 19
ATOM 536 C CA . GLY B 1 19 ? 6.700 11.056 0.555 1.00 0.00 ? 41 GLY B CA 1 19
ATOM 537 C C . GLY B 1 19 ? 6.147 11.903 1.668 1.00 0.00 ? 41 GLY B C 1 19
ATOM 538 O O . GLY B 1 19 ? 5.674 12.963 1.432 1.00 0.00 ? 41 GLY B O 1 19
ATOM 539 H H . GLY B 1 19 ? 7.774 9.342 1.051 1.00 0.00 ? 41 GLY B H 1 19
ATOM 540 H HA2 . GLY B 1 19 ? 6.952 11.701 -0.252 1.00 0.00 ? 41 GLY B HA2 1 19
ATOM 541 H HA3 . GLY B 1 19 ? 5.954 10.361 0.252 1.00 0.00 ? 41 GLY B HA3 1 19
ATOM 542 N N . GLY B 1 20 ? 6.259 11.457 2.902 1.00 0.00 ? 42 GLY B N 1 20
ATOM 543 C CA . GLY B 1 20 ? 5.817 12.089 4.094 1.00 0.00 ? 42 GLY B CA 1 20
ATOM 544 C C . GLY B 1 20 ? 4.363 11.957 4.468 1.00 0.00 ? 42 GLY B C 1 20
ATOM 545 O O . GLY B 1 20 ? 3.816 12.881 5.017 1.00 0.00 ? 42 GLY B O 1 20
ATOM 546 H H . GLY B 1 20 ? 6.660 10.567 3.040 1.00 0.00 ? 42 GLY B H 1 20
ATOM 547 H HA2 . GLY B 1 20 ? 6.366 11.694 4.905 1.00 0.00 ? 42 GLY B HA2 1 20
ATOM 548 H HA3 . GLY B 1 20 ? 6.051 13.124 4.021 1.00 0.00 ? 42 GLY B HA3 1 20
ATOM 549 N N . TYR B 1 21 ? 3.756 10.830 4.210 1.00 0.00 ? 43 TYR B N 1 21
ATOM 550 C CA . TYR B 1 21 ? 2.377 10.560 4.409 1.00 0.00 ? 43 TYR B CA 1 21
ATOM 551 C C . TYR B 1 21 ? 1.850 10.803 5.767 1.00 0.00 ? 43 TYR B C 1 21
ATOM 552 O O . TYR B 1 21 ? 0.716 11.077 5.913 1.00 0.00 ? 43 TYR B O 1 21
ATOM 553 C CB . TYR B 1 21 ? 2.177 9.116 4.046 1.00 0.00 ? 43 TYR B CB 1 21
ATOM 554 C CG . TYR B 1 21 ? 1.847 8.812 2.616 1.00 0.00 ? 43 TYR B CG 1 21
ATOM 555 C CD1 . TYR B 1 21 ? 0.707 9.265 1.953 1.00 0.00 ? 43 TYR B CD1 1 21
ATOM 556 C CD2 . TYR B 1 21 ? 2.704 7.910 1.993 1.00 0.00 ? 43 TYR B CD2 1 21
ATOM 557 C CE1 . TYR B 1 21 ? 0.379 8.738 0.705 1.00 0.00 ? 43 TYR B CE1 1 21
ATOM 558 C CE2 . TYR B 1 21 ? 2.409 7.401 0.730 1.00 0.00 ? 43 TYR B CE2 1 21
ATOM 559 C CZ . TYR B 1 21 ? 1.223 7.797 0.096 1.00 0.00 ? 43 TYR B CZ 1 21
ATOM 560 O OH . TYR B 1 21 ? 0.945 7.310 -1.145 1.00 0.00 ? 43 TYR B OH 1 21
ATOM 561 H H . TYR B 1 21 ? 4.286 10.117 3.815 1.00 0.00 ? 43 TYR B H 1 21
ATOM 562 H HA . TYR B 1 21 ? 1.852 11.150 3.697 1.00 0.00 ? 43 TYR B HA 1 21
ATOM 563 H HB2 . TYR B 1 21 ? 3.097 8.589 4.297 1.00 0.00 ? 43 TYR B HB2 1 21
ATOM 564 H HB3 . TYR B 1 21 ? 1.413 8.652 4.623 1.00 0.00 ? 43 TYR B HB3 1 21
ATOM 565 H HD1 . TYR B 1 21 ? 0.033 9.952 2.418 1.00 0.00 ? 43 TYR B HD1 1 21
ATOM 566 H HD2 . TYR B 1 21 ? 3.547 7.575 2.563 1.00 0.00 ? 43 TYR B HD2 1 21
ATOM 567 H HE1 . TYR B 1 21 ? -0.492 9.072 0.184 1.00 0.00 ? 43 TYR B HE1 1 21
ATOM 568 H HE2 . TYR B 1 21 ? 3.063 6.659 0.313 1.00 0.00 ? 43 TYR B HE2 1 21
ATOM 569 H HH . TYR B 1 21 ? 1.521 7.727 -1.758 1.00 0.00 ? 43 TYR B HH 1 21
HETATM 570 N N . NH2 B 1 22 ? 2.635 10.746 6.793 1.00 0.00 ? 44 NH2 B N 1 22
HETATM 571 H HN1 . NH2 B 1 22 ? 2.259 10.889 7.676 1.00 0.00 ? 44 NH2 B HN1 1 22
HETATM 572 H HN2 . NH2 B 1 22 ? 3.559 10.486 6.689 1.00 0.00 ? 44 NH2 B HN2 1 22
HETATM 573 C C . ACE C 1 1 ? -7.734 11.246 -3.193 1.00 0.00 ? 45 ACE C C 1 1
HETATM 574 O O . ACE C 1 1 ? -7.935 10.287 -2.489 1.00 0.00 ? 45 ACE C O 1 1
HETATM 575 C CH3 . ACE C 1 1 ? -8.575 11.535 -4.377 1.00 0.00 ? 45 ACE C CH3 1 1
HETATM 576 H H1 . ACE C 1 1 ? -8.822 11.738 -4.550 1.00 0.00 ? 45 ACE C H1 1 1
HETATM 577 H H2 . ACE C 1 1 ? -8.624 11.625 -4.699 1.00 0.00 ? 45 ACE C H2 1 1
HETATM 578 H H3 . ACE C 1 1 ? -8.887 11.423 -4.685 1.00 0.00 ? 45 ACE C H3 1 1
ATOM 579 N N . ALA C 1 2 ? -6.803 12.108 -2.958 1.00 0.00 ? 46 ALA C N 1 2
ATOM 580 C CA . ALA C 1 2 ? -5.806 11.919 -1.968 1.00 0.00 ? 46 ALA C CA 1 2
ATOM 581 C C . ALA C 1 2 ? -6.259 11.993 -0.541 1.00 0.00 ? 46 ALA C C 1 2
ATOM 582 O O . ALA C 1 2 ? -5.509 11.682 0.338 1.00 0.00 ? 46 ALA C O 1 2
ATOM 583 C CB . ALA C 1 2 ? -4.696 12.880 -2.269 1.00 0.00 ? 46 ALA C CB 1 2
ATOM 584 H H . ALA C 1 2 ? -6.757 12.884 -3.535 1.00 0.00 ? 46 ALA C H 1 2
ATOM 585 H HA . ALA C 1 2 ? -5.420 10.937 -2.091 1.00 0.00 ? 46 ALA C HA 1 2
ATOM 586 H HB1 . ALA C 1 2 ? -3.890 12.747 -1.617 1.00 0.00 ? 46 ALA C HB1 1 2
ATOM 587 H HB2 . ALA C 1 2 ? -4.313 12.771 -3.227 1.00 0.00 ? 46 ALA C HB2 1 2
ATOM 588 H HB3 . ALA C 1 2 ? -5.042 13.870 -2.178 1.00 0.00 ? 46 ALA C HB3 1 2
ATOM 589 N N . LYS C 1 3 ? -7.481 12.327 -0.236 1.00 0.00 ? 47 LYS C N 1 3
ATOM 590 C CA . LYS C 1 3 ? -8.032 12.214 1.068 1.00 0.00 ? 47 LYS C CA 1 3
ATOM 591 C C . LYS C 1 3 ? -7.955 10.830 1.679 1.00 0.00 ? 47 LYS C C 1 3
ATOM 592 O O . LYS C 1 3 ? -7.721 10.670 2.866 1.00 0.00 ? 47 LYS C O 1 3
ATOM 593 C CB . LYS C 1 3 ? -9.451 12.614 1.023 1.00 0.00 ? 47 LYS C CB 1 3
ATOM 594 C CG . LYS C 1 3 ? -9.777 14.006 0.586 1.00 0.00 ? 47 LYS C CG 1 3
ATOM 595 C CD . LYS C 1 3 ? -11.143 14.385 0.757 1.00 0.00 ? 47 LYS C CD 1 3
ATOM 596 C CE . LYS C 1 3 ? -11.988 13.818 -0.102 1.00 0.00 ? 47 LYS C CE 1 3
ATOM 597 N NZ . LYS C 1 3 ? -13.247 14.258 -0.055 1.00 0.00 ? 47 LYS C NZ 1 3
ATOM 598 H H . LYS C 1 3 ? -8.036 12.647 -0.981 1.00 0.00 ? 47 LYS C H 1 3
ATOM 599 H HA . LYS C 1 3 ? -7.527 12.848 1.734 1.00 0.00 ? 47 LYS C HA 1 3
ATOM 600 H HB2 . LYS C 1 3 ? -9.978 11.929 0.358 1.00 0.00 ? 47 LYS C HB2 1 3
ATOM 601 H HB3 . LYS C 1 3 ? -9.797 12.440 1.976 1.00 0.00 ? 47 LYS C HB3 1 3
ATOM 602 H HG2 . LYS C 1 3 ? -9.147 14.694 1.151 1.00 0.00 ? 47 LYS C HG2 1 3
ATOM 603 H HG3 . LYS C 1 3 ? -9.576 14.169 -0.387 1.00 0.00 ? 47 LYS C HG3 1 3
ATOM 604 H HD2 . LYS C 1 3 ? -11.444 14.124 1.771 1.00 0.00 ? 47 LYS C HD2 1 3
ATOM 605 H HD3 . LYS C 1 3 ? -11.286 15.415 0.664 1.00 0.00 ? 47 LYS C HD3 1 3
ATOM 606 H HE2 . LYS C 1 3 ? -11.617 13.988 -1.113 1.00 0.00 ? 47 LYS C HE2 1 3
ATOM 607 H HE3 . LYS C 1 3 ? -11.917 12.864 0.051 1.00 0.00 ? 47 LYS C HE3 1 3
ATOM 608 H HZ1 . LYS C 1 3 ? -13.750 13.880 -0.624 1.00 0.00 ? 47 LYS C HZ1 1 3
ATOM 609 H HZ2 . LYS C 1 3 ? -13.392 15.138 -0.200 1.00 0.00 ? 47 LYS C HZ2 1 3
ATOM 610 H HZ3 . LYS C 1 3 ? -13.561 14.075 0.673 1.00 0.00 ? 47 LYS C HZ3 1 3
ATOM 611 N N . ALA C 1 4 ? -8.074 9.815 0.833 1.00 0.00 ? 48 ALA C N 1 4
ATOM 612 C CA . ALA C 1 4 ? -7.888 8.417 1.139 1.00 0.00 ? 48 ALA C CA 1 4
ATOM 613 C C . ALA C 1 4 ? -6.537 8.069 1.725 1.00 0.00 ? 48 ALA C C 1 4
ATOM 614 O O . ALA C 1 4 ? -6.359 6.963 2.215 1.00 0.00 ? 48 ALA C O 1 4
ATOM 615 C CB . ALA C 1 4 ? -8.099 7.674 -0.168 1.00 0.00 ? 48 ALA C CB 1 4
ATOM 616 H H . ALA C 1 4 ? -8.255 10.075 -0.113 1.00 0.00 ? 48 ALA C H 1 4
ATOM 617 H HA . ALA C 1 4 ? -8.591 8.078 1.887 1.00 0.00 ? 48 ALA C HA 1 4
ATOM 618 H HB1 . ALA C 1 4 ? -7.998 6.616 -0.010 1.00 0.00 ? 48 ALA C HB1 1 4
ATOM 619 H HB2 . ALA C 1 4 ? -9.064 7.875 -0.570 1.00 0.00 ? 48 ALA C HB2 1 4
ATOM 620 H HB3 . ALA C 1 4 ? -7.382 7.960 -0.898 1.00 0.00 ? 48 ALA C HB3 1 4
ATOM 621 N N . ALA C 1 5 ? -5.578 8.988 1.666 1.00 0.00 ? 49 ALA C N 1 5
ATOM 622 C CA . ALA C 1 5 ? -4.188 8.756 1.964 1.00 0.00 ? 49 ALA C CA 1 5
ATOM 623 C C . ALA C 1 5 ? -3.964 8.416 3.422 1.00 0.00 ? 49 ALA C C 1 5
ATOM 624 O O . ALA C 1 5 ? -4.000 7.249 3.794 1.00 0.00 ? 49 ALA C O 1 5
ATOM 625 C CB . ALA C 1 5 ? -3.359 9.917 1.448 1.00 0.00 ? 49 ALA C CB 1 5
ATOM 626 H H . ALA C 1 5 ? -5.856 9.909 1.384 1.00 0.00 ? 49 ALA C H 1 5
ATOM 627 H HA . ALA C 1 5 ? -3.874 7.915 1.369 1.00 0.00 ? 49 ALA C HA 1 5
ATOM 628 H HB1 . ALA C 1 5 ? -3.475 9.994 0.379 1.00 0.00 ? 49 ALA C HB1 1 5
ATOM 629 H HB2 . ALA C 1 5 ? -3.681 10.818 1.903 1.00 0.00 ? 49 ALA C HB2 1 5
ATOM 630 H HB3 . ALA C 1 5 ? -2.337 9.779 1.714 1.00 0.00 ? 49 ALA C HB3 1 5
ATOM 631 N N . ALA C 1 6 ? -3.819 9.408 4.292 1.00 0.00 ? 50 ALA C N 1 6
ATOM 632 C CA . ALA C 1 6 ? -3.551 9.185 5.684 1.00 0.00 ? 50 ALA C CA 1 6
ATOM 633 C C . ALA C 1 6 ? -4.758 8.748 6.486 1.00 0.00 ? 50 ALA C C 1 6
ATOM 634 O O . ALA C 1 6 ? -4.864 9.029 7.645 1.00 0.00 ? 50 ALA C O 1 6
ATOM 635 C CB . ALA C 1 6 ? -2.921 10.447 6.242 1.00 0.00 ? 50 ALA C CB 1 6
ATOM 636 H H . ALA C 1 6 ? -3.935 10.332 3.931 1.00 0.00 ? 50 ALA C H 1 6
ATOM 637 H HA . ALA C 1 6 ? -2.841 8.367 5.733 1.00 0.00 ? 50 ALA C HA 1 6
ATOM 638 H HB1 . ALA C 1 6 ? -2.545 10.293 7.219 1.00 0.00 ? 50 ALA C HB1 1 6
ATOM 639 H HB2 . ALA C 1 6 ? -2.122 10.745 5.618 1.00 0.00 ? 50 ALA C HB2 1 6
ATOM 640 H HB3 . ALA C 1 6 ? -3.650 11.212 6.318 1.00 0.00 ? 50 ALA C HB3 1 6
ATOM 641 N N . ALA C 1 7 ? -5.644 8.007 5.856 1.00 0.00 ? 51 ALA C N 1 7
ATOM 642 C CA . ALA C 1 7 ? -6.790 7.275 6.333 1.00 0.00 ? 51 ALA C CA 1 7
ATOM 643 C C . ALA C 1 7 ? -6.718 5.796 6.012 1.00 0.00 ? 51 ALA C C 1 7
ATOM 644 O O . ALA C 1 7 ? -7.205 4.981 6.771 1.00 0.00 ? 51 ALA C O 1 7
ATOM 645 C CB . ALA C 1 7 ? -8.029 7.854 5.687 1.00 0.00 ? 51 ALA C CB 1 7
ATOM 646 H H . ALA C 1 7 ? -5.344 7.856 4.932 1.00 0.00 ? 51 ALA C H 1 7
ATOM 647 H HA . ALA C 1 7 ? -6.874 7.384 7.405 1.00 0.00 ? 51 ALA C HA 1 7
ATOM 648 H HB1 . ALA C 1 7 ? -8.195 8.844 6.033 1.00 0.00 ? 51 ALA C HB1 1 7
ATOM 649 H HB2 . ALA C 1 7 ? -7.939 7.882 4.630 1.00 0.00 ? 51 ALA C HB2 1 7
ATOM 650 H HB3 . ALA C 1 7 ? -8.895 7.295 5.968 1.00 0.00 ? 51 ALA C HB3 1 7
ATOM 651 N N . ALA C 1 8 ? -6.033 5.414 4.952 1.00 0.00 ? 52 ALA C N 1 8
ATOM 652 C CA . ALA C 1 8 ? -5.657 4.059 4.638 1.00 0.00 ? 52 ALA C CA 1 8
ATOM 653 C C . ALA C 1 8 ? -4.200 3.779 4.932 1.00 0.00 ? 52 ALA C C 1 8
ATOM 654 O O . ALA C 1 8 ? -3.907 2.820 5.626 1.00 0.00 ? 52 ALA C O 1 8
ATOM 655 C CB . ALA C 1 8 ? -5.964 3.753 3.185 1.00 0.00 ? 52 ALA C CB 1 8
ATOM 656 H H . ALA C 1 8 ? -5.714 6.098 4.306 1.00 0.00 ? 52 ALA C H 1 8
ATOM 657 H HA . ALA C 1 8 ? -6.250 3.379 5.236 1.00 0.00 ? 52 ALA C HA 1 8
ATOM 658 H HB1 . ALA C 1 8 ? -6.032 2.696 3.026 1.00 0.00 ? 52 ALA C HB1 1 8
ATOM 659 H HB2 . ALA C 1 8 ? -6.896 4.200 2.889 1.00 0.00 ? 52 ALA C HB2 1 8
ATOM 660 H HB3 . ALA C 1 8 ? -5.177 4.137 2.586 1.00 0.00 ? 52 ALA C HB3 1 8
ATOM 661 N N . ILE C 1 9 ? -3.298 4.638 4.467 1.00 0.00 ? 53 ILE C N 1 9
ATOM 662 C CA . ILE C 1 9 ? -1.874 4.492 4.637 1.00 0.00 ? 53 ILE C CA 1 9
ATOM 663 C C . ILE C 1 9 ? -1.501 4.346 6.099 1.00 0.00 ? 53 ILE C C 1 9
ATOM 664 O O . ILE C 1 9 ? -0.591 3.604 6.427 1.00 0.00 ? 53 ILE C O 1 9
ATOM 665 C CB . ILE C 1 9 ? -1.084 5.628 4.007 1.00 0.00 ? 53 ILE C CB 1 9
ATOM 666 C CG1 . ILE C 1 9 ? -1.356 5.890 2.536 1.00 0.00 ? 53 ILE C CG1 1 9
ATOM 667 C CG2 . ILE C 1 9 ? 0.403 5.452 4.207 1.00 0.00 ? 53 ILE C CG2 1 9
ATOM 668 C CD1 . ILE C 1 9 ? -1.178 4.707 1.638 1.00 0.00 ? 53 ILE C CD1 1 9
ATOM 669 H H . ILE C 1 9 ? -3.635 5.421 3.951 1.00 0.00 ? 53 ILE C H 1 9
ATOM 670 H HA . ILE C 1 9 ? -1.562 3.585 4.134 1.00 0.00 ? 53 ILE C HA 1 9
ATOM 671 H HB . ILE C 1 9 ? -1.357 6.517 4.559 1.00 0.00 ? 53 ILE C HB 1 9
ATOM 672 H HG12 . ILE C 1 9 ? -2.380 6.251 2.434 1.00 0.00 ? 53 ILE C HG12 1 9
ATOM 673 H HG13 . ILE C 1 9 ? -0.724 6.670 2.198 1.00 0.00 ? 53 ILE C HG13 1 9
ATOM 674 H HG21 . ILE C 1 9 ? 0.688 4.474 3.891 1.00 0.00 ? 53 ILE C HG21 1 9
ATOM 675 H HG22 . ILE C 1 9 ? 0.908 6.208 3.647 1.00 0.00 ? 53 ILE C HG22 1 9
ATOM 676 H HG23 . ILE C 1 9 ? 0.660 5.594 5.239 1.00 0.00 ? 53 ILE C HG23 1 9
ATOM 677 H HD11 . ILE C 1 9 ? -1.319 5.017 0.630 1.00 0.00 ? 53 ILE C HD11 1 9
ATOM 678 H HD12 . ILE C 1 9 ? -0.212 4.319 1.715 1.00 0.00 ? 53 ILE C HD12 1 9
ATOM 679 H HD13 . ILE C 1 9 ? -1.883 3.993 1.902 1.00 0.00 ? 53 ILE C HD13 1 9
ATOM 680 N N . LYS C 1 10 ? -2.209 5.003 7.010 1.00 0.00 ? 54 LYS C N 1 10
ATOM 681 C CA . LYS C 1 10 ? -2.043 4.864 8.439 1.00 0.00 ? 54 LYS C CA 1 10
ATOM 682 C C . LYS C 1 10 ? -2.168 3.433 8.930 1.00 0.00 ? 54 LYS C C 1 10
ATOM 683 O O . LYS C 1 10 ? -1.209 2.814 9.327 1.00 0.00 ? 54 LYS C O 1 10
ATOM 684 C CB . LYS C 1 10 ? -3.009 5.832 9.097 1.00 0.00 ? 54 LYS C CB 1 10
ATOM 685 C CG . LYS C 1 10 ? -4.496 5.797 8.837 1.00 0.00 ? 54 LYS C CG 1 10
ATOM 686 C CD . LYS C 1 10 ? -5.275 6.548 9.858 1.00 0.00 ? 54 LYS C CD 1 10
ATOM 687 C CE . LYS C 1 10 ? -5.253 5.835 11.172 1.00 0.00 ? 54 LYS C CE 1 10
ATOM 688 N NZ . LYS C 1 10 ? -5.963 6.535 12.196 1.00 0.00 ? 54 LYS C NZ 1 10
ATOM 689 H H . LYS C 1 10 ? -2.868 5.664 6.655 1.00 0.00 ? 54 LYS C H 1 10
ATOM 690 H HA . LYS C 1 10 ? -1.010 5.136 8.636 1.00 0.00 ? 54 LYS C HA 1 10
ATOM 691 H HB2 . LYS C 1 10 ? -2.859 5.760 10.174 1.00 0.00 ? 54 LYS C HB2 1 10
ATOM 692 H HB3 . LYS C 1 10 ? -2.732 6.818 8.762 1.00 0.00 ? 54 LYS C HB3 1 10
ATOM 693 H HG2 . LYS C 1 10 ? -4.675 6.244 7.859 1.00 0.00 ? 54 LYS C HG2 1 10
ATOM 694 H HG3 . LYS C 1 10 ? -4.920 4.831 8.770 1.00 0.00 ? 54 LYS C HG3 1 10
ATOM 695 H HD2 . LYS C 1 10 ? -4.858 7.548 9.974 1.00 0.00 ? 54 LYS C HD2 1 10
ATOM 696 H HD3 . LYS C 1 10 ? -6.283 6.669 9.547 1.00 0.00 ? 54 LYS C HD3 1 10
ATOM 697 H HE2 . LYS C 1 10 ? -5.678 4.839 11.051 1.00 0.00 ? 54 LYS C HE2 1 10
ATOM 698 H HE3 . LYS C 1 10 ? -4.256 5.719 11.480 1.00 0.00 ? 54 LYS C HE3 1 10
ATOM 699 H HZ1 . LYS C 1 10 ? -5.547 7.370 12.385 1.00 0.00 ? 54 LYS C HZ1 1 10
ATOM 700 H HZ2 . LYS C 1 10 ? -6.886 6.733 11.955 1.00 0.00 ? 54 LYS C HZ2 1 10
ATOM 701 H HZ3 . LYS C 1 10 ? -5.998 6.015 13.004 1.00 0.00 ? 54 LYS C HZ3 1 10
ATOM 702 N N . ALA C 1 11 ? -3.353 2.886 8.692 1.00 0.00 ? 55 ALA C N 1 11
ATOM 703 C CA . ALA C 1 11 ? -3.774 1.508 8.766 1.00 0.00 ? 55 ALA C CA 1 11
ATOM 704 C C . ALA C 1 11 ? -3.110 0.573 7.782 1.00 0.00 ? 55 ALA C C 1 11
ATOM 705 O O . ALA C 1 11 ? -3.544 -0.559 7.640 1.00 0.00 ? 55 ALA C O 1 11
ATOM 706 C CB . ALA C 1 11 ? -5.272 1.509 8.609 1.00 0.00 ? 55 ALA C CB 1 11
ATOM 707 H H . ALA C 1 11 ? -3.977 3.599 8.391 1.00 0.00 ? 55 ALA C H 1 11
ATOM 708 H HA . ALA C 1 11 ? -3.518 1.169 9.754 1.00 0.00 ? 55 ALA C HA 1 11
ATOM 709 H HB1 . ALA C 1 11 ? -5.685 2.145 9.353 1.00 0.00 ? 55 ALA C HB1 1 11
ATOM 710 H HB2 . ALA C 1 11 ? -5.542 1.853 7.652 1.00 0.00 ? 55 ALA C HB2 1 11
ATOM 711 H HB3 . ALA C 1 11 ? -5.686 0.528 8.733 1.00 0.00 ? 55 ALA C HB3 1 11
ATOM 712 N N . ILE C 1 12 ? -2.043 0.997 7.116 1.00 0.00 ? 56 ILE C N 1 12
ATOM 713 C CA . ILE C 1 12 ? -1.194 0.160 6.304 1.00 0.00 ? 56 ILE C CA 1 12
ATOM 714 C C . ILE C 1 12 ? 0.238 0.230 6.808 1.00 0.00 ? 56 ILE C C 1 12
ATOM 715 O O . ILE C 1 12 ? 0.781 -0.829 7.097 1.00 0.00 ? 56 ILE C O 1 12
ATOM 716 C CB . ILE C 1 12 ? -1.365 0.398 4.818 1.00 0.00 ? 56 ILE C CB 1 12
ATOM 717 C CG1 . ILE C 1 12 ? -2.712 -0.066 4.323 1.00 0.00 ? 56 ILE C CG1 1 12
ATOM 718 C CG2 . ILE C 1 12 ? -0.263 -0.157 3.980 1.00 0.00 ? 56 ILE C CG2 1 12
ATOM 719 C CD1 . ILE C 1 12 ? -2.885 -1.540 4.232 1.00 0.00 ? 56 ILE C CD1 1 12
ATOM 720 H H . ILE C 1 12 ? -1.793 1.951 7.216 1.00 0.00 ? 56 ILE C H 1 12
ATOM 721 H HA . ILE C 1 12 ? -1.429 -0.882 6.481 1.00 0.00 ? 56 ILE C HA 1 12
ATOM 722 H HB . ILE C 1 12 ? -1.356 1.453 4.658 1.00 0.00 ? 56 ILE C HB 1 12
ATOM 723 H HG12 . ILE C 1 12 ? -3.472 0.320 5.002 1.00 0.00 ? 56 ILE C HG12 1 12
ATOM 724 H HG13 . ILE C 1 12 ? -2.917 0.383 3.379 1.00 0.00 ? 56 ILE C HG13 1 12
ATOM 725 H HG21 . ILE C 1 12 ? -0.140 -1.191 4.143 1.00 0.00 ? 56 ILE C HG21 1 12
ATOM 726 H HG22 . ILE C 1 12 ? -0.498 -0.036 2.945 1.00 0.00 ? 56 ILE C HG22 1 12
ATOM 727 H HG23 . ILE C 1 12 ? 0.662 0.330 4.209 1.00 0.00 ? 56 ILE C HG23 1 12
ATOM 728 H HD11 . ILE C 1 12 ? -2.239 -1.915 3.503 1.00 0.00 ? 56 ILE C HD11 1 12
ATOM 729 H HD12 . ILE C 1 12 ? -2.655 -2.026 5.134 1.00 0.00 ? 56 ILE C HD12 1 12
ATOM 730 H HD13 . ILE C 1 12 ? -3.869 -1.808 3.939 1.00 0.00 ? 56 ILE C HD13 1 12
ATOM 731 N N . ALA C 1 13 ? 0.834 1.401 7.029 1.00 0.00 ? 57 ALA C N 1 13
ATOM 732 C CA . ALA C 1 13 ? 2.195 1.465 7.508 1.00 0.00 ? 57 ALA C CA 1 13
ATOM 733 C C . ALA C 1 13 ? 2.383 0.869 8.891 1.00 0.00 ? 57 ALA C C 1 13
ATOM 734 O O . ALA C 1 13 ? 3.463 0.391 9.196 1.00 0.00 ? 57 ALA C O 1 13
ATOM 735 C CB . ALA C 1 13 ? 2.602 2.930 7.451 1.00 0.00 ? 57 ALA C CB 1 13
ATOM 736 H H . ALA C 1 13 ? 0.286 2.229 6.865 1.00 0.00 ? 57 ALA C H 1 13
ATOM 737 H HA . ALA C 1 13 ? 2.815 0.886 6.831 1.00 0.00 ? 57 ALA C HA 1 13
ATOM 738 H HB1 . ALA C 1 13 ? 2.432 3.302 6.455 1.00 0.00 ? 57 ALA C HB1 1 13
ATOM 739 H HB2 . ALA C 1 13 ? 2.015 3.475 8.158 1.00 0.00 ? 57 ALA C HB2 1 13
ATOM 740 H HB3 . ALA C 1 13 ? 3.658 3.012 7.666 1.00 0.00 ? 57 ALA C HB3 1 13
ATOM 741 N N . ALA C 1 14 ? 1.319 0.819 9.689 1.00 0.00 ? 58 ALA C N 1 14
ATOM 742 C CA . ALA C 1 14 ? 1.250 0.121 10.951 1.00 0.00 ? 58 ALA C CA 1 14
ATOM 743 C C . ALA C 1 14 ? 1.081 -1.377 10.794 1.00 0.00 ? 58 ALA C C 1 14
ATOM 744 O O . ALA C 1 14 ? 1.666 -2.138 11.540 1.00 0.00 ? 58 ALA C O 1 14
ATOM 745 C CB . ALA C 1 14 ? 0.094 0.705 11.745 1.00 0.00 ? 58 ALA C CB 1 14
ATOM 746 H H . ALA C 1 14 ? 0.489 1.235 9.313 1.00 0.00 ? 58 ALA C H 1 14
ATOM 747 H HA . ALA C 1 14 ? 2.176 0.282 11.480 1.00 0.00 ? 58 ALA C HA 1 14
ATOM 748 H HB1 . ALA C 1 14 ? -0.821 0.512 11.235 1.00 0.00 ? 58 ALA C HB1 1 14
ATOM 749 H HB2 . ALA C 1 14 ? 0.033 0.245 12.708 1.00 0.00 ? 58 ALA C HB2 1 14
ATOM 750 H HB3 . ALA C 1 14 ? 0.253 1.745 11.905 1.00 0.00 ? 58 ALA C HB3 1 14
ATOM 751 N N . ILE C 1 15 ? 0.279 -1.787 9.820 1.00 0.00 ? 59 ILE C N 1 15
ATOM 752 C CA . ILE C 1 15 ? 0.007 -3.155 9.447 1.00 0.00 ? 59 ILE C CA 1 15
ATOM 753 C C . ILE C 1 15 ? 1.204 -3.774 8.751 1.00 0.00 ? 59 ILE C C 1 15
ATOM 754 O O . ILE C 1 15 ? 1.471 -4.941 8.968 1.00 0.00 ? 59 ILE C O 1 15
ATOM 755 C CB . ILE C 1 15 ? -1.261 -3.179 8.605 1.00 0.00 ? 59 ILE C CB 1 15
ATOM 756 C CG1 . ILE C 1 15 ? -2.544 -3.248 9.417 1.00 0.00 ? 59 ILE C CG1 1 15
ATOM 757 C CG2 . ILE C 1 15 ? -1.279 -4.302 7.591 1.00 0.00 ? 59 ILE C CG2 1 15
ATOM 758 C CD1 . ILE C 1 15 ? -2.770 -2.126 10.401 1.00 0.00 ? 59 ILE C CD1 1 15
ATOM 759 H H . ILE C 1 15 ? -0.121 -1.048 9.286 1.00 0.00 ? 59 ILE C H 1 15
ATOM 760 H HA . ILE C 1 15 ? -0.182 -3.729 10.346 1.00 0.00 ? 59 ILE C HA 1 15
ATOM 761 H HB . ILE C 1 15 ? -1.300 -2.250 8.052 1.00 0.00 ? 59 ILE C HB 1 15
ATOM 762 H HG12 . ILE C 1 15 ? -3.384 -3.267 8.722 1.00 0.00 ? 59 ILE C HG12 1 15
ATOM 763 H HG13 . ILE C 1 15 ? -2.576 -4.182 9.963 1.00 0.00 ? 59 ILE C HG13 1 15
ATOM 764 H HG21 . ILE C 1 15 ? -1.179 -5.255 8.064 1.00 0.00 ? 59 ILE C HG21 1 15
ATOM 765 H HG22 . ILE C 1 15 ? -2.208 -4.282 7.064 1.00 0.00 ? 59 ILE C HG22 1 15
ATOM 766 H HG23 . ILE C 1 15 ? -0.501 -4.178 6.855 1.00 0.00 ? 59 ILE C HG23 1 15
ATOM 767 H HD11 . ILE C 1 15 ? -2.659 -1.172 9.943 1.00 0.00 ? 59 ILE C HD11 1 15
ATOM 768 H HD12 . ILE C 1 15 ? -3.774 -2.223 10.750 1.00 0.00 ? 59 ILE C HD12 1 15
ATOM 769 H HD13 . ILE C 1 15 ? -2.092 -2.180 11.221 1.00 0.00 ? 59 ILE C HD13 1 15
ATOM 770 N N . ILE C 1 16 ? 2.019 -3.032 8.004 1.00 0.00 ? 60 ILE C N 1 16
ATOM 771 C CA . ILE C 1 16 ? 3.304 -3.449 7.489 1.00 0.00 ? 60 ILE C CA 1 16
ATOM 772 C C . ILE C 1 16 ? 4.193 -3.960 8.605 1.00 0.00 ? 60 ILE C C 1 16
ATOM 773 O O . ILE C 1 16 ? 4.691 -5.076 8.541 1.00 0.00 ? 60 ILE C O 1 16
ATOM 774 C CB . ILE C 1 16 ? 3.924 -2.298 6.709 1.00 0.00 ? 60 ILE C CB 1 16
ATOM 775 C CG1 . ILE C 1 16 ? 3.194 -2.125 5.387 1.00 0.00 ? 60 ILE C CG1 1 16
ATOM 776 C CG2 . ILE C 1 16 ? 5.417 -2.428 6.464 1.00 0.00 ? 60 ILE C CG2 1 16
ATOM 777 C CD1 . ILE C 1 16 ? 3.746 -1.107 4.401 1.00 0.00 ? 60 ILE C CD1 1 16
ATOM 778 H H . ILE C 1 16 ? 1.685 -2.111 7.822 1.00 0.00 ? 60 ILE C H 1 16
ATOM 779 H HA . ILE C 1 16 ? 3.155 -4.293 6.826 1.00 0.00 ? 60 ILE C HA 1 16
ATOM 780 H HB . ILE C 1 16 ? 3.775 -1.395 7.290 1.00 0.00 ? 60 ILE C HB 1 16
ATOM 781 H HG12 . ILE C 1 16 ? 3.134 -3.095 4.894 1.00 0.00 ? 60 ILE C HG12 1 16
ATOM 782 H HG13 . ILE C 1 16 ? 2.193 -1.780 5.612 1.00 0.00 ? 60 ILE C HG13 1 16
ATOM 783 H HG21 . ILE C 1 16 ? 5.616 -3.265 5.822 1.00 0.00 ? 60 ILE C HG21 1 16
ATOM 784 H HG22 . ILE C 1 16 ? 5.811 -1.540 6.003 1.00 0.00 ? 60 ILE C HG22 1 16
ATOM 785 H HG23 . ILE C 1 16 ? 5.945 -2.535 7.394 1.00 0.00 ? 60 ILE C HG23 1 16
ATOM 786 H HD11 . ILE C 1 16 ? 3.795 -0.134 4.858 1.00 0.00 ? 60 ILE C HD11 1 16
ATOM 787 H HD12 . ILE C 1 16 ? 4.702 -1.443 4.058 1.00 0.00 ? 60 ILE C HD12 1 16
ATOM 788 H HD13 . ILE C 1 16 ? 3.086 -1.032 3.555 1.00 0.00 ? 60 ILE C HD13 1 16
ATOM 789 N N . LYS C 1 17 ? 4.338 -3.172 9.662 1.00 0.00 ? 61 LYS C N 1 17
ATOM 790 C CA . LYS C 1 17 ? 5.095 -3.425 10.867 1.00 0.00 ? 61 LYS C CA 1 17
ATOM 791 C C . LYS C 1 17 ? 4.571 -4.642 11.606 1.00 0.00 ? 61 LYS C C 1 17
ATOM 792 O O . LYS C 1 17 ? 5.354 -5.493 11.973 1.00 0.00 ? 61 LYS C O 1 17
ATOM 793 C CB . LYS C 1 17 ? 5.080 -2.171 11.728 1.00 0.00 ? 61 LYS C CB 1 17
ATOM 794 C CG . LYS C 1 17 ? 6.134 -1.169 11.306 1.00 0.00 ? 61 LYS C CG 1 17
ATOM 795 C CD . LYS C 1 17 ? 6.049 0.111 12.104 1.00 0.00 ? 61 LYS C CD 1 17
ATOM 796 C CE . LYS C 1 17 ? 7.153 1.065 11.908 1.00 0.00 ? 61 LYS C CE 1 17
ATOM 797 N NZ . LYS C 1 17 ? 8.379 0.623 12.397 1.00 0.00 ? 61 LYS C NZ 1 17
ATOM 798 H H . LYS C 1 17 ? 3.900 -2.275 9.565 1.00 0.00 ? 61 LYS C H 1 17
ATOM 799 H HA . LYS C 1 17 ? 6.111 -3.655 10.572 1.00 0.00 ? 61 LYS C HA 1 17
ATOM 800 H HB2 . LYS C 1 17 ? 4.096 -1.706 11.673 1.00 0.00 ? 61 LYS C HB2 1 17
ATOM 801 H HB3 . LYS C 1 17 ? 5.247 -2.434 12.761 1.00 0.00 ? 61 LYS C HB3 1 17
ATOM 802 H HG2 . LYS C 1 17 ? 7.121 -1.612 11.444 1.00 0.00 ? 61 LYS C HG2 1 17
ATOM 803 H HG3 . LYS C 1 17 ? 6.053 -0.942 10.256 1.00 0.00 ? 61 LYS C HG3 1 17
ATOM 804 H HD2 . LYS C 1 17 ? 5.113 0.608 11.848 1.00 0.00 ? 61 LYS C HD2 1 17
ATOM 805 H HD3 . LYS C 1 17 ? 6.011 -0.089 13.102 1.00 0.00 ? 61 LYS C HD3 1 17
ATOM 806 H HE2 . LYS C 1 17 ? 7.248 1.279 10.844 1.00 0.00 ? 61 LYS C HE2 1 17
ATOM 807 H HE3 . LYS C 1 17 ? 6.943 1.987 12.398 1.00 0.00 ? 61 LYS C HE3 1 17
ATOM 808 H HZ1 . LYS C 1 17 ? 9.068 1.300 12.298 1.00 0.00 ? 61 LYS C HZ1 1 17
ATOM 809 H HZ2 . LYS C 1 17 ? 8.344 0.425 13.318 1.00 0.00 ? 61 LYS C HZ2 1 17
ATOM 810 H HZ3 . LYS C 1 17 ? 8.684 -0.183 11.951 1.00 0.00 ? 61 LYS C HZ3 1 17
ATOM 811 N N . ALA C 1 18 ? 3.268 -4.745 11.800 1.00 0.00 ? 62 ALA C N 1 18
ATOM 812 C CA . ALA C 1 18 ? 2.600 -5.812 12.504 1.00 0.00 ? 62 ALA C CA 1 18
ATOM 813 C C . ALA C 1 18 ? 2.625 -7.098 11.707 1.00 0.00 ? 62 ALA C C 1 18
ATOM 814 O O . ALA C 1 18 ? 2.780 -8.165 12.248 1.00 0.00 ? 62 ALA C O 1 18
ATOM 815 C CB . ALA C 1 18 ? 1.193 -5.350 12.812 1.00 0.00 ? 62 ALA C CB 1 18
ATOM 816 H H . ALA C 1 18 ? 2.723 -3.987 11.440 1.00 0.00 ? 62 ALA C H 1 18
ATOM 817 H HA . ALA C 1 18 ? 3.136 -5.978 13.425 1.00 0.00 ? 62 ALA C HA 1 18
ATOM 818 H HB1 . ALA C 1 18 ? 1.174 -4.423 13.339 1.00 0.00 ? 62 ALA C HB1 1 18
ATOM 819 H HB2 . ALA C 1 18 ? 0.623 -5.241 11.915 1.00 0.00 ? 62 ALA C HB2 1 18
ATOM 820 H HB3 . ALA C 1 18 ? 0.748 -6.077 13.457 1.00 0.00 ? 62 ALA C HB3 1 18
ATOM 821 N N . GLY C 1 19 ? 2.507 -7.007 10.401 1.00 0.00 ? 63 GLY C N 1 19
ATOM 822 C CA . GLY C 1 19 ? 2.576 -8.026 9.382 1.00 0.00 ? 63 GLY C CA 1 19
ATOM 823 C C . GLY C 1 19 ? 3.968 -8.614 9.268 1.00 0.00 ? 63 GLY C C 1 19
ATOM 824 O O . GLY C 1 19 ? 4.120 -9.790 9.097 1.00 0.00 ? 63 GLY C O 1 19
ATOM 825 H H . GLY C 1 19 ? 2.376 -6.087 10.086 1.00 0.00 ? 63 GLY C H 1 19
ATOM 826 H HA2 . GLY C 1 19 ? 1.838 -8.791 9.578 1.00 0.00 ? 63 GLY C HA2 1 19
ATOM 827 H HA3 . GLY C 1 19 ? 2.334 -7.561 8.438 1.00 0.00 ? 63 GLY C HA3 1 19
ATOM 828 N N . GLY C 1 20 ? 5.010 -7.832 9.443 1.00 0.00 ? 64 GLY C N 1 20
ATOM 829 C CA . GLY C 1 20 ? 6.402 -8.204 9.382 1.00 0.00 ? 64 GLY C CA 1 20
ATOM 830 C C . GLY C 1 20 ? 6.923 -8.373 7.978 1.00 0.00 ? 64 GLY C C 1 20
ATOM 831 O O . GLY C 1 20 ? 7.633 -9.315 7.681 1.00 0.00 ? 64 GLY C O 1 20
ATOM 832 H H . GLY C 1 20 ? 4.807 -6.866 9.527 1.00 0.00 ? 64 GLY C H 1 20
ATOM 833 H HA2 . GLY C 1 20 ? 6.983 -7.459 9.875 1.00 0.00 ? 64 GLY C HA2 1 20
ATOM 834 H HA3 . GLY C 1 20 ? 6.546 -9.136 9.880 1.00 0.00 ? 64 GLY C HA3 1 20
ATOM 835 N N . TYR C 1 21 ? 6.568 -7.472 7.074 1.00 0.00 ? 65 TYR C N 1 21
ATOM 836 C CA . TYR C 1 21 ? 7.049 -7.426 5.716 1.00 0.00 ? 65 TYR C CA 1 21
ATOM 837 C C . TYR C 1 21 ? 8.530 -7.167 5.644 1.00 0.00 ? 65 TYR C C 1 21
ATOM 838 O O . TYR C 1 21 ? 9.071 -6.307 6.234 1.00 0.00 ? 65 TYR C O 1 21
ATOM 839 C CB . TYR C 1 21 ? 6.308 -6.324 4.990 1.00 0.00 ? 65 TYR C CB 1 21
ATOM 840 C CG . TYR C 1 21 ? 4.959 -6.631 4.405 1.00 0.00 ? 65 TYR C CG 1 21
ATOM 841 C CD1 . TYR C 1 21 ? 4.754 -7.688 3.518 1.00 0.00 ? 65 TYR C CD1 1 21
ATOM 842 C CD2 . TYR C 1 21 ? 3.924 -5.728 4.655 1.00 0.00 ? 65 TYR C CD2 1 21
ATOM 843 C CE1 . TYR C 1 21 ? 3.533 -7.789 2.854 1.00 0.00 ? 65 TYR C CE1 1 21
ATOM 844 C CE2 . TYR C 1 21 ? 2.700 -5.810 3.994 1.00 0.00 ? 65 TYR C CE2 1 21
ATOM 845 C CZ . TYR C 1 21 ? 2.513 -6.851 3.073 1.00 0.00 ? 65 TYR C CZ 1 21
ATOM 846 O OH . TYR C 1 21 ? 1.329 -6.976 2.419 1.00 0.00 ? 65 TYR C OH 1 21
ATOM 847 H H . TYR C 1 21 ? 6.007 -6.701 7.381 1.00 0.00 ? 65 TYR C H 1 21
ATOM 848 H HA . TYR C 1 21 ? 6.852 -8.370 5.230 1.00 0.00 ? 65 TYR C HA 1 21
ATOM 849 H HB2 . TYR C 1 21 ? 6.186 -5.504 5.697 1.00 0.00 ? 65 TYR C HB2 1 21
ATOM 850 H HB3 . TYR C 1 21 ? 6.869 -5.929 4.168 1.00 0.00 ? 65 TYR C HB3 1 21
ATOM 851 H HD1 . TYR C 1 21 ? 5.533 -8.391 3.301 1.00 0.00 ? 65 TYR C HD1 1 21
ATOM 852 H HD2 . TYR C 1 21 ? 4.147 -4.913 5.311 1.00 0.00 ? 65 TYR C HD2 1 21
ATOM 853 H HE1 . TYR C 1 21 ? 3.407 -8.568 2.135 1.00 0.00 ? 65 TYR C HE1 1 21
ATOM 854 H HE2 . TYR C 1 21 ? 1.938 -5.088 4.214 1.00 0.00 ? 65 TYR C HE2 1 21
ATOM 855 H HH . TYR C 1 21 ? 0.700 -7.318 3.030 1.00 0.00 ? 65 TYR C HH 1 21
HETATM 856 N N . NH2 C 1 22 ? 9.235 -7.862 4.853 1.00 0.00 ? 66 NH2 C N 1 22
HETATM 857 H HN1 . NH2 C 1 22 ? 10.204 -7.673 4.763 1.00 0.00 ? 66 NH2 C HN1 1 22
HETATM 858 H HN2 . NH2 C 1 22 ? 8.810 -8.589 4.383 1.00 0.00 ? 66 NH2 C HN2 1 22
HETATM 859 C C . ACE D 1 1 ? 4.239 -12.615 5.644 1.00 0.00 ? 67 ACE D C 1 1
HETATM 860 O O . ACE D 1 1 ? 3.881 -11.573 5.238 1.00 0.00 ? 67 ACE D O 1 1
HETATM 861 C CH3 . ACE D 1 1 ? 5.180 -12.693 6.785 1.00 0.00 ? 67 ACE D CH3 1 1
HETATM 862 H H1 . ACE D 1 1 ? 5.526 -12.649 6.880 1.00 0.00 ? 67 ACE D H1 1 1
HETATM 863 H H2 . ACE D 1 1 ? 5.291 -12.575 7.132 1.00 0.00 ? 67 ACE D H2 1 1
HETATM 864 H H3 . ACE D 1 1 ? 5.407 -12.927 7.145 1.00 0.00 ? 67 ACE D H3 1 1
ATOM 865 N N . ALA D 1 2 ? 3.860 -13.723 5.125 1.00 0.00 ? 68 ALA D N 1 2
ATOM 866 C CA . ALA D 1 2 ? 2.908 -13.827 4.081 1.00 0.00 ? 68 ALA D CA 1 2
ATOM 867 C C . ALA D 1 2 ? 1.485 -13.584 4.504 1.00 0.00 ? 68 ALA D C 1 2
ATOM 868 O O . ALA D 1 2 ? 0.680 -13.241 3.670 1.00 0.00 ? 68 ALA D O 1 2
ATOM 869 C CB . ALA D 1 2 ? 3.085 -15.161 3.427 1.00 0.00 ? 68 ALA D CB 1 2
ATOM 870 H H . ALA D 1 2 ? 4.200 -14.530 5.539 1.00 0.00 ? 68 ALA D H 1 2
ATOM 871 H HA . ALA D 1 2 ? 3.131 -13.068 3.381 1.00 0.00 ? 68 ALA D HA 1 2
ATOM 872 H HB1 . ALA D 1 2 ? 4.051 -15.262 3.004 1.00 0.00 ? 68 ALA D HB1 1 2
ATOM 873 H HB2 . ALA D 1 2 ? 2.922 -15.915 4.120 1.00 0.00 ? 68 ALA D HB2 1 2
ATOM 874 H HB3 . ALA D 1 2 ? 2.376 -15.281 2.665 1.00 0.00 ? 68 ALA D HB3 1 2
ATOM 875 N N . LYS D 1 3 ? 1.159 -13.671 5.780 1.00 0.00 ? 69 LYS D N 1 3
ATOM 876 C CA . LYS D 1 3 ? -0.030 -13.139 6.387 1.00 0.00 ? 69 LYS D CA 1 3
ATOM 877 C C . LYS D 1 3 ? -0.233 -11.679 6.043 1.00 0.00 ? 69 LYS D C 1 3
ATOM 878 O O . LYS D 1 3 ? -1.279 -11.287 5.544 1.00 0.00 ? 69 LYS D O 1 3
ATOM 879 C CB . LYS D 1 3 ? 0.088 -13.250 7.890 1.00 0.00 ? 69 LYS D CB 1 3
ATOM 880 C CG . LYS D 1 3 ? 0.010 -14.642 8.436 1.00 0.00 ? 69 LYS D CG 1 3
ATOM 881 C CD . LYS D 1 3 ? 0.017 -14.726 9.904 1.00 0.00 ? 69 LYS D CD 1 3
ATOM 882 C CE . LYS D 1 3 ? 0.027 -16.093 10.496 1.00 0.00 ? 69 LYS D CE 1 3
ATOM 883 N NZ . LYS D 1 3 ? -1.205 -16.730 10.388 1.00 0.00 ? 69 LYS D NZ 1 3
ATOM 884 H H . LYS D 1 3 ? 1.858 -14.025 6.382 1.00 0.00 ? 69 LYS D H 1 3
ATOM 885 H HA . LYS D 1 3 ? -0.883 -13.676 6.003 1.00 0.00 ? 69 LYS D HA 1 3
ATOM 886 H HB2 . LYS D 1 3 ? 1.040 -12.815 8.196 1.00 0.00 ? 69 LYS D HB2 1 3
ATOM 887 H HB3 . LYS D 1 3 ? -0.670 -12.654 8.328 1.00 0.00 ? 69 LYS D HB3 1 3
ATOM 888 H HG2 . LYS D 1 3 ? -0.908 -15.104 8.072 1.00 0.00 ? 69 LYS D HG2 1 3
ATOM 889 H HG3 . LYS D 1 3 ? 0.767 -15.185 8.047 1.00 0.00 ? 69 LYS D HG3 1 3
ATOM 890 H HD2 . LYS D 1 3 ? 0.921 -14.226 10.251 1.00 0.00 ? 69 LYS D HD2 1 3
ATOM 891 H HD3 . LYS D 1 3 ? -0.723 -14.152 10.256 1.00 0.00 ? 69 LYS D HD3 1 3
ATOM 892 H HE2 . LYS D 1 3 ? 0.789 -16.691 9.995 1.00 0.00 ? 69 LYS D HE2 1 3
ATOM 893 H HE3 . LYS D 1 3 ? 0.277 -16.074 11.493 1.00 0.00 ? 69 LYS D HE3 1 3
ATOM 894 H HZ1 . LYS D 1 3 ? -1.526 -16.802 9.514 1.00 0.00 ? 69 LYS D HZ1 1 3
ATOM 895 H HZ2 . LYS D 1 3 ? -1.156 -17.572 10.729 1.00 0.00 ? 69 LYS D HZ2 1 3
ATOM 896 H HZ3 . LYS D 1 3 ? -1.851 -16.305 10.834 1.00 0.00 ? 69 LYS D HZ3 1 3
ATOM 897 N N . ALA D 1 4 ? 0.798 -10.865 6.252 1.00 0.00 ? 70 ALA D N 1 4
ATOM 898 C CA . ALA D 1 4 ? 0.886 -9.483 5.840 1.00 0.00 ? 70 ALA D CA 1 4
ATOM 899 C C . ALA D 1 4 ? 0.431 -9.272 4.409 1.00 0.00 ? 70 ALA D C 1 4
ATOM 900 O O . ALA D 1 4 ? -0.267 -8.320 4.095 1.00 0.00 ? 70 ALA D O 1 4
ATOM 901 C CB . ALA D 1 4 ? 2.326 -9.021 6.005 1.00 0.00 ? 70 ALA D CB 1 4
ATOM 902 H H . ALA D 1 4 ? 1.584 -11.289 6.695 1.00 0.00 ? 70 ALA D H 1 4
ATOM 903 H HA . ALA D 1 4 ? 0.241 -8.897 6.486 1.00 0.00 ? 70 ALA D HA 1 4
ATOM 904 H HB1 . ALA D 1 4 ? 2.403 -7.949 5.985 1.00 0.00 ? 70 ALA D HB1 1 4
ATOM 905 H HB2 . ALA D 1 4 ? 2.696 -9.412 6.937 1.00 0.00 ? 70 ALA D HB2 1 4
ATOM 906 H HB3 . ALA D 1 4 ? 2.939 -9.408 5.225 1.00 0.00 ? 70 ALA D HB3 1 4
ATOM 907 N N . ALA D 1 5 ? 0.801 -10.229 3.562 1.00 0.00 ? 71 ALA D N 1 5
ATOM 908 C CA . ALA D 1 5 ? 0.613 -10.221 2.137 1.00 0.00 ? 71 ALA D CA 1 5
ATOM 909 C C . ALA D 1 5 ? -0.746 -10.699 1.664 1.00 0.00 ? 71 ALA D C 1 5
ATOM 910 O O . ALA D 1 5 ? -0.990 -10.739 0.480 1.00 0.00 ? 71 ALA D O 1 5
ATOM 911 C CB . ALA D 1 5 ? 1.744 -10.965 1.458 1.00 0.00 ? 71 ALA D CB 1 5
ATOM 912 H H . ALA D 1 5 ? 1.169 -11.021 4.026 1.00 0.00 ? 71 ALA D H 1 5
ATOM 913 H HA . ALA D 1 5 ? 0.656 -9.203 1.762 1.00 0.00 ? 71 ALA D HA 1 5
ATOM 914 H HB1 . ALA D 1 5 ? 2.685 -10.753 1.916 1.00 0.00 ? 71 ALA D HB1 1 5
ATOM 915 H HB2 . ALA D 1 5 ? 1.556 -12.012 1.559 1.00 0.00 ? 71 ALA D HB2 1 5
ATOM 916 H HB3 . ALA D 1 5 ? 1.781 -10.725 0.424 1.00 0.00 ? 71 ALA D HB3 1 5
ATOM 917 N N . ALA D 1 6 ? -1.671 -10.989 2.558 1.00 0.00 ? 72 ALA D N 1 6
ATOM 918 C CA . ALA D 1 6 ? -3.086 -10.858 2.332 1.00 0.00 ? 72 ALA D CA 1 6
ATOM 919 C C . ALA D 1 6 ? -3.610 -9.621 3.023 1.00 0.00 ? 72 ALA D C 1 6
ATOM 920 O O . ALA D 1 6 ? -4.028 -8.688 2.364 1.00 0.00 ? 72 ALA D O 1 6
ATOM 921 C CB . ALA D 1 6 ? -3.760 -12.134 2.779 1.00 0.00 ? 72 ALA D CB 1 6
ATOM 922 H H . ALA D 1 6 ? -1.343 -11.061 3.494 1.00 0.00 ? 72 ALA D H 1 6
ATOM 923 H HA . ALA D 1 6 ? -3.242 -10.687 1.278 1.00 0.00 ? 72 ALA D HA 1 6
ATOM 924 H HB1 . ALA D 1 6 ? -3.600 -12.329 3.812 1.00 0.00 ? 72 ALA D HB1 1 6
ATOM 925 H HB2 . ALA D 1 6 ? -4.810 -12.049 2.587 1.00 0.00 ? 72 ALA D HB2 1 6
ATOM 926 H HB3 . ALA D 1 6 ? -3.372 -12.972 2.226 1.00 0.00 ? 72 ALA D HB3 1 6
ATOM 927 N N . ALA D 1 7 ? -3.517 -9.547 4.342 1.00 0.00 ? 73 ALA D N 1 7
ATOM 928 C CA . ALA D 1 7 ? -4.181 -8.598 5.191 1.00 0.00 ? 73 ALA D CA 1 7
ATOM 929 C C . ALA D 1 7 ? -3.950 -7.147 4.839 1.00 0.00 ? 73 ALA D C 1 7
ATOM 930 O O . ALA D 1 7 ? -4.868 -6.352 4.915 1.00 0.00 ? 73 ALA D O 1 7
ATOM 931 C CB . ALA D 1 7 ? -3.820 -8.875 6.609 1.00 0.00 ? 73 ALA D CB 1 7
ATOM 932 H H . ALA D 1 7 ? -3.030 -10.314 4.750 1.00 0.00 ? 73 ALA D H 1 7
ATOM 933 H HA . ALA D 1 7 ? -5.232 -8.756 5.119 1.00 0.00 ? 73 ALA D HA 1 7
ATOM 934 H HB1 . ALA D 1 7 ? -4.271 -8.193 7.255 1.00 0.00 ? 73 ALA D HB1 1 7
ATOM 935 H HB2 . ALA D 1 7 ? -4.111 -9.825 6.892 1.00 0.00 ? 73 ALA D HB2 1 7
ATOM 936 H HB3 . ALA D 1 7 ? -2.814 -8.839 6.751 1.00 0.00 ? 73 ALA D HB3 1 7
ATOM 937 N N . ALA D 1 8 ? -2.748 -6.796 4.410 1.00 0.00 ? 74 ALA D N 1 8
ATOM 938 C CA . ALA D 1 8 ? -2.510 -5.428 4.023 1.00 0.00 ? 74 ALA D CA 1 8
ATOM 939 C C . ALA D 1 8 ? -3.076 -5.100 2.655 1.00 0.00 ? 74 ALA D C 1 8
ATOM 940 O O . ALA D 1 8 ? -3.642 -4.044 2.427 1.00 0.00 ? 74 ALA D O 1 8
ATOM 941 C CB . ALA D 1 8 ? -1.026 -5.103 4.084 1.00 0.00 ? 74 ALA D CB 1 8
ATOM 942 H H . ALA D 1 8 ? -2.067 -7.510 4.243 1.00 0.00 ? 74 ALA D H 1 8
ATOM 943 H HA . ALA D 1 8 ? -3.037 -4.792 4.722 1.00 0.00 ? 74 ALA D HA 1 8
ATOM 944 H HB1 . ALA D 1 8 ? -0.890 -4.056 4.106 1.00 0.00 ? 74 ALA D HB1 1 8
ATOM 945 H HB2 . ALA D 1 8 ? -0.637 -5.520 4.973 1.00 0.00 ? 74 ALA D HB2 1 8
ATOM 946 H HB3 . ALA D 1 8 ? -0.545 -5.514 3.237 1.00 0.00 ? 74 ALA D HB3 1 8
ATOM 947 N N . ILE D 1 9 ? -2.915 -6.061 1.758 1.00 0.00 ? 75 ILE D N 1 9
ATOM 948 C CA . ILE D 1 9 ? -3.334 -5.971 0.381 1.00 0.00 ? 75 ILE D CA 1 9
ATOM 949 C C . ILE D 1 9 ? -4.845 -5.980 0.261 1.00 0.00 ? 75 ILE D C 1 9
ATOM 950 O O . ILE D 1 9 ? -5.370 -5.169 -0.486 1.00 0.00 ? 75 ILE D O 1 9
ATOM 951 C CB . ILE D 1 9 ? -2.795 -7.159 -0.405 1.00 0.00 ? 75 ILE D CB 1 9
ATOM 952 C CG1 . ILE D 1 9 ? -1.314 -7.429 -0.187 1.00 0.00 ? 75 ILE D CG1 1 9
ATOM 953 C CG2 . ILE D 1 9 ? -3.105 -7.033 -1.885 1.00 0.00 ? 75 ILE D CG2 1 9
ATOM 954 C CD1 . ILE D 1 9 ? -0.433 -6.218 -0.442 1.00 0.00 ? 75 ILE D CD1 1 9
ATOM 955 H H . ILE D 1 9 ? -2.552 -6.939 2.081 1.00 0.00 ? 75 ILE D H 1 9
ATOM 956 H HA . ILE D 1 9 ? -2.947 -5.061 -0.066 1.00 0.00 ? 75 ILE D HA 1 9
ATOM 957 H HB . ILE D 1 9 ? -3.364 -8.018 -0.072 1.00 0.00 ? 75 ILE D HB 1 9
ATOM 958 H HG12 . ILE D 1 9 ? -1.169 -7.759 0.842 1.00 0.00 ? 75 ILE D HG12 1 9
ATOM 959 H HG13 . ILE D 1 9 ? -0.979 -8.244 -0.814 1.00 0.00 ? 75 ILE D HG13 1 9
ATOM 960 H HG21 . ILE D 1 9 ? -2.825 -6.051 -2.216 1.00 0.00 ? 75 ILE D HG21 1 9
ATOM 961 H HG22 . ILE D 1 9 ? -2.607 -7.811 -2.428 1.00 0.00 ? 75 ILE D HG22 1 9
ATOM 962 H HG23 . ILE D 1 9 ? -4.165 -7.168 -1.992 1.00 0.00 ? 75 ILE D HG23 1 9
ATOM 963 H HD11 . ILE D 1 9 ? 0.597 -6.485 -0.299 1.00 0.00 ? 75 ILE D HD11 1 9
ATOM 964 H HD12 . ILE D 1 9 ? -0.570 -5.905 -1.453 1.00 0.00 ? 75 ILE D HD12 1 9
ATOM 965 H HD13 . ILE D 1 9 ? -0.686 -5.416 0.201 1.00 0.00 ? 75 ILE D HD13 1 9
ATOM 966 N N . LYS D 1 10 ? -5.536 -6.854 0.986 1.00 0.00 ? 76 LYS D N 1 10
ATOM 967 C CA . LYS D 1 10 ? -6.965 -7.021 0.959 1.00 0.00 ? 76 LYS D CA 1 10
ATOM 968 C C . LYS D 1 10 ? -7.736 -5.885 1.593 1.00 0.00 ? 76 LYS D C 1 10
ATOM 969 O O . LYS D 1 10 ? -8.819 -5.541 1.158 1.00 0.00 ? 76 LYS D O 1 10
ATOM 970 C CB . LYS D 1 10 ? -7.267 -8.338 1.647 1.00 0.00 ? 76 LYS D CB 1 10
ATOM 971 C CG . LYS D 1 10 ? -7.007 -9.547 0.788 1.00 0.00 ? 76 LYS D CG 1 10
ATOM 972 C CD . LYS D 1 10 ? -7.463 -10.810 1.432 1.00 0.00 ? 76 LYS D CD 1 10
ATOM 973 C CE . LYS D 1 10 ? -7.207 -12.000 0.547 1.00 0.00 ? 76 LYS D CE 1 10
ATOM 974 N NZ . LYS D 1 10 ? -7.805 -13.216 1.056 1.00 0.00 ? 76 LYS D NZ 1 10
ATOM 975 H H . LYS D 1 10 ? -4.964 -7.433 1.570 1.00 0.00 ? 76 LYS D H 1 10
ATOM 976 H HA . LYS D 1 10 ? -7.282 -7.032 -0.071 1.00 0.00 ? 76 LYS D HA 1 10
ATOM 977 H HB2 . LYS D 1 10 ? -6.677 -8.412 2.561 1.00 0.00 ? 76 LYS D HB2 1 10
ATOM 978 H HB3 . LYS D 1 10 ? -8.294 -8.342 1.919 1.00 0.00 ? 76 LYS D HB3 1 10
ATOM 979 H HG2 . LYS D 1 10 ? -7.532 -9.420 -0.159 1.00 0.00 ? 76 LYS D HG2 1 10
ATOM 980 H HG3 . LYS D 1 10 ? -5.980 -9.655 0.536 1.00 0.00 ? 76 LYS D HG3 1 10
ATOM 981 H HD2 . LYS D 1 10 ? -6.966 -10.944 2.393 1.00 0.00 ? 76 LYS D HD2 1 10
ATOM 982 H HD3 . LYS D 1 10 ? -8.504 -10.733 1.599 1.00 0.00 ? 76 LYS D HD3 1 10
ATOM 983 H HE2 . LYS D 1 10 ? -7.604 -11.800 -0.449 1.00 0.00 ? 76 LYS D HE2 1 10
ATOM 984 H HE3 . LYS D 1 10 ? -6.157 -12.113 0.438 1.00 0.00 ? 76 LYS D HE3 1 10
ATOM 985 H HZ1 . LYS D 1 10 ? -7.956 -13.507 1.352 1.00 0.00 ? 76 LYS D HZ1 1 10
ATOM 986 H HZ2 . LYS D 1 10 ? -8.068 -13.434 1.147 1.00 0.00 ? 76 LYS D HZ2 1 10
ATOM 987 H HZ3 . LYS D 1 10 ? -7.819 -13.582 1.113 1.00 0.00 ? 76 LYS D HZ3 1 10
ATOM 988 N N . ALA D 1 11 ? -7.118 -5.238 2.571 1.00 0.00 ? 77 ALA D N 1 11
ATOM 989 C CA . ALA D 1 11 ? -7.449 -3.885 2.938 1.00 0.00 ? 77 ALA D CA 1 11
ATOM 990 C C . ALA D 1 11 ? -7.254 -2.921 1.781 1.00 0.00 ? 77 ALA D C 1 11
ATOM 991 O O . ALA D 1 11 ? -8.205 -2.349 1.270 1.00 0.00 ? 77 ALA D O 1 11
ATOM 992 C CB . ALA D 1 11 ? -6.649 -3.525 4.170 1.00 0.00 ? 77 ALA D CB 1 11
ATOM 993 H H . ALA D 1 11 ? -6.313 -5.684 2.953 1.00 0.00 ? 77 ALA D H 1 11
ATOM 994 H HA . ALA D 1 11 ? -8.507 -3.844 3.168 1.00 0.00 ? 77 ALA D HA 1 11
ATOM 995 H HB1 . ALA D 1 11 ? -5.607 -3.651 3.998 1.00 0.00 ? 77 ALA D HB1 1 11
ATOM 996 H HB2 . ALA D 1 11 ? -6.859 -2.516 4.454 1.00 0.00 ? 77 ALA D HB2 1 11
ATOM 997 H HB3 . ALA D 1 11 ? -6.936 -4.159 4.988 1.00 0.00 ? 77 ALA D HB3 1 11
ATOM 998 N N . ILE D 1 12 ? -6.045 -2.707 1.280 1.00 0.00 ? 78 ILE D N 1 12
ATOM 999 C CA . ILE D 1 12 ? -5.704 -1.600 0.417 1.00 0.00 ? 78 ILE D CA 1 12
ATOM 1000 C C . ILE D 1 12 ? -6.355 -1.720 -0.948 1.00 0.00 ? 78 ILE D C 1 12
ATOM 1001 O O . ILE D 1 12 ? -6.963 -0.763 -1.396 1.00 0.00 ? 78 ILE D O 1 12
ATOM 1002 C CB . ILE D 1 12 ? -4.204 -1.346 0.415 1.00 0.00 ? 78 ILE D CB 1 12
ATOM 1003 C CG1 . ILE D 1 12 ? -3.977 0.156 0.436 1.00 0.00 ? 78 ILE D CG1 1 12
ATOM 1004 C CG2 . ILE D 1 12 ? -3.520 -2.040 -0.748 1.00 0.00 ? 78 ILE D CG2 1 12
ATOM 1005 C CD1 . ILE D 1 12 ? -2.549 0.634 0.374 1.00 0.00 ? 78 ILE D CD1 1 12
ATOM 1006 H H . ILE D 1 12 ? -5.317 -3.348 1.526 1.00 0.00 ? 78 ILE D H 1 12
ATOM 1007 H HA . ILE D 1 12 ? -6.170 -0.724 0.856 1.00 0.00 ? 78 ILE D HA 1 12
ATOM 1008 H HB . ILE D 1 12 ? -3.792 -1.735 1.337 1.00 0.00 ? 78 ILE D HB 1 12
ATOM 1009 H HG12 . ILE D 1 12 ? -4.534 0.612 -0.383 1.00 0.00 ? 78 ILE D HG12 1 12
ATOM 1010 H HG13 . ILE D 1 12 ? -4.401 0.486 1.378 1.00 0.00 ? 78 ILE D HG13 1 12
ATOM 1011 H HG21 . ILE D 1 12 ? -3.784 -1.585 -1.691 1.00 0.00 ? 78 ILE D HG21 1 12
ATOM 1012 H HG22 . ILE D 1 12 ? -2.451 -2.026 -0.645 1.00 0.00 ? 78 ILE D HG22 1 12
ATOM 1013 H HG23 . ILE D 1 12 ? -3.825 -3.075 -0.761 1.00 0.00 ? 78 ILE D HG23 1 12
ATOM 1014 H HD11 . ILE D 1 12 ? -1.964 0.067 1.050 1.00 0.00 ? 78 ILE D HD11 1 12
ATOM 1015 H HD12 . ILE D 1 12 ? -2.173 0.478 -0.603 1.00 0.00 ? 78 ILE D HD12 1 12
ATOM 1016 H HD13 . ILE D 1 12 ? -2.490 1.662 0.618 1.00 0.00 ? 78 ILE D HD13 1 12
ATOM 1017 N N . ALA D 1 13 ? -6.437 -2.900 -1.550 1.00 0.00 ? 79 ALA D N 1 13
ATOM 1018 C CA . ALA D 1 13 ? -7.053 -2.985 -2.854 1.00 0.00 ? 79 ALA D CA 1 13
ATOM 1019 C C . ALA D 1 13 ? -8.553 -2.800 -2.838 1.00 0.00 ? 79 ALA D C 1 13
ATOM 1020 O O . ALA D 1 13 ? -9.162 -2.624 -3.852 1.00 0.00 ? 79 ALA D O 1 13
ATOM 1021 C CB . ALA D 1 13 ? -6.632 -4.281 -3.508 1.00 0.00 ? 79 ALA D CB 1 13
ATOM 1022 H H . ALA D 1 13 ? -6.023 -3.690 -1.091 1.00 0.00 ? 79 ALA D H 1 13
ATOM 1023 H HA . ALA D 1 13 ? -6.663 -2.189 -3.479 1.00 0.00 ? 79 ALA D HA 1 13
ATOM 1024 H HB1 . ALA D 1 13 ? -6.940 -5.078 -2.916 1.00 0.00 ? 79 ALA D HB1 1 13
ATOM 1025 H HB2 . ALA D 1 13 ? -7.093 -4.374 -4.448 1.00 0.00 ? 79 ALA D HB2 1 13
ATOM 1026 H HB3 . ALA D 1 13 ? -5.610 -4.330 -3.641 1.00 0.00 ? 79 ALA D HB3 1 13
ATOM 1027 N N . ALA D 1 14 ? -9.198 -2.835 -1.690 1.00 0.00 ? 80 ALA D N 1 14
ATOM 1028 C CA . ALA D 1 14 ? -10.588 -2.520 -1.494 1.00 0.00 ? 80 ALA D CA 1 14
ATOM 1029 C C . ALA D 1 14 ? -10.821 -1.116 -0.998 1.00 0.00 ? 80 ALA D C 1 14
ATOM 1030 O O . ALA D 1 14 ? -11.749 -0.451 -1.428 1.00 0.00 ? 80 ALA D O 1 14
ATOM 1031 C CB . ALA D 1 14 ? -11.103 -3.540 -0.510 1.00 0.00 ? 80 ALA D CB 1 14
ATOM 1032 H H . ALA D 1 14 ? -8.594 -2.926 -0.904 1.00 0.00 ? 80 ALA D H 1 14
ATOM 1033 H HA . ALA D 1 14 ? -11.121 -2.590 -2.424 1.00 0.00 ? 80 ALA D HA 1 14
ATOM 1034 H HB1 . ALA D 1 14 ? -10.959 -4.523 -0.882 1.00 0.00 ? 80 ALA D HB1 1 14
ATOM 1035 H HB2 . ALA D 1 14 ? -10.583 -3.463 0.413 1.00 0.00 ? 80 ALA D HB2 1 14
ATOM 1036 H HB3 . ALA D 1 14 ? -12.140 -3.383 -0.306 1.00 0.00 ? 80 ALA D HB3 1 14
ATOM 1037 N N . ILE D 1 15 ? -9.924 -0.622 -0.155 1.00 0.00 ? 81 ILE D N 1 15
ATOM 1038 C CA . ILE D 1 15 ? -9.897 0.737 0.340 1.00 0.00 ? 81 ILE D CA 1 15
ATOM 1039 C C . ILE D 1 15 ? -9.489 1.673 -0.785 1.00 0.00 ? 81 ILE D C 1 15
ATOM 1040 O O . ILE D 1 15 ? -9.947 2.801 -0.799 1.00 0.00 ? 81 ILE D O 1 15
ATOM 1041 C CB . ILE D 1 15 ? -9.004 0.854 1.563 1.00 0.00 ? 81 ILE D CB 1 15
ATOM 1042 C CG1 . ILE D 1 15 ? -9.536 0.066 2.747 1.00 0.00 ? 81 ILE D CG1 1 15
ATOM 1043 C CG2 . ILE D 1 15 ? -8.813 2.298 1.993 1.00 0.00 ? 81 ILE D CG2 1 15
ATOM 1044 C CD1 . ILE D 1 15 ? -8.557 -0.174 3.883 1.00 0.00 ? 81 ILE D CD1 1 15
ATOM 1045 H H . ILE D 1 15 ? -9.176 -1.223 0.130 1.00 0.00 ? 81 ILE D H 1 15
ATOM 1046 H HA . ILE D 1 15 ? -10.882 1.019 0.674 1.00 0.00 ? 81 ILE D HA 1 15
ATOM 1047 H HB . ILE D 1 15 ? -8.018 0.500 1.292 1.00 0.00 ? 81 ILE D HB 1 15
ATOM 1048 H HG12 . ILE D 1 15 ? -10.398 0.598 3.149 1.00 0.00 ? 81 ILE D HG12 1 15
ATOM 1049 H HG13 . ILE D 1 15 ? -9.901 -0.890 2.393 1.00 0.00 ? 81 ILE D HG13 1 15
ATOM 1050 H HG21 . ILE D 1 15 ? -9.738 2.833 2.053 1.00 0.00 ? 81 ILE D HG21 1 15
ATOM 1051 H HG22 . ILE D 1 15 ? -8.367 2.317 2.954 1.00 0.00 ? 81 ILE D HG22 1 15
ATOM 1052 H HG23 . ILE D 1 15 ? -8.146 2.812 1.342 1.00 0.00 ? 81 ILE D HG23 1 15
ATOM 1053 H HD11 . ILE D 1 15 ? -8.945 -0.934 4.530 1.00 0.00 ? 81 ILE D HD11 1 15
ATOM 1054 H HD12 . ILE D 1 15 ? -7.654 -0.563 3.486 1.00 0.00 ? 81 ILE D HD12 1 15
ATOM 1055 H HD13 . ILE D 1 15 ? -8.381 0.731 4.428 1.00 0.00 ? 81 ILE D HD13 1 15
ATOM 1056 N N . ILE D 1 16 ? -8.725 1.246 -1.782 1.00 0.00 ? 82 ILE D N 1 16
ATOM 1057 C CA . ILE D 1 16 ? -8.441 2.062 -2.937 1.00 0.00 ? 82 ILE D CA 1 16
ATOM 1058 C C . ILE D 1 16 ? -9.678 2.323 -3.763 1.00 0.00 ? 82 ILE D C 1 16
ATOM 1059 O O . ILE D 1 16 ? -9.982 3.467 -4.069 1.00 0.00 ? 82 ILE D O 1 16
ATOM 1060 C CB . ILE D 1 16 ? -7.277 1.458 -3.698 1.00 0.00 ? 82 ILE D CB 1 16
ATOM 1061 C CG1 . ILE D 1 16 ? -6.022 1.768 -2.910 1.00 0.00 ? 82 ILE D CG1 1 16
ATOM 1062 C CG2 . ILE D 1 16 ? -7.133 2.046 -5.088 1.00 0.00 ? 82 ILE D CG2 1 16
ATOM 1063 C CD1 . ILE D 1 16 ? -4.723 1.217 -3.431 1.00 0.00 ? 82 ILE D CD1 1 16
ATOM 1064 H H . ILE D 1 16 ? -8.323 0.328 -1.726 1.00 0.00 ? 82 ILE D H 1 16
ATOM 1065 H HA . ILE D 1 16 ? -8.136 3.054 -2.619 1.00 0.00 ? 82 ILE D HA 1 16
ATOM 1066 H HB . ILE D 1 16 ? -7.415 0.383 -3.728 1.00 0.00 ? 82 ILE D HB 1 16
ATOM 1067 H HG12 . ILE D 1 16 ? -5.927 2.852 -2.854 1.00 0.00 ? 82 ILE D HG12 1 16
ATOM 1068 H HG13 . ILE D 1 16 ? -6.142 1.421 -1.894 1.00 0.00 ? 82 ILE D HG13 1 16
ATOM 1069 H HG21 . ILE D 1 16 ? -6.985 3.112 -5.013 1.00 0.00 ? 82 ILE D HG21 1 16
ATOM 1070 H HG22 . ILE D 1 16 ? -6.314 1.607 -5.635 1.00 0.00 ? 82 ILE D HG22 1 16
ATOM 1071 H HG23 . ILE D 1 16 ? -8.004 1.889 -5.695 1.00 0.00 ? 82 ILE D HG23 1 16
ATOM 1072 H HD11 . ILE D 1 16 ? -3.956 1.499 -2.748 1.00 0.00 ? 82 ILE D HD11 1 16
ATOM 1073 H HD12 . ILE D 1 16 ? -4.757 0.164 -3.450 1.00 0.00 ? 82 ILE D HD12 1 16
ATOM 1074 H HD13 . ILE D 1 16 ? -4.496 1.630 -4.393 1.00 0.00 ? 82 ILE D HD13 1 16
ATOM 1075 N N . LYS D 1 17 ? -10.396 1.254 -4.082 1.00 0.00 ? 83 LYS D N 1 17
ATOM 1076 C CA . LYS D 1 17 ? -11.674 1.298 -4.743 1.00 0.00 ? 83 LYS D CA 1 17
ATOM 1077 C C . LYS D 1 17 ? -12.702 2.176 -4.059 1.00 0.00 ? 83 LYS D C 1 17
ATOM 1078 O O . LYS D 1 17 ? -13.487 2.808 -4.736 1.00 0.00 ? 83 LYS D O 1 17
ATOM 1079 C CB . LYS D 1 17 ? -12.165 -0.133 -4.872 1.00 0.00 ? 83 LYS D CB 1 17
ATOM 1080 C CG . LYS D 1 17 ? -13.036 -0.358 -6.074 1.00 0.00 ? 83 LYS D CG 1 17
ATOM 1081 C CD . LYS D 1 17 ? -12.255 -0.478 -7.309 1.00 0.00 ? 83 LYS D CD 1 17
ATOM 1082 C CE . LYS D 1 17 ? -13.156 -0.803 -8.452 1.00 0.00 ? 83 LYS D CE 1 17
ATOM 1083 N NZ . LYS D 1 17 ? -12.831 -1.481 -9.341 1.00 0.00 ? 83 LYS D NZ 1 17
ATOM 1084 H H . LYS D 1 17 ? -9.966 0.370 -3.944 1.00 0.00 ? 83 LYS D H 1 17
ATOM 1085 H HA . LYS D 1 17 ? -11.470 1.706 -5.725 1.00 0.00 ? 83 LYS D HA 1 17
ATOM 1086 H HB2 . LYS D 1 17 ? -11.308 -0.805 -4.918 1.00 0.00 ? 83 LYS D HB2 1 17
ATOM 1087 H HB3 . LYS D 1 17 ? -12.731 -0.392 -3.996 1.00 0.00 ? 83 LYS D HB3 1 17
ATOM 1088 H HG2 . LYS D 1 17 ? -13.604 -1.277 -5.929 1.00 0.00 ? 83 LYS D HG2 1 17
ATOM 1089 H HG3 . LYS D 1 17 ? -13.753 0.404 -6.152 1.00 0.00 ? 83 LYS D HG3 1 17
ATOM 1090 H HD2 . LYS D 1 17 ? -11.735 0.459 -7.508 1.00 0.00 ? 83 LYS D HD2 1 17
ATOM 1091 H HD3 . LYS D 1 17 ? -11.519 -1.200 -7.192 1.00 0.00 ? 83 LYS D HD3 1 17
ATOM 1092 H HE2 . LYS D 1 17 ? -14.056 -1.251 -8.030 1.00 0.00 ? 83 LYS D HE2 1 17
ATOM 1093 H HE3 . LYS D 1 17 ? -13.374 -0.123 -8.825 1.00 0.00 ? 83 LYS D HE3 1 17
ATOM 1094 H HZ1 . LYS D 1 17 ? -12.483 -1.420 -9.186 1.00 0.00 ? 83 LYS D HZ1 1 17
ATOM 1095 H HZ2 . LYS D 1 17 ? -12.877 -1.924 -9.575 1.00 0.00 ? 83 LYS D HZ2 1 17
ATOM 1096 H HZ3 . LYS D 1 17 ? -12.885 -1.529 -9.942 1.00 0.00 ? 83 LYS D HZ3 1 17
ATOM 1097 N N . ALA D 1 18 ? -12.703 2.209 -2.735 1.00 0.00 ? 84 ALA D N 1 18
ATOM 1098 C CA . ALA D 1 18 ? -13.620 2.964 -1.922 1.00 0.00 ? 84 ALA D CA 1 18
ATOM 1099 C C . ALA D 1 18 ? -13.165 4.389 -1.704 1.00 0.00 ? 84 ALA D C 1 18
ATOM 1100 O O . ALA D 1 18 ? -13.948 5.300 -1.795 1.00 0.00 ? 84 ALA D O 1 18
ATOM 1101 C CB . ALA D 1 18 ? -13.850 2.234 -0.624 1.00 0.00 ? 84 ALA D CB 1 18
ATOM 1102 H H . ALA D 1 18 ? -12.054 1.597 -2.283 1.00 0.00 ? 84 ALA D H 1 18
ATOM 1103 H HA . ALA D 1 18 ? -14.572 3.006 -2.436 1.00 0.00 ? 84 ALA D HA 1 18
ATOM 1104 H HB1 . ALA D 1 18 ? -12.947 2.147 -0.069 1.00 0.00 ? 84 ALA D HB1 1 18
ATOM 1105 H HB2 . ALA D 1 18 ? -14.544 2.780 -0.041 1.00 0.00 ? 84 ALA D HB2 1 18
ATOM 1106 H HB3 . ALA D 1 18 ? -14.233 1.262 -0.839 1.00 0.00 ? 84 ALA D HB3 1 18
ATOM 1107 N N . GLY D 1 19 ? -11.882 4.580 -1.444 1.00 0.00 ? 85 GLY D N 1 19
ATOM 1108 C CA . GLY D 1 19 ? -11.209 5.826 -1.161 1.00 0.00 ? 85 GLY D CA 1 19
ATOM 1109 C C . GLY D 1 19 ? -11.163 6.810 -2.318 1.00 0.00 ? 85 GLY D C 1 19
ATOM 1110 O O . GLY D 1 19 ? -11.171 7.990 -2.117 1.00 0.00 ? 85 GLY D O 1 19
ATOM 1111 H H . GLY D 1 19 ? -11.316 3.771 -1.356 1.00 0.00 ? 85 GLY D H 1 19
ATOM 1112 H HA2 . GLY D 1 19 ? -11.644 6.336 -0.315 1.00 0.00 ? 85 GLY D HA2 1 19
ATOM 1113 H HA3 . GLY D 1 19 ? -10.175 5.632 -0.903 1.00 0.00 ? 85 GLY D HA3 1 19
ATOM 1114 N N . GLY D 1 20 ? -11.131 6.318 -3.536 1.00 0.00 ? 86 GLY D N 1 20
ATOM 1115 C CA . GLY D 1 20 ? -11.096 7.093 -4.738 1.00 0.00 ? 86 GLY D CA 1 20
ATOM 1116 C C . GLY D 1 20 ? -9.773 7.749 -5.061 1.00 0.00 ? 86 GLY D C 1 20
ATOM 1117 O O . GLY D 1 20 ? -9.730 8.787 -5.625 1.00 0.00 ? 86 GLY D O 1 20
ATOM 1118 H H . GLY D 1 20 ? -11.140 5.333 -3.611 1.00 0.00 ? 86 GLY D H 1 20
ATOM 1119 H HA2 . GLY D 1 20 ? -11.371 6.458 -5.556 1.00 0.00 ? 86 GLY D HA2 1 20
ATOM 1120 H HA3 . GLY D 1 20 ? -11.843 7.857 -4.664 1.00 0.00 ? 86 GLY D HA3 1 20
ATOM 1121 N N . TYR D 1 21 ? -8.690 7.141 -4.712 1.00 0.00 ? 87 TYR D N 1 21
ATOM 1122 C CA . TYR D 1 21 ? -7.340 7.538 -4.961 1.00 0.00 ? 87 TYR D CA 1 21
ATOM 1123 C C . TYR D 1 21 ? -6.978 7.856 -6.367 1.00 0.00 ? 87 TYR D C 1 21
ATOM 1124 O O . TYR D 1 21 ? -6.052 8.567 -6.614 1.00 0.00 ? 87 TYR D O 1 21
ATOM 1125 C CB . TYR D 1 21 ? -6.491 6.387 -4.488 1.00 0.00 ? 87 TYR D CB 1 21
ATOM 1126 C CG . TYR D 1 21 ? -6.055 6.369 -3.053 1.00 0.00 ? 87 TYR D CG 1 21
ATOM 1127 C CD1 . TYR D 1 21 ? -5.132 7.243 -2.511 1.00 0.00 ? 87 TYR D CD1 1 21
ATOM 1128 C CD2 . TYR D 1 21 ? -6.466 5.285 -2.304 1.00 0.00 ? 87 TYR D CD2 1 21
ATOM 1129 C CE1 . TYR D 1 21 ? -4.597 6.991 -1.248 1.00 0.00 ? 87 TYR D CE1 1 21
ATOM 1130 C CE2 . TYR D 1 21 ? -5.925 4.993 -1.052 1.00 0.00 ? 87 TYR D CE2 1 21
ATOM 1131 C CZ . TYR D 1 21 ? -4.969 5.865 -0.525 1.00 0.00 ? 87 TYR D CZ 1 21
ATOM 1132 O OH . TYR D 1 21 ? -4.464 5.637 0.713 1.00 0.00 ? 87 TYR D OH 1 21
ATOM 1133 H H . TYR D 1 21 ? -8.822 6.325 -4.177 1.00 0.00 ? 87 TYR D H 1 21
ATOM 1134 H HA . TYR D 1 21 ? -7.135 8.395 -4.352 1.00 0.00 ? 87 TYR D HA 1 21
ATOM 1135 H HB2 . TYR D 1 21 ? -7.055 5.473 -4.675 1.00 0.00 ? 87 TYR D HB2 1 21
ATOM 1136 H HB3 . TYR D 1 21 ? -5.593 6.305 -5.064 1.00 0.00 ? 87 TYR D HB3 1 21
ATOM 1137 H HD1 . TYR D 1 21 ? -4.803 8.087 -3.056 1.00 0.00 ? 87 TYR D HD1 1 21
ATOM 1138 H HD2 . TYR D 1 21 ? -7.175 4.634 -2.762 1.00 0.00 ? 87 TYR D HD2 1 21
ATOM 1139 H HE1 . TYR D 1 21 ? -3.901 7.698 -0.867 1.00 0.00 ? 87 TYR D HE1 1 21
ATOM 1140 H HE2 . TYR D 1 21 ? -6.236 4.130 -0.503 1.00 0.00 ? 87 TYR D HE2 1 21
ATOM 1141 H HH . TYR D 1 21 ? -5.124 5.916 1.337 1.00 0.00 ? 87 TYR D HH 1 21
HETATM 1142 N N . NH2 D 1 22 ? -7.630 7.348 -7.313 1.00 0.00 ? 88 NH2 D N 1 22
HETATM 1143 H HN1 . NH2 D 1 22 ? -7.411 7.582 -8.224 1.00 0.00 ? 88 NH2 D HN1 1 22
HETATM 1144 H HN2 . NH2 D 1 22 ? -8.322 6.740 -7.061 1.00 0.00 ? 88 NH2 D HN2 1 22
HETATM 1145 C C . ACE A 1 1 ? 1.254 15.548 2.684 1.00 0.00 ? 1 ACE A C 2 1
HETATM 1146 O O . ACE A 1 1 ? 0.447 16.151 2.018 1.00 0.00 ? 1 ACE A O 2 1
HETATM 1147 C CH3 . ACE A 1 1 ? 2.220 16.311 3.547 1.00 0.00 ? 1 ACE A CH3 2 1
HETATM 1148 H H1 . ACE A 1 1 ? 2.238 16.735 3.876 1.00 0.00 ? 1 ACE A H1 2 1
HETATM 1149 H H2 . ACE A 1 1 ? 2.502 16.132 3.879 1.00 0.00 ? 1 ACE A H2 2 1
HETATM 1150 H H3 . ACE A 1 1 ? 2.640 16.603 3.475 1.00 0.00 ? 1 ACE A H3 2 1
ATOM 1151 N N . ALA A 1 2 ? 1.326 14.232 2.685 1.00 0.00 ? 2 ALA A N 2 2
ATOM 1152 C CA . ALA A 1 2 ? 0.524 13.260 2.003 1.00 0.00 ? 2 ALA A CA 2 2
ATOM 1153 C C . ALA A 1 2 ? 0.377 13.425 0.505 1.00 0.00 ? 2 ALA A C 2 2
ATOM 1154 O O . ALA A 1 2 ? -0.471 12.796 -0.108 1.00 0.00 ? 2 ALA A O 2 2
ATOM 1155 C CB . ALA A 1 2 ? -0.795 13.116 2.717 1.00 0.00 ? 2 ALA A CB 2 2
ATOM 1156 H H . ALA A 1 2 ? 1.968 13.863 3.325 1.00 0.00 ? 2 ALA A H 2 2
ATOM 1157 H HA . ALA A 1 2 ? 1.048 12.339 2.141 1.00 0.00 ? 2 ALA A HA 2 2
ATOM 1158 H HB1 . ALA A 1 2 ? -1.352 14.010 2.639 1.00 0.00 ? 2 ALA A HB1 2 2
ATOM 1159 H HB2 . ALA A 1 2 ? -1.358 12.305 2.298 1.00 0.00 ? 2 ALA A HB2 2 2
ATOM 1160 H HB3 . ALA A 1 2 ? -0.644 12.895 3.745 1.00 0.00 ? 2 ALA A HB3 2 2
ATOM 1161 N N . LYS A 1 3 ? 1.198 14.227 -0.161 1.00 0.00 ? 3 LYS A N 2 3
ATOM 1162 C CA . LYS A 1 3 ? 1.183 14.423 -1.587 1.00 0.00 ? 3 LYS A CA 2 3
ATOM 1163 C C . LYS A 1 3 ? 1.585 13.233 -2.431 1.00 0.00 ? 3 LYS A C 2 3
ATOM 1164 O O . LYS A 1 3 ? 1.332 13.205 -3.625 1.00 0.00 ? 3 LYS A O 2 3
ATOM 1165 C CB . LYS A 1 3 ? 2.081 15.568 -1.996 1.00 0.00 ? 3 LYS A CB 2 3
ATOM 1166 C CG . LYS A 1 3 ? 1.796 16.882 -1.303 1.00 0.00 ? 3 LYS A CG 2 3
ATOM 1167 C CD . LYS A 1 3 ? 2.661 18.010 -1.797 1.00 0.00 ? 3 LYS A CD 2 3
ATOM 1168 C CE . LYS A 1 3 ? 3.593 18.371 -1.245 1.00 0.00 ? 3 LYS A CE 2 3
ATOM 1169 N NZ . LYS A 1 3 ? 4.353 19.494 -1.585 1.00 0.00 ? 3 LYS A NZ 2 3
ATOM 1170 H H . LYS A 1 3 ? 1.842 14.732 0.399 1.00 0.00 ? 3 LYS A H 2 3
ATOM 1171 H HA . LYS A 1 3 ? 0.179 14.636 -1.896 1.00 0.00 ? 3 LYS A HA 2 3
ATOM 1172 H HB2 . LYS A 1 3 ? 3.115 15.292 -1.790 1.00 0.00 ? 3 LYS A HB2 2 3
ATOM 1173 H HB3 . LYS A 1 3 ? 1.999 15.653 -3.055 1.00 0.00 ? 3 LYS A HB3 2 3
ATOM 1174 H HG2 . LYS A 1 3 ? 0.754 17.142 -1.490 1.00 0.00 ? 3 LYS A HG2 2 3
ATOM 1175 H HG3 . LYS A 1 3 ? 1.866 16.813 -0.251 1.00 0.00 ? 3 LYS A HG3 2 3
ATOM 1176 H HD2 . LYS A 1 3 ? 2.979 17.743 -2.805 1.00 0.00 ? 3 LYS A HD2 2 3
ATOM 1177 H HD3 . LYS A 1 3 ? 2.266 18.649 -1.846 1.00 0.00 ? 3 LYS A HD3 2 3
ATOM 1178 H HE2 . LYS A 1 3 ? 3.296 18.504 -0.204 1.00 0.00 ? 3 LYS A HE2 2 3
ATOM 1179 H HE3 . LYS A 1 3 ? 4.007 17.817 -1.285 1.00 0.00 ? 3 LYS A HE3 2 3
ATOM 1180 H HZ1 . LYS A 1 3 ? 5.002 19.760 -1.183 1.00 0.00 ? 3 LYS A HZ1 2 3
ATOM 1181 H HZ2 . LYS A 1 3 ? 3.928 20.046 -1.600 1.00 0.00 ? 3 LYS A HZ2 2 3
ATOM 1182 H HZ3 . LYS A 1 3 ? 4.681 19.480 -2.213 1.00 0.00 ? 3 LYS A HZ3 2 3
ATOM 1183 N N . ALA A 1 4 ? 2.190 12.214 -1.829 1.00 0.00 ? 4 ALA A N 2 4
ATOM 1184 C CA . ALA A 1 4 ? 2.507 10.929 -2.403 1.00 0.00 ? 4 ALA A CA 2 4
ATOM 1185 C C . ALA A 1 4 ? 1.337 10.117 -2.926 1.00 0.00 ? 4 ALA A C 2 4
ATOM 1186 O O . ALA A 1 4 ? 1.489 9.016 -3.438 1.00 0.00 ? 4 ALA A O 2 4
ATOM 1187 C CB . ALA A 1 4 ? 3.287 10.176 -1.342 1.00 0.00 ? 4 ALA A CB 2 4
ATOM 1188 H H . ALA A 1 4 ? 2.404 12.400 -0.871 1.00 0.00 ? 4 ALA A H 2 4
ATOM 1189 H HA . ALA A 1 4 ? 3.147 11.074 -3.257 1.00 0.00 ? 4 ALA A HA 2 4
ATOM 1190 H HB1 . ALA A 1 4 ? 4.183 10.750 -1.154 1.00 0.00 ? 4 ALA A HB1 2 4
ATOM 1191 H HB2 . ALA A 1 4 ? 2.748 10.069 -0.411 1.00 0.00 ? 4 ALA A HB2 2 4
ATOM 1192 H HB3 . ALA A 1 4 ? 3.575 9.205 -1.697 1.00 0.00 ? 4 ALA A HB3 2 4
ATOM 1193 N N . ALA A 1 5 ? 0.130 10.670 -2.828 1.00 0.00 ? 5 ALA A N 2 5
ATOM 1194 C CA . ALA A 1 5 ? -1.098 9.920 -2.877 1.00 0.00 ? 5 ALA A CA 2 5
ATOM 1195 C C . ALA A 1 5 ? -1.699 9.687 -4.250 1.00 0.00 ? 5 ALA A C 2 5
ATOM 1196 O O . ALA A 1 5 ? -2.753 9.106 -4.370 1.00 0.00 ? 5 ALA A O 2 5
ATOM 1197 C CB . ALA A 1 5 ? -2.074 10.618 -1.950 1.00 0.00 ? 5 ALA A CB 2 5
ATOM 1198 H H . ALA A 1 5 ? 0.126 11.632 -2.565 1.00 0.00 ? 5 ALA A H 2 5
ATOM 1199 H HA . ALA A 1 5 ? -0.899 8.926 -2.492 1.00 0.00 ? 5 ALA A HA 2 5
ATOM 1200 H HB1 . ALA A 1 5 ? -1.692 10.629 -0.951 1.00 0.00 ? 5 ALA A HB1 2 5
ATOM 1201 H HB2 . ALA A 1 5 ? -2.231 11.638 -2.231 1.00 0.00 ? 5 ALA A HB2 2 5
ATOM 1202 H HB3 . ALA A 1 5 ? -3.021 10.121 -1.992 1.00 0.00 ? 5 ALA A HB3 2 5
ATOM 1203 N N . ALA A 1 6 ? -0.985 10.007 -5.315 1.00 0.00 ? 6 ALA A N 2 6
ATOM 1204 C CA . ALA A 1 6 ? -1.126 9.351 -6.590 1.00 0.00 ? 6 ALA A CA 2 6
ATOM 1205 C C . ALA A 1 6 ? 0.067 8.476 -6.909 1.00 0.00 ? 6 ALA A C 2 6
ATOM 1206 O O . ALA A 1 6 ? -0.088 7.276 -7.074 1.00 0.00 ? 6 ALA A O 2 6
ATOM 1207 C CB . ALA A 1 6 ? -1.392 10.426 -7.626 1.00 0.00 ? 6 ALA A CB 2 6
ATOM 1208 H H . ALA A 1 6 ? -0.173 10.561 -5.156 1.00 0.00 ? 6 ALA A H 2 6
ATOM 1209 H HA . ALA A 1 6 ? -1.988 8.694 -6.535 1.00 0.00 ? 6 ALA A HA 2 6
ATOM 1210 H HB1 . ALA A 1 6 ? -0.538 11.017 -7.779 1.00 0.00 ? 6 ALA A HB1 2 6
ATOM 1211 H HB2 . ALA A 1 6 ? -1.657 9.992 -8.561 1.00 0.00 ? 6 ALA A HB2 2 6
ATOM 1212 H HB3 . ALA A 1 6 ? -2.182 11.052 -7.283 1.00 0.00 ? 6 ALA A HB3 2 6
ATOM 1213 N N . ALA A 1 7 ? 1.273 9.030 -6.870 1.00 0.00 ? 7 ALA A N 2 7
ATOM 1214 C CA . ALA A 1 7 ? 2.504 8.470 -7.363 1.00 0.00 ? 7 ALA A CA 2 7
ATOM 1215 C C . ALA A 1 7 ? 2.840 7.124 -6.756 1.00 0.00 ? 7 ALA A C 2 7
ATOM 1216 O O . ALA A 1 7 ? 3.321 6.275 -7.467 1.00 0.00 ? 7 ALA A O 2 7
ATOM 1217 C CB . ALA A 1 7 ? 3.613 9.456 -7.084 1.00 0.00 ? 7 ALA A CB 2 7
ATOM 1218 H H . ALA A 1 7 ? 1.258 9.987 -6.593 1.00 0.00 ? 7 ALA A H 2 7
ATOM 1219 H HA . ALA A 1 7 ? 2.413 8.369 -8.424 1.00 0.00 ? 7 ALA A HA 2 7
ATOM 1220 H HB1 . ALA A 1 7 ? 3.437 10.378 -7.604 1.00 0.00 ? 7 ALA A HB1 2 7
ATOM 1221 H HB2 . ALA A 1 7 ? 3.643 9.630 -6.029 1.00 0.00 ? 7 ALA A HB2 2 7
ATOM 1222 H HB3 . ALA A 1 7 ? 4.544 9.058 -7.405 1.00 0.00 ? 7 ALA A HB3 2 7
ATOM 1223 N N . ALA A 1 8 ? 2.527 6.883 -5.500 1.00 0.00 ? 8 ALA A N 2 8
ATOM 1224 C CA . ALA A 1 8 ? 2.771 5.610 -4.865 1.00 0.00 ? 8 ALA A CA 2 8
ATOM 1225 C C . ALA A 1 8 ? 1.635 4.633 -5.101 1.00 0.00 ? 8 ALA A C 2 8
ATOM 1226 O O . ALA A 1 8 ? 1.860 3.470 -5.371 1.00 0.00 ? 8 ALA A O 2 8
ATOM 1227 C CB . ALA A 1 8 ? 3.015 5.803 -3.381 1.00 0.00 ? 8 ALA A CB 2 8
ATOM 1228 H H . ALA A 1 8 ? 2.036 7.598 -4.996 1.00 0.00 ? 8 ALA A H 2 8
ATOM 1229 H HA . ALA A 1 8 ? 3.675 5.188 -5.289 1.00 0.00 ? 8 ALA A HA 2 8
ATOM 1230 H HB1 . ALA A 1 8 ? 2.349 6.187 -2.928 1.00 0.00 ? 8 ALA A HB1 2 8
ATOM 1231 H HB2 . ALA A 1 8 ? 3.157 5.019 -2.906 1.00 0.00 ? 8 ALA A HB2 2 8
ATOM 1232 H HB3 . ALA A 1 8 ? 3.746 6.303 -3.227 1.00 0.00 ? 8 ALA A HB3 2 8
ATOM 1233 N N . ILE A 1 9 ? 0.398 5.115 -5.046 1.00 0.00 ? 9 ILE A N 2 9
ATOM 1234 C CA . ILE A 1 9 ? -0.809 4.353 -5.271 1.00 0.00 ? 9 ILE A CA 2 9
ATOM 1235 C C . ILE A 1 9 ? -0.909 3.830 -6.691 1.00 0.00 ? 9 ILE A C 2 9
ATOM 1236 O O . ILE A 1 9 ? -1.227 2.672 -6.890 1.00 0.00 ? 9 ILE A O 2 9
ATOM 1237 C CB . ILE A 1 9 ? -2.046 5.188 -4.964 1.00 0.00 ? 9 ILE A CB 2 9
ATOM 1238 C CG1 . ILE A 1 9 ? -2.047 5.866 -3.605 1.00 0.00 ? 9 ILE A CG1 2 9
ATOM 1239 C CG2 . ILE A 1 9 ? -3.296 4.343 -5.147 1.00 0.00 ? 9 ILE A CG2 2 9
ATOM 1240 C CD1 . ILE A 1 9 ? -1.942 4.928 -2.418 1.00 0.00 ? 9 ILE A CD1 2 9
ATOM 1241 H H . ILE A 1 9 ? 0.309 6.075 -4.825 1.00 0.00 ? 9 ILE A H 2 9
ATOM 1242 H HA . ILE A 1 9 ? -0.795 3.482 -4.619 1.00 0.00 ? 9 ILE A HA 2 9
ATOM 1243 H HB . ILE A 1 9 ? -2.100 5.943 -5.738 1.00 0.00 ? 9 ILE A HB 2 9
ATOM 1244 H HG12 . ILE A 1 9 ? -1.218 6.573 -3.565 1.00 0.00 ? 9 ILE A HG12 2 9
ATOM 1245 H HG13 . ILE A 1 9 ? -2.962 6.440 -3.519 1.00 0.00 ? 9 ILE A HG13 2 9
ATOM 1246 H HG21 . ILE A 1 9 ? -3.168 3.382 -4.676 1.00 0.00 ? 9 ILE A HG21 2 9
ATOM 1247 H HG22 . ILE A 1 9 ? -4.144 4.892 -4.768 1.00 0.00 ? 9 ILE A HG22 2 9
ATOM 1248 H HG23 . ILE A 1 9 ? -3.462 4.198 -6.202 1.00 0.00 ? 9 ILE A HG23 2 9
ATOM 1249 H HD11 . ILE A 1 9 ? -1.029 4.369 -2.472 1.00 0.00 ? 9 ILE A HD11 2 9
ATOM 1250 H HD12 . ILE A 1 9 ? -1.948 5.498 -1.510 1.00 0.00 ? 9 ILE A HD12 2 9
ATOM 1251 H HD13 . ILE A 1 9 ? -2.772 4.270 -2.425 1.00 0.00 ? 9 ILE A HD13 2 9
ATOM 1252 N N . LYS A 1 10 ? -0.613 4.675 -7.672 1.00 0.00 ? 10 LYS A N 2 10
ATOM 1253 C CA . LYS A 1 10 ? -0.667 4.415 -9.091 1.00 0.00 ? 10 LYS A CA 2 10
ATOM 1254 C C . LYS A 1 10 ? 0.358 3.364 -9.472 1.00 0.00 ? 10 LYS A C 2 10
ATOM 1255 O O . LYS A 1 10 ? 0.045 2.508 -10.277 1.00 0.00 ? 10 LYS A O 2 10
ATOM 1256 C CB . LYS A 1 10 ? -0.507 5.731 -9.838 1.00 0.00 ? 10 LYS A CB 2 10
ATOM 1257 C CG . LYS A 1 10 ? -1.800 6.531 -9.879 1.00 0.00 ? 10 LYS A CG 2 10
ATOM 1258 C CD . LYS A 1 10 ? -1.690 7.729 -10.787 1.00 0.00 ? 10 LYS A CD 2 10
ATOM 1259 C CE . LYS A 1 10 ? -2.998 8.417 -10.939 1.00 0.00 ? 10 LYS A CE 2 10
ATOM 1260 N NZ . LYS A 1 10 ? -2.970 9.485 -11.889 1.00 0.00 ? 10 LYS A NZ 2 10
ATOM 1261 H H . LYS A 1 10 ? -0.320 5.570 -7.336 1.00 0.00 ? 10 LYS A H 2 10
ATOM 1262 H HA . LYS A 1 10 ? -1.622 3.936 -9.267 1.00 0.00 ? 10 LYS A HA 2 10
ATOM 1263 H HB2 . LYS A 1 10 ? 0.260 6.328 -9.344 1.00 0.00 ? 10 LYS A HB2 2 10
ATOM 1264 H HB3 . LYS A 1 10 ? -0.136 5.546 -10.834 1.00 0.00 ? 10 LYS A HB3 2 10
ATOM 1265 H HG2 . LYS A 1 10 ? -2.603 5.885 -10.234 1.00 0.00 ? 10 LYS A HG2 2 10
ATOM 1266 H HG3 . LYS A 1 10 ? -2.092 6.852 -8.902 1.00 0.00 ? 10 LYS A HG3 2 10
ATOM 1267 H HD2 . LYS A 1 10 ? -0.935 8.423 -10.419 1.00 0.00 ? 10 LYS A HD2 2 10
ATOM 1268 H HD3 . LYS A 1 10 ? -1.402 7.354 -11.724 1.00 0.00 ? 10 LYS A HD3 2 10
ATOM 1269 H HE2 . LYS A 1 10 ? -3.752 7.691 -11.244 1.00 0.00 ? 10 LYS A HE2 2 10
ATOM 1270 H HE3 . LYS A 1 10 ? -3.287 8.787 -10.006 1.00 0.00 ? 10 LYS A HE3 2 10
ATOM 1271 H HZ1 . LYS A 1 10 ? -3.840 9.903 -11.989 1.00 0.00 ? 10 LYS A HZ1 2 10
ATOM 1272 H HZ2 . LYS A 1 10 ? -2.378 10.183 -11.630 1.00 0.00 ? 10 LYS A HZ2 2 10
ATOM 1273 H HZ3 . LYS A 1 10 ? -2.710 9.191 -12.760 1.00 0.00 ? 10 LYS A HZ3 2 10
ATOM 1274 N N . ALA A 1 11 ? 1.545 3.387 -8.881 1.00 0.00 ? 11 ALA A N 2 11
ATOM 1275 C CA . ALA A 1 11 ? 2.424 2.247 -8.891 1.00 0.00 ? 11 ALA A CA 2 11
ATOM 1276 C C . ALA A 1 11 ? 1.754 1.027 -8.295 1.00 0.00 ? 11 ALA A C 2 11
ATOM 1277 O O . ALA A 1 11 ? 1.619 0.020 -8.972 1.00 0.00 ? 11 ALA A O 2 11
ATOM 1278 C CB . ALA A 1 11 ? 3.748 2.599 -8.254 1.00 0.00 ? 11 ALA A CB 2 11
ATOM 1279 H H . ALA A 1 11 ? 1.800 4.196 -8.362 1.00 0.00 ? 11 ALA A H 2 11
ATOM 1280 H HA . ALA A 1 11 ? 2.605 1.996 -9.925 1.00 0.00 ? 11 ALA A HA 2 11
ATOM 1281 H HB1 . ALA A 1 11 ? 3.843 2.621 -7.424 1.00 0.00 ? 11 ALA A HB1 2 11
ATOM 1282 H HB2 . ALA A 1 11 ? 4.110 3.303 -8.430 1.00 0.00 ? 11 ALA A HB2 2 11
ATOM 1283 H HB3 . ALA A 1 11 ? 4.360 2.098 -8.442 1.00 0.00 ? 11 ALA A HB3 2 11
ATOM 1284 N N . ILE A 1 12 ? 1.314 1.076 -7.039 1.00 0.00 ? 12 ILE A N 2 12
ATOM 1285 C CA . ILE A 1 12 ? 0.884 -0.063 -6.263 1.00 0.00 ? 12 ILE A CA 2 12
ATOM 1286 C C . ILE A 1 12 ? -0.374 -0.721 -6.805 1.00 0.00 ? 12 ILE A C 2 12
ATOM 1287 O O . ILE A 1 12 ? -0.334 -1.927 -7.007 1.00 0.00 ? 12 ILE A O 2 12
ATOM 1288 C CB . ILE A 1 12 ? 0.846 0.231 -4.777 1.00 0.00 ? 12 ILE A CB 2 12
ATOM 1289 C CG1 . ILE A 1 12 ? 1.902 -0.537 -4.061 1.00 0.00 ? 12 ILE A CG1 2 12
ATOM 1290 C CG2 . ILE A 1 12 ? -0.455 0.103 -4.048 1.00 0.00 ? 12 ILE A CG2 2 12
ATOM 1291 C CD1 . ILE A 1 12 ? 1.697 -2.013 -3.980 1.00 0.00 ? 12 ILE A CD1 2 12
ATOM 1292 H H . ILE A 1 12 ? 1.142 1.978 -6.633 1.00 0.00 ? 12 ILE A H 2 12
ATOM 1293 H HA . ILE A 1 12 ? 1.618 -0.845 -6.421 1.00 0.00 ? 12 ILE A HA 2 12
ATOM 1294 H HB . ILE A 1 12 ? 1.107 1.255 -4.658 1.00 0.00 ? 12 ILE A HB 2 12
ATOM 1295 H HG12 . ILE A 1 12 ? 2.856 -0.352 -4.555 1.00 0.00 ? 12 ILE A HG12 2 12
ATOM 1296 H HG13 . ILE A 1 12 ? 1.986 -0.140 -3.061 1.00 0.00 ? 12 ILE A HG13 2 12
ATOM 1297 H HG21 . ILE A 1 12 ? -0.795 -0.895 -4.070 1.00 0.00 ? 12 ILE A HG21 2 12
ATOM 1298 H HG22 . ILE A 1 12 ? -0.366 0.375 -3.013 1.00 0.00 ? 12 ILE A HG22 2 12
ATOM 1299 H HG23 . ILE A 1 12 ? -1.200 0.707 -4.513 1.00 0.00 ? 12 ILE A HG23 2 12
ATOM 1300 H HD11 . ILE A 1 12 ? 0.833 -2.212 -3.421 1.00 0.00 ? 12 ILE A HD11 2 12
ATOM 1301 H HD12 . ILE A 1 12 ? 1.627 -2.448 -4.940 1.00 0.00 ? 12 ILE A HD12 2 12
ATOM 1302 H HD13 . ILE A 1 12 ? 2.518 -2.446 -3.495 1.00 0.00 ? 12 ILE A HD13 2 12
ATOM 1303 N N . ALA A 1 13 ? -1.426 0.009 -7.171 1.00 0.00 ? 13 ALA A N 2 13
ATOM 1304 C CA . ALA A 1 13 ? -2.617 -0.628 -7.677 1.00 0.00 ? 13 ALA A CA 2 13
ATOM 1305 C C . ALA A 1 13 ? -2.410 -1.376 -8.982 1.00 0.00 ? 13 ALA A C 2 13
ATOM 1306 O O . ALA A 1 13 ? -3.098 -2.340 -9.259 1.00 0.00 ? 13 ALA A O 2 13
ATOM 1307 C CB . ALA A 1 13 ? -3.704 0.433 -7.765 1.00 0.00 ? 13 ALA A CB 2 13
ATOM 1308 H H . ALA A 1 13 ? -1.338 1.005 -7.069 1.00 0.00 ? 13 ALA A H 2 13
ATOM 1309 H HA . ALA A 1 13 ? -2.899 -1.383 -6.954 1.00 0.00 ? 13 ALA A HA 2 13
ATOM 1310 H HB1 . ALA A 1 13 ? -4.611 -0.048 -8.033 1.00 0.00 ? 13 ALA A HB1 2 13
ATOM 1311 H HB2 . ALA A 1 13 ? -3.799 0.897 -6.814 1.00 0.00 ? 13 ALA A HB2 2 13
ATOM 1312 H HB3 . ALA A 1 13 ? -3.474 1.149 -8.525 1.00 0.00 ? 13 ALA A HB3 2 13
ATOM 1313 N N . ALA A 1 14 ? -1.395 -1.001 -9.751 1.00 0.00 ? 14 ALA A N 2 14
ATOM 1314 C CA . ALA A 1 14 ? -0.984 -1.670 -10.965 1.00 0.00 ? 14 ALA A CA 2 14
ATOM 1315 C C . ALA A 1 14 ? -0.020 -2.805 -10.698 1.00 0.00 ? 14 ALA A C 2 14
ATOM 1316 O O . ALA A 1 14 ? -0.158 -3.888 -11.245 1.00 0.00 ? 14 ALA A O 2 14
ATOM 1317 C CB . ALA A 1 14 ? -0.387 -0.665 -11.905 1.00 0.00 ? 14 ALA A CB 2 14
ATOM 1318 H H . ALA A 1 14 ? -0.769 -0.360 -9.309 1.00 0.00 ? 14 ALA A H 2 14
ATOM 1319 H HA . ALA A 1 14 ? -1.851 -2.102 -11.421 1.00 0.00 ? 14 ALA A HA 2 14
ATOM 1320 H HB1 . ALA A 1 14 ? 0.505 -0.252 -11.516 1.00 0.00 ? 14 ALA A HB1 2 14
ATOM 1321 H HB2 . ALA A 1 14 ? -0.119 -1.109 -12.844 1.00 0.00 ? 14 ALA A HB2 2 14
ATOM 1322 H HB3 . ALA A 1 14 ? -1.079 0.108 -12.131 1.00 0.00 ? 14 ALA A HB3 2 14
ATOM 1323 N N . ILE A 1 15 ? 0.899 -2.617 -9.759 1.00 0.00 ? 15 ILE A N 2 15
ATOM 1324 C CA . ILE A 1 15 ? 1.799 -3.622 -9.243 1.00 0.00 ? 15 ILE A CA 2 15
ATOM 1325 C C . ILE A 1 15 ? 1.000 -4.734 -8.592 1.00 0.00 ? 15 ILE A C 2 15
ATOM 1326 O O . ILE A 1 15 ? 1.419 -5.879 -8.690 1.00 0.00 ? 15 ILE A O 2 15
ATOM 1327 C CB . ILE A 1 15 ? 2.810 -3.004 -8.290 1.00 0.00 ? 15 ILE A CB 2 15
ATOM 1328 C CG1 . ILE A 1 15 ? 3.894 -2.245 -9.033 1.00 0.00 ? 15 ILE A CG1 2 15
ATOM 1329 C CG2 . ILE A 1 15 ? 3.477 -3.997 -7.375 1.00 0.00 ? 15 ILE A CG2 2 15
ATOM 1330 C CD1 . ILE A 1 15 ? 4.694 -1.263 -8.199 1.00 0.00 ? 15 ILE A CD1 2 15
ATOM 1331 H H . ILE A 1 15 ? 0.908 -1.724 -9.300 1.00 0.00 ? 15 ILE A H 2 15
ATOM 1332 H HA . ILE A 1 15 ? 2.350 -4.065 -10.066 1.00 0.00 ? 15 ILE A HA 2 15
ATOM 1333 H HB . ILE A 1 15 ? 2.279 -2.330 -7.643 1.00 0.00 ? 15 ILE A HB 2 15
ATOM 1334 H HG12 . ILE A 1 15 ? 4.573 -2.966 -9.487 1.00 0.00 ? 15 ILE A HG12 2 15
ATOM 1335 H HG13 . ILE A 1 15 ? 3.470 -1.652 -9.819 1.00 0.00 ? 15 ILE A HG13 2 15
ATOM 1336 H HG21 . ILE A 1 15 ? 3.803 -4.707 -7.712 1.00 0.00 ? 15 ILE A HG21 2 15
ATOM 1337 H HG22 . ILE A 1 15 ? 3.032 -4.273 -6.739 1.00 0.00 ? 15 ILE A HG22 2 15
ATOM 1338 H HG23 . ILE A 1 15 ? 4.135 -3.685 -6.969 1.00 0.00 ? 15 ILE A HG23 2 15
ATOM 1339 H HD11 . ILE A 1 15 ? 5.188 -1.655 -7.565 1.00 0.00 ? 15 ILE A HD11 2 15
ATOM 1340 H HD12 . ILE A 1 15 ? 5.286 -0.783 -8.651 1.00 0.00 ? 15 ILE A HD12 2 15
ATOM 1341 H HD13 . ILE A 1 15 ? 4.193 -0.660 -7.786 1.00 0.00 ? 15 ILE A HD13 2 15
ATOM 1342 N N . ILE A 1 16 ? -0.140 -4.452 -7.969 1.00 0.00 ? 16 ILE A N 2 16
ATOM 1343 C CA . ILE A 1 16 ? -1.033 -5.445 -7.426 1.00 0.00 ? 16 ILE A CA 2 16
ATOM 1344 C C . ILE A 1 16 ? -1.624 -6.328 -8.501 1.00 0.00 ? 16 ILE A C 2 16
ATOM 1345 O O . ILE A 1 16 ? -1.438 -7.533 -8.459 1.00 0.00 ? 16 ILE A O 2 16
ATOM 1346 C CB . ILE A 1 16 ? -2.063 -4.807 -6.505 1.00 0.00 ? 16 ILE A CB 2 16
ATOM 1347 C CG1 . ILE A 1 16 ? -1.351 -4.385 -5.236 1.00 0.00 ? 16 ILE A CG1 2 16
ATOM 1348 C CG2 . ILE A 1 16 ? -3.199 -5.751 -6.142 1.00 0.00 ? 16 ILE A CG2 2 16
ATOM 1349 C CD1 . ILE A 1 16 ? -2.183 -3.718 -4.164 1.00 0.00 ? 16 ILE A CD1 2 16
ATOM 1350 H H . ILE A 1 16 ? -0.374 -3.487 -7.831 1.00 0.00 ? 16 ILE A H 2 16
ATOM 1351 H HA . ILE A 1 16 ? -0.425 -6.106 -6.832 1.00 0.00 ? 16 ILE A HA 2 16
ATOM 1352 H HB . ILE A 1 16 ? -2.411 -3.921 -7.023 1.00 0.00 ? 16 ILE A HB 2 16
ATOM 1353 H HG12 . ILE A 1 16 ? -0.870 -5.263 -4.805 1.00 0.00 ? 16 ILE A HG12 2 16
ATOM 1354 H HG13 . ILE A 1 16 ? -0.582 -3.680 -5.502 1.00 0.00 ? 16 ILE A HG13 2 16
ATOM 1355 H HG21 . ILE A 1 16 ? -3.904 -5.234 -5.519 1.00 0.00 ? 16 ILE A HG21 2 16
ATOM 1356 H HG22 . ILE A 1 16 ? -3.730 -6.070 -7.021 1.00 0.00 ? 16 ILE A HG22 2 16
ATOM 1357 H HG23 . ILE A 1 16 ? -2.810 -6.630 -5.659 1.00 0.00 ? 16 ILE A HG23 2 16
ATOM 1358 H HD11 . ILE A 1 16 ? -2.640 -2.844 -4.549 1.00 0.00 ? 16 ILE A HD11 2 16
ATOM 1359 H HD12 . ILE A 1 16 ? -2.896 -4.397 -3.760 1.00 0.00 ? 16 ILE A HD12 2 16
ATOM 1360 H HD13 . ILE A 1 16 ? -1.538 -3.462 -3.363 1.00 0.00 ? 16 ILE A HD13 2 16
ATOM 1361 N N . LYS A 1 17 ? -2.309 -5.729 -9.469 1.00 0.00 ? 17 LYS A N 2 17
ATOM 1362 C CA . LYS A 1 17 ? -2.844 -6.379 -10.641 1.00 0.00 ? 17 LYS A CA 2 17
ATOM 1363 C C . LYS A 1 17 ? -1.819 -7.261 -11.319 1.00 0.00 ? 17 LYS A C 2 17
ATOM 1364 O O . LYS A 1 17 ? -2.166 -8.351 -11.721 1.00 0.00 ? 17 LYS A O 2 17
ATOM 1365 C CB . LYS A 1 17 ? -3.413 -5.327 -11.575 1.00 0.00 ? 17 LYS A CB 2 17
ATOM 1366 C CG . LYS A 1 17 ? -4.107 -5.763 -12.844 1.00 0.00 ? 17 LYS A CG 2 17
ATOM 1367 C CD . LYS A 1 17 ? -5.333 -6.604 -12.679 1.00 0.00 ? 17 LYS A CD 2 17
ATOM 1368 C CE . LYS A 1 17 ? -5.217 -8.029 -12.965 1.00 0.00 ? 17 LYS A CE 2 17
ATOM 1369 N NZ . LYS A 1 17 ? -4.853 -8.290 -14.237 1.00 0.00 ? 17 LYS A NZ 2 17
ATOM 1370 H H . LYS A 1 17 ? -2.392 -4.751 -9.355 1.00 0.00 ? 17 LYS A H 2 17
ATOM 1371 H HA . LYS A 1 17 ? -3.649 -7.026 -10.321 1.00 0.00 ? 17 LYS A HA 2 17
ATOM 1372 H HB2 . LYS A 1 17 ? -4.135 -4.746 -11.001 1.00 0.00 ? 17 LYS A HB2 2 17
ATOM 1373 H HB3 . LYS A 1 17 ? -2.626 -4.643 -11.822 1.00 0.00 ? 17 LYS A HB3 2 17
ATOM 1374 H HG2 . LYS A 1 17 ? -4.389 -4.866 -13.395 1.00 0.00 ? 17 LYS A HG2 2 17
ATOM 1375 H HG3 . LYS A 1 17 ? -3.410 -6.285 -13.468 1.00 0.00 ? 17 LYS A HG3 2 17
ATOM 1376 H HD2 . LYS A 1 17 ? -5.699 -6.480 -11.660 1.00 0.00 ? 17 LYS A HD2 2 17
ATOM 1377 H HD3 . LYS A 1 17 ? -6.050 -6.271 -13.323 1.00 0.00 ? 17 LYS A HD3 2 17
ATOM 1378 H HE2 . LYS A 1 17 ? -4.498 -8.472 -12.276 1.00 0.00 ? 17 LYS A HE2 2 17
ATOM 1379 H HE3 . LYS A 1 17 ? -6.118 -8.527 -12.843 1.00 0.00 ? 17 LYS A HE3 2 17
ATOM 1380 H HZ1 . LYS A 1 17 ? -4.002 -7.955 -14.390 1.00 0.00 ? 17 LYS A HZ1 2 17
ATOM 1381 H HZ2 . LYS A 1 17 ? -4.833 -9.217 -14.465 1.00 0.00 ? 17 LYS A HZ2 2 17
ATOM 1382 H HZ3 . LYS A 1 17 ? -5.417 -7.867 -14.789 1.00 0.00 ? 17 LYS A HZ3 2 17
ATOM 1383 N N . ALA A 1 18 ? -0.587 -6.802 -11.471 1.00 0.00 ? 18 ALA A N 2 18
ATOM 1384 C CA . ALA A 1 18 ? 0.468 -7.498 -12.160 1.00 0.00 ? 18 ALA A CA 2 18
ATOM 1385 C C . ALA A 1 18 ? 1.226 -8.466 -11.280 1.00 0.00 ? 18 ALA A C 2 18
ATOM 1386 O O . ALA A 1 18 ? 1.824 -9.392 -11.764 1.00 0.00 ? 18 ALA A O 2 18
ATOM 1387 C CB . ALA A 1 18 ? 1.376 -6.479 -12.805 1.00 0.00 ? 18 ALA A CB 2 18
ATOM 1388 H H . ALA A 1 18 ? -0.411 -5.875 -11.136 1.00 0.00 ? 18 ALA A H 2 18
ATOM 1389 H HA . ALA A 1 18 ? 0.042 -8.068 -12.970 1.00 0.00 ? 18 ALA A HA 2 18
ATOM 1390 H HB1 . ALA A 1 18 ? 0.828 -5.914 -13.510 1.00 0.00 ? 18 ALA A HB1 2 18
ATOM 1391 H HB2 . ALA A 1 18 ? 1.831 -5.857 -12.080 1.00 0.00 ? 18 ALA A HB2 2 18
ATOM 1392 H HB3 . ALA A 1 18 ? 2.155 -6.952 -13.337 1.00 0.00 ? 18 ALA A HB3 2 18
ATOM 1393 N N . GLY A 1 19 ? 1.231 -8.253 -9.981 1.00 0.00 ? 19 GLY A N 2 19
ATOM 1394 C CA . GLY A 1 19 ? 1.942 -8.974 -8.965 1.00 0.00 ? 19 GLY A CA 2 19
ATOM 1395 C C . GLY A 1 19 ? 1.351 -10.332 -8.657 1.00 0.00 ? 19 GLY A C 2 19
ATOM 1396 O O . GLY A 1 19 ? 2.077 -11.296 -8.525 1.00 0.00 ? 19 GLY A O 2 19
ATOM 1397 H H . GLY A 1 19 ? 0.772 -7.440 -9.663 1.00 0.00 ? 19 GLY A H 2 19
ATOM 1398 H HA2 . GLY A 1 19 ? 2.969 -9.105 -9.247 1.00 0.00 ? 19 GLY A HA2 2 19
ATOM 1399 H HA3 . GLY A 1 19 ? 1.955 -8.406 -8.058 1.00 0.00 ? 19 GLY A HA3 2 19
ATOM 1400 N N . GLY A 1 20 ? 0.032 -10.410 -8.641 1.00 0.00 ? 20 GLY A N 2 20
ATOM 1401 C CA . GLY A 1 20 ? -0.758 -11.580 -8.343 1.00 0.00 ? 20 GLY A CA 2 20
ATOM 1402 C C . GLY A 1 20 ? -1.034 -11.776 -6.880 1.00 0.00 ? 20 GLY A C 2 20
ATOM 1403 O O . GLY A 1 20 ? -1.228 -12.871 -6.443 1.00 0.00 ? 20 GLY A O 2 20
ATOM 1404 H H . GLY A 1 20 ? -0.457 -9.562 -8.810 1.00 0.00 ? 20 GLY A H 2 20
ATOM 1405 H HA2 . GLY A 1 20 ? -1.682 -11.470 -8.857 1.00 0.00 ? 20 GLY A HA2 2 20
ATOM 1406 H HA3 . GLY A 1 20 ? -0.299 -12.469 -8.706 1.00 0.00 ? 20 GLY A HA3 2 20
ATOM 1407 N N . TYR A 1 21 ? -1.060 -10.706 -6.104 1.00 0.00 ? 21 TYR A N 2 21
ATOM 1408 C CA . TYR A 1 21 ? -1.351 -10.683 -4.707 1.00 0.00 ? 21 TYR A CA 2 21
ATOM 1409 C C . TYR A 1 21 ? -2.639 -11.308 -4.328 1.00 0.00 ? 21 TYR A C 2 21
ATOM 1410 O O . TYR A 1 21 ? -2.768 -11.815 -3.271 1.00 0.00 ? 21 TYR A O 2 21
ATOM 1411 C CB . TYR A 1 21 ? -1.355 -9.245 -4.241 1.00 0.00 ? 21 TYR A CB 2 21
ATOM 1412 C CG . TYR A 1 21 ? -0.045 -8.618 -3.858 1.00 0.00 ? 21 TYR A CG 2 21
ATOM 1413 C CD1 . TYR A 1 21 ? 0.657 -8.974 -2.719 1.00 0.00 ? 21 TYR A CD1 2 21
ATOM 1414 C CD2 . TYR A 1 21 ? 0.358 -7.518 -4.582 1.00 0.00 ? 21 TYR A CD2 2 21
ATOM 1415 C CE1 . TYR A 1 21 ? 1.702 -8.158 -2.288 1.00 0.00 ? 21 TYR A CE1 2 21
ATOM 1416 C CE2 . TYR A 1 21 ? 1.404 -6.693 -4.168 1.00 0.00 ? 21 TYR A CE2 2 21
ATOM 1417 C CZ . TYR A 1 21 ? 2.084 -7.026 -3.008 1.00 0.00 ? 21 TYR A CZ 2 21
ATOM 1418 O OH . TYR A 1 21 ? 3.129 -6.268 -2.587 1.00 0.00 ? 21 TYR A OH 2 21
ATOM 1419 H H . TYR A 1 21 ? -0.943 -9.826 -6.513 1.00 0.00 ? 21 TYR A H 2 21
ATOM 1420 H HA . TYR A 1 21 ? -0.579 -11.195 -4.187 1.00 0.00 ? 21 TYR A HA 2 21
ATOM 1421 H HB2 . TYR A 1 21 ? -1.784 -8.644 -5.043 1.00 0.00 ? 21 TYR A HB2 2 21
ATOM 1422 H HB3 . TYR A 1 21 ? -2.028 -9.154 -3.405 1.00 0.00 ? 21 TYR A HB3 2 21
ATOM 1423 H HD1 . TYR A 1 21 ? 0.390 -9.821 -2.140 1.00 0.00 ? 21 TYR A HD1 2 21
ATOM 1424 H HD2 . TYR A 1 21 ? -0.214 -7.297 -5.447 1.00 0.00 ? 21 TYR A HD2 2 21
ATOM 1425 H HE1 . TYR A 1 21 ? 2.210 -8.345 -1.377 1.00 0.00 ? 21 TYR A HE1 2 21
ATOM 1426 H HE2 . TYR A 1 21 ? 1.622 -5.786 -4.689 1.00 0.00 ? 21 TYR A HE2 2 21
ATOM 1427 H HH . TYR A 1 21 ? 3.837 -6.372 -3.190 1.00 0.00 ? 21 TYR A HH 2 21
HETATM 1428 N N . NH2 A 1 22 ? -3.639 -11.278 -5.166 1.00 0.00 ? 22 NH2 A N 2 22
HETATM 1429 H HN1 . NH2 A 1 22 ? -4.485 -11.656 -4.902 1.00 0.00 ? 22 NH2 A HN1 2 22
HETATM 1430 H HN2 . NH2 A 1 22 ? -3.542 -10.789 -5.982 1.00 0.00 ? 22 NH2 A HN2 2 22
HETATM 1431 C C . ACE B 1 1 ? 2.030 -13.663 -5.410 1.00 0.00 ? 23 ACE B C 2 1
HETATM 1432 O O . ACE B 1 1 ? 2.433 -12.545 -5.621 1.00 0.00 ? 23 ACE B O 2 1
HETATM 1433 C CH3 . ACE B 1 1 ? 1.667 -14.605 -6.529 1.00 0.00 ? 23 ACE B CH3 2 1
HETATM 1434 H H1 . ACE B 1 1 ? 2.163 -15.289 -6.601 1.00 0.00 ? 23 ACE B H1 2 1
HETATM 1435 H H2 . ACE B 1 1 ? 1.693 -14.241 -7.304 1.00 0.00 ? 23 ACE B H2 2 1
HETATM 1436 H H3 . ACE B 1 1 ? 0.901 -14.898 -6.493 1.00 0.00 ? 23 ACE B H3 2 1
ATOM 1437 N N . ALA B 1 2 ? 1.950 -14.153 -4.192 1.00 0.00 ? 24 ALA B N 2 2
ATOM 1438 C CA . ALA B 1 2 ? 2.299 -13.435 -2.996 1.00 0.00 ? 24 ALA B CA 2 2
ATOM 1439 C C . ALA B 1 2 ? 3.738 -13.023 -2.868 1.00 0.00 ? 24 ALA B C 2 2
ATOM 1440 O O . ALA B 1 2 ? 4.036 -12.152 -2.081 1.00 0.00 ? 24 ALA B O 2 2
ATOM 1441 C CB . ALA B 1 2 ? 1.866 -14.261 -1.822 1.00 0.00 ? 24 ALA B CB 2 2
ATOM 1442 H H . ALA B 1 2 ? 1.602 -15.076 -4.117 1.00 0.00 ? 24 ALA B H 2 2
ATOM 1443 H HA . ALA B 1 2 ? 1.737 -12.531 -2.971 1.00 0.00 ? 24 ALA B HA 2 2
ATOM 1444 H HB1 . ALA B 1 2 ? 2.437 -14.828 -1.591 1.00 0.00 ? 24 ALA B HB1 2 2
ATOM 1445 H HB2 . ALA B 1 2 ? 1.769 -13.816 -1.069 1.00 0.00 ? 24 ALA B HB2 2 2
ATOM 1446 H HB3 . ALA B 1 2 ? 1.081 -14.698 -1.903 1.00 0.00 ? 24 ALA B HB3 2 2
ATOM 1447 N N . LYS B 1 3 ? 4.613 -13.474 -3.730 1.00 0.00 ? 25 LYS B N 2 3
ATOM 1448 C CA . LYS B 1 3 ? 5.945 -12.964 -3.881 1.00 0.00 ? 25 LYS B CA 2 3
ATOM 1449 C C . LYS B 1 3 ? 6.033 -11.507 -4.294 1.00 0.00 ? 25 LYS B C 2 3
ATOM 1450 O O . LYS B 1 3 ? 7.071 -10.888 -4.112 1.00 0.00 ? 25 LYS B O 2 3
ATOM 1451 C CB . LYS B 1 3 ? 6.700 -13.751 -4.914 1.00 0.00 ? 25 LYS B CB 2 3
ATOM 1452 C CG . LYS B 1 3 ? 7.027 -15.162 -4.531 1.00 0.00 ? 25 LYS B CG 2 3
ATOM 1453 C CD . LYS B 1 3 ? 7.728 -15.932 -5.564 1.00 0.00 ? 25 LYS B CD 2 3
ATOM 1454 C CE . LYS B 1 3 ? 8.019 -17.329 -5.188 1.00 0.00 ? 25 LYS B CE 2 3
ATOM 1455 N NZ . LYS B 1 3 ? 7.056 -18.203 -5.367 1.00 0.00 ? 25 LYS B NZ 2 3
ATOM 1456 H H . LYS B 1 3 ? 4.273 -14.150 -4.373 1.00 0.00 ? 25 LYS B H 2 3
ATOM 1457 H HA . LYS B 1 3 ? 6.459 -13.084 -2.949 1.00 0.00 ? 25 LYS B HA 2 3
ATOM 1458 H HB2 . LYS B 1 3 ? 6.153 -13.748 -5.856 1.00 0.00 ? 25 LYS B HB2 2 3
ATOM 1459 H HB3 . LYS B 1 3 ? 7.604 -13.223 -5.021 1.00 0.00 ? 25 LYS B HB3 2 3
ATOM 1460 H HG2 . LYS B 1 3 ? 7.606 -15.161 -3.607 1.00 0.00 ? 25 LYS B HG2 2 3
ATOM 1461 H HG3 . LYS B 1 3 ? 6.151 -15.700 -4.393 1.00 0.00 ? 25 LYS B HG3 2 3
ATOM 1462 H HD2 . LYS B 1 3 ? 7.153 -15.912 -6.490 1.00 0.00 ? 25 LYS B HD2 2 3
ATOM 1463 H HD3 . LYS B 1 3 ? 8.630 -15.471 -5.714 1.00 0.00 ? 25 LYS B HD3 2 3
ATOM 1464 H HE2 . LYS B 1 3 ? 8.902 -17.669 -5.727 1.00 0.00 ? 25 LYS B HE2 2 3
ATOM 1465 H HE3 . LYS B 1 3 ? 8.215 -17.285 -4.272 1.00 0.00 ? 25 LYS B HE3 2 3
ATOM 1466 H HZ1 . LYS B 1 3 ? 6.790 -18.222 -6.168 1.00 0.00 ? 25 LYS B HZ1 2 3
ATOM 1467 H HZ2 . LYS B 1 3 ? 7.279 -19.117 -5.202 1.00 0.00 ? 25 LYS B HZ2 2 3
ATOM 1468 H HZ3 . LYS B 1 3 ? 6.414 -17.944 -4.858 1.00 0.00 ? 25 LYS B HZ3 2 3
ATOM 1469 N N . ALA B 1 4 ? 4.940 -10.935 -4.789 1.00 0.00 ? 26 ALA B N 2 4
ATOM 1470 C CA . ALA B 1 4 ? 4.776 -9.532 -5.043 1.00 0.00 ? 26 ALA B CA 2 4
ATOM 1471 C C . ALA B 1 4 ? 5.045 -8.634 -3.858 1.00 0.00 ? 26 ALA B C 2 4
ATOM 1472 O O . ALA B 1 4 ? 5.185 -7.429 -3.983 1.00 0.00 ? 26 ALA B O 2 4
ATOM 1473 C CB . ALA B 1 4 ? 3.356 -9.350 -5.537 1.00 0.00 ? 26 ALA B CB 2 4
ATOM 1474 H H . ALA B 1 4 ? 4.133 -11.519 -4.879 1.00 0.00 ? 26 ALA B H 2 4
ATOM 1475 H HA . ALA B 1 4 ? 5.455 -9.222 -5.820 1.00 0.00 ? 26 ALA B HA 2 4
ATOM 1476 H HB1 . ALA B 1 4 ? 2.648 -9.656 -4.809 1.00 0.00 ? 26 ALA B HB1 2 4
ATOM 1477 H HB2 . ALA B 1 4 ? 3.138 -8.324 -5.775 1.00 0.00 ? 26 ALA B HB2 2 4
ATOM 1478 H HB3 . ALA B 1 4 ? 3.154 -9.926 -6.416 1.00 0.00 ? 26 ALA B HB3 2 4
ATOM 1479 N N . ALA B 1 5 ? 5.131 -9.220 -2.670 1.00 0.00 ? 27 ALA B N 2 5
ATOM 1480 C CA . ALA B 1 5 ? 5.231 -8.624 -1.360 1.00 0.00 ? 27 ALA B CA 2 5
ATOM 1481 C C . ALA B 1 5 ? 6.462 -7.754 -1.195 1.00 0.00 ? 27 ALA B C 2 5
ATOM 1482 O O . ALA B 1 5 ? 6.445 -6.593 -1.567 1.00 0.00 ? 27 ALA B O 2 5
ATOM 1483 C CB . ALA B 1 5 ? 5.080 -9.711 -0.314 1.00 0.00 ? 27 ALA B CB 2 5
ATOM 1484 H H . ALA B 1 5 ? 5.185 -10.222 -2.713 1.00 0.00 ? 27 ALA B H 2 5
ATOM 1485 H HA . ALA B 1 5 ? 4.389 -7.953 -1.216 1.00 0.00 ? 27 ALA B HA 2 5
ATOM 1486 H HB1 . ALA B 1 5 ? 4.080 -10.098 -0.400 1.00 0.00 ? 27 ALA B HB1 2 5
ATOM 1487 H HB2 . ALA B 1 5 ? 5.770 -10.508 -0.492 1.00 0.00 ? 27 ALA B HB2 2 5
ATOM 1488 H HB3 . ALA B 1 5 ? 5.213 -9.308 0.663 1.00 0.00 ? 27 ALA B HB3 2 5
ATOM 1489 N N . ALA B 1 6 ? 7.565 -8.301 -0.694 1.00 0.00 ? 28 ALA B N 2 6
ATOM 1490 C CA . ALA B 1 6 ? 8.795 -7.587 -0.448 1.00 0.00 ? 28 ALA B CA 2 6
ATOM 1491 C C . ALA B 1 6 ? 9.588 -7.346 -1.710 1.00 0.00 ? 28 ALA B C 2 6
ATOM 1492 O O . ALA B 1 6 ? 10.801 -7.271 -1.705 1.00 0.00 ? 28 ALA B O 2 6
ATOM 1493 C CB . ALA B 1 6 ? 9.548 -8.345 0.630 1.00 0.00 ? 28 ALA B CB 2 6
ATOM 1494 H H . ALA B 1 6 ? 7.525 -9.284 -0.551 1.00 0.00 ? 28 ALA B H 2 6
ATOM 1495 H HA . ALA B 1 6 ? 8.498 -6.618 -0.065 1.00 0.00 ? 28 ALA B HA 2 6
ATOM 1496 H HB1 . ALA B 1 6 ? 8.924 -8.463 1.487 1.00 0.00 ? 28 ALA B HB1 2 6
ATOM 1497 H HB2 . ALA B 1 6 ? 9.888 -9.303 0.298 1.00 0.00 ? 28 ALA B HB2 2 6
ATOM 1498 H HB3 . ALA B 1 6 ? 10.429 -7.827 0.943 1.00 0.00 ? 28 ALA B HB3 2 6
ATOM 1499 N N . ALA B 1 7 ? 8.879 -7.158 -2.810 1.00 0.00 ? 29 ALA B N 2 7
ATOM 1500 C CA . ALA B 1 7 ? 9.294 -6.655 -4.099 1.00 0.00 ? 29 ALA B CA 2 7
ATOM 1501 C C . ALA B 1 7 ? 8.674 -5.309 -4.407 1.00 0.00 ? 29 ALA B C 2 7
ATOM 1502 O O . ALA B 1 7 ? 9.325 -4.461 -4.980 1.00 0.00 ? 29 ALA B O 2 7
ATOM 1503 C CB . ALA B 1 7 ? 8.958 -7.680 -5.163 1.00 0.00 ? 29 ALA B CB 2 7
ATOM 1504 H H . ALA B 1 7 ? 7.917 -7.186 -2.593 1.00 0.00 ? 29 ALA B H 2 7
ATOM 1505 H HA . ALA B 1 7 ? 10.361 -6.482 -4.100 1.00 0.00 ? 29 ALA B HA 2 7
ATOM 1506 H HB1 . ALA B 1 7 ? 9.294 -7.975 -5.557 1.00 0.00 ? 29 ALA B HB1 2 7
ATOM 1507 H HB2 . ALA B 1 7 ? 8.726 -8.161 -5.039 1.00 0.00 ? 29 ALA B HB2 2 7
ATOM 1508 H HB3 . ALA B 1 7 ? 8.595 -7.649 -5.670 1.00 0.00 ? 29 ALA B HB3 2 7
ATOM 1509 N N . ALA B 1 8 ? 7.423 -5.110 -4.008 1.00 0.00 ? 30 ALA B N 2 8
ATOM 1510 C CA . ALA B 1 8 ? 6.731 -3.845 -4.081 1.00 0.00 ? 30 ALA B CA 2 8
ATOM 1511 C C . ALA B 1 8 ? 6.832 -3.087 -2.776 1.00 0.00 ? 30 ALA B C 2 8
ATOM 1512 O O . ALA B 1 8 ? 7.301 -1.966 -2.729 1.00 0.00 ? 30 ALA B O 2 8
ATOM 1513 C CB . ALA B 1 8 ? 5.282 -4.086 -4.464 1.00 0.00 ? 30 ALA B CB 2 8
ATOM 1514 H H . ALA B 1 8 ? 6.951 -5.841 -3.509 1.00 0.00 ? 30 ALA B H 2 8
ATOM 1515 H HA . ALA B 1 8 ? 7.169 -3.221 -4.845 1.00 0.00 ? 30 ALA B HA 2 8
ATOM 1516 H HB1 . ALA B 1 8 ? 5.230 -4.664 -5.348 1.00 0.00 ? 30 ALA B HB1 2 8
ATOM 1517 H HB2 . ALA B 1 8 ? 4.743 -4.571 -3.681 1.00 0.00 ? 30 ALA B HB2 2 8
ATOM 1518 H HB3 . ALA B 1 8 ? 4.845 -3.128 -4.635 1.00 0.00 ? 30 ALA B HB3 2 8
ATOM 1519 N N . ILE B 1 9 ? 6.393 -3.701 -1.682 1.00 0.00 ? 31 ILE B N 2 9
ATOM 1520 C CA . ILE B 1 9 ? 6.352 -3.146 -0.349 1.00 0.00 ? 31 ILE B CA 2 9
ATOM 1521 C C . ILE B 1 9 ? 7.681 -2.579 0.111 1.00 0.00 ? 31 ILE B C 2 9
ATOM 1522 O O . ILE B 1 9 ? 7.681 -1.618 0.868 1.00 0.00 ? 31 ILE B O 2 9
ATOM 1523 C CB . ILE B 1 9 ? 5.875 -4.186 0.651 1.00 0.00 ? 31 ILE B CB 2 9
ATOM 1524 C CG1 . ILE B 1 9 ? 4.559 -4.867 0.317 1.00 0.00 ? 31 ILE B CG1 2 9
ATOM 1525 C CG2 . ILE B 1 9 ? 5.788 -3.662 2.071 1.00 0.00 ? 31 ILE B CG2 2 9
ATOM 1526 C CD1 . ILE B 1 9 ? 3.416 -3.928 0.054 1.00 0.00 ? 31 ILE B CD1 2 9
ATOM 1527 H H . ILE B 1 9 ? 6.085 -4.643 -1.777 1.00 0.00 ? 31 ILE B H 2 9
ATOM 1528 H HA . ILE B 1 9 ? 5.642 -2.328 -0.327 1.00 0.00 ? 31 ILE B HA 2 9
ATOM 1529 H HB . ILE B 1 9 ? 6.657 -4.936 0.658 1.00 0.00 ? 31 ILE B HB 2 9
ATOM 1530 H HG12 . ILE B 1 9 ? 4.701 -5.499 -0.560 1.00 0.00 ? 31 ILE B HG12 2 9
ATOM 1531 H HG13 . ILE B 1 9 ? 4.313 -5.512 1.134 1.00 0.00 ? 31 ILE B HG13 2 9
ATOM 1532 H HG21 . ILE B 1 9 ? 5.225 -2.754 2.106 1.00 0.00 ? 31 ILE B HG21 2 9
ATOM 1533 H HG22 . ILE B 1 9 ? 5.350 -4.383 2.736 1.00 0.00 ? 31 ILE B HG22 2 9
ATOM 1534 H HG23 . ILE B 1 9 ? 6.781 -3.483 2.451 1.00 0.00 ? 31 ILE B HG23 2 9
ATOM 1535 H HD11 . ILE B 1 9 ? 2.633 -4.165 0.203 1.00 0.00 ? 31 ILE B HD11 2 9
ATOM 1536 H HD12 . ILE B 1 9 ? 3.361 -3.697 -0.698 1.00 0.00 ? 31 ILE B HD12 2 9
ATOM 1537 H HD13 . ILE B 1 9 ? 3.429 -3.204 0.455 1.00 0.00 ? 31 ILE B HD13 2 9
ATOM 1538 N N . LYS B 1 10 ? 8.796 -3.123 -0.370 1.00 0.00 ? 32 LYS B N 2 10
ATOM 1539 C CA . LYS B 1 10 ? 10.125 -2.675 -0.044 1.00 0.00 ? 32 LYS B CA 2 10
ATOM 1540 C C . LYS B 1 10 ? 10.408 -1.236 -0.436 1.00 0.00 ? 32 LYS B C 2 10
ATOM 1541 O O . LYS B 1 10 ? 10.674 -0.356 0.366 1.00 0.00 ? 32 LYS B O 2 10
ATOM 1542 C CB . LYS B 1 10 ? 11.147 -3.635 -0.635 1.00 0.00 ? 32 LYS B CB 2 10
ATOM 1543 C CG . LYS B 1 10 ? 11.218 -3.967 -2.116 1.00 0.00 ? 32 LYS B CG 2 10
ATOM 1544 C CD . LYS B 1 10 ? 12.551 -4.449 -2.516 1.00 0.00 ? 32 LYS B CD 2 10
ATOM 1545 C CE . LYS B 1 10 ? 12.653 -4.604 -4.001 1.00 0.00 ? 32 LYS B CE 2 10
ATOM 1546 N NZ . LYS B 1 10 ? 13.954 -4.871 -4.481 1.00 0.00 ? 32 LYS B NZ 2 10
ATOM 1547 H H . LYS B 1 10 ? 8.678 -3.939 -0.923 1.00 0.00 ? 32 LYS B H 2 10
ATOM 1548 H HA . LYS B 1 10 ? 10.156 -2.649 1.042 1.00 0.00 ? 32 LYS B HA 2 10
ATOM 1549 H HB2 . LYS B 1 10 ? 12.128 -3.249 -0.357 1.00 0.00 ? 32 LYS B HB2 2 10
ATOM 1550 H HB3 . LYS B 1 10 ? 11.026 -4.579 -0.129 1.00 0.00 ? 32 LYS B HB3 2 10
ATOM 1551 H HG2 . LYS B 1 10 ? 10.475 -4.734 -2.336 1.00 0.00 ? 32 LYS B HG2 2 10
ATOM 1552 H HG3 . LYS B 1 10 ? 10.994 -3.170 -2.730 1.00 0.00 ? 32 LYS B HG3 2 10
ATOM 1553 H HD2 . LYS B 1 10 ? 13.301 -3.733 -2.180 1.00 0.00 ? 32 LYS B HD2 2 10
ATOM 1554 H HD3 . LYS B 1 10 ? 12.784 -5.321 -2.058 1.00 0.00 ? 32 LYS B HD3 2 10
ATOM 1555 H HE2 . LYS B 1 10 ? 11.979 -5.396 -4.328 1.00 0.00 ? 32 LYS B HE2 2 10
ATOM 1556 H HE3 . LYS B 1 10 ? 12.355 -3.726 -4.424 1.00 0.00 ? 32 LYS B HE3 2 10
ATOM 1557 H HZ1 . LYS B 1 10 ? 14.136 -4.950 -5.195 1.00 0.00 ? 32 LYS B HZ1 2 10
ATOM 1558 H HZ2 . LYS B 1 10 ? 14.167 -5.425 -4.229 1.00 0.00 ? 32 LYS B HZ2 2 10
ATOM 1559 H HZ3 . LYS B 1 10 ? 14.525 -4.412 -4.424 1.00 0.00 ? 32 LYS B HZ3 2 10
ATOM 1560 N N . ALA B 1 11 ? 10.292 -1.030 -1.745 1.00 0.00 ? 33 ALA B N 2 11
ATOM 1561 C CA . ALA B 1 11 ? 10.247 0.264 -2.384 1.00 0.00 ? 33 ALA B CA 2 11
ATOM 1562 C C . ALA B 1 11 ? 9.164 1.140 -1.787 1.00 0.00 ? 33 ALA B C 2 11
ATOM 1563 O O . ALA B 1 11 ? 9.431 2.282 -1.431 1.00 0.00 ? 33 ALA B O 2 11
ATOM 1564 C CB . ALA B 1 11 ? 10.027 0.038 -3.870 1.00 0.00 ? 33 ALA B CB 2 11
ATOM 1565 H H . ALA B 1 11 ? 10.115 -1.895 -2.217 1.00 0.00 ? 33 ALA B H 2 11
ATOM 1566 H HA . ALA B 1 11 ? 11.212 0.747 -2.258 1.00 0.00 ? 33 ALA B HA 2 11
ATOM 1567 H HB1 . ALA B 1 11 ? 9.918 0.953 -4.356 1.00 0.00 ? 33 ALA B HB1 2 11
ATOM 1568 H HB2 . ALA B 1 11 ? 10.835 -0.488 -4.285 1.00 0.00 ? 33 ALA B HB2 2 11
ATOM 1569 H HB3 . ALA B 1 11 ? 9.165 -0.531 -4.063 1.00 0.00 ? 33 ALA B HB3 2 11
ATOM 1570 N N . ILE B 1 12 ? 7.946 0.636 -1.622 1.00 0.00 ? 34 ILE B N 2 12
ATOM 1571 C CA . ILE B 1 12 ? 6.793 1.399 -1.205 1.00 0.00 ? 34 ILE B CA 2 12
ATOM 1572 C C . ILE B 1 12 ? 6.942 1.866 0.230 1.00 0.00 ? 34 ILE B C 2 12
ATOM 1573 O O . ILE B 1 12 ? 6.697 3.037 0.483 1.00 0.00 ? 34 ILE B O 2 12
ATOM 1574 C CB . ILE B 1 12 ? 5.492 0.666 -1.472 1.00 0.00 ? 34 ILE B CB 2 12
ATOM 1575 C CG1 . ILE B 1 12 ? 5.192 0.600 -2.956 1.00 0.00 ? 34 ILE B CG1 2 12
ATOM 1576 C CG2 . ILE B 1 12 ? 4.282 1.214 -0.747 1.00 0.00 ? 34 ILE B CG2 2 12
ATOM 1577 C CD1 . ILE B 1 12 ? 4.760 1.859 -3.669 1.00 0.00 ? 34 ILE B CD1 2 12
ATOM 1578 H H . ILE B 1 12 ? 7.851 -0.360 -1.702 1.00 0.00 ? 34 ILE B H 2 12
ATOM 1579 H HA . ILE B 1 12 ? 6.780 2.314 -1.792 1.00 0.00 ? 34 ILE B HA 2 12
ATOM 1580 H HB . ILE B 1 12 ? 5.612 -0.353 -1.126 1.00 0.00 ? 34 ILE B HB 2 12
ATOM 1581 H HG12 . ILE B 1 12 ? 6.079 0.215 -3.458 1.00 0.00 ? 34 ILE B HG12 2 12
ATOM 1582 H HG13 . ILE B 1 12 ? 4.406 -0.103 -3.098 1.00 0.00 ? 34 ILE B HG13 2 12
ATOM 1583 H HG21 . ILE B 1 12 ? 4.429 1.062 0.296 1.00 0.00 ? 34 ILE B HG21 2 12
ATOM 1584 H HG22 . ILE B 1 12 ? 4.136 2.246 -0.941 1.00 0.00 ? 34 ILE B HG22 2 12
ATOM 1585 H HG23 . ILE B 1 12 ? 3.401 0.672 -1.013 1.00 0.00 ? 34 ILE B HG23 2 12
ATOM 1586 H HD11 . ILE B 1 12 ? 4.439 2.338 -3.465 1.00 0.00 ? 34 ILE B HD11 2 12
ATOM 1587 H HD12 . ILE B 1 12 ? 5.074 2.315 -3.968 1.00 0.00 ? 34 ILE B HD12 2 12
ATOM 1588 H HD13 . ILE B 1 12 ? 4.403 1.866 -4.120 1.00 0.00 ? 34 ILE B HD13 2 12
ATOM 1589 N N . ALA B 1 13 ? 7.441 1.068 1.169 1.00 0.00 ? 35 ALA B N 2 13
ATOM 1590 C CA . ALA B 1 13 ? 7.641 1.554 2.510 1.00 0.00 ? 35 ALA B CA 2 13
ATOM 1591 C C . ALA B 1 13 ? 8.674 2.655 2.644 1.00 0.00 ? 35 ALA B C 2 13
ATOM 1592 O O . ALA B 1 13 ? 8.663 3.429 3.579 1.00 0.00 ? 35 ALA B O 2 13
ATOM 1593 C CB . ALA B 1 13 ? 7.897 0.368 3.430 1.00 0.00 ? 35 ALA B CB 2 13
ATOM 1594 H H . ALA B 1 13 ? 7.659 0.122 0.909 1.00 0.00 ? 35 ALA B H 2 13
ATOM 1595 H HA . ALA B 1 13 ? 6.714 2.009 2.841 1.00 0.00 ? 35 ALA B HA 2 13
ATOM 1596 H HB1 . ALA B 1 13 ? 7.931 0.689 4.456 1.00 0.00 ? 35 ALA B HB1 2 13
ATOM 1597 H HB2 . ALA B 1 13 ? 7.116 -0.366 3.309 1.00 0.00 ? 35 ALA B HB2 2 13
ATOM 1598 H HB3 . ALA B 1 13 ? 8.846 -0.062 3.172 1.00 0.00 ? 35 ALA B HB3 2 13
ATOM 1599 N N . ALA B 1 14 ? 9.567 2.790 1.671 1.00 0.00 ? 36 ALA B N 2 14
ATOM 1600 C CA . ALA B 1 14 ? 10.549 3.842 1.532 1.00 0.00 ? 36 ALA B CA 2 14
ATOM 1601 C C . ALA B 1 14 ? 10.021 5.057 0.796 1.00 0.00 ? 36 ALA B C 2 14
ATOM 1602 O O . ALA B 1 14 ? 10.264 6.185 1.174 1.00 0.00 ? 36 ALA B O 2 14
ATOM 1603 C CB . ALA B 1 14 ? 11.802 3.280 0.889 1.00 0.00 ? 36 ALA B CB 2 14
ATOM 1604 H H . ALA B 1 14 ? 9.393 2.198 0.886 1.00 0.00 ? 36 ALA B H 2 14
ATOM 1605 H HA . ALA B 1 14 ? 10.852 4.199 2.507 1.00 0.00 ? 36 ALA B HA 2 14
ATOM 1606 H HB1 . ALA B 1 14 ? 12.392 3.165 1.277 1.00 0.00 ? 36 ALA B HB1 2 14
ATOM 1607 H HB2 . ALA B 1 14 ? 11.832 2.689 0.575 1.00 0.00 ? 36 ALA B HB2 2 14
ATOM 1608 H HB3 . ALA B 1 14 ? 12.158 3.618 0.379 1.00 0.00 ? 36 ALA B HB3 2 14
ATOM 1609 N N . ILE B 1 15 ? 9.206 4.825 -0.221 1.00 0.00 ? 37 ILE B N 2 15
ATOM 1610 C CA . ILE B 1 15 ? 8.462 5.796 -0.991 1.00 0.00 ? 37 ILE B CA 2 15
ATOM 1611 C C . ILE B 1 15 ? 7.438 6.472 -0.094 1.00 0.00 ? 37 ILE B C 2 15
ATOM 1612 O O . ILE B 1 15 ? 7.196 7.664 -0.227 1.00 0.00 ? 37 ILE B O 2 15
ATOM 1613 C CB . ILE B 1 15 ? 7.832 5.116 -2.198 1.00 0.00 ? 37 ILE B CB 2 15
ATOM 1614 C CG1 . ILE B 1 15 ? 8.874 4.802 -3.260 1.00 0.00 ? 37 ILE B CG1 2 15
ATOM 1615 C CG2 . ILE B 1 15 ? 6.661 5.829 -2.846 1.00 0.00 ? 37 ILE B CG2 2 15
ATOM 1616 C CD1 . ILE B 1 15 ? 8.524 3.705 -4.254 1.00 0.00 ? 37 ILE B CD1 2 15
ATOM 1617 H H . ILE B 1 15 ? 9.055 3.852 -0.408 1.00 0.00 ? 37 ILE B H 2 15
ATOM 1618 H HA . ILE B 1 15 ? 9.111 6.599 -1.321 1.00 0.00 ? 37 ILE B HA 2 15
ATOM 1619 H HB . ILE B 1 15 ? 7.431 4.172 -1.866 1.00 0.00 ? 37 ILE B HB 2 15
ATOM 1620 H HG12 . ILE B 1 15 ? 9.085 5.719 -3.809 1.00 0.00 ? 37 ILE B HG12 2 15
ATOM 1621 H HG13 . ILE B 1 15 ? 9.800 4.471 -2.806 1.00 0.00 ? 37 ILE B HG13 2 15
ATOM 1622 H HG21 . ILE B 1 15 ? 6.280 5.193 -3.630 1.00 0.00 ? 37 ILE B HG21 2 15
ATOM 1623 H HG22 . ILE B 1 15 ? 5.878 6.019 -2.136 1.00 0.00 ? 37 ILE B HG22 2 15
ATOM 1624 H HG23 . ILE B 1 15 ? 6.946 6.762 -3.282 1.00 0.00 ? 37 ILE B HG23 2 15
ATOM 1625 H HD11 . ILE B 1 15 ? 8.272 2.804 -3.779 1.00 0.00 ? 37 ILE B HD11 2 15
ATOM 1626 H HD12 . ILE B 1 15 ? 7.730 4.007 -4.889 1.00 0.00 ? 37 ILE B HD12 2 15
ATOM 1627 H HD13 . ILE B 1 15 ? 9.354 3.506 -4.883 1.00 0.00 ? 37 ILE B HD13 2 15
ATOM 1628 N N . ILE B 1 16 ? 6.854 5.756 0.863 1.00 0.00 ? 38 ILE B N 2 16
ATOM 1629 C CA . ILE B 1 16 ? 5.975 6.293 1.873 1.00 0.00 ? 38 ILE B CA 2 16
ATOM 1630 C C . ILE B 1 16 ? 6.711 7.259 2.787 1.00 0.00 ? 38 ILE B C 2 16
ATOM 1631 O O . ILE B 1 16 ? 6.275 8.392 2.940 1.00 0.00 ? 38 ILE B O 2 16
ATOM 1632 C CB . ILE B 1 16 ? 5.256 5.190 2.637 1.00 0.00 ? 38 ILE B CB 2 16
ATOM 1633 C CG1 . ILE B 1 16 ? 4.201 4.634 1.687 1.00 0.00 ? 38 ILE B CG1 2 16
ATOM 1634 C CG2 . ILE B 1 16 ? 4.651 5.597 3.974 1.00 0.00 ? 38 ILE B CG2 2 16
ATOM 1635 C CD1 . ILE B 1 16 ? 3.282 3.574 2.257 1.00 0.00 ? 38 ILE B CD1 2 16
ATOM 1636 H H . ILE B 1 16 ? 7.033 4.774 0.866 1.00 0.00 ? 38 ILE B H 2 16
ATOM 1637 H HA . ILE B 1 16 ? 5.239 6.886 1.344 1.00 0.00 ? 38 ILE B HA 2 16
ATOM 1638 H HB . ILE B 1 16 ? 5.991 4.418 2.837 1.00 0.00 ? 38 ILE B HB 2 16
ATOM 1639 H HG12 . ILE B 1 16 ? 3.601 5.460 1.306 1.00 0.00 ? 38 ILE B HG12 2 16
ATOM 1640 H HG13 . ILE B 1 16 ? 4.714 4.165 0.858 1.00 0.00 ? 38 ILE B HG13 2 16
ATOM 1641 H HG21 . ILE B 1 16 ? 3.877 6.319 3.841 1.00 0.00 ? 38 ILE B HG21 2 16
ATOM 1642 H HG22 . ILE B 1 16 ? 4.246 4.760 4.490 1.00 0.00 ? 38 ILE B HG22 2 16
ATOM 1643 H HG23 . ILE B 1 16 ? 5.401 6.010 4.611 1.00 0.00 ? 38 ILE B HG23 2 16
ATOM 1644 H HD11 . ILE B 1 16 ? 3.829 2.824 2.771 1.00 0.00 ? 38 ILE B HD11 2 16
ATOM 1645 H HD12 . ILE B 1 16 ? 2.621 4.072 2.936 1.00 0.00 ? 38 ILE B HD12 2 16
ATOM 1646 H HD13 . ILE B 1 16 ? 2.676 3.124 1.491 1.00 0.00 ? 38 ILE B HD13 2 16
ATOM 1647 N N . LYS B 1 17 ? 7.843 6.821 3.334 1.00 0.00 ? 39 LYS B N 2 17
ATOM 1648 C CA . LYS B 1 17 ? 8.685 7.627 4.186 1.00 0.00 ? 39 LYS B CA 2 17
ATOM 1649 C C . LYS B 1 17 ? 9.141 8.915 3.527 1.00 0.00 ? 39 LYS B C 2 17
ATOM 1650 O O . LYS B 1 17 ? 9.073 9.975 4.122 1.00 0.00 ? 39 LYS B O 2 17
ATOM 1651 C CB . LYS B 1 17 ? 9.818 6.779 4.736 1.00 0.00 ? 39 LYS B CB 2 17
ATOM 1652 C CG . LYS B 1 17 ? 10.708 7.453 5.762 1.00 0.00 ? 39 LYS B CG 2 17
ATOM 1653 C CD . LYS B 1 17 ? 10.063 7.811 7.075 1.00 0.00 ? 39 LYS B CD 2 17
ATOM 1654 C CE . LYS B 1 17 ? 9.671 6.640 7.921 1.00 0.00 ? 39 LYS B CE 2 17
ATOM 1655 N NZ . LYS B 1 17 ? 10.806 5.993 8.462 1.00 0.00 ? 39 LYS B NZ 2 17
ATOM 1656 H H . LYS B 1 17 ? 8.030 5.840 3.233 1.00 0.00 ? 39 LYS B H 2 17
ATOM 1657 H HA . LYS B 1 17 ? 8.068 7.945 5.018 1.00 0.00 ? 39 LYS B HA 2 17
ATOM 1658 H HB2 . LYS B 1 17 ? 9.402 5.872 5.174 1.00 0.00 ? 39 LYS B HB2 2 17
ATOM 1659 H HB3 . LYS B 1 17 ? 10.434 6.496 3.900 1.00 0.00 ? 39 LYS B HB3 2 17
ATOM 1660 H HG2 . LYS B 1 17 ? 11.554 6.796 5.963 1.00 0.00 ? 39 LYS B HG2 2 17
ATOM 1661 H HG3 . LYS B 1 17 ? 11.107 8.356 5.333 1.00 0.00 ? 39 LYS B HG3 2 17
ATOM 1662 H HD2 . LYS B 1 17 ? 10.759 8.426 7.646 1.00 0.00 ? 39 LYS B HD2 2 17
ATOM 1663 H HD3 . LYS B 1 17 ? 9.217 8.429 6.874 1.00 0.00 ? 39 LYS B HD3 2 17
ATOM 1664 H HE2 . LYS B 1 17 ? 9.019 6.974 8.728 1.00 0.00 ? 39 LYS B HE2 2 17
ATOM 1665 H HE3 . LYS B 1 17 ? 9.122 5.944 7.346 1.00 0.00 ? 39 LYS B HE3 2 17
ATOM 1666 H HZ1 . LYS B 1 17 ? 11.363 5.617 7.793 1.00 0.00 ? 39 LYS B HZ1 2 17
ATOM 1667 H HZ2 . LYS B 1 17 ? 11.336 6.586 8.989 1.00 0.00 ? 39 LYS B HZ2 2 17
ATOM 1668 H HZ3 . LYS B 1 17 ? 10.526 5.270 9.062 1.00 0.00 ? 39 LYS B HZ3 2 17
ATOM 1669 N N . ALA B 1 18 ? 9.523 8.842 2.258 1.00 0.00 ? 40 ALA B N 2 18
ATOM 1670 C CA . ALA B 1 18 ? 9.891 9.937 1.393 1.00 0.00 ? 40 ALA B CA 2 18
ATOM 1671 C C . ALA B 1 18 ? 8.702 10.790 0.998 1.00 0.00 ? 40 ALA B C 2 18
ATOM 1672 O O . ALA B 1 18 ? 8.827 11.990 0.826 1.00 0.00 ? 40 ALA B O 2 18
ATOM 1673 C CB . ALA B 1 18 ? 10.601 9.409 0.161 1.00 0.00 ? 40 ALA B CB 2 18
ATOM 1674 H H . ALA B 1 18 ? 9.520 7.911 1.898 1.00 0.00 ? 40 ALA B H 2 18
ATOM 1675 H HA . ALA B 1 18 ? 10.555 10.574 1.959 1.00 0.00 ? 40 ALA B HA 2 18
ATOM 1676 H HB1 . ALA B 1 18 ? 11.483 8.869 0.418 1.00 0.00 ? 40 ALA B HB1 2 18
ATOM 1677 H HB2 . ALA B 1 18 ? 9.945 8.794 -0.423 1.00 0.00 ? 40 ALA B HB2 2 18
ATOM 1678 H HB3 . ALA B 1 18 ? 10.900 10.230 -0.450 1.00 0.00 ? 40 ALA B HB3 2 18
ATOM 1679 N N . GLY B 1 19 ? 7.543 10.175 0.891 1.00 0.00 ? 41 GLY B N 2 19
ATOM 1680 C CA . GLY B 1 19 ? 6.290 10.723 0.427 1.00 0.00 ? 41 GLY B CA 2 19
ATOM 1681 C C . GLY B 1 19 ? 5.544 11.631 1.385 1.00 0.00 ? 41 GLY B C 2 19
ATOM 1682 O O . GLY B 1 19 ? 4.570 12.265 1.019 1.00 0.00 ? 41 GLY B O 2 19
ATOM 1683 H H . GLY B 1 19 ? 7.560 9.185 0.999 1.00 0.00 ? 41 GLY B H 2 19
ATOM 1684 H HA2 . GLY B 1 19 ? 6.459 11.274 -0.487 1.00 0.00 ? 41 GLY B HA2 2 19
ATOM 1685 H HA3 . GLY B 1 19 ? 5.608 9.911 0.207 1.00 0.00 ? 41 GLY B HA3 2 19
ATOM 1686 N N . GLY B 1 20 ? 5.909 11.622 2.656 1.00 0.00 ? 42 GLY B N 2 20
ATOM 1687 C CA . GLY B 1 20 ? 5.321 12.468 3.671 1.00 0.00 ? 42 GLY B CA 2 20
ATOM 1688 C C . GLY B 1 20 ? 3.921 12.107 4.067 1.00 0.00 ? 42 GLY B C 2 20
ATOM 1689 O O . GLY B 1 20 ? 3.195 12.917 4.600 1.00 0.00 ? 42 GLY B O 2 20
ATOM 1690 H H . GLY B 1 20 ? 6.666 11.028 2.885 1.00 0.00 ? 42 GLY B H 2 20
ATOM 1691 H HA2 . GLY B 1 20 ? 5.935 12.433 4.537 1.00 0.00 ? 42 GLY B HA2 2 20
ATOM 1692 H HA3 . GLY B 1 20 ? 5.351 13.495 3.387 1.00 0.00 ? 42 GLY B HA3 2 20
ATOM 1693 N N . TYR B 1 21 ? 3.477 10.883 3.796 1.00 0.00 ? 43 TYR B N 2 21
ATOM 1694 C CA . TYR B 1 21 ? 2.221 10.292 4.202 1.00 0.00 ? 43 TYR B CA 2 21
ATOM 1695 C C . TYR B 1 21 ? 2.027 10.262 5.704 1.00 0.00 ? 43 TYR B C 2 21
ATOM 1696 O O . TYR B 1 21 ? 0.929 10.418 6.162 1.00 0.00 ? 43 TYR B O 2 21
ATOM 1697 C CB . TYR B 1 21 ? 2.289 8.883 3.634 1.00 0.00 ? 43 TYR B CB 2 21
ATOM 1698 C CG . TYR B 1 21 ? 1.805 8.659 2.231 1.00 0.00 ? 43 TYR B CG 2 21
ATOM 1699 C CD1 . TYR B 1 21 ? 0.503 8.917 1.825 1.00 0.00 ? 43 TYR B CD1 2 21
ATOM 1700 C CD2 . TYR B 1 21 ? 2.651 7.983 1.361 1.00 0.00 ? 43 TYR B CD2 2 21
ATOM 1701 C CE1 . TYR B 1 21 ? 0.047 8.478 0.581 1.00 0.00 ? 43 TYR B CE1 2 21
ATOM 1702 C CE2 . TYR B 1 21 ? 2.201 7.487 0.137 1.00 0.00 ? 43 TYR B CE2 2 21
ATOM 1703 C CZ . TYR B 1 21 ? 0.891 7.763 -0.273 1.00 0.00 ? 43 TYR B CZ 2 21
ATOM 1704 O OH . TYR B 1 21 ? 0.455 7.324 -1.479 1.00 0.00 ? 43 TYR B OH 2 21
ATOM 1705 H H . TYR B 1 21 ? 4.086 10.244 3.331 1.00 0.00 ? 43 TYR B H 2 21
ATOM 1706 H HA . TYR B 1 21 ? 1.375 10.832 3.802 1.00 0.00 ? 43 TYR B HA 2 21
ATOM 1707 H HB2 . TYR B 1 21 ? 3.332 8.569 3.677 1.00 0.00 ? 43 TYR B HB2 2 21
ATOM 1708 H HB3 . TYR B 1 21 ? 1.740 8.186 4.259 1.00 0.00 ? 43 TYR B HB3 2 21
ATOM 1709 H HD1 . TYR B 1 21 ? -0.161 9.431 2.485 1.00 0.00 ? 43 TYR B HD1 2 21
ATOM 1710 H HD2 . TYR B 1 21 ? 3.663 7.807 1.656 1.00 0.00 ? 43 TYR B HD2 2 21
ATOM 1711 H HE1 . TYR B 1 21 ? -0.955 8.681 0.273 1.00 0.00 ? 43 TYR B HE1 2 21
ATOM 1712 H HE2 . TYR B 1 21 ? 2.861 6.899 -0.470 1.00 0.00 ? 43 TYR B HE2 2 21
ATOM 1713 H HH . TYR B 1 21 ? 1.036 7.625 -2.126 1.00 0.00 ? 43 TYR B HH 2 21
HETATM 1714 N N . NH2 B 1 22 ? 3.041 10.071 6.512 1.00 0.00 ? 44 NH2 B N 2 22
HETATM 1715 H HN1 . NH2 B 1 22 ? 2.895 10.064 7.500 1.00 0.00 ? 44 NH2 B HN1 2 22
HETATM 1716 H HN2 . NH2 B 1 22 ? 3.936 9.941 6.116 1.00 0.00 ? 44 NH2 B HN2 2 22
HETATM 1717 C C . ACE C 1 1 ? -8.166 11.140 -3.865 1.00 0.00 ? 45 ACE C C 2 1
HETATM 1718 O O . ACE C 1 1 ? -8.412 10.342 -2.983 1.00 0.00 ? 45 ACE C O 2 1
HETATM 1719 C CH3 . ACE C 1 1 ? -9.113 11.289 -5.019 1.00 0.00 ? 45 ACE C CH3 2 1
HETATM 1720 H H1 . ACE C 1 1 ? -9.372 11.209 -5.236 1.00 0.00 ? 45 ACE C H1 2 1
HETATM 1721 H H2 . ACE C 1 1 ? -9.411 11.387 -5.266 1.00 0.00 ? 45 ACE C H2 2 1
HETATM 1722 H H3 . ACE C 1 1 ? -9.241 11.335 -5.339 1.00 0.00 ? 45 ACE C H3 2 1
ATOM 1723 N N . ALA C 1 2 ? -7.098 11.909 -3.901 1.00 0.00 ? 46 ALA C N 2 2
ATOM 1724 C CA . ALA C 1 2 ? -5.945 11.799 -3.041 1.00 0.00 ? 46 ALA C CA 2 2
ATOM 1725 C C . ALA C 1 2 ? -6.227 11.905 -1.560 1.00 0.00 ? 46 ALA C C 2 2
ATOM 1726 O O . ALA C 1 2 ? -5.410 11.446 -0.778 1.00 0.00 ? 46 ALA C O 2 2
ATOM 1727 C CB . ALA C 1 2 ? -4.996 12.873 -3.511 1.00 0.00 ? 46 ALA C CB 2 2
ATOM 1728 H H . ALA C 1 2 ? -6.994 12.517 -4.678 1.00 0.00 ? 46 ALA C H 2 2
ATOM 1729 H HA . ALA C 1 2 ? -5.532 10.817 -3.189 1.00 0.00 ? 46 ALA C HA 2 2
ATOM 1730 H HB1 . ALA C 1 2 ? -5.416 13.842 -3.355 1.00 0.00 ? 46 ALA C HB1 2 2
ATOM 1731 H HB2 . ALA C 1 2 ? -4.087 12.808 -2.957 1.00 0.00 ? 46 ALA C HB2 2 2
ATOM 1732 H HB3 . ALA C 1 2 ? -4.754 12.745 -4.542 1.00 0.00 ? 46 ALA C HB3 2 2
ATOM 1733 N N . LYS C 1 3 ? -7.363 12.436 -1.130 1.00 0.00 ? 47 LYS C N 2 3
ATOM 1734 C CA . LYS C 1 3 ? -7.788 12.456 0.247 1.00 0.00 ? 47 LYS C CA 2 3
ATOM 1735 C C . LYS C 1 3 ? -8.062 11.102 0.869 1.00 0.00 ? 47 LYS C C 2 3
ATOM 1736 O O . LYS C 1 3 ? -8.136 10.999 2.065 1.00 0.00 ? 47 LYS C O 2 3
ATOM 1737 C CB . LYS C 1 3 ? -9.033 13.311 0.392 1.00 0.00 ? 47 LYS C CB 2 3
ATOM 1738 C CG . LYS C 1 3 ? -8.753 14.786 0.295 1.00 0.00 ? 47 LYS C CG 2 3
ATOM 1739 C CD . LYS C 1 3 ? -9.891 15.609 0.707 1.00 0.00 ? 47 LYS C CD 2 3
ATOM 1740 C CE . LYS C 1 3 ? -9.558 17.015 0.605 1.00 0.00 ? 47 LYS C CE 2 3
ATOM 1741 N NZ . LYS C 1 3 ? -10.525 17.881 1.075 1.00 0.00 ? 47 LYS C NZ 2 3
ATOM 1742 H H . LYS C 1 3 ? -7.895 12.852 -1.859 1.00 0.00 ? 47 LYS C H 2 3
ATOM 1743 H HA . LYS C 1 3 ? -6.977 12.880 0.825 1.00 0.00 ? 47 LYS C HA 2 3
ATOM 1744 H HB2 . LYS C 1 3 ? -9.775 13.023 -0.353 1.00 0.00 ? 47 LYS C HB2 2 3
ATOM 1745 H HB3 . LYS C 1 3 ? -9.421 13.123 1.375 1.00 0.00 ? 47 LYS C HB3 2 3
ATOM 1746 H HG2 . LYS C 1 3 ? -7.900 15.020 0.932 1.00 0.00 ? 47 LYS C HG2 2 3
ATOM 1747 H HG3 . LYS C 1 3 ? -8.465 15.062 -0.679 1.00 0.00 ? 47 LYS C HG3 2 3
ATOM 1748 H HD2 . LYS C 1 3 ? -10.752 15.390 0.075 1.00 0.00 ? 47 LYS C HD2 2 3
ATOM 1749 H HD3 . LYS C 1 3 ? -10.157 15.377 1.630 1.00 0.00 ? 47 LYS C HD3 2 3
ATOM 1750 H HE2 . LYS C 1 3 ? -8.627 17.196 1.142 1.00 0.00 ? 47 LYS C HE2 2 3
ATOM 1751 H HE3 . LYS C 1 3 ? -9.413 17.239 -0.318 1.00 0.00 ? 47 LYS C HE3 2 3
ATOM 1752 H HZ1 . LYS C 1 3 ? -11.326 17.830 0.658 1.00 0.00 ? 47 LYS C HZ1 2 3
ATOM 1753 H HZ2 . LYS C 1 3 ? -10.683 17.689 1.935 1.00 0.00 ? 47 LYS C HZ2 2 3
ATOM 1754 H HZ3 . LYS C 1 3 ? -10.261 18.775 1.049 1.00 0.00 ? 47 LYS C HZ3 2 3
ATOM 1755 N N . ALA C 1 4 ? -8.172 10.054 0.064 1.00 0.00 ? 48 ALA C N 2 4
ATOM 1756 C CA . ALA C 1 4 ? -8.178 8.674 0.460 1.00 0.00 ? 48 ALA C CA 2 4
ATOM 1757 C C . ALA C 1 4 ? -6.936 8.219 1.198 1.00 0.00 ? 48 ALA C C 2 4
ATOM 1758 O O . ALA C 1 4 ? -6.887 7.085 1.638 1.00 0.00 ? 48 ALA C O 2 4
ATOM 1759 C CB . ALA C 1 4 ? -8.407 7.856 -0.800 1.00 0.00 ? 48 ALA C CB 2 4
ATOM 1760 H H . ALA C 1 4 ? -8.173 10.281 -0.909 1.00 0.00 ? 48 ALA C H 2 4
ATOM 1761 H HA . ALA C 1 4 ? -8.982 8.560 1.167 1.00 0.00 ? 48 ALA C HA 2 4
ATOM 1762 H HB1 . ALA C 1 4 ? -7.683 8.125 -1.534 1.00 0.00 ? 48 ALA C HB1 2 4
ATOM 1763 H HB2 . ALA C 1 4 ? -8.318 6.799 -0.637 1.00 0.00 ? 48 ALA C HB2 2 4
ATOM 1764 H HB3 . ALA C 1 4 ? -9.346 8.092 -1.250 1.00 0.00 ? 48 ALA C HB3 2 4
ATOM 1765 N N . ALA C 1 5 ? -5.946 9.089 1.322 1.00 0.00 ? 49 ALA C N 2 5
ATOM 1766 C CA . ALA C 1 5 ? -4.603 8.781 1.745 1.00 0.00 ? 49 ALA C CA 2 5
ATOM 1767 C C . ALA C 1 5 ? -4.439 8.511 3.229 1.00 0.00 ? 49 ALA C C 2 5
ATOM 1768 O O . ALA C 1 5 ? -4.191 7.394 3.655 1.00 0.00 ? 49 ALA C O 2 5
ATOM 1769 C CB . ALA C 1 5 ? -3.659 9.855 1.231 1.00 0.00 ? 49 ALA C CB 2 5
ATOM 1770 H H . ALA C 1 5 ? -6.154 10.043 1.129 1.00 0.00 ? 49 ALA C H 2 5
ATOM 1771 H HA . ALA C 1 5 ? -4.309 7.849 1.286 1.00 0.00 ? 49 ALA C HA 2 5
ATOM 1772 H HB1 . ALA C 1 5 ? -3.665 9.741 0.167 1.00 0.00 ? 49 ALA C HB1 2 5
ATOM 1773 H HB2 . ALA C 1 5 ? -3.960 10.844 1.527 1.00 0.00 ? 49 ALA C HB2 2 5
ATOM 1774 H HB3 . ALA C 1 5 ? -2.655 9.685 1.582 1.00 0.00 ? 49 ALA C HB3 2 5
ATOM 1775 N N . ALA C 1 6 ? -4.552 9.545 4.055 1.00 0.00 ? 50 ALA C N 2 6
ATOM 1776 C CA . ALA C 1 6 ? -4.224 9.565 5.460 1.00 0.00 ? 50 ALA C CA 2 6
ATOM 1777 C C . ALA C 1 6 ? -5.159 8.799 6.369 1.00 0.00 ? 50 ALA C C 2 6
ATOM 1778 O O . ALA C 1 6 ? -4.889 8.663 7.549 1.00 0.00 ? 50 ALA C O 2 6
ATOM 1779 C CB . ALA C 1 6 ? -3.987 10.980 5.928 1.00 0.00 ? 50 ALA C CB 2 6
ATOM 1780 H H . ALA C 1 6 ? -4.778 10.434 3.654 1.00 0.00 ? 50 ALA C H 2 6
ATOM 1781 H HA . ALA C 1 6 ? -3.290 9.033 5.499 1.00 0.00 ? 50 ALA C HA 2 6
ATOM 1782 H HB1 . ALA C 1 6 ? -3.561 10.991 6.901 1.00 0.00 ? 50 ALA C HB1 2 6
ATOM 1783 H HB2 . ALA C 1 6 ? -3.329 11.516 5.290 1.00 0.00 ? 50 ALA C HB2 2 6
ATOM 1784 H HB3 . ALA C 1 6 ? -4.895 11.535 5.947 1.00 0.00 ? 50 ALA C HB3 2 6
ATOM 1785 N N . ALA C 1 7 ? -6.221 8.205 5.833 1.00 0.00 ? 51 ALA C N 2 7
ATOM 1786 C CA . ALA C 1 7 ? -6.927 7.134 6.482 1.00 0.00 ? 51 ALA C CA 2 7
ATOM 1787 C C . ALA C 1 7 ? -6.255 5.816 6.187 1.00 0.00 ? 51 ALA C C 2 7
ATOM 1788 O O . ALA C 1 7 ? -5.901 5.110 7.089 1.00 0.00 ? 51 ALA C O 2 7
ATOM 1789 C CB . ALA C 1 7 ? -8.380 7.166 6.087 1.00 0.00 ? 51 ALA C CB 2 7
ATOM 1790 H H . ALA C 1 7 ? -6.370 8.376 4.863 1.00 0.00 ? 51 ALA C H 2 7
ATOM 1791 H HA . ALA C 1 7 ? -6.880 7.246 7.550 1.00 0.00 ? 51 ALA C HA 2 7
ATOM 1792 H HB1 . ALA C 1 7 ? -8.482 7.100 5.039 1.00 0.00 ? 51 ALA C HB1 2 7
ATOM 1793 H HB2 . ALA C 1 7 ? -8.911 6.364 6.533 1.00 0.00 ? 51 ALA C HB2 2 7
ATOM 1794 H HB3 . ALA C 1 7 ? -8.804 8.092 6.387 1.00 0.00 ? 51 ALA C HB3 2 7
ATOM 1795 N N . ALA C 1 8 ? -6.066 5.458 4.925 1.00 0.00 ? 52 ALA C N 2 8
ATOM 1796 C CA . ALA C 1 8 ? -5.572 4.186 4.460 1.00 0.00 ? 52 ALA C CA 2 8
ATOM 1797 C C . ALA C 1 8 ? -4.168 3.868 4.938 1.00 0.00 ? 52 ALA C C 2 8
ATOM 1798 O O . ALA C 1 8 ? -3.951 2.981 5.750 1.00 0.00 ? 52 ALA C O 2 8
ATOM 1799 C CB . ALA C 1 8 ? -5.614 4.192 2.947 1.00 0.00 ? 52 ALA C CB 2 8
ATOM 1800 H H . ALA C 1 8 ? -6.249 6.123 4.218 1.00 0.00 ? 52 ALA C H 2 8
ATOM 1801 H HA . ALA C 1 8 ? -6.222 3.407 4.834 1.00 0.00 ? 52 ALA C HA 2 8
ATOM 1802 H HB1 . ALA C 1 8 ? -4.920 4.906 2.572 1.00 0.00 ? 52 ALA C HB1 2 8
ATOM 1803 H HB2 . ALA C 1 8 ? -5.351 3.223 2.567 1.00 0.00 ? 52 ALA C HB2 2 8
ATOM 1804 H HB3 . ALA C 1 8 ? -6.602 4.463 2.614 1.00 0.00 ? 52 ALA C HB3 2 8
ATOM 1805 N N . ILE C 1 9 ? -3.173 4.585 4.438 1.00 0.00 ? 53 ILE C N 2 9
ATOM 1806 C CA . ILE C 1 9 ? -1.781 4.227 4.563 1.00 0.00 ? 53 ILE C CA 2 9
ATOM 1807 C C . ILE C 1 9 ? -1.290 4.319 5.997 1.00 0.00 ? 53 ILE C C 2 9
ATOM 1808 O O . ILE C 1 9 ? -0.282 3.738 6.366 1.00 0.00 ? 53 ILE C O 2 9
ATOM 1809 C CB . ILE C 1 9 ? -0.887 4.942 3.565 1.00 0.00 ? 53 ILE C CB 2 9
ATOM 1810 C CG1 . ILE C 1 9 ? -0.185 6.170 4.117 1.00 0.00 ? 53 ILE C CG1 2 9
ATOM 1811 C CG2 . ILE C 1 9 ? -1.534 5.346 2.250 1.00 0.00 ? 53 ILE C CG2 2 9
ATOM 1812 C CD1 . ILE C 1 9 ? -1.128 7.243 4.619 1.00 0.00 ? 53 ILE C CD1 2 9
ATOM 1813 H H . ILE C 1 9 ? -3.349 5.411 3.894 1.00 0.00 ? 53 ILE C H 2 9
ATOM 1814 H HA . ILE C 1 9 ? -1.725 3.187 4.281 1.00 0.00 ? 53 ILE C HA 2 9
ATOM 1815 H HB . ILE C 1 9 ? -0.106 4.263 3.263 1.00 0.00 ? 53 ILE C HB 2 9
ATOM 1816 H HG12 . ILE C 1 9 ? 0.481 5.869 4.926 1.00 0.00 ? 53 ILE C HG12 2 9
ATOM 1817 H HG13 . ILE C 1 9 ? 0.421 6.600 3.330 1.00 0.00 ? 53 ILE C HG13 2 9
ATOM 1818 H HG21 . ILE C 1 9 ? -2.291 6.092 2.402 1.00 0.00 ? 53 ILE C HG21 2 9
ATOM 1819 H HG22 . ILE C 1 9 ? -0.793 5.769 1.620 1.00 0.00 ? 53 ILE C HG22 2 9
ATOM 1820 H HG23 . ILE C 1 9 ? -1.998 4.504 1.784 1.00 0.00 ? 53 ILE C HG23 2 9
ATOM 1821 H HD11 . ILE C 1 9 ? -1.466 7.870 3.839 1.00 0.00 ? 53 ILE C HD11 2 9
ATOM 1822 H HD12 . ILE C 1 9 ? -1.987 6.809 5.071 1.00 0.00 ? 53 ILE C HD12 2 9
ATOM 1823 H HD13 . ILE C 1 9 ? -0.598 7.816 5.318 1.00 0.00 ? 53 ILE C HD13 2 9
ATOM 1824 N N . LYS C 1 10 ? -2.026 5.051 6.818 1.00 0.00 ? 54 LYS C N 2 10
ATOM 1825 C CA . LYS C 1 10 ? -1.710 5.453 8.169 1.00 0.00 ? 54 LYS C CA 2 10
ATOM 1826 C C . LYS C 1 10 ? -1.948 4.300 9.129 1.00 0.00 ? 54 LYS C C 2 10
ATOM 1827 O O . LYS C 1 10 ? -1.136 4.002 9.975 1.00 0.00 ? 54 LYS C O 2 10
ATOM 1828 C CB . LYS C 1 10 ? -2.576 6.680 8.384 1.00 0.00 ? 54 LYS C CB 2 10
ATOM 1829 C CG . LYS C 1 10 ? -2.092 7.762 9.323 1.00 0.00 ? 54 LYS C CG 2 10
ATOM 1830 C CD . LYS C 1 10 ? -2.077 7.361 10.691 1.00 0.00 ? 54 LYS C CD 2 10
ATOM 1831 C CE . LYS C 1 10 ? -1.690 8.471 11.619 1.00 0.00 ? 54 LYS C CE 2 10
ATOM 1832 N NZ . LYS C 1 10 ? -2.649 9.492 11.832 1.00 0.00 ? 54 LYS C NZ 2 10
ATOM 1833 H H . LYS C 1 10 ? -2.844 5.461 6.422 1.00 0.00 ? 54 LYS C H 2 10
ATOM 1834 H HA . LYS C 1 10 ? -0.663 5.710 8.213 1.00 0.00 ? 54 LYS C HA 2 10
ATOM 1835 H HB2 . LYS C 1 10 ? -2.698 7.148 7.407 1.00 0.00 ? 54 LYS C HB2 2 10
ATOM 1836 H HB3 . LYS C 1 10 ? -3.568 6.387 8.659 1.00 0.00 ? 54 LYS C HB3 2 10
ATOM 1837 H HG2 . LYS C 1 10 ? -1.085 8.066 9.035 1.00 0.00 ? 54 LYS C HG2 2 10
ATOM 1838 H HG3 . LYS C 1 10 ? -2.716 8.590 9.186 1.00 0.00 ? 54 LYS C HG3 2 10
ATOM 1839 H HD2 . LYS C 1 10 ? -3.052 6.966 10.976 1.00 0.00 ? 54 LYS C HD2 2 10
ATOM 1840 H HD3 . LYS C 1 10 ? -1.386 6.613 10.750 1.00 0.00 ? 54 LYS C HD3 2 10
ATOM 1841 H HE2 . LYS C 1 10 ? -1.443 8.036 12.587 1.00 0.00 ? 54 LYS C HE2 2 10
ATOM 1842 H HE3 . LYS C 1 10 ? -0.838 8.888 11.257 1.00 0.00 ? 54 LYS C HE3 2 10
ATOM 1843 H HZ1 . LYS C 1 10 ? -2.801 9.976 11.043 1.00 0.00 ? 54 LYS C HZ1 2 10
ATOM 1844 H HZ2 . LYS C 1 10 ? -3.492 9.158 12.097 1.00 0.00 ? 54 LYS C HZ2 2 10
ATOM 1845 H HZ3 . LYS C 1 10 ? -2.369 10.142 12.497 1.00 0.00 ? 54 LYS C HZ3 2 10
ATOM 1846 N N . ALA C 1 11 ? -3.033 3.564 8.920 1.00 0.00 ? 55 ALA C N 2 11
ATOM 1847 C CA . ALA C 1 11 ? -3.217 2.242 9.472 1.00 0.00 ? 55 ALA C CA 2 11
ATOM 1848 C C . ALA C 1 11 ? -2.226 1.232 8.931 1.00 0.00 ? 55 ALA C C 2 11
ATOM 1849 O O . ALA C 1 11 ? -1.686 0.418 9.668 1.00 0.00 ? 55 ALA C O 2 11
ATOM 1850 C CB . ALA C 1 11 ? -4.631 1.803 9.168 1.00 0.00 ? 55 ALA C CB 2 11
ATOM 1851 H H . ALA C 1 11 ? -3.646 3.821 8.175 1.00 0.00 ? 55 ALA C H 2 11
ATOM 1852 H HA . ALA C 1 11 ? -3.119 2.270 10.548 1.00 0.00 ? 55 ALA C HA 2 11
ATOM 1853 H HB1 . ALA C 1 11 ? -5.311 2.529 9.535 1.00 0.00 ? 55 ALA C HB1 2 11
ATOM 1854 H HB2 . ALA C 1 11 ? -4.806 1.732 8.132 1.00 0.00 ? 55 ALA C HB2 2 11
ATOM 1855 H HB3 . ALA C 1 11 ? -4.860 0.871 9.627 1.00 0.00 ? 55 ALA C HB3 2 11
ATOM 1856 N N . ILE C 1 12 ? -1.952 1.293 7.630 1.00 0.00 ? 56 ILE C N 2 12
ATOM 1857 C CA . ILE C 1 12 ? -1.266 0.233 6.929 1.00 0.00 ? 56 ILE C CA 2 12
ATOM 1858 C C . ILE C 1 12 ? 0.231 0.286 7.170 1.00 0.00 ? 56 ILE C C 2 12
ATOM 1859 O O . ILE C 1 12 ? 0.826 -0.774 7.318 1.00 0.00 ? 56 ILE C O 2 12
ATOM 1860 C CB . ILE C 1 12 ? -1.700 0.176 5.474 1.00 0.00 ? 56 ILE C CB 2 12
ATOM 1861 C CG1 . ILE C 1 12 ? -3.151 -0.257 5.432 1.00 0.00 ? 56 ILE C CG1 2 12
ATOM 1862 C CG2 . ILE C 1 12 ? -0.839 -0.741 4.641 1.00 0.00 ? 56 ILE C CG2 2 12
ATOM 1863 C CD1 . ILE C 1 12 ? -3.800 -0.065 4.089 1.00 0.00 ? 56 ILE C CD1 2 12
ATOM 1864 H H . ILE C 1 12 ? -2.321 2.062 7.108 1.00 0.00 ? 56 ILE C H 2 12
ATOM 1865 H HA . ILE C 1 12 ? -1.533 -0.718 7.372 1.00 0.00 ? 56 ILE C HA 2 12
ATOM 1866 H HB . ILE C 1 12 ? -1.605 1.168 5.083 1.00 0.00 ? 56 ILE C HB 2 12
ATOM 1867 H HG12 . ILE C 1 12 ? -3.222 -1.304 5.724 1.00 0.00 ? 56 ILE C HG12 2 12
ATOM 1868 H HG13 . ILE C 1 12 ? -3.710 0.321 6.129 1.00 0.00 ? 56 ILE C HG13 2 12
ATOM 1869 H HG21 . ILE C 1 12 ? 0.180 -0.402 4.643 1.00 0.00 ? 56 ILE C HG21 2 12
ATOM 1870 H HG22 . ILE C 1 12 ? -0.868 -1.717 5.039 1.00 0.00 ? 56 ILE C HG22 2 12
ATOM 1871 H HG23 . ILE C 1 12 ? -1.183 -0.787 3.627 1.00 0.00 ? 56 ILE C HG23 2 12
ATOM 1872 H HD11 . ILE C 1 12 ? -3.640 -0.777 3.461 1.00 0.00 ? 56 ILE C HD11 2 12
ATOM 1873 H HD12 . ILE C 1 12 ? -4.719 -0.050 4.193 1.00 0.00 ? 56 ILE C HD12 2 12
ATOM 1874 H HD13 . ILE C 1 12 ? -3.603 0.742 3.646 1.00 0.00 ? 56 ILE C HD13 2 12
ATOM 1875 N N . ALA C 1 13 ? 0.856 1.427 7.457 1.00 0.00 ? 57 ALA C N 2 13
ATOM 1876 C CA . ALA C 1 13 ? 2.212 1.510 7.942 1.00 0.00 ? 57 ALA C CA 2 13
ATOM 1877 C C . ALA C 1 13 ? 2.437 0.749 9.235 1.00 0.00 ? 57 ALA C C 2 13
ATOM 1878 O O . ALA C 1 13 ? 3.506 0.193 9.444 1.00 0.00 ? 57 ALA C O 2 13
ATOM 1879 C CB . ALA C 1 13 ? 2.633 2.965 8.048 1.00 0.00 ? 57 ALA C CB 2 13
ATOM 1880 H H . ALA C 1 13 ? 0.306 2.266 7.392 1.00 0.00 ? 57 ALA C H 2 13
ATOM 1881 H HA . ALA C 1 13 ? 2.853 1.047 7.204 1.00 0.00 ? 57 ALA C HA 2 13
ATOM 1882 H HB1 . ALA C 1 13 ? 3.653 3.039 8.358 1.00 0.00 ? 57 ALA C HB1 2 13
ATOM 1883 H HB2 . ALA C 1 13 ? 2.541 3.413 7.083 1.00 0.00 ? 57 ALA C HB2 2 13
ATOM 1884 H HB3 . ALA C 1 13 ? 1.990 3.499 8.705 1.00 0.00 ? 57 ALA C HB3 2 13
ATOM 1885 N N . ALA C 1 14 ? 1.424 0.610 10.085 1.00 0.00 ? 58 ALA C N 2 14
ATOM 1886 C CA . ALA C 1 14 ? 1.444 -0.179 11.296 1.00 0.00 ? 58 ALA C CA 2 14
ATOM 1887 C C . ALA C 1 14 ? 1.200 -1.651 11.048 1.00 0.00 ? 58 ALA C C 2 14
ATOM 1888 O O . ALA C 1 14 ? 1.885 -2.498 11.597 1.00 0.00 ? 58 ALA C O 2 14
ATOM 1889 C CB . ALA C 1 14 ? 0.498 0.422 12.301 1.00 0.00 ? 58 ALA C CB 2 14
ATOM 1890 H H . ALA C 1 14 ? 0.549 0.888 9.688 1.00 0.00 ? 58 ALA C H 2 14
ATOM 1891 H HA . ALA C 1 14 ? 2.435 -0.120 11.719 1.00 0.00 ? 58 ALA C HA 2 14
ATOM 1892 H HB1 . ALA C 1 14 ? 0.709 1.355 12.474 1.00 0.00 ? 58 ALA C HB1 2 14
ATOM 1893 H HB2 . ALA C 1 14 ? -0.443 0.429 12.029 1.00 0.00 ? 58 ALA C HB2 2 14
ATOM 1894 H HB3 . ALA C 1 14 ? 0.542 -0.069 13.141 1.00 0.00 ? 58 ALA C HB3 2 14
ATOM 1895 N N . ILE C 1 15 ? 0.277 -1.964 10.143 1.00 0.00 ? 59 ILE C N 2 15
ATOM 1896 C CA . ILE C 1 15 ? -0.054 -3.293 9.680 1.00 0.00 ? 59 ILE C CA 2 15
ATOM 1897 C C . ILE C 1 15 ? 1.087 -3.896 8.884 1.00 0.00 ? 59 ILE C C 2 15
ATOM 1898 O O . ILE C 1 15 ? 1.282 -5.100 8.908 1.00 0.00 ? 59 ILE C O 2 15
ATOM 1899 C CB . ILE C 1 15 ? -1.356 -3.256 8.895 1.00 0.00 ? 59 ILE C CB 2 15
ATOM 1900 C CG1 . ILE C 1 15 ? -2.539 -2.898 9.769 1.00 0.00 ? 59 ILE C CG1 2 15
ATOM 1901 C CG2 . ILE C 1 15 ? -1.625 -4.524 8.106 1.00 0.00 ? 59 ILE C CG2 2 15
ATOM 1902 C CD1 . ILE C 1 15 ? -3.701 -2.220 9.070 1.00 0.00 ? 59 ILE C CD1 2 15
ATOM 1903 H H . ILE C 1 15 ? -0.180 -1.167 9.757 1.00 0.00 ? 59 ILE C H 2 15
ATOM 1904 H HA . ILE C 1 15 ? -0.222 -3.919 10.546 1.00 0.00 ? 59 ILE C HA 2 15
ATOM 1905 H HB . ILE C 1 15 ? -1.234 -2.477 8.158 1.00 0.00 ? 59 ILE C HB 2 15
ATOM 1906 H HG12 . ILE C 1 15 ? -2.894 -3.803 10.263 1.00 0.00 ? 59 ILE C HG12 2 15
ATOM 1907 H HG13 . ILE C 1 15 ? -2.244 -2.184 10.529 1.00 0.00 ? 59 ILE C HG13 2 15
ATOM 1908 H HG21 . ILE C 1 15 ? -0.912 -4.650 7.340 1.00 0.00 ? 59 ILE C HG21 2 15
ATOM 1909 H HG22 . ILE C 1 15 ? -1.611 -5.373 8.738 1.00 0.00 ? 59 ILE C HG22 2 15
ATOM 1910 H HG23 . ILE C 1 15 ? -2.566 -4.458 7.649 1.00 0.00 ? 59 ILE C HG23 2 15
ATOM 1911 H HD11 . ILE C 1 15 ? -3.408 -1.265 8.665 1.00 0.00 ? 59 ILE C HD11 2 15
ATOM 1912 H HD12 . ILE C 1 15 ? -4.077 -2.856 8.299 1.00 0.00 ? 59 ILE C HD12 2 15
ATOM 1913 H HD13 . ILE C 1 15 ? -4.488 -2.055 9.774 1.00 0.00 ? 59 ILE C HD13 2 15
ATOM 1914 N N . ILE C 1 16 ? 1.919 -3.099 8.225 1.00 0.00 ? 60 ILE C N 2 16
ATOM 1915 C CA . ILE C 1 16 ? 3.125 -3.547 7.564 1.00 0.00 ? 60 ILE C CA 2 16
ATOM 1916 C C . ILE C 1 16 ? 4.076 -4.151 8.575 1.00 0.00 ? 60 ILE C C 2 16
ATOM 1917 O O . ILE C 1 16 ? 4.529 -5.277 8.418 1.00 0.00 ? 60 ILE C O 2 16
ATOM 1918 C CB . ILE C 1 16 ? 3.696 -2.422 6.712 1.00 0.00 ? 60 ILE C CB 2 16
ATOM 1919 C CG1 . ILE C 1 16 ? 2.875 -2.395 5.434 1.00 0.00 ? 60 ILE C CG1 2 16
ATOM 1920 C CG2 . ILE C 1 16 ? 5.183 -2.521 6.417 1.00 0.00 ? 60 ILE C CG2 2 16
ATOM 1921 C CD1 . ILE C 1 16 ? 3.279 -1.405 4.360 1.00 0.00 ? 60 ILE C CD1 2 16
ATOM 1922 H H . ILE C 1 16 ? 1.641 -2.143 8.117 1.00 0.00 ? 60 ILE C H 2 16
ATOM 1923 H HA . ILE C 1 16 ? 2.824 -4.382 6.940 1.00 0.00 ? 60 ILE C HA 2 16
ATOM 1924 H HB . ILE C 1 16 ? 3.533 -1.490 7.244 1.00 0.00 ? 60 ILE C HB 2 16
ATOM 1925 H HG12 . ILE C 1 16 ? 2.870 -3.395 4.999 1.00 0.00 ? 60 ILE C HG12 2 16
ATOM 1926 H HG13 . ILE C 1 16 ? 1.868 -2.146 5.753 1.00 0.00 ? 60 ILE C HG13 2 16
ATOM 1927 H HG21 . ILE C 1 16 ? 5.398 -3.421 5.883 1.00 0.00 ? 60 ILE C HG21 2 16
ATOM 1928 H HG22 . ILE C 1 16 ? 5.546 -1.714 5.821 1.00 0.00 ? 60 ILE C HG22 2 16
ATOM 1929 H HG23 . ILE C 1 16 ? 5.727 -2.506 7.343 1.00 0.00 ? 60 ILE C HG23 2 16
ATOM 1930 H HD11 . ILE C 1 16 ? 4.242 -1.728 3.989 1.00 0.00 ? 60 ILE C HD11 2 16
ATOM 1931 H HD12 . ILE C 1 16 ? 2.558 -1.429 3.564 1.00 0.00 ? 60 ILE C HD12 2 16
ATOM 1932 H HD13 . ILE C 1 16 ? 3.382 -0.434 4.815 1.00 0.00 ? 60 ILE C HD13 2 16
ATOM 1933 N N . LYS C 1 17 ? 4.375 -3.399 9.631 1.00 0.00 ? 61 LYS C N 2 17
ATOM 1934 C CA . LYS C 1 17 ? 5.274 -3.764 10.701 1.00 0.00 ? 61 LYS C CA 2 17
ATOM 1935 C C . LYS C 1 17 ? 4.776 -4.977 11.458 1.00 0.00 ? 61 LYS C C 2 17
ATOM 1936 O O . LYS C 1 17 ? 5.537 -5.889 11.754 1.00 0.00 ? 61 LYS C O 2 17
ATOM 1937 C CB . LYS C 1 17 ? 5.562 -2.570 11.592 1.00 0.00 ? 61 LYS C CB 2 17
ATOM 1938 C CG . LYS C 1 17 ? 6.819 -2.769 12.392 1.00 0.00 ? 61 LYS C CG 2 17
ATOM 1939 C CD . LYS C 1 17 ? 7.347 -1.487 12.985 1.00 0.00 ? 61 LYS C CD 2 17
ATOM 1940 C CE . LYS C 1 17 ? 6.554 -0.913 14.067 1.00 0.00 ? 61 LYS C CE 2 17
ATOM 1941 N NZ . LYS C 1 17 ? 7.087 0.278 14.594 1.00 0.00 ? 61 LYS C NZ 2 17
ATOM 1942 H H . LYS C 1 17 ? 3.992 -2.487 9.630 1.00 0.00 ? 61 LYS C H 2 17
ATOM 1943 H HA . LYS C 1 17 ? 6.207 -4.060 10.233 1.00 0.00 ? 61 LYS C HA 2 17
ATOM 1944 H HB2 . LYS C 1 17 ? 5.669 -1.679 10.973 1.00 0.00 ? 61 LYS C HB2 2 17
ATOM 1945 H HB3 . LYS C 1 17 ? 4.733 -2.378 12.247 1.00 0.00 ? 61 LYS C HB3 2 17
ATOM 1946 H HG2 . LYS C 1 17 ? 6.635 -3.494 13.184 1.00 0.00 ? 61 LYS C HG2 2 17
ATOM 1947 H HG3 . LYS C 1 17 ? 7.583 -3.149 11.761 1.00 0.00 ? 61 LYS C HG3 2 17
ATOM 1948 H HD2 . LYS C 1 17 ? 8.348 -1.686 13.370 1.00 0.00 ? 61 LYS C HD2 2 17
ATOM 1949 H HD3 . LYS C 1 17 ? 7.466 -0.786 12.271 1.00 0.00 ? 61 LYS C HD3 2 17
ATOM 1950 H HE2 . LYS C 1 17 ? 5.541 -0.724 13.712 1.00 0.00 ? 61 LYS C HE2 2 17
ATOM 1951 H HE3 . LYS C 1 17 ? 6.504 -1.598 14.783 1.00 0.00 ? 61 LYS C HE3 2 17
ATOM 1952 H HZ1 . LYS C 1 17 ? 7.353 0.563 14.380 1.00 0.00 ? 61 LYS C HZ1 2 17
ATOM 1953 H HZ2 . LYS C 1 17 ? 6.926 0.763 14.899 1.00 0.00 ? 61 LYS C HZ2 2 17
ATOM 1954 H HZ3 . LYS C 1 17 ? 7.408 0.344 14.968 1.00 0.00 ? 61 LYS C HZ3 2 17
ATOM 1955 N N . ALA C 1 18 ? 3.476 -5.030 11.726 1.00 0.00 ? 62 ALA C N 2 18
ATOM 1956 C CA . ALA C 1 18 ? 2.793 -6.132 12.367 1.00 0.00 ? 62 ALA C CA 2 18
ATOM 1957 C C . ALA C 1 18 ? 2.586 -7.332 11.466 1.00 0.00 ? 62 ALA C C 2 18
ATOM 1958 O O . ALA C 1 18 ? 2.518 -8.417 11.910 1.00 0.00 ? 62 ALA C O 2 18
ATOM 1959 C CB . ALA C 1 18 ? 1.482 -5.612 12.934 1.00 0.00 ? 62 ALA C CB 2 18
ATOM 1960 H H . ALA C 1 18 ? 2.947 -4.257 11.360 1.00 0.00 ? 62 ALA C H 2 18
ATOM 1961 H HA . ALA C 1 18 ? 3.390 -6.432 13.220 1.00 0.00 ? 62 ALA C HA 2 18
ATOM 1962 H HB1 . ALA C 1 18 ? 1.666 -4.790 13.602 1.00 0.00 ? 62 ALA C HB1 2 18
ATOM 1963 H HB2 . ALA C 1 18 ? 0.860 -5.299 12.120 1.00 0.00 ? 62 ALA C HB2 2 18
ATOM 1964 H HB3 . ALA C 1 18 ? 0.967 -6.385 13.479 1.00 0.00 ? 62 ALA C HB3 2 18
ATOM 1965 N N . GLY C 1 19 ? 2.579 -7.151 10.179 1.00 0.00 ? 63 GLY C N 2 19
ATOM 1966 C CA . GLY C 1 19 ? 2.593 -8.128 9.117 1.00 0.00 ? 63 GLY C CA 2 19
ATOM 1967 C C . GLY C 1 19 ? 3.950 -8.775 8.932 1.00 0.00 ? 63 GLY C C 2 19
ATOM 1968 O O . GLY C 1 19 ? 4.002 -9.935 8.660 1.00 0.00 ? 63 GLY C O 2 19
ATOM 1969 H H . GLY C 1 19 ? 2.578 -6.204 9.913 1.00 0.00 ? 63 GLY C H 2 19
ATOM 1970 H HA2 . GLY C 1 19 ? 1.861 -8.891 9.342 1.00 0.00 ? 63 GLY C HA2 2 19
ATOM 1971 H HA3 . GLY C 1 19 ? 2.320 -7.668 8.170 1.00 0.00 ? 63 GLY C HA3 2 19
ATOM 1972 N N . GLY C 1 20 ? 5.039 -8.070 9.150 1.00 0.00 ? 64 GLY C N 2 20
ATOM 1973 C CA . GLY C 1 20 ? 6.372 -8.617 9.053 1.00 0.00 ? 64 GLY C CA 2 20
ATOM 1974 C C . GLY C 1 20 ? 6.940 -8.557 7.650 1.00 0.00 ? 64 GLY C C 2 20
ATOM 1975 O O . GLY C 1 20 ? 7.809 -9.321 7.282 1.00 0.00 ? 64 GLY C O 2 20
ATOM 1976 H H . GLY C 1 20 ? 4.951 -7.119 9.377 1.00 0.00 ? 64 GLY C H 2 20
ATOM 1977 H HA2 . GLY C 1 20 ? 7.005 -8.027 9.691 1.00 0.00 ? 64 GLY C HA2 2 20
ATOM 1978 H HA3 . GLY C 1 20 ? 6.371 -9.645 9.376 1.00 0.00 ? 64 GLY C HA3 2 20
ATOM 1979 N N . TYR C 1 21 ? 6.472 -7.623 6.831 1.00 0.00 ? 65 TYR C N 2 21
ATOM 1980 C CA . TYR C 1 21 ? 6.920 -7.379 5.485 1.00 0.00 ? 65 TYR C CA 2 21
ATOM 1981 C C . TYR C 1 21 ? 8.381 -7.042 5.313 1.00 0.00 ? 65 TYR C C 2 21
ATOM 1982 O O . TYR C 1 21 ? 8.925 -7.145 4.263 1.00 0.00 ? 65 TYR C O 2 21
ATOM 1983 C CB . TYR C 1 21 ? 6.034 -6.268 4.949 1.00 0.00 ? 65 TYR C CB 2 21
ATOM 1984 C CG . TYR C 1 21 ? 4.724 -6.637 4.309 1.00 0.00 ? 65 TYR C CG 2 21
ATOM 1985 C CD1 . TYR C 1 21 ? 4.616 -7.471 3.206 1.00 0.00 ? 65 TYR C CD1 2 21
ATOM 1986 C CD2 . TYR C 1 21 ? 3.601 -5.962 4.752 1.00 0.00 ? 65 TYR C CD2 2 21
ATOM 1987 C CE1 . TYR C 1 21 ? 3.391 -7.604 2.545 1.00 0.00 ? 65 TYR C CE1 2 21
ATOM 1988 C CE2 . TYR C 1 21 ? 2.383 -6.060 4.075 1.00 0.00 ? 65 TYR C CE2 2 21
ATOM 1989 C CZ . TYR C 1 21 ? 2.278 -6.858 2.933 1.00 0.00 ? 65 TYR C CZ 2 21
ATOM 1990 O OH . TYR C 1 21 ? 1.087 -6.940 2.279 1.00 0.00 ? 65 TYR C OH 2 21
ATOM 1991 H H . TYR C 1 21 ? 5.811 -6.967 7.196 1.00 0.00 ? 65 TYR C H 2 21
ATOM 1992 H HA . TYR C 1 21 ? 6.735 -8.273 4.908 1.00 0.00 ? 65 TYR C HA 2 21
ATOM 1993 H HB2 . TYR C 1 21 ? 5.812 -5.602 5.783 1.00 0.00 ? 65 TYR C HB2 2 21
ATOM 1994 H HB3 . TYR C 1 21 ? 6.587 -5.681 4.241 1.00 0.00 ? 65 TYR C HB3 2 21
ATOM 1995 H HD1 . TYR C 1 21 ? 5.453 -8.021 2.851 1.00 0.00 ? 65 TYR C HD1 2 21
ATOM 1996 H HD2 . TYR C 1 21 ? 3.726 -5.286 5.565 1.00 0.00 ? 65 TYR C HD2 2 21
ATOM 1997 H HE1 . TYR C 1 21 ? 3.307 -8.268 1.718 1.00 0.00 ? 65 TYR C HE1 2 21
ATOM 1998 H HE2 . TYR C 1 21 ? 1.543 -5.482 4.409 1.00 0.00 ? 65 TYR C HE2 2 21
ATOM 1999 H HH . TYR C 1 21 ? 0.461 -7.346 2.871 1.00 0.00 ? 65 TYR C HH 2 21
HETATM 2000 N N . NH2 C 1 22 ? 9.054 -6.595 6.329 1.00 0.00 ? 66 NH2 C N 2 22
HETATM 2001 H HN1 . NH2 C 1 22 ? 10.004 -6.401 6.217 1.00 0.00 ? 66 NH2 C HN1 2 22
HETATM 2002 H HN2 . NH2 C 1 22 ? 8.624 -6.491 7.202 1.00 0.00 ? 66 NH2 C HN2 2 22
HETATM 2003 C C . ACE D 1 1 ? 4.457 -11.924 4.141 1.00 0.00 ? 67 ACE D C 2 1
HETATM 2004 O O . ACE D 1 1 ? 3.842 -11.356 3.314 1.00 0.00 ? 67 ACE D O 2 1
HETATM 2005 C CH3 . ACE D 1 1 ? 5.437 -11.177 4.951 1.00 0.00 ? 67 ACE D CH3 2 1
HETATM 2006 H H1 . ACE D 1 1 ? 5.633 -11.063 5.191 1.00 0.00 ? 67 ACE D H1 2 1
HETATM 2007 H H2 . ACE D 1 1 ? 5.727 -11.004 5.018 1.00 0.00 ? 67 ACE D H2 2 1
HETATM 2008 H H3 . ACE D 1 1 ? 5.614 -10.897 5.135 1.00 0.00 ? 67 ACE D H3 2 1
ATOM 2009 N N . ALA D 1 2 ? 4.284 -13.176 4.388 1.00 0.00 ? 68 ALA D N 2 2
ATOM 2010 C CA . ALA D 1 2 ? 3.445 -14.063 3.644 1.00 0.00 ? 68 ALA D CA 2 2
ATOM 2011 C C . ALA D 1 2 ? 1.970 -13.846 3.834 1.00 0.00 ? 68 ALA D C 2 2
ATOM 2012 O O . ALA D 1 2 ? 1.235 -13.824 2.886 1.00 0.00 ? 68 ALA D O 2 2
ATOM 2013 C CB . ALA D 1 2 ? 3.809 -15.455 4.023 1.00 0.00 ? 68 ALA D CB 2 2
ATOM 2014 H H . ALA D 1 2 ? 4.862 -13.513 5.099 1.00 0.00 ? 68 ALA D H 2 2
ATOM 2015 H HA . ALA D 1 2 ? 3.661 -13.984 2.600 1.00 0.00 ? 68 ALA D HA 2 2
ATOM 2016 H HB1 . ALA D 1 2 ? 3.498 -15.647 5.013 1.00 0.00 ? 68 ALA D HB1 2 2
ATOM 2017 H HB2 . ALA D 1 2 ? 3.301 -16.125 3.388 1.00 0.00 ? 68 ALA D HB2 2 2
ATOM 2018 H HB3 . ALA D 1 2 ? 4.852 -15.641 3.931 1.00 0.00 ? 68 ALA D HB3 2 2
ATOM 2019 N N . LYS D 1 3 ? 1.542 -13.724 5.067 1.00 0.00 ? 69 LYS D N 2 3
ATOM 2020 C CA . LYS D 1 3 ? 0.206 -13.509 5.547 1.00 0.00 ? 69 LYS D CA 2 3
ATOM 2021 C C . LYS D 1 3 ? -0.242 -12.081 5.396 1.00 0.00 ? 69 LYS D C 2 3
ATOM 2022 O O . LYS D 1 3 ? -1.314 -11.800 4.894 1.00 0.00 ? 69 LYS D O 2 3
ATOM 2023 C CB . LYS D 1 3 ? 0.168 -13.856 7.015 1.00 0.00 ? 69 LYS D CB 2 3
ATOM 2024 C CG . LYS D 1 3 ? -1.195 -13.883 7.646 1.00 0.00 ? 69 LYS D CG 2 3
ATOM 2025 C CD . LYS D 1 3 ? -1.196 -14.251 9.083 1.00 0.00 ? 69 LYS D CD 2 3
ATOM 2026 C CE . LYS D 1 3 ? -2.531 -14.251 9.696 1.00 0.00 ? 69 LYS D CE 2 3
ATOM 2027 N NZ . LYS D 1 3 ? -2.546 -14.638 11.033 1.00 0.00 ? 69 LYS D NZ 2 3
ATOM 2028 H H . LYS D 1 3 ? 2.247 -13.739 5.745 1.00 0.00 ? 69 LYS D H 2 3
ATOM 2029 H HA . LYS D 1 3 ? -0.505 -14.111 5.006 1.00 0.00 ? 69 LYS D HA 2 3
ATOM 2030 H HB2 . LYS D 1 3 ? 0.630 -14.833 7.155 1.00 0.00 ? 69 LYS D HB2 2 3
ATOM 2031 H HB3 . LYS D 1 3 ? 0.786 -13.141 7.510 1.00 0.00 ? 69 LYS D HB3 2 3
ATOM 2032 H HG2 . LYS D 1 3 ? -1.664 -12.906 7.526 1.00 0.00 ? 69 LYS D HG2 2 3
ATOM 2033 H HG3 . LYS D 1 3 ? -1.778 -14.588 7.137 1.00 0.00 ? 69 LYS D HG3 2 3
ATOM 2034 H HD2 . LYS D 1 3 ? -0.754 -15.241 9.196 1.00 0.00 ? 69 LYS D HD2 2 3
ATOM 2035 H HD3 . LYS D 1 3 ? -0.607 -13.602 9.589 1.00 0.00 ? 69 LYS D HD3 2 3
ATOM 2036 H HE2 . LYS D 1 3 ? -2.968 -13.257 9.608 1.00 0.00 ? 69 LYS D HE2 2 3
ATOM 2037 H HE3 . LYS D 1 3 ? -3.083 -14.869 9.181 1.00 0.00 ? 69 LYS D HE3 2 3
ATOM 2038 H HZ1 . LYS D 1 3 ? -2.142 -14.762 11.228 1.00 0.00 ? 69 LYS D HZ1 2 3
ATOM 2039 H HZ2 . LYS D 1 3 ? -2.688 -14.420 11.510 1.00 0.00 ? 69 LYS D HZ2 2 3
ATOM 2040 H HZ3 . LYS D 1 3 ? -2.790 -15.034 11.358 1.00 0.00 ? 69 LYS D HZ3 2 3
ATOM 2041 N N . ALA D 1 4 ? 0.685 -11.199 5.742 1.00 0.00 ? 70 ALA D N 2 4
ATOM 2042 C CA . ALA D 1 4 ? 0.629 -9.783 5.481 1.00 0.00 ? 70 ALA D CA 2 4
ATOM 2043 C C . ALA D 1 4 ? 0.228 -9.505 4.045 1.00 0.00 ? 70 ALA D C 2 4
ATOM 2044 O O . ALA D 1 4 ? -0.514 -8.577 3.758 1.00 0.00 ? 70 ALA D O 2 4
ATOM 2045 C CB . ALA D 1 4 ? 1.999 -9.214 5.777 1.00 0.00 ? 70 ALA D CB 2 4
ATOM 2046 H H . ALA D 1 4 ? 1.492 -11.563 6.198 1.00 0.00 ? 70 ALA D H 2 4
ATOM 2047 H HA . ALA D 1 4 ? -0.090 -9.335 6.144 1.00 0.00 ? 70 ALA D HA 2 4
ATOM 2048 H HB1 . ALA D 1 4 ? 2.060 -8.272 5.734 1.00 0.00 ? 70 ALA D HB1 2 4
ATOM 2049 H HB2 . ALA D 1 4 ? 2.303 -9.430 6.633 1.00 0.00 ? 70 ALA D HB2 2 4
ATOM 2050 H HB3 . ALA D 1 4 ? 2.707 -9.543 5.246 1.00 0.00 ? 70 ALA D HB3 2 4
ATOM 2051 N N . ALA D 1 5 ? 0.657 -10.362 3.123 1.00 0.00 ? 71 ALA D N 2 5
ATOM 2052 C CA . ALA D 1 5 ? 0.488 -10.229 1.695 1.00 0.00 ? 71 ALA D CA 2 5
ATOM 2053 C C . ALA D 1 5 ? -0.848 -10.715 1.171 1.00 0.00 ? 71 ALA D C 2 5
ATOM 2054 O O . ALA D 1 5 ? -1.099 -10.628 -0.024 1.00 0.00 ? 71 ALA D O 2 5
ATOM 2055 C CB . ALA D 1 5 ? 1.688 -10.852 1.004 1.00 0.00 ? 71 ALA D CB 2 5
ATOM 2056 H H . ALA D 1 5 ? 1.089 -11.162 3.541 1.00 0.00 ? 71 ALA D H 2 5
ATOM 2057 H HA . ALA D 1 5 ? 0.500 -9.166 1.489 1.00 0.00 ? 71 ALA D HA 2 5
ATOM 2058 H HB1 . ALA D 1 5 ? 1.596 -10.754 -0.046 1.00 0.00 ? 71 ALA D HB1 2 5
ATOM 2059 H HB2 . ALA D 1 5 ? 2.584 -10.340 1.302 1.00 0.00 ? 71 ALA D HB2 2 5
ATOM 2060 H HB3 . ALA D 1 5 ? 1.786 -11.892 1.235 1.00 0.00 ? 71 ALA D HB3 2 5
ATOM 2061 N N . ALA D 1 6 ? -1.758 -11.097 2.054 1.00 0.00 ? 72 ALA D N 2 6
ATOM 2062 C CA . ALA D 1 6 ? -3.177 -10.969 1.817 1.00 0.00 ? 72 ALA D CA 2 6
ATOM 2063 C C . ALA D 1 6 ? -3.803 -9.904 2.697 1.00 0.00 ? 72 ALA D C 2 6
ATOM 2064 O O . ALA D 1 6 ? -4.375 -8.960 2.168 1.00 0.00 ? 72 ALA D O 2 6
ATOM 2065 C CB . ALA D 1 6 ? -3.857 -12.320 1.946 1.00 0.00 ? 72 ALA D CB 2 6
ATOM 2066 H H . ALA D 1 6 ? -1.500 -11.198 3.011 1.00 0.00 ? 72 ALA D H 2 6
ATOM 2067 H HA . ALA D 1 6 ? -3.334 -10.625 0.803 1.00 0.00 ? 72 ALA D HA 2 6
ATOM 2068 H HB1 . ALA D 1 6 ? -4.923 -12.234 1.785 1.00 0.00 ? 72 ALA D HB1 2 6
ATOM 2069 H HB2 . ALA D 1 6 ? -3.425 -12.986 1.222 1.00 0.00 ? 72 ALA D HB2 2 6
ATOM 2070 H HB3 . ALA D 1 6 ? -3.682 -12.736 2.927 1.00 0.00 ? 72 ALA D HB3 2 6
ATOM 2071 N N . ALA D 1 7 ? -3.671 -10.010 4.016 1.00 0.00 ? 73 ALA D N 2 7
ATOM 2072 C CA . ALA D 1 7 ? -4.332 -9.230 5.029 1.00 0.00 ? 73 ALA D CA 2 7
ATOM 2073 C C . ALA D 1 7 ? -4.208 -7.731 4.830 1.00 0.00 ? 73 ALA D C 2 7
ATOM 2074 O O . ALA D 1 7 ? -5.180 -7.014 5.018 1.00 0.00 ? 73 ALA D O 2 7
ATOM 2075 C CB . ALA D 1 7 ? -3.801 -9.660 6.381 1.00 0.00 ? 73 ALA D CB 2 7
ATOM 2076 H H . ALA D 1 7 ? -3.116 -10.782 4.329 1.00 0.00 ? 73 ALA D H 2 7
ATOM 2077 H HA . ALA D 1 7 ? -5.387 -9.445 4.992 1.00 0.00 ? 73 ALA D HA 2 7
ATOM 2078 H HB1 . ALA D 1 7 ? -4.000 -10.706 6.531 1.00 0.00 ? 73 ALA D HB1 2 7
ATOM 2079 H HB2 . ALA D 1 7 ? -2.738 -9.495 6.467 1.00 0.00 ? 73 ALA D HB2 2 7
ATOM 2080 H HB3 . ALA D 1 7 ? -4.328 -9.073 7.114 1.00 0.00 ? 73 ALA D HB3 2 7
ATOM 2081 N N . ALA D 1 8 ? -3.047 -7.233 4.428 1.00 0.00 ? 74 ALA D N 2 8
ATOM 2082 C CA . ALA D 1 8 ? -2.824 -5.819 4.249 1.00 0.00 ? 74 ALA D CA 2 8
ATOM 2083 C C . ALA D 1 8 ? -3.279 -5.315 2.893 1.00 0.00 ? 74 ALA D C 2 8
ATOM 2084 O O . ALA D 1 8 ? -3.842 -4.248 2.725 1.00 0.00 ? 74 ALA D O 2 8
ATOM 2085 C CB . ALA D 1 8 ? -1.356 -5.527 4.476 1.00 0.00 ? 74 ALA D CB 2 8
ATOM 2086 H H . ALA D 1 8 ? -2.331 -7.888 4.172 1.00 0.00 ? 74 ALA D H 2 8
ATOM 2087 H HA . ALA D 1 8 ? -3.408 -5.306 5.003 1.00 0.00 ? 74 ALA D HA 2 8
ATOM 2088 H HB1 . ALA D 1 8 ? -0.786 -5.829 3.618 1.00 0.00 ? 74 ALA D HB1 2 8
ATOM 2089 H HB2 . ALA D 1 8 ? -1.206 -4.473 4.626 1.00 0.00 ? 74 ALA D HB2 2 8
ATOM 2090 H HB3 . ALA D 1 8 ? -0.996 -6.028 5.343 1.00 0.00 ? 74 ALA D HB3 2 8
ATOM 2091 N N . ILE D 1 9 ? -3.078 -6.160 1.885 1.00 0.00 ? 75 ILE D N 2 9
ATOM 2092 C CA . ILE D 1 9 ? -3.515 -5.908 0.530 1.00 0.00 ? 75 ILE D CA 2 9
ATOM 2093 C C . ILE D 1 9 ? -5.028 -5.886 0.437 1.00 0.00 ? 75 ILE D C 2 9
ATOM 2094 O O . ILE D 1 9 ? -5.614 -5.028 -0.205 1.00 0.00 ? 75 ILE D O 2 9
ATOM 2095 C CB . ILE D 1 9 ? -2.988 -6.993 -0.398 1.00 0.00 ? 75 ILE D CB 2 9
ATOM 2096 C CG1 . ILE D 1 9 ? -1.479 -7.182 -0.331 1.00 0.00 ? 75 ILE D CG1 2 9
ATOM 2097 C CG2 . ILE D 1 9 ? -3.449 -6.734 -1.818 1.00 0.00 ? 75 ILE D CG2 2 9
ATOM 2098 C CD1 . ILE D 1 9 ? -0.679 -5.928 -0.562 1.00 0.00 ? 75 ILE D CD1 2 9
ATOM 2099 H H . ILE D 1 9 ? -2.663 -7.044 2.104 1.00 0.00 ? 75 ILE D H 2 9
ATOM 2100 H HA . ILE D 1 9 ? -3.138 -4.945 0.203 1.00 0.00 ? 75 ILE D HA 2 9
ATOM 2101 H HB . ILE D 1 9 ? -3.478 -7.915 -0.103 1.00 0.00 ? 75 ILE D HB 2 9
ATOM 2102 H HG12 . ILE D 1 9 ? -1.224 -7.581 0.651 1.00 0.00 ? 75 ILE D HG12 2 9
ATOM 2103 H HG13 . ILE D 1 9 ? -1.171 -7.919 -1.052 1.00 0.00 ? 75 ILE D HG13 2 9
ATOM 2104 H HG21 . ILE D 1 9 ? -4.372 -6.855 -1.875 1.00 0.00 ? 75 ILE D HG21 2 9
ATOM 2105 H HG22 . ILE D 1 9 ? -3.285 -5.895 -2.127 1.00 0.00 ? 75 ILE D HG22 2 9
ATOM 2106 H HG23 . ILE D 1 9 ? -3.086 -7.355 -2.401 1.00 0.00 ? 75 ILE D HG23 2 9
ATOM 2107 H HD11 . ILE D 1 9 ? 0.153 -5.964 -0.483 1.00 0.00 ? 75 ILE D HD11 2 9
ATOM 2108 H HD12 . ILE D 1 9 ? -0.729 -5.580 -1.281 1.00 0.00 ? 75 ILE D HD12 2 9
ATOM 2109 H HD13 . ILE D 1 9 ? -0.872 -5.305 -0.075 1.00 0.00 ? 75 ILE D HD13 2 9
ATOM 2110 N N . LYS D 1 10 ? -5.688 -6.828 1.107 1.00 0.00 ? 76 LYS D N 2 10
ATOM 2111 C CA . LYS D 1 10 ? -7.124 -6.982 1.101 1.00 0.00 ? 76 LYS D CA 2 10
ATOM 2112 C C . LYS D 1 10 ? -7.827 -5.763 1.676 1.00 0.00 ? 76 LYS D C 2 10
ATOM 2113 O O . LYS D 1 10 ? -8.879 -5.379 1.178 1.00 0.00 ? 76 LYS D O 2 10
ATOM 2114 C CB . LYS D 1 10 ? -7.477 -8.227 1.894 1.00 0.00 ? 76 LYS D CB 2 10
ATOM 2115 C CG . LYS D 1 10 ? -7.439 -9.468 1.019 1.00 0.00 ? 76 LYS D CG 2 10
ATOM 2116 C CD . LYS D 1 10 ? -7.647 -10.735 1.812 1.00 0.00 ? 76 LYS D CD 2 10
ATOM 2117 C CE . LYS D 1 10 ? -9.002 -10.785 2.448 1.00 0.00 ? 76 LYS D CE 2 10
ATOM 2118 N NZ . LYS D 1 10 ? -9.189 -12.009 3.175 1.00 0.00 ? 76 LYS D NZ 2 10
ATOM 2119 H H . LYS D 1 10 ? -5.116 -7.508 1.575 1.00 0.00 ? 76 LYS D H 2 10
ATOM 2120 H HA . LYS D 1 10 ? -7.442 -7.037 0.065 1.00 0.00 ? 76 LYS D HA 2 10
ATOM 2121 H HB2 . LYS D 1 10 ? -6.788 -8.344 2.731 1.00 0.00 ? 76 LYS D HB2 2 10
ATOM 2122 H HB3 . LYS D 1 10 ? -8.473 -8.105 2.301 1.00 0.00 ? 76 LYS D HB3 2 10
ATOM 2123 H HG2 . LYS D 1 10 ? -8.207 -9.390 0.250 1.00 0.00 ? 76 LYS D HG2 2 10
ATOM 2124 H HG3 . LYS D 1 10 ? -6.486 -9.527 0.511 1.00 0.00 ? 76 LYS D HG3 2 10
ATOM 2125 H HD2 . LYS D 1 10 ? -7.528 -11.594 1.150 1.00 0.00 ? 76 LYS D HD2 2 10
ATOM 2126 H HD3 . LYS D 1 10 ? -6.898 -10.830 2.568 1.00 0.00 ? 76 LYS D HD3 2 10
ATOM 2127 H HE2 . LYS D 1 10 ? -9.123 -9.937 3.122 1.00 0.00 ? 76 LYS D HE2 2 10
ATOM 2128 H HE3 . LYS D 1 10 ? -9.738 -10.691 1.693 1.00 0.00 ? 76 LYS D HE3 2 10
ATOM 2129 H HZ1 . LYS D 1 10 ? -8.453 -12.186 3.769 1.00 0.00 ? 76 LYS D HZ1 2 10
ATOM 2130 H HZ2 . LYS D 1 10 ? -10.002 -11.998 3.713 1.00 0.00 ? 76 LYS D HZ2 2 10
ATOM 2131 H HZ3 . LYS D 1 10 ? -9.217 -12.773 2.562 1.00 0.00 ? 76 LYS D HZ3 2 10
ATOM 2132 N N . ALA D 1 11 ? -7.221 -5.124 2.672 1.00 0.00 ? 77 ALA D N 2 11
ATOM 2133 C CA . ALA D 1 11 ? -7.574 -3.799 3.126 1.00 0.00 ? 77 ALA D CA 2 11
ATOM 2134 C C . ALA D 1 11 ? -7.389 -2.812 1.987 1.00 0.00 ? 77 ALA D C 2 11
ATOM 2135 O O . ALA D 1 11 ? -8.356 -2.214 1.530 1.00 0.00 ? 77 ALA D O 2 11
ATOM 2136 C CB . ALA D 1 11 ? -6.771 -3.475 4.371 1.00 0.00 ? 77 ALA D CB 2 11
ATOM 2137 H H . ALA D 1 11 ? -6.464 -5.597 3.121 1.00 0.00 ? 77 ALA D H 2 11
ATOM 2138 H HA . ALA D 1 11 ? -8.630 -3.781 3.344 1.00 0.00 ? 77 ALA D HA 2 11
ATOM 2139 H HB1 . ALA D 1 11 ? -6.918 -3.718 5.020 1.00 0.00 ? 77 ALA D HB1 2 11
ATOM 2140 H HB2 . ALA D 1 11 ? -6.755 -2.858 4.580 1.00 0.00 ? 77 ALA D HB2 2 11
ATOM 2141 H HB3 . ALA D 1 11 ? -6.119 -3.585 4.427 1.00 0.00 ? 77 ALA D HB3 2 11
ATOM 2142 N N . ILE D 1 12 ? -6.182 -2.661 1.448 1.00 0.00 ? 78 ILE D N 2 12
ATOM 2143 C CA . ILE D 1 12 ? -5.825 -1.618 0.512 1.00 0.00 ? 78 ILE D CA 2 12
ATOM 2144 C C . ILE D 1 12 ? -6.629 -1.716 -0.770 1.00 0.00 ? 78 ILE D C 2 12
ATOM 2145 O O . ILE D 1 12 ? -7.244 -0.734 -1.164 1.00 0.00 ? 78 ILE D O 2 12
ATOM 2146 C CB . ILE D 1 12 ? -4.321 -1.449 0.373 1.00 0.00 ? 78 ILE D CB 2 12
ATOM 2147 C CG1 . ILE D 1 12 ? -4.033 0.043 0.368 1.00 0.00 ? 78 ILE D CG1 2 12
ATOM 2148 C CG2 . ILE D 1 12 ? -3.753 -2.133 -0.861 1.00 0.00 ? 78 ILE D CG2 2 12
ATOM 2149 C CD1 . ILE D 1 12 ? -2.594 0.442 0.270 1.00 0.00 ? 78 ILE D CD1 2 12
ATOM 2150 H H . ILE D 1 12 ? -5.489 -3.357 1.653 1.00 0.00 ? 78 ILE D H 2 12
ATOM 2151 H HA . ILE D 1 12 ? -6.252 -0.721 0.952 1.00 0.00 ? 78 ILE D HA 2 12
ATOM 2152 H HB . ILE D 1 12 ? -3.848 -1.881 1.247 1.00 0.00 ? 78 ILE D HB 2 12
ATOM 2153 H HG12 . ILE D 1 12 ? -4.582 0.511 -0.449 1.00 0.00 ? 78 ILE D HG12 2 12
ATOM 2154 H HG13 . ILE D 1 12 ? -4.420 0.403 1.295 1.00 0.00 ? 78 ILE D HG13 2 12
ATOM 2155 H HG21 . ILE D 1 12 ? -4.029 -1.624 -1.758 1.00 0.00 ? 78 ILE D HG21 2 12
ATOM 2156 H HG22 . ILE D 1 12 ? -2.690 -2.191 -0.807 1.00 0.00 ? 78 ILE D HG22 2 12
ATOM 2157 H HG23 . ILE D 1 12 ? -4.126 -3.130 -0.921 1.00 0.00 ? 78 ILE D HG23 2 12
ATOM 2158 H HD11 . ILE D 1 12 ? -2.020 -0.032 0.108 1.00 0.00 ? 78 ILE D HD11 2 12
ATOM 2159 H HD12 . ILE D 1 12 ? -2.354 0.697 0.863 1.00 0.00 ? 78 ILE D HD12 2 12
ATOM 2160 H HD13 . ILE D 1 12 ? -2.362 0.958 -0.189 1.00 0.00 ? 78 ILE D HD13 2 12
ATOM 2161 N N . ALA D 1 13 ? -6.781 -2.897 -1.361 1.00 0.00 ? 79 ALA D N 2 13
ATOM 2162 C CA . ALA D 1 13 ? -7.483 -3.000 -2.621 1.00 0.00 ? 79 ALA D CA 2 13
ATOM 2163 C C . ALA D 1 13 ? -8.972 -2.745 -2.534 1.00 0.00 ? 79 ALA D C 2 13
ATOM 2164 O O . ALA D 1 13 ? -9.600 -2.517 -3.542 1.00 0.00 ? 79 ALA D O 2 13
ATOM 2165 C CB . ALA D 1 13 ? -7.168 -4.353 -3.227 1.00 0.00 ? 79 ALA D CB 2 13
ATOM 2166 H H . ALA D 1 13 ? -6.369 -3.664 -0.866 1.00 0.00 ? 79 ALA D H 2 13
ATOM 2167 H HA . ALA D 1 13 ? -7.084 -2.219 -3.254 1.00 0.00 ? 79 ALA D HA 2 13
ATOM 2168 H HB1 . ALA D 1 13 ? -7.498 -5.119 -2.575 1.00 0.00 ? 79 ALA D HB1 2 13
ATOM 2169 H HB2 . ALA D 1 13 ? -7.660 -4.431 -4.164 1.00 0.00 ? 79 ALA D HB2 2 13
ATOM 2170 H HB3 . ALA D 1 13 ? -6.127 -4.446 -3.420 1.00 0.00 ? 79 ALA D HB3 2 13
ATOM 2171 N N . ALA D 1 14 ? -9.555 -2.791 -1.348 1.00 0.00 ? 80 ALA D N 2 14
ATOM 2172 C CA . ALA D 1 14 ? -10.914 -2.395 -1.076 1.00 0.00 ? 80 ALA D CA 2 14
ATOM 2173 C C . ALA D 1 14 ? -10.992 -0.913 -0.781 1.00 0.00 ? 80 ALA D C 2 14
ATOM 2174 O O . ALA D 1 14 ? -11.819 -0.208 -1.288 1.00 0.00 ? 80 ALA D O 2 14
ATOM 2175 C CB . ALA D 1 14 ? -11.468 -3.242 0.050 1.00 0.00 ? 80 ALA D CB 2 14
ATOM 2176 H H . ALA D 1 14 ? -8.924 -2.930 -0.583 1.00 0.00 ? 80 ALA D H 2 14
ATOM 2177 H HA . ALA D 1 14 ? -11.516 -2.550 -1.962 1.00 0.00 ? 80 ALA D HA 2 14
ATOM 2178 H HB1 . ALA D 1 14 ? -12.467 -2.969 0.272 1.00 0.00 ? 80 ALA D HB1 2 14
ATOM 2179 H HB2 . ALA D 1 14 ? -11.429 -4.269 -0.203 1.00 0.00 ? 80 ALA D HB2 2 14
ATOM 2180 H HB3 . ALA D 1 14 ? -10.899 -3.096 0.930 1.00 0.00 ? 80 ALA D HB3 2 14
ATOM 2181 N N . ILE D 1 15 ? -10.068 -0.415 0.025 1.00 0.00 ? 81 ILE D N 2 15
ATOM 2182 C CA . ILE D 1 15 ? -9.925 0.964 0.432 1.00 0.00 ? 81 ILE D CA 2 15
ATOM 2183 C C . ILE D 1 15 ? -9.600 1.852 -0.756 1.00 0.00 ? 81 ILE D C 2 15
ATOM 2184 O O . ILE D 1 15 ? -10.088 2.972 -0.822 1.00 0.00 ? 81 ILE D O 2 15
ATOM 2185 C CB . ILE D 1 15 ? -8.913 1.057 1.559 1.00 0.00 ? 81 ILE D CB 2 15
ATOM 2186 C CG1 . ILE D 1 15 ? -9.456 0.458 2.845 1.00 0.00 ? 81 ILE D CG1 2 15
ATOM 2187 C CG2 . ILE D 1 15 ? -8.534 2.505 1.836 1.00 0.00 ? 81 ILE D CG2 2 15
ATOM 2188 C CD1 . ILE D 1 15 ? -8.406 0.092 3.874 1.00 0.00 ? 81 ILE D CD1 2 15
ATOM 2189 H H . ILE D 1 15 ? -9.354 -1.047 0.323 1.00 0.00 ? 81 ILE D H 2 15
ATOM 2190 H HA . ILE D 1 15 ? -10.878 1.302 0.826 1.00 0.00 ? 81 ILE D HA 2 15
ATOM 2191 H HB . ILE D 1 15 ? -8.015 0.534 1.260 1.00 0.00 ? 81 ILE D HB 2 15
ATOM 2192 H HG12 . ILE D 1 15 ? -10.159 1.164 3.287 1.00 0.00 ? 81 ILE D HG12 2 15
ATOM 2193 H HG13 . ILE D 1 15 ? -9.998 -0.451 2.636 1.00 0.00 ? 81 ILE D HG13 2 15
ATOM 2194 H HG21 . ILE D 1 15 ? -7.943 2.617 2.722 1.00 0.00 ? 81 ILE D HG21 2 15
ATOM 2195 H HG22 . ILE D 1 15 ? -7.988 2.933 1.012 1.00 0.00 ? 81 ILE D HG22 2 15
ATOM 2196 H HG23 . ILE D 1 15 ? -9.416 3.099 1.956 1.00 0.00 ? 81 ILE D HG23 2 15
ATOM 2197 H HD11 . ILE D 1 15 ? -8.197 0.473 4.320 1.00 0.00 ? 81 ILE D HD11 2 15
ATOM 2198 H HD12 . ILE D 1 15 ? -8.461 -0.360 4.262 1.00 0.00 ? 81 ILE D HD12 2 15
ATOM 2199 H HD13 . ILE D 1 15 ? -7.756 -0.068 3.816 1.00 0.00 ? 81 ILE D HD13 2 15
ATOM 2200 N N . ILE D 1 16 ? -8.850 1.381 -1.750 1.00 0.00 ? 82 ILE D N 2 16
ATOM 2201 C CA . ILE D 1 16 ? -8.517 2.097 -2.958 1.00 0.00 ? 82 ILE D CA 2 16
ATOM 2202 C C . ILE D 1 16 ? -9.767 2.426 -3.751 1.00 0.00 ? 82 ILE D C 2 16
ATOM 2203 O O . ILE D 1 16 ? -9.967 3.571 -4.130 1.00 0.00 ? 82 ILE D O 2 16
ATOM 2204 C CB . ILE D 1 16 ? -7.508 1.307 -3.774 1.00 0.00 ? 82 ILE D CB 2 16
ATOM 2205 C CG1 . ILE D 1 16 ? -6.142 1.379 -3.106 1.00 0.00 ? 82 ILE D CG1 2 16
ATOM 2206 C CG2 . ILE D 1 16 ? -7.365 1.798 -5.205 1.00 0.00 ? 82 ILE D CG2 2 16
ATOM 2207 C CD1 . ILE D 1 16 ? -5.069 0.493 -3.689 1.00 0.00 ? 82 ILE D CD1 2 16
ATOM 2208 H H . ILE D 1 16 ? -8.438 0.479 -1.622 1.00 0.00 ? 82 ILE D H 2 16
ATOM 2209 H HA . ILE D 1 16 ? -8.073 3.055 -2.702 1.00 0.00 ? 82 ILE D HA 2 16
ATOM 2210 H HB . ILE D 1 16 ? -7.878 0.286 -3.779 1.00 0.00 ? 82 ILE D HB 2 16
ATOM 2211 H HG12 . ILE D 1 16 ? -5.798 2.413 -3.145 1.00 0.00 ? 82 ILE D HG12 2 16
ATOM 2212 H HG13 . ILE D 1 16 ? -6.230 1.112 -2.067 1.00 0.00 ? 82 ILE D HG13 2 16
ATOM 2213 H HG21 . ILE D 1 16 ? -6.705 1.199 -5.754 1.00 0.00 ? 82 ILE D HG21 2 16
ATOM 2214 H HG22 . ILE D 1 16 ? -8.254 1.745 -5.725 1.00 0.00 ? 82 ILE D HG22 2 16
ATOM 2215 H HG23 . ILE D 1 16 ? -6.989 2.766 -5.222 1.00 0.00 ? 82 ILE D HG23 2 16
ATOM 2216 H HD11 . ILE D 1 16 ? -5.475 -0.467 -3.927 1.00 0.00 ? 82 ILE D HD11 2 16
ATOM 2217 H HD12 . ILE D 1 16 ? -4.703 0.993 -4.565 1.00 0.00 ? 82 ILE D HD12 2 16
ATOM 2218 H HD13 . ILE D 1 16 ? -4.241 0.418 -3.003 1.00 0.00 ? 82 ILE D HD13 2 16
ATOM 2219 N N . LYS D 1 17 ? -10.614 1.426 -3.943 1.00 0.00 ? 83 LYS D N 2 17
ATOM 2220 C CA . LYS D 1 17 ? -11.906 1.505 -4.572 1.00 0.00 ? 83 LYS D CA 2 17
ATOM 2221 C C . LYS D 1 17 ? -12.883 2.351 -3.782 1.00 0.00 ? 83 LYS D C 2 17
ATOM 2222 O O . LYS D 1 17 ? -13.585 3.146 -4.375 1.00 0.00 ? 83 LYS D O 2 17
ATOM 2223 C CB . LYS D 1 17 ? -12.422 0.095 -4.787 1.00 0.00 ? 83 LYS D CB 2 17
ATOM 2224 C CG . LYS D 1 17 ? -11.806 -0.519 -6.025 1.00 0.00 ? 83 LYS D CG 2 17
ATOM 2225 C CD . LYS D 1 17 ? -12.512 -1.724 -6.494 1.00 0.00 ? 83 LYS D CD 2 17
ATOM 2226 C CE . LYS D 1 17 ? -12.395 -2.878 -5.835 1.00 0.00 ? 83 LYS D CE 2 17
ATOM 2227 N NZ . LYS D 1 17 ? -13.167 -3.952 -6.219 1.00 0.00 ? 83 LYS D NZ 2 17
ATOM 2228 H H . LYS D 1 17 ? -10.311 0.534 -3.607 1.00 0.00 ? 83 LYS D H 2 17
ATOM 2229 H HA . LYS D 1 17 ? -11.817 1.971 -5.544 1.00 0.00 ? 83 LYS D HA 2 17
ATOM 2230 H HB2 . LYS D 1 17 ? -12.208 -0.523 -3.915 1.00 0.00 ? 83 LYS D HB2 2 17
ATOM 2231 H HB3 . LYS D 1 17 ? -13.495 0.140 -4.914 1.00 0.00 ? 83 LYS D HB3 2 17
ATOM 2232 H HG2 . LYS D 1 17 ? -11.798 0.224 -6.823 1.00 0.00 ? 83 LYS D HG2 2 17
ATOM 2233 H HG3 . LYS D 1 17 ? -10.806 -0.771 -5.829 1.00 0.00 ? 83 LYS D HG3 2 17
ATOM 2234 H HD2 . LYS D 1 17 ? -13.571 -1.467 -6.500 1.00 0.00 ? 83 LYS D HD2 2 17
ATOM 2235 H HD3 . LYS D 1 17 ? -12.333 -1.979 -7.343 1.00 0.00 ? 83 LYS D HD3 2 17
ATOM 2236 H HE2 . LYS D 1 17 ? -11.357 -3.204 -5.896 1.00 0.00 ? 83 LYS D HE2 2 17
ATOM 2237 H HE3 . LYS D 1 17 ? -12.526 -2.569 -4.973 1.00 0.00 ? 83 LYS D HE3 2 17
ATOM 2238 H HZ1 . LYS D 1 17 ? -13.076 -4.249 -6.994 1.00 0.00 ? 83 LYS D HZ1 2 17
ATOM 2239 H HZ2 . LYS D 1 17 ? -13.049 -4.697 -5.796 1.00 0.00 ? 83 LYS D HZ2 2 17
ATOM 2240 H HZ3 . LYS D 1 17 ? -13.947 -3.726 -6.106 1.00 0.00 ? 83 LYS D HZ3 2 17
ATOM 2241 N N . ALA D 1 18 ? -12.991 2.173 -2.478 1.00 0.00 ? 84 ALA D N 2 18
ATOM 2242 C CA . ALA D 1 18 ? -13.955 2.793 -1.608 1.00 0.00 ? 84 ALA D CA 2 18
ATOM 2243 C C . ALA D 1 18 ? -13.624 4.233 -1.286 1.00 0.00 ? 84 ALA D C 2 18
ATOM 2244 O O . ALA D 1 18 ? -14.473 5.090 -1.278 1.00 0.00 ? 84 ALA D O 2 18
ATOM 2245 C CB . ALA D 1 18 ? -14.075 1.986 -0.349 1.00 0.00 ? 84 ALA D CB 2 18
ATOM 2246 H H . ALA D 1 18 ? -12.365 1.492 -2.114 1.00 0.00 ? 84 ALA D H 2 18
ATOM 2247 H HA . ALA D 1 18 ? -14.915 2.768 -2.088 1.00 0.00 ? 84 ALA D HA 2 18
ATOM 2248 H HB1 . ALA D 1 18 ? -14.406 0.998 -0.556 1.00 0.00 ? 84 ALA D HB1 2 18
ATOM 2249 H HB2 . ALA D 1 18 ? -13.158 1.907 0.171 1.00 0.00 ? 84 ALA D HB2 2 18
ATOM 2250 H HB3 . ALA D 1 18 ? -14.784 2.424 0.277 1.00 0.00 ? 84 ALA D HB3 2 18
ATOM 2251 N N . GLY D 1 19 ? -12.340 4.488 -1.087 1.00 0.00 ? 85 GLY D N 2 19
ATOM 2252 C CA . GLY D 1 19 ? -11.746 5.798 -0.986 1.00 0.00 ? 85 GLY D CA 2 19
ATOM 2253 C C . GLY D 1 19 ? -11.768 6.559 -2.295 1.00 0.00 ? 85 GLY D C 2 19
ATOM 2254 O O . GLY D 1 19 ? -11.937 7.759 -2.317 1.00 0.00 ? 85 GLY D O 2 19
ATOM 2255 H H . GLY D 1 19 ? -11.744 3.698 -1.143 1.00 0.00 ? 85 GLY D H 2 19
ATOM 2256 H HA2 . GLY D 1 19 ? -12.267 6.373 -0.242 1.00 0.00 ? 85 GLY D HA2 2 19
ATOM 2257 H HA3 . GLY D 1 19 ? -10.719 5.738 -0.673 1.00 0.00 ? 85 GLY D HA3 2 19
ATOM 2258 N N . GLY D 1 20 ? -11.621 5.870 -3.411 1.00 0.00 ? 86 GLY D N 2 20
ATOM 2259 C CA . GLY D 1 20 ? -11.644 6.394 -4.753 1.00 0.00 ? 86 GLY D CA 2 20
ATOM 2260 C C . GLY D 1 20 ? -10.388 7.155 -5.107 1.00 0.00 ? 86 GLY D C 2 20
ATOM 2261 O O . GLY D 1 20 ? -10.503 8.287 -5.517 1.00 0.00 ? 86 GLY D O 2 20
ATOM 2262 H H . GLY D 1 20 ? -11.430 4.915 -3.300 1.00 0.00 ? 86 GLY D H 2 20
ATOM 2263 H HA2 . GLY D 1 20 ? -11.754 5.584 -5.459 1.00 0.00 ? 86 GLY D HA2 2 20
ATOM 2264 H HA3 . GLY D 1 20 ? -12.497 7.041 -4.881 1.00 0.00 ? 86 GLY D HA3 2 20
ATOM 2265 N N . TYR D 1 21 ? -9.209 6.580 -4.916 1.00 0.00 ? 87 TYR D N 2 21
ATOM 2266 C CA . TYR D 1 21 ? -7.951 7.160 -5.322 1.00 0.00 ? 87 TYR D CA 2 21
ATOM 2267 C C . TYR D 1 21 ? -7.918 7.450 -6.801 1.00 0.00 ? 87 TYR D C 2 21
ATOM 2268 O O . TYR D 1 21 ? -8.558 6.805 -7.593 1.00 0.00 ? 87 TYR D O 2 21
ATOM 2269 C CB . TYR D 1 21 ? -6.814 6.237 -4.921 1.00 0.00 ? 87 TYR D CB 2 21
ATOM 2270 C CG . TYR D 1 21 ? -6.321 6.232 -3.496 1.00 0.00 ? 87 TYR D CG 2 21
ATOM 2271 C CD1 . TYR D 1 21 ? -5.626 7.288 -2.908 1.00 0.00 ? 87 TYR D CD1 2 21
ATOM 2272 C CD2 . TYR D 1 21 ? -6.392 5.016 -2.833 1.00 0.00 ? 87 TYR D CD2 2 21
ATOM 2273 C CE1 . TYR D 1 21 ? -5.087 7.124 -1.631 1.00 0.00 ? 87 TYR D CE1 2 21
ATOM 2274 C CE2 . TYR D 1 21 ? -5.863 4.826 -1.554 1.00 0.00 ? 87 TYR D CE2 2 21
ATOM 2275 C CZ . TYR D 1 21 ? -5.210 5.906 -0.949 1.00 0.00 ? 87 TYR D CZ 2 21
ATOM 2276 O OH . TYR D 1 21 ? -4.798 5.779 0.340 1.00 0.00 ? 87 TYR D OH 2 21
ATOM 2277 H H . TYR D 1 21 ? -9.212 5.630 -4.635 1.00 0.00 ? 87 TYR D H 2 21
ATOM 2278 H HA . TYR D 1 21 ? -7.778 8.058 -4.754 1.00 0.00 ? 87 TYR D HA 2 21
ATOM 2279 H HB2 . TYR D 1 21 ? -7.134 5.222 -5.160 1.00 0.00 ? 87 TYR D HB2 2 21
ATOM 2280 H HB3 . TYR D 1 21 ? -5.934 6.422 -5.507 1.00 0.00 ? 87 TYR D HB3 2 21
ATOM 2281 H HD1 . TYR D 1 21 ? -5.520 8.253 -3.364 1.00 0.00 ? 87 TYR D HD1 2 21
ATOM 2282 H HD2 . TYR D 1 21 ? -6.831 4.210 -3.382 1.00 0.00 ? 87 TYR D HD2 2 21
ATOM 2283 H HE1 . TYR D 1 21 ? -4.617 7.956 -1.147 1.00 0.00 ? 87 TYR D HE1 2 21
ATOM 2284 H HE2 . TYR D 1 21 ? -5.930 3.876 -1.062 1.00 0.00 ? 87 TYR D HE2 2 21
ATOM 2285 H HH . TYR D 1 21 ? -5.514 6.029 0.894 1.00 0.00 ? 87 TYR D HH 2 21
HETATM 2286 N N . NH2 D 1 22 ? -7.184 8.441 -7.239 1.00 0.00 ? 88 NH2 D N 2 22
HETATM 2287 H HN1 . NH2 D 1 22 ? -7.198 8.620 -8.191 1.00 0.00 ? 88 NH2 D HN1 2 22
HETATM 2288 H HN2 . NH2 D 1 22 ? -6.630 8.951 -6.623 1.00 0.00 ? 88 NH2 D HN2 2 22
HETATM 2289 C C . ACE A 1 1 ? 1.175 13.812 1.621 1.00 0.00 ? 1 ACE A C 3 1
HETATM 2290 O O . ACE A 1 1 ? 1.726 12.942 0.995 1.00 0.00 ? 1 ACE A O 3 1
HETATM 2291 C CH3 . ACE A 1 1 ? 1.968 14.642 2.587 1.00 0.00 ? 1 ACE A CH3 3 1
HETATM 2292 H H1 . ACE A 1 1 ? 2.463 14.946 2.476 1.00 0.00 ? 1 ACE A H1 3 1
HETATM 2293 H H2 . ACE A 1 1 ? 1.846 15.151 2.953 1.00 0.00 ? 1 ACE A H2 3 1
HETATM 2294 H H3 . ACE A 1 1 ? 2.171 14.382 3.005 1.00 0.00 ? 1 ACE A H3 3 1
ATOM 2295 N N . ALA A 1 2 ? -0.120 14.031 1.536 1.00 0.00 ? 2 ALA A N 3 2
ATOM 2296 C CA . ALA A 1 2 ? -1.010 13.195 0.774 1.00 0.00 ? 2 ALA A CA 3 2
ATOM 2297 C C . ALA A 1 2 ? -0.730 13.183 -0.707 1.00 0.00 ? 2 ALA A C 3 2
ATOM 2298 O O . ALA A 1 2 ? -1.134 12.255 -1.374 1.00 0.00 ? 2 ALA A O 3 2
ATOM 2299 C CB . ALA A 1 2 ? -2.446 13.604 1.033 1.00 0.00 ? 2 ALA A CB 3 2
ATOM 2300 H H . ALA A 1 2 ? -0.490 14.797 2.042 1.00 0.00 ? 2 ALA A H 3 2
ATOM 2301 H HA . ALA A 1 2 ? -0.914 12.176 1.122 1.00 0.00 ? 2 ALA A HA 3 2
ATOM 2302 H HB1 . ALA A 1 2 ? -3.119 13.001 0.475 1.00 0.00 ? 2 ALA A HB1 3 2
ATOM 2303 H HB2 . ALA A 1 2 ? -2.674 13.501 2.068 1.00 0.00 ? 2 ALA A HB2 3 2
ATOM 2304 H HB3 . ALA A 1 2 ? -2.599 14.626 0.780 1.00 0.00 ? 2 ALA A HB3 3 2
ATOM 2305 N N . LYS A 1 3 ? 0.019 14.130 -1.251 1.00 0.00 ? 3 LYS A N 3 3
ATOM 2306 C CA . LYS A 1 3 ? 0.467 14.176 -2.619 1.00 0.00 ? 3 LYS A CA 3 3
ATOM 2307 C C . LYS A 1 3 ? 1.339 13.001 -3.012 1.00 0.00 ? 3 LYS A C 3 3
ATOM 2308 O O . LYS A 1 3 ? 1.451 12.713 -4.194 1.00 0.00 ? 3 LYS A O 3 3
ATOM 2309 C CB . LYS A 1 3 ? 1.254 15.438 -2.930 1.00 0.00 ? 3 LYS A CB 3 3
ATOM 2310 C CG . LYS A 1 3 ? 0.529 16.719 -2.689 1.00 0.00 ? 3 LYS A CG 3 3
ATOM 2311 C CD . LYS A 1 3 ? 1.301 17.933 -3.073 1.00 0.00 ? 3 LYS A CD 3 3
ATOM 2312 C CE . LYS A 1 3 ? 1.417 18.124 -4.434 1.00 0.00 ? 3 LYS A CE 3 3
ATOM 2313 N NZ . LYS A 1 3 ? 2.346 19.093 -4.794 1.00 0.00 ? 3 LYS A NZ 3 3
ATOM 2314 H H . LYS A 1 3 ? 0.247 14.874 -0.633 1.00 0.00 ? 3 LYS A H 3 3
ATOM 2315 H HA . LYS A 1 3 ? -0.387 14.139 -3.278 1.00 0.00 ? 3 LYS A HA 3 3
ATOM 2316 H HB2 . LYS A 1 3 ? 2.165 15.440 -2.333 1.00 0.00 ? 3 LYS A HB2 3 3
ATOM 2317 H HB3 . LYS A 1 3 ? 1.545 15.377 -3.947 1.00 0.00 ? 3 LYS A HB3 3 3
ATOM 2318 H HG2 . LYS A 1 3 ? -0.410 16.706 -3.242 1.00 0.00 ? 3 LYS A HG2 3 3
ATOM 2319 H HG3 . LYS A 1 3 ? 0.297 16.778 -1.694 1.00 0.00 ? 3 LYS A HG3 3 3
ATOM 2320 H HD2 . LYS A 1 3 ? 0.824 18.808 -2.632 1.00 0.00 ? 3 LYS A HD2 3 3
ATOM 2321 H HD3 . LYS A 1 3 ? 2.204 17.872 -2.694 1.00 0.00 ? 3 LYS A HD3 3 3
ATOM 2322 H HE2 . LYS A 1 3 ? 1.655 17.176 -4.914 1.00 0.00 ? 3 LYS A HE2 3 3
ATOM 2323 H HE3 . LYS A 1 3 ? 0.590 18.470 -4.796 1.00 0.00 ? 3 LYS A HE3 3 3
ATOM 2324 H HZ1 . LYS A 1 3 ? 2.229 19.950 -4.450 1.00 0.00 ? 3 LYS A HZ1 3 3
ATOM 2325 H HZ2 . LYS A 1 3 ? 3.117 18.799 -4.549 1.00 0.00 ? 3 LYS A HZ2 3 3
ATOM 2326 H HZ3 . LYS A 1 3 ? 2.367 19.216 -5.666 1.00 0.00 ? 3 LYS A HZ3 3 3
ATOM 2327 N N . ALA A 1 4 ? 1.878 12.259 -2.049 1.00 0.00 ? 4 ALA A N 3 4
ATOM 2328 C CA . ALA A 1 4 ? 2.512 10.972 -2.197 1.00 0.00 ? 4 ALA A CA 3 4
ATOM 2329 C C . ALA A 1 4 ? 1.632 9.919 -2.842 1.00 0.00 ? 4 ALA A C 3 4
ATOM 2330 O O . ALA A 1 4 ? 2.098 8.830 -3.151 1.00 0.00 ? 4 ALA A O 3 4
ATOM 2331 C CB . ALA A 1 4 ? 3.013 10.535 -0.832 1.00 0.00 ? 4 ALA A CB 3 4
ATOM 2332 H H . ALA A 1 4 ? 1.756 12.563 -1.107 1.00 0.00 ? 4 ALA A H 3 4
ATOM 2333 H HA . ALA A 1 4 ? 3.358 11.099 -2.853 1.00 0.00 ? 4 ALA A HA 3 4
ATOM 2334 H HB1 . ALA A 1 4 ? 2.186 10.328 -0.184 1.00 0.00 ? 4 ALA A HB1 3 4
ATOM 2335 H HB2 . ALA A 1 4 ? 3.573 9.621 -0.888 1.00 0.00 ? 4 ALA A HB2 3 4
ATOM 2336 H HB3 . ALA A 1 4 ? 3.646 11.266 -0.373 1.00 0.00 ? 4 ALA A HB3 3 4
ATOM 2337 N N . ALA A 1 5 ? 0.336 10.169 -2.996 1.00 0.00 ? 5 ALA A N 3 5
ATOM 2338 C CA . ALA A 1 5 ? -0.674 9.204 -3.354 1.00 0.00 ? 5 ALA A CA 3 5
ATOM 2339 C C . ALA A 1 5 ? -0.473 8.604 -4.734 1.00 0.00 ? 5 ALA A C 3 5
ATOM 2340 O O . ALA A 1 5 ? 0.165 7.574 -4.884 1.00 0.00 ? 5 ALA A O 3 5
ATOM 2341 C CB . ALA A 1 5 ? -2.051 9.779 -3.063 1.00 0.00 ? 5 ALA A CB 3 5
ATOM 2342 H H . ALA A 1 5 ? 0.096 11.132 -2.878 1.00 0.00 ? 5 ALA A H 3 5
ATOM 2343 H HA . ALA A 1 5 ? -0.578 8.359 -2.679 1.00 0.00 ? 5 ALA A HA 3 5
ATOM 2344 H HB1 . ALA A 1 5 ? -2.196 10.709 -3.596 1.00 0.00 ? 5 ALA A HB1 3 5
ATOM 2345 H HB2 . ALA A 1 5 ? -2.825 9.090 -3.361 1.00 0.00 ? 5 ALA A HB2 3 5
ATOM 2346 H HB3 . ALA A 1 5 ? -2.131 9.937 -1.995 1.00 0.00 ? 5 ALA A HB3 3 5
ATOM 2347 N N . ALA A 1 6 ? -0.983 9.221 -5.797 1.00 0.00 ? 6 ALA A N 3 6
ATOM 2348 C CA . ALA A 1 6 ? -1.080 8.616 -7.097 1.00 0.00 ? 6 ALA A CA 3 6
ATOM 2349 C C . ALA A 1 6 ? 0.241 8.390 -7.804 1.00 0.00 ? 6 ALA A C 3 6
ATOM 2350 O O . ALA A 1 6 ? 0.237 7.952 -8.936 1.00 0.00 ? 6 ALA A O 3 6
ATOM 2351 C CB . ALA A 1 6 ? -2.059 9.390 -7.954 1.00 0.00 ? 6 ALA A CB 3 6
ATOM 2352 H H . ALA A 1 6 ? -1.410 10.111 -5.634 1.00 0.00 ? 6 ALA A H 3 6
ATOM 2353 H HA . ALA A 1 6 ? -1.498 7.636 -6.917 1.00 0.00 ? 6 ALA A HA 3 6
ATOM 2354 H HB1 . ALA A 1 6 ? -1.707 10.397 -8.071 1.00 0.00 ? 6 ALA A HB1 3 6
ATOM 2355 H HB2 . ALA A 1 6 ? -2.158 8.911 -8.916 1.00 0.00 ? 6 ALA A HB2 3 6
ATOM 2356 H HB3 . ALA A 1 6 ? -3.034 9.390 -7.507 1.00 0.00 ? 6 ALA A HB3 3 6
ATOM 2357 N N . ALA A 1 7 ? 1.386 8.641 -7.185 1.00 0.00 ? 7 ALA A N 3 7
ATOM 2358 C CA . ALA A 1 7 ? 2.691 8.185 -7.605 1.00 0.00 ? 7 ALA A CA 3 7
ATOM 2359 C C . ALA A 1 7 ? 3.047 6.854 -6.975 1.00 0.00 ? 7 ALA A C 3 7
ATOM 2360 O O . ALA A 1 7 ? 3.498 5.976 -7.628 1.00 0.00 ? 7 ALA A O 3 7
ATOM 2361 C CB . ALA A 1 7 ? 3.716 9.243 -7.251 1.00 0.00 ? 7 ALA A CB 3 7
ATOM 2362 H H . ALA A 1 7 ? 1.282 8.988 -6.269 1.00 0.00 ? 7 ALA A H 3 7
ATOM 2363 H HA . ALA A 1 7 ? 2.688 8.065 -8.686 1.00 0.00 ? 7 ALA A HA 3 7
ATOM 2364 H HB1 . ALA A 1 7 ? 3.480 10.126 -7.787 1.00 0.00 ? 7 ALA A HB1 3 7
ATOM 2365 H HB2 . ALA A 1 7 ? 3.721 9.430 -6.197 1.00 0.00 ? 7 ALA A HB2 3 7
ATOM 2366 H HB3 . ALA A 1 7 ? 4.688 8.929 -7.508 1.00 0.00 ? 7 ALA A HB3 3 7
ATOM 2367 N N . ALA A 1 8 ? 2.823 6.641 -5.710 1.00 0.00 ? 8 ALA A N 3 8
ATOM 2368 C CA . ALA A 1 8 ? 3.214 5.447 -4.995 1.00 0.00 ? 8 ALA A CA 3 8
ATOM 2369 C C . ALA A 1 8 ? 2.093 4.428 -5.013 1.00 0.00 ? 8 ALA A C 3 8
ATOM 2370 O O . ALA A 1 8 ? 2.373 3.258 -5.181 1.00 0.00 ? 8 ALA A O 3 8
ATOM 2371 C CB . ALA A 1 8 ? 3.569 5.820 -3.571 1.00 0.00 ? 8 ALA A CB 3 8
ATOM 2372 H H . ALA A 1 8 ? 2.309 7.325 -5.210 1.00 0.00 ? 8 ALA A H 3 8
ATOM 2373 H HA . ALA A 1 8 ? 4.073 4.995 -5.481 1.00 0.00 ? 8 ALA A HA 3 8
ATOM 2374 H HB1 . ALA A 1 8 ? 4.076 5.941 -3.351 1.00 0.00 ? 8 ALA A HB1 3 8
ATOM 2375 H HB2 . ALA A 1 8 ? 3.375 6.261 -3.218 1.00 0.00 ? 8 ALA A HB2 3 8
ATOM 2376 H HB3 . ALA A 1 8 ? 3.468 5.492 -3.074 1.00 0.00 ? 8 ALA A HB3 3 8
ATOM 2377 N N . ILE A 1 9 ? 0.836 4.846 -4.905 1.00 0.00 ? 9 ILE A N 3 9
ATOM 2378 C CA . ILE A 1 9 ? -0.331 4.006 -5.057 1.00 0.00 ? 9 ILE A CA 3 9
ATOM 2379 C C . ILE A 1 9 ? -0.358 3.359 -6.430 1.00 0.00 ? 9 ILE A C 3 9
ATOM 2380 O O . ILE A 1 9 ? -0.650 2.174 -6.522 1.00 0.00 ? 9 ILE A O 3 9
ATOM 2381 C CB . ILE A 1 9 ? -1.632 4.759 -4.811 1.00 0.00 ? 9 ILE A CB 3 9
ATOM 2382 C CG1 . ILE A 1 9 ? -1.742 5.382 -3.428 1.00 0.00 ? 9 ILE A CG1 3 9
ATOM 2383 C CG2 . ILE A 1 9 ? -2.804 3.827 -5.056 1.00 0.00 ? 9 ILE A CG2 3 9
ATOM 2384 C CD1 . ILE A 1 9 ? -1.631 4.439 -2.246 1.00 0.00 ? 9 ILE A CD1 3 9
ATOM 2385 H H . ILE A 1 9 ? 0.698 5.817 -4.754 1.00 0.00 ? 9 ILE A H 3 9
ATOM 2386 H HA . ILE A 1 9 ? -0.242 3.190 -4.347 1.00 0.00 ? 9 ILE A HA 3 9
ATOM 2387 H HB . ILE A 1 9 ? -1.669 5.511 -5.593 1.00 0.00 ? 9 ILE A HB 3 9
ATOM 2388 H HG12 . ILE A 1 9 ? -0.957 6.132 -3.337 1.00 0.00 ? 9 ILE A HG12 3 9
ATOM 2389 H HG13 . ILE A 1 9 ? -2.675 5.909 -3.333 1.00 0.00 ? 9 ILE A HG13 3 9
ATOM 2390 H HG21 . ILE A 1 9 ? -2.646 2.910 -4.510 1.00 0.00 ? 9 ILE A HG21 3 9
ATOM 2391 H HG22 . ILE A 1 9 ? -3.691 4.320 -4.700 1.00 0.00 ? 9 ILE A HG22 3 9
ATOM 2392 H HG23 . ILE A 1 9 ? -2.868 3.634 -6.113 1.00 0.00 ? 9 ILE A HG23 3 9
ATOM 2393 H HD11 . ILE A 1 9 ? -2.416 3.710 -2.256 1.00 0.00 ? 9 ILE A HD11 3 9
ATOM 2394 H HD12 . ILE A 1 9 ? -0.698 3.926 -2.262 1.00 0.00 ? 9 ILE A HD12 3 9
ATOM 2395 H HD13 . ILE A 1 9 ? -1.739 4.983 -1.323 1.00 0.00 ? 9 ILE A HD13 3 9
ATOM 2396 N N . LYS A 1 10 ? 0.020 4.062 -7.495 1.00 0.00 ? 10 LYS A N 3 10
ATOM 2397 C CA . LYS A 1 10 ? 0.192 3.510 -8.814 1.00 0.00 ? 10 LYS A CA 3 10
ATOM 2398 C C . LYS A 1 10 ? 1.126 2.317 -8.842 1.00 0.00 ? 10 LYS A C 3 10
ATOM 2399 O O . LYS A 1 10 ? 0.750 1.248 -9.292 1.00 0.00 ? 10 LYS A O 3 10
ATOM 2400 C CB . LYS A 1 10 ? 0.601 4.646 -9.730 1.00 0.00 ? 10 LYS A CB 3 10
ATOM 2401 C CG . LYS A 1 10 ? -0.563 5.303 -10.443 1.00 0.00 ? 10 LYS A CG 3 10
ATOM 2402 C CD . LYS A 1 10 ? -1.054 4.504 -11.627 1.00 0.00 ? 10 LYS A CD 3 10
ATOM 2403 C CE . LYS A 1 10 ? -2.222 5.118 -12.344 1.00 0.00 ? 10 LYS A CE 3 10
ATOM 2404 N NZ . LYS A 1 10 ? -1.905 6.343 -13.009 1.00 0.00 ? 10 LYS A NZ 3 10
ATOM 2405 H H . LYS A 1 10 ? 0.248 5.010 -7.288 1.00 0.00 ? 10 LYS A H 3 10
ATOM 2406 H HA . LYS A 1 10 ? -0.755 3.102 -9.137 1.00 0.00 ? 10 LYS A HA 3 10
ATOM 2407 H HB2 . LYS A 1 10 ? 1.104 5.403 -9.127 1.00 0.00 ? 10 LYS A HB2 3 10
ATOM 2408 H HB3 . LYS A 1 10 ? 1.342 4.324 -10.445 1.00 0.00 ? 10 LYS A HB3 3 10
ATOM 2409 H HG2 . LYS A 1 10 ? -1.383 5.454 -9.741 1.00 0.00 ? 10 LYS A HG2 3 10
ATOM 2410 H HG3 . LYS A 1 10 ? -0.243 6.269 -10.790 1.00 0.00 ? 10 LYS A HG3 3 10
ATOM 2411 H HD2 . LYS A 1 10 ? -0.229 4.379 -12.329 1.00 0.00 ? 10 LYS A HD2 3 10
ATOM 2412 H HD3 . LYS A 1 10 ? -1.362 3.534 -11.332 1.00 0.00 ? 10 LYS A HD3 3 10
ATOM 2413 H HE2 . LYS A 1 10 ? -2.594 4.410 -13.085 1.00 0.00 ? 10 LYS A HE2 3 10
ATOM 2414 H HE3 . LYS A 1 10 ? -3.005 5.248 -11.640 1.00 0.00 ? 10 LYS A HE3 3 10
ATOM 2415 H HZ1 . LYS A 1 10 ? -2.667 6.694 -13.526 1.00 0.00 ? 10 LYS A HZ1 3 10
ATOM 2416 H HZ2 . LYS A 1 10 ? -1.661 7.024 -12.361 1.00 0.00 ? 10 LYS A HZ2 3 10
ATOM 2417 H HZ3 . LYS A 1 10 ? -1.154 6.230 -13.595 1.00 0.00 ? 10 LYS A HZ3 3 10
ATOM 2418 N N . ALA A 1 11 ? 2.309 2.475 -8.257 1.00 0.00 ? 11 ALA A N 3 11
ATOM 2419 C CA . ALA A 1 11 ? 3.304 1.458 -8.009 1.00 0.00 ? 11 ALA A CA 3 11
ATOM 2420 C C . ALA A 1 11 ? 2.936 0.406 -6.979 1.00 0.00 ? 11 ALA A C 3 11
ATOM 2421 O O . ALA A 1 11 ? 3.749 -0.464 -6.697 1.00 0.00 ? 11 ALA A O 3 11
ATOM 2422 C CB . ALA A 1 11 ? 4.603 2.187 -7.698 1.00 0.00 ? 11 ALA A CB 3 11
ATOM 2423 H H . ALA A 1 11 ? 2.505 3.405 -7.925 1.00 0.00 ? 11 ALA A H 3 11
ATOM 2424 H HA . ALA A 1 11 ? 3.463 0.937 -8.950 1.00 0.00 ? 11 ALA A HA 3 11
ATOM 2425 H HB1 . ALA A 1 11 ? 4.506 2.786 -6.818 1.00 0.00 ? 11 ALA A HB1 3 11
ATOM 2426 H HB2 . ALA A 1 11 ? 5.383 1.474 -7.562 1.00 0.00 ? 11 ALA A HB2 3 11
ATOM 2427 H HB3 . ALA A 1 11 ? 4.850 2.824 -8.506 1.00 0.00 ? 11 ALA A HB3 3 11
ATOM 2428 N N . ILE A 1 12 ? 1.701 0.411 -6.482 1.00 0.00 ? 12 ILE A N 3 12
ATOM 2429 C CA . ILE A 1 12 ? 0.990 -0.697 -5.885 1.00 0.00 ? 12 ILE A CA 3 12
ATOM 2430 C C . ILE A 1 12 ? -0.138 -1.164 -6.790 1.00 0.00 ? 12 ILE A C 3 12
ATOM 2431 O O . ILE A 1 12 ? -0.062 -2.313 -7.210 1.00 0.00 ? 12 ILE A O 3 12
ATOM 2432 C CB . ILE A 1 12 ? 0.444 -0.474 -4.484 1.00 0.00 ? 12 ILE A CB 3 12
ATOM 2433 C CG1 . ILE A 1 12 ? 1.351 0.355 -3.605 1.00 0.00 ? 12 ILE A CG1 3 12
ATOM 2434 C CG2 . ILE A 1 12 ? 0.150 -1.765 -3.793 1.00 0.00 ? 12 ILE A CG2 3 12
ATOM 2435 C CD1 . ILE A 1 12 ? 0.727 0.836 -2.330 1.00 0.00 ? 12 ILE A CD1 3 12
ATOM 2436 H H . ILE A 1 12 ? 1.165 1.216 -6.710 1.00 0.00 ? 12 ILE A H 3 12
ATOM 2437 H HA . ILE A 1 12 ? 1.631 -1.569 -5.909 1.00 0.00 ? 12 ILE A HA 3 12
ATOM 2438 H HB . ILE A 1 12 ? -0.486 0.027 -4.594 1.00 0.00 ? 12 ILE A HB 3 12
ATOM 2439 H HG12 . ILE A 1 12 ? 2.260 -0.203 -3.381 1.00 0.00 ? 12 ILE A HG12 3 12
ATOM 2440 H HG13 . ILE A 1 12 ? 1.586 1.211 -4.172 1.00 0.00 ? 12 ILE A HG13 3 12
ATOM 2441 H HG21 . ILE A 1 12 ? -0.556 -2.318 -4.362 1.00 0.00 ? 12 ILE A HG21 3 12
ATOM 2442 H HG22 . ILE A 1 12 ? 1.042 -2.321 -3.612 1.00 0.00 ? 12 ILE A HG22 3 12
ATOM 2443 H HG23 . ILE A 1 12 ? -0.349 -1.595 -2.850 1.00 0.00 ? 12 ILE A HG23 3 12
ATOM 2444 H HD11 . ILE A 1 12 ? 0.661 0.068 -1.628 1.00 0.00 ? 12 ILE A HD11 3 12
ATOM 2445 H HD12 . ILE A 1 12 ? 1.312 1.618 -1.889 1.00 0.00 ? 12 ILE A HD12 3 12
ATOM 2446 H HD13 . ILE A 1 12 ? -0.230 1.212 -2.518 1.00 0.00 ? 12 ILE A HD13 3 12
ATOM 2447 N N . ALA A 1 13 ? -1.170 -0.399 -7.141 1.00 0.00 ? 13 ALA A N 3 13
ATOM 2448 C CA . ALA A 1 13 ? -2.359 -0.849 -7.819 1.00 0.00 ? 13 ALA A CA 3 13
ATOM 2449 C C . ALA A 1 13 ? -2.082 -1.561 -9.130 1.00 0.00 ? 13 ALA A C 3 13
ATOM 2450 O O . ALA A 1 13 ? -2.779 -2.509 -9.466 1.00 0.00 ? 13 ALA A O 3 13
ATOM 2451 C CB . ALA A 1 13 ? -3.255 0.357 -8.015 1.00 0.00 ? 13 ALA A CB 3 13
ATOM 2452 H H . ALA A 1 13 ? -1.117 0.573 -6.891 1.00 0.00 ? 13 ALA A H 3 13
ATOM 2453 H HA . ALA A 1 13 ? -2.886 -1.537 -7.183 1.00 0.00 ? 13 ALA A HA 3 13
ATOM 2454 H HB1 . ALA A 1 13 ? -3.427 0.854 -7.088 1.00 0.00 ? 13 ALA A HB1 3 13
ATOM 2455 H HB2 . ALA A 1 13 ? -2.800 1.063 -8.677 1.00 0.00 ? 13 ALA A HB2 3 13
ATOM 2456 H HB3 . ALA A 1 13 ? -4.192 0.054 -8.423 1.00 0.00 ? 13 ALA A HB3 3 13
ATOM 2457 N N . ALA A 1 14 ? -1.038 -1.151 -9.845 1.00 0.00 ? 14 ALA A N 3 14
ATOM 2458 C CA . ALA A 1 14 ? -0.505 -1.824 -11.009 1.00 0.00 ? 14 ALA A CA 3 14
ATOM 2459 C C . ALA A 1 14 ? 0.170 -3.141 -10.677 1.00 0.00 ? 14 ALA A C 3 14
ATOM 2460 O O . ALA A 1 14 ? 0.010 -4.120 -11.393 1.00 0.00 ? 14 ALA A O 3 14
ATOM 2461 C CB . ALA A 1 14 ? 0.488 -0.907 -11.692 1.00 0.00 ? 14 ALA A CB 3 14
ATOM 2462 H H . ALA A 1 14 ? -0.548 -0.372 -9.444 1.00 0.00 ? 14 ALA A H 3 14
ATOM 2463 H HA . ALA A 1 14 ? -1.325 -2.028 -11.682 1.00 0.00 ? 14 ALA A HA 3 14
ATOM 2464 H HB1 . ALA A 1 14 ? 0.813 -1.373 -12.599 1.00 0.00 ? 14 ALA A HB1 3 14
ATOM 2465 H HB2 . ALA A 1 14 ? 0.039 0.025 -11.963 1.00 0.00 ? 14 ALA A HB2 3 14
ATOM 2466 H HB3 . ALA A 1 14 ? 1.328 -0.730 -11.053 1.00 0.00 ? 14 ALA A HB3 3 14
ATOM 2467 N N . ILE A 1 15 ? 0.931 -3.186 -9.587 1.00 0.00 ? 15 ILE A N 3 15
ATOM 2468 C CA . ILE A 1 15 ? 1.583 -4.354 -9.037 1.00 0.00 ? 15 ILE A CA 3 15
ATOM 2469 C C . ILE A 1 15 ? 0.568 -5.304 -8.430 1.00 0.00 ? 15 ILE A C 3 15
ATOM 2470 O O . ILE A 1 15 ? 0.758 -6.504 -8.536 1.00 0.00 ? 15 ILE A O 3 15
ATOM 2471 C CB . ILE A 1 15 ? 2.639 -3.908 -8.036 1.00 0.00 ? 15 ILE A CB 3 15
ATOM 2472 C CG1 . ILE A 1 15 ? 3.929 -3.435 -8.689 1.00 0.00 ? 15 ILE A CG1 3 15
ATOM 2473 C CG2 . ILE A 1 15 ? 3.013 -5.006 -7.051 1.00 0.00 ? 15 ILE A CG2 3 15
ATOM 2474 C CD1 . ILE A 1 15 ? 3.768 -2.189 -9.542 1.00 0.00 ? 15 ILE A CD1 3 15
ATOM 2475 H H . ILE A 1 15 ? 0.853 -2.359 -9.024 1.00 0.00 ? 15 ILE A H 3 15
ATOM 2476 H HA . ILE A 1 15 ? 2.104 -4.866 -9.839 1.00 0.00 ? 15 ILE A HA 3 15
ATOM 2477 H HB . ILE A 1 15 ? 2.244 -3.081 -7.455 1.00 0.00 ? 15 ILE A HB 3 15
ATOM 2478 H HG12 . ILE A 1 15 ? 4.663 -3.230 -7.910 1.00 0.00 ? 15 ILE A HG12 3 15
ATOM 2479 H HG13 . ILE A 1 15 ? 4.331 -4.242 -9.283 1.00 0.00 ? 15 ILE A HG13 3 15
ATOM 2480 H HG21 . ILE A 1 15 ? 3.179 -5.919 -7.591 1.00 0.00 ? 15 ILE A HG21 3 15
ATOM 2481 H HG22 . ILE A 1 15 ? 3.914 -4.758 -6.519 1.00 0.00 ? 15 ILE A HG22 3 15
ATOM 2482 H HG23 . ILE A 1 15 ? 2.254 -5.129 -6.311 1.00 0.00 ? 15 ILE A HG23 3 15
ATOM 2483 H HD11 . ILE A 1 15 ? 3.167 -1.465 -9.041 1.00 0.00 ? 15 ILE A HD11 3 15
ATOM 2484 H HD12 . ILE A 1 15 ? 4.721 -1.737 -9.736 1.00 0.00 ? 15 ILE A HD12 3 15
ATOM 2485 H HD13 . ILE A 1 15 ? 3.315 -2.447 -10.468 1.00 0.00 ? 15 ILE A HD13 3 15
ATOM 2486 N N . ILE A 1 16 ? -0.526 -4.853 -7.827 1.00 0.00 ? 16 ILE A N 3 16
ATOM 2487 C CA . ILE A 1 16 ? -1.601 -5.701 -7.373 1.00 0.00 ? 16 ILE A CA 3 16
ATOM 2488 C C . ILE A 1 16 ? -2.077 -6.618 -8.487 1.00 0.00 ? 16 ILE A C 3 16
ATOM 2489 O O . ILE A 1 16 ? -2.186 -7.819 -8.292 1.00 0.00 ? 16 ILE A O 3 16
ATOM 2490 C CB . ILE A 1 16 ? -2.735 -4.858 -6.807 1.00 0.00 ? 16 ILE A CB 3 16
ATOM 2491 C CG1 . ILE A 1 16 ? -2.307 -4.047 -5.599 1.00 0.00 ? 16 ILE A CG1 3 16
ATOM 2492 C CG2 . ILE A 1 16 ? -3.916 -5.761 -6.482 1.00 0.00 ? 16 ILE A CG2 3 16
ATOM 2493 C CD1 . ILE A 1 16 ? -3.369 -3.378 -4.752 1.00 0.00 ? 16 ILE A CD1 3 16
ATOM 2494 H H . ILE A 1 16 ? -0.571 -3.865 -7.648 1.00 0.00 ? 16 ILE A H 3 16
ATOM 2495 H HA . ILE A 1 16 ? -1.244 -6.342 -6.574 1.00 0.00 ? 16 ILE A HA 3 16
ATOM 2496 H HB . ILE A 1 16 ? -3.053 -4.152 -7.566 1.00 0.00 ? 16 ILE A HB 3 16
ATOM 2497 H HG12 . ILE A 1 16 ? -1.712 -4.693 -4.953 1.00 0.00 ? 16 ILE A HG12 3 16
ATOM 2498 H HG13 . ILE A 1 16 ? -1.682 -3.254 -5.957 1.00 0.00 ? 16 ILE A HG13 3 16
ATOM 2499 H HG21 . ILE A 1 16 ? -4.735 -5.192 -6.080 1.00 0.00 ? 16 ILE A HG21 3 16
ATOM 2500 H HG22 . ILE A 1 16 ? -4.321 -6.195 -7.376 1.00 0.00 ? 16 ILE A HG22 3 16
ATOM 2501 H HG23 . ILE A 1 16 ? -3.650 -6.526 -5.789 1.00 0.00 ? 16 ILE A HG23 3 16
ATOM 2502 H HD11 . ILE A 1 16 ? -4.038 -2.801 -5.354 1.00 0.00 ? 16 ILE A HD11 3 16
ATOM 2503 H HD12 . ILE A 1 16 ? -3.888 -4.140 -4.207 1.00 0.00 ? 16 ILE A HD12 3 16
ATOM 2504 H HD13 . ILE A 1 16 ? -2.919 -2.764 -4.011 1.00 0.00 ? 16 ILE A HD13 3 16
ATOM 2505 N N . LYS A 1 17 ? -2.290 -6.058 -9.676 1.00 0.00 ? 17 LYS A N 3 17
ATOM 2506 C CA . LYS A 1 17 ? -2.690 -6.763 -10.872 1.00 0.00 ? 17 LYS A CA 3 17
ATOM 2507 C C . LYS A 1 17 ? -1.571 -7.556 -11.520 1.00 0.00 ? 17 LYS A C 3 17
ATOM 2508 O O . LYS A 1 17 ? -1.766 -8.717 -11.846 1.00 0.00 ? 17 LYS A O 3 17
ATOM 2509 C CB . LYS A 1 17 ? -3.294 -5.739 -11.821 1.00 0.00 ? 17 LYS A CB 3 17
ATOM 2510 C CG . LYS A 1 17 ? -4.692 -5.317 -11.421 1.00 0.00 ? 17 LYS A CG 3 17
ATOM 2511 C CD . LYS A 1 17 ? -5.301 -4.400 -12.436 1.00 0.00 ? 17 LYS A CD 3 17
ATOM 2512 C CE . LYS A 1 17 ? -6.680 -3.974 -12.044 1.00 0.00 ? 17 LYS A CE 3 17
ATOM 2513 N NZ . LYS A 1 17 ? -7.315 -3.102 -12.935 1.00 0.00 ? 17 LYS A NZ 3 17
ATOM 2514 H H . LYS A 1 17 ? -2.199 -5.059 -9.709 1.00 0.00 ? 17 LYS A H 3 17
ATOM 2515 H HA . LYS A 1 17 ? -3.440 -7.499 -10.618 1.00 0.00 ? 17 LYS A HA 3 17
ATOM 2516 H HB2 . LYS A 1 17 ? -2.646 -4.863 -11.865 1.00 0.00 ? 17 LYS A HB2 3 17
ATOM 2517 H HB3 . LYS A 1 17 ? -3.357 -6.148 -12.820 1.00 0.00 ? 17 LYS A HB3 3 17
ATOM 2518 H HG2 . LYS A 1 17 ? -5.318 -6.201 -11.298 1.00 0.00 ? 17 LYS A HG2 3 17
ATOM 2519 H HG3 . LYS A 1 17 ? -4.675 -4.808 -10.483 1.00 0.00 ? 17 LYS A HG3 3 17
ATOM 2520 H HD2 . LYS A 1 17 ? -4.672 -3.519 -12.559 1.00 0.00 ? 17 LYS A HD2 3 17
ATOM 2521 H HD3 . LYS A 1 17 ? -5.315 -4.898 -13.351 1.00 0.00 ? 17 LYS A HD3 3 17
ATOM 2522 H HE2 . LYS A 1 17 ? -7.295 -4.870 -11.957 1.00 0.00 ? 17 LYS A HE2 3 17
ATOM 2523 H HE3 . LYS A 1 17 ? -6.682 -3.564 -11.131 1.00 0.00 ? 17 LYS A HE3 3 17
ATOM 2524 H HZ1 . LYS A 1 17 ? -6.829 -2.292 -13.019 1.00 0.00 ? 17 LYS A HZ1 3 17
ATOM 2525 H HZ2 . LYS A 1 17 ? -7.323 -3.493 -13.817 1.00 0.00 ? 17 LYS A HZ2 3 17
ATOM 2526 H HZ3 . LYS A 1 17 ? -8.235 -2.897 -12.663 1.00 0.00 ? 17 LYS A HZ3 3 17
ATOM 2527 N N . ALA A 1 18 ? -0.385 -6.972 -11.644 1.00 0.00 ? 18 ALA A N 3 18
ATOM 2528 C CA . ALA A 1 18 ? 0.709 -7.552 -12.384 1.00 0.00 ? 18 ALA A CA 3 18
ATOM 2529 C C . ALA A 1 18 ? 1.491 -8.565 -11.596 1.00 0.00 ? 18 ALA A C 3 18
ATOM 2530 O O . ALA A 1 18 ? 1.770 -9.634 -12.093 1.00 0.00 ? 18 ALA A O 3 18
ATOM 2531 C CB . ALA A 1 18 ? 1.606 -6.480 -12.922 1.00 0.00 ? 18 ALA A CB 3 18
ATOM 2532 H H . ALA A 1 18 ? -0.291 -6.047 -11.273 1.00 0.00 ? 18 ALA A H 3 18
ATOM 2533 H HA . ALA A 1 18 ? 0.274 -8.077 -13.212 1.00 0.00 ? 18 ALA A HA 3 18
ATOM 2534 H HB1 . ALA A 1 18 ? 1.048 -5.759 -13.459 1.00 0.00 ? 18 ALA A HB1 3 18
ATOM 2535 H HB2 . ALA A 1 18 ? 2.127 -6.007 -12.128 1.00 0.00 ? 18 ALA A HB2 3 18
ATOM 2536 H HB3 . ALA A 1 18 ? 2.321 -6.929 -13.573 1.00 0.00 ? 18 ALA A HB3 3 18
ATOM 2537 N N . GLY A 1 19 ? 1.782 -8.278 -10.339 1.00 0.00 ? 19 GLY A N 3 19
ATOM 2538 C CA . GLY A 1 19 ? 2.218 -9.220 -9.341 1.00 0.00 ? 19 GLY A CA 3 19
ATOM 2539 C C . GLY A 1 19 ? 1.180 -10.285 -9.043 1.00 0.00 ? 19 GLY A C 3 19
ATOM 2540 O O . GLY A 1 19 ? 1.538 -11.429 -8.836 1.00 0.00 ? 19 GLY A O 3 19
ATOM 2541 H H . GLY A 1 19 ? 1.467 -7.400 -10.018 1.00 0.00 ? 19 GLY A H 3 19
ATOM 2542 H HA2 . GLY A 1 19 ? 3.107 -9.704 -9.701 1.00 0.00 ? 19 GLY A HA2 3 19
ATOM 2543 H HA3 . GLY A 1 19 ? 2.440 -8.681 -8.427 1.00 0.00 ? 19 GLY A HA3 3 19
ATOM 2544 N N . GLY A 1 20 ? -0.093 -9.935 -9.055 1.00 0.00 ? 20 GLY A N 3 20
ATOM 2545 C CA . GLY A 1 20 ? -1.229 -10.788 -8.823 1.00 0.00 ? 20 GLY A CA 3 20
ATOM 2546 C C . GLY A 1 20 ? -1.358 -11.191 -7.369 1.00 0.00 ? 20 GLY A C 3 20
ATOM 2547 O O . GLY A 1 20 ? -1.284 -12.377 -7.125 1.00 0.00 ? 20 GLY A O 3 20
ATOM 2548 H H . GLY A 1 20 ? -0.307 -8.985 -9.241 1.00 0.00 ? 20 GLY A H 3 20
ATOM 2549 H HA2 . GLY A 1 20 ? -2.127 -10.274 -9.107 1.00 0.00 ? 20 GLY A HA2 3 20
ATOM 2550 H HA3 . GLY A 1 20 ? -1.118 -11.673 -9.417 1.00 0.00 ? 20 GLY A HA3 3 20
ATOM 2551 N N . TYR A 1 21 ? -1.557 -10.269 -6.437 1.00 0.00 ? 21 TYR A N 3 21
ATOM 2552 C CA . TYR A 1 21 ? -1.587 -10.553 -5.038 1.00 0.00 ? 21 TYR A CA 3 21
ATOM 2553 C C . TYR A 1 21 ? -2.536 -11.639 -4.621 1.00 0.00 ? 21 TYR A C 3 21
ATOM 2554 O O . TYR A 1 21 ? -2.183 -12.459 -3.811 1.00 0.00 ? 21 TYR A O 3 21
ATOM 2555 C CB . TYR A 1 21 ? -1.896 -9.304 -4.230 1.00 0.00 ? 21 TYR A CB 3 21
ATOM 2556 C CG . TYR A 1 21 ? -0.694 -8.492 -3.843 1.00 0.00 ? 21 TYR A CG 3 21
ATOM 2557 C CD1 . TYR A 1 21 ? 0.302 -8.989 -3.004 1.00 0.00 ? 21 TYR A CD1 3 21
ATOM 2558 C CD2 . TYR A 1 21 ? -0.662 -7.158 -4.255 1.00 0.00 ? 21 TYR A CD2 3 21
ATOM 2559 C CE1 . TYR A 1 21 ? 1.377 -8.167 -2.675 1.00 0.00 ? 21 TYR A CE1 3 21
ATOM 2560 C CE2 . TYR A 1 21 ? 0.440 -6.346 -3.988 1.00 0.00 ? 21 TYR A CE2 3 21
ATOM 2561 C CZ . TYR A 1 21 ? 1.469 -6.864 -3.186 1.00 0.00 ? 21 TYR A CZ 3 21
ATOM 2562 O OH . TYR A 1 21 ? 2.547 -6.073 -2.935 1.00 0.00 ? 21 TYR A OH 3 21
ATOM 2563 H H . TYR A 1 21 ? -1.607 -9.333 -6.764 1.00 0.00 ? 21 TYR A H 3 21
ATOM 2564 H HA . TYR A 1 21 ? -0.613 -10.902 -4.764 1.00 0.00 ? 21 TYR A HA 3 21
ATOM 2565 H HB2 . TYR A 1 21 ? -2.569 -8.677 -4.814 1.00 0.00 ? 21 TYR A HB2 3 21
ATOM 2566 H HB3 . TYR A 1 21 ? -2.419 -9.551 -3.319 1.00 0.00 ? 21 TYR A HB3 3 21
ATOM 2567 H HD1 . TYR A 1 21 ? 0.269 -9.981 -2.592 1.00 0.00 ? 21 TYR A HD1 3 21
ATOM 2568 H HD2 . TYR A 1 21 ? -1.524 -6.739 -4.742 1.00 0.00 ? 21 TYR A HD2 3 21
ATOM 2569 H HE1 . TYR A 1 21 ? 2.136 -8.552 -2.033 1.00 0.00 ? 21 TYR A HE1 3 21
ATOM 2570 H HE2 . TYR A 1 21 ? 0.496 -5.328 -4.335 1.00 0.00 ? 21 TYR A HE2 3 21
ATOM 2571 H HH . TYR A 1 21 ? 3.265 -6.441 -3.407 1.00 0.00 ? 21 TYR A HH 3 21
HETATM 2572 N N . NH2 A 1 22 ? -3.730 -11.677 -5.128 1.00 0.00 ? 22 NH2 A N 3 22
HETATM 2573 H HN1 . NH2 A 1 22 ? -4.393 -12.339 -4.823 1.00 0.00 ? 22 NH2 A HN1 3 22
HETATM 2574 H HN2 . NH2 A 1 22 ? -3.944 -10.999 -5.797 1.00 0.00 ? 22 NH2 A HN2 3 22
HETATM 2575 C C . ACE B 1 1 ? 1.675 -14.026 -4.709 1.00 0.00 ? 23 ACE B C 3 1
HETATM 2576 O O . ACE B 1 1 ? 1.898 -12.914 -5.120 1.00 0.00 ? 23 ACE B O 3 1
HETATM 2577 C CH3 . ACE B 1 1 ? 1.184 -15.091 -5.631 1.00 0.00 ? 23 ACE B CH3 3 1
HETATM 2578 H H1 . ACE B 1 1 ? 0.907 -15.088 -5.942 1.00 0.00 ? 23 ACE B H1 3 1
HETATM 2579 H H2 . ACE B 1 1 ? 1.330 -15.406 -6.038 1.00 0.00 ? 23 ACE B H2 3 1
HETATM 2580 H H3 . ACE B 1 1 ? 0.978 -15.551 -5.621 1.00 0.00 ? 23 ACE B H3 3 1
ATOM 2581 N N . ALA B 1 2 ? 1.835 -14.381 -3.451 1.00 0.00 ? 24 ALA B N 3 2
ATOM 2582 C CA . ALA B 1 2 ? 2.224 -13.503 -2.394 1.00 0.00 ? 24 ALA B CA 3 2
ATOM 2583 C C . ALA B 1 2 ? 3.545 -12.822 -2.600 1.00 0.00 ? 24 ALA B C 3 2
ATOM 2584 O O . ALA B 1 2 ? 3.754 -11.741 -2.108 1.00 0.00 ? 24 ALA B O 3 2
ATOM 2585 C CB . ALA B 1 2 ? 2.206 -14.275 -1.102 1.00 0.00 ? 24 ALA B CB 3 2
ATOM 2586 H H . ALA B 1 2 ? 1.652 -15.317 -3.192 1.00 0.00 ? 24 ALA B H 3 2
ATOM 2587 H HA . ALA B 1 2 ? 1.519 -12.705 -2.319 1.00 0.00 ? 24 ALA B HA 3 2
ATOM 2588 H HB1 . ALA B 1 2 ? 2.439 -13.629 -0.295 1.00 0.00 ? 24 ALA B HB1 3 2
ATOM 2589 H HB2 . ALA B 1 2 ? 1.252 -14.696 -0.936 1.00 0.00 ? 24 ALA B HB2 3 2
ATOM 2590 H HB3 . ALA B 1 2 ? 2.938 -15.034 -1.085 1.00 0.00 ? 24 ALA B HB3 3 2
ATOM 2591 N N . LYS B 1 3 ? 4.412 -13.367 -3.427 1.00 0.00 ? 25 LYS B N 3 3
ATOM 2592 C CA . LYS B 1 3 ? 5.651 -12.777 -3.837 1.00 0.00 ? 25 LYS B CA 3 3
ATOM 2593 C C . LYS B 1 3 ? 5.562 -11.423 -4.497 1.00 0.00 ? 25 LYS B C 3 3
ATOM 2594 O O . LYS B 1 3 ? 6.556 -10.730 -4.552 1.00 0.00 ? 25 LYS B O 3 3
ATOM 2595 C CB . LYS B 1 3 ? 6.343 -13.700 -4.802 1.00 0.00 ? 25 LYS B CB 3 3
ATOM 2596 C CG . LYS B 1 3 ? 6.877 -14.955 -4.174 1.00 0.00 ? 25 LYS B CG 3 3
ATOM 2597 C CD . LYS B 1 3 ? 7.577 -15.847 -5.142 1.00 0.00 ? 25 LYS B CD 3 3
ATOM 2598 C CE . LYS B 1 3 ? 8.244 -16.991 -4.484 1.00 0.00 ? 25 LYS B CE 3 3
ATOM 2599 N NZ . LYS B 1 3 ? 8.958 -17.776 -5.404 1.00 0.00 ? 25 LYS B NZ 3 3
ATOM 2600 H H . LYS B 1 3 ? 4.173 -14.276 -3.727 1.00 0.00 ? 25 LYS B H 3 3
ATOM 2601 H HA . LYS B 1 3 ? 6.267 -12.612 -2.969 1.00 0.00 ? 25 LYS B HA 3 3
ATOM 2602 H HB2 . LYS B 1 3 ? 5.669 -13.957 -5.619 1.00 0.00 ? 25 LYS B HB2 3 3
ATOM 2603 H HB3 . LYS B 1 3 ? 7.177 -13.152 -5.188 1.00 0.00 ? 25 LYS B HB3 3 3
ATOM 2604 H HG2 . LYS B 1 3 ? 7.569 -14.689 -3.374 1.00 0.00 ? 25 LYS B HG2 3 3
ATOM 2605 H HG3 . LYS B 1 3 ? 6.071 -15.460 -3.725 1.00 0.00 ? 25 LYS B HG3 3 3
ATOM 2606 H HD2 . LYS B 1 3 ? 6.862 -16.217 -5.876 1.00 0.00 ? 25 LYS B HD2 3 3
ATOM 2607 H HD3 . LYS B 1 3 ? 8.276 -15.302 -5.642 1.00 0.00 ? 25 LYS B HD3 3 3
ATOM 2608 H HE2 . LYS B 1 3 ? 8.934 -16.613 -3.730 1.00 0.00 ? 25 LYS B HE2 3 3
ATOM 2609 H HE3 . LYS B 1 3 ? 7.566 -17.566 -3.977 1.00 0.00 ? 25 LYS B HE3 3 3
ATOM 2610 H HZ1 . LYS B 1 3 ? 8.360 -18.199 -6.034 1.00 0.00 ? 25 LYS B HZ1 3 3
ATOM 2611 H HZ2 . LYS B 1 3 ? 9.592 -17.253 -5.889 1.00 0.00 ? 25 LYS B HZ2 3 3
ATOM 2612 H HZ3 . LYS B 1 3 ? 9.482 -18.471 -4.948 1.00 0.00 ? 25 LYS B HZ3 3 3
ATOM 2613 N N . ALA B 1 4 ? 4.385 -11.017 -4.936 1.00 0.00 ? 26 ALA B N 3 4
ATOM 2614 C CA . ALA B 1 4 ? 4.013 -9.688 -5.331 1.00 0.00 ? 26 ALA B CA 3 4
ATOM 2615 C C . ALA B 1 4 ? 4.334 -8.649 -4.277 1.00 0.00 ? 26 ALA B C 3 4
ATOM 2616 O O . ALA B 1 4 ? 4.271 -7.461 -4.557 1.00 0.00 ? 26 ALA B O 3 4
ATOM 2617 C CB . ALA B 1 4 ? 2.534 -9.688 -5.671 1.00 0.00 ? 26 ALA B CB 3 4
ATOM 2618 H H . ALA B 1 4 ? 3.648 -11.672 -4.844 1.00 0.00 ? 26 ALA B H 3 4
ATOM 2619 H HA . ALA B 1 4 ? 4.567 -9.409 -6.214 1.00 0.00 ? 26 ALA B HA 3 4
ATOM 2620 H HB1 . ALA B 1 4 ? 2.325 -10.359 -6.486 1.00 0.00 ? 26 ALA B HB1 3 4
ATOM 2621 H HB2 . ALA B 1 4 ? 1.933 -9.992 -4.834 1.00 0.00 ? 26 ALA B HB2 3 4
ATOM 2622 H HB3 . ALA B 1 4 ? 2.182 -8.715 -5.949 1.00 0.00 ? 26 ALA B HB3 3 4
ATOM 2623 N N . ALA B 1 5 ? 4.643 -9.076 -3.056 1.00 0.00 ? 27 ALA B N 3 5
ATOM 2624 C CA . ALA B 1 5 ? 4.807 -8.292 -1.854 1.00 0.00 ? 27 ALA B CA 3 5
ATOM 2625 C C . ALA B 1 5 ? 5.914 -7.269 -2.035 1.00 0.00 ? 27 ALA B C 3 5
ATOM 2626 O O . ALA B 1 5 ? 5.618 -6.130 -2.361 1.00 0.00 ? 27 ALA B O 3 5
ATOM 2627 C CB . ALA B 1 5 ? 4.901 -9.224 -0.653 1.00 0.00 ? 27 ALA B CB 3 5
ATOM 2628 H H . ALA B 1 5 ? 4.772 -10.059 -2.961 1.00 0.00 ? 27 ALA B H 3 5
ATOM 2629 H HA . ALA B 1 5 ? 3.935 -7.669 -1.696 1.00 0.00 ? 27 ALA B HA 3 5
ATOM 2630 H HB1 . ALA B 1 5 ? 3.955 -9.720 -0.510 1.00 0.00 ? 27 ALA B HB1 3 5
ATOM 2631 H HB2 . ALA B 1 5 ? 5.672 -9.960 -0.813 1.00 0.00 ? 27 ALA B HB2 3 5
ATOM 2632 H HB3 . ALA B 1 5 ? 5.132 -8.671 0.239 1.00 0.00 ? 27 ALA B HB3 3 5
ATOM 2633 N N . ALA B 1 6 ? 7.174 -7.666 -1.869 1.00 0.00 ? 28 ALA B N 3 6
ATOM 2634 C CA . ALA B 1 6 ? 8.257 -6.715 -1.812 1.00 0.00 ? 28 ALA B CA 3 6
ATOM 2635 C C . ALA B 1 6 ? 8.400 -5.900 -3.081 1.00 0.00 ? 28 ALA B C 3 6
ATOM 2636 O O . ALA B 1 6 ? 8.772 -4.741 -3.039 1.00 0.00 ? 28 ALA B O 3 6
ATOM 2637 C CB . ALA B 1 6 ? 9.543 -7.452 -1.482 1.00 0.00 ? 28 ALA B CB 3 6
ATOM 2638 H H . ALA B 1 6 ? 7.327 -8.600 -1.578 1.00 0.00 ? 28 ALA B H 3 6
ATOM 2639 H HA . ALA B 1 6 ? 8.005 -6.024 -1.017 1.00 0.00 ? 28 ALA B HA 3 6
ATOM 2640 H HB1 . ALA B 1 6 ? 9.620 -8.325 -2.016 1.00 0.00 ? 28 ALA B HB1 3 6
ATOM 2641 H HB2 . ALA B 1 6 ? 10.366 -6.880 -1.667 1.00 0.00 ? 28 ALA B HB2 3 6
ATOM 2642 H HB3 . ALA B 1 6 ? 9.594 -7.666 -0.472 1.00 0.00 ? 28 ALA B HB3 3 6
ATOM 2643 N N . ALA B 1 7 ? 7.978 -6.444 -4.218 1.00 0.00 ? 29 ALA B N 3 7
ATOM 2644 C CA . ALA B 1 7 ? 8.018 -5.739 -5.480 1.00 0.00 ? 29 ALA B CA 3 7
ATOM 2645 C C . ALA B 1 7 ? 7.069 -4.568 -5.580 1.00 0.00 ? 29 ALA B C 3 7
ATOM 2646 O O . ALA B 1 7 ? 7.196 -3.752 -6.465 1.00 0.00 ? 29 ALA B O 3 7
ATOM 2647 C CB . ALA B 1 7 ? 7.781 -6.748 -6.581 1.00 0.00 ? 29 ALA B CB 3 7
ATOM 2648 H H . ALA B 1 7 ? 7.623 -7.370 -4.127 1.00 0.00 ? 29 ALA B H 3 7
ATOM 2649 H HA . ALA B 1 7 ? 8.979 -5.250 -5.571 1.00 0.00 ? 29 ALA B HA 3 7
ATOM 2650 H HB1 . ALA B 1 7 ? 6.810 -7.174 -6.481 1.00 0.00 ? 29 ALA B HB1 3 7
ATOM 2651 H HB2 . ALA B 1 7 ? 7.859 -6.250 -7.523 1.00 0.00 ? 29 ALA B HB2 3 7
ATOM 2652 H HB3 . ALA B 1 7 ? 8.495 -7.537 -6.552 1.00 0.00 ? 29 ALA B HB3 3 7
ATOM 2653 N N . ALA B 1 8 ? 6.129 -4.416 -4.663 1.00 0.00 ? 30 ALA B N 3 8
ATOM 2654 C CA . ALA B 1 8 ? 5.583 -3.146 -4.257 1.00 0.00 ? 30 ALA B CA 3 8
ATOM 2655 C C . ALA B 1 8 ? 6.138 -2.749 -2.905 1.00 0.00 ? 30 ALA B C 3 8
ATOM 2656 O O . ALA B 1 8 ? 6.881 -1.789 -2.784 1.00 0.00 ? 30 ALA B O 3 8
ATOM 2657 C CB . ALA B 1 8 ? 4.077 -3.178 -4.214 1.00 0.00 ? 30 ALA B CB 3 8
ATOM 2658 H H . ALA B 1 8 ? 5.958 -5.156 -4.013 1.00 0.00 ? 30 ALA B H 3 8
ATOM 2659 H HA . ALA B 1 8 ? 5.875 -2.393 -4.968 1.00 0.00 ? 30 ALA B HA 3 8
ATOM 2660 H HB1 . ALA B 1 8 ? 3.674 -3.116 -5.200 1.00 0.00 ? 30 ALA B HB1 3 8
ATOM 2661 H HB2 . ALA B 1 8 ? 3.703 -4.067 -3.786 1.00 0.00 ? 30 ALA B HB2 3 8
ATOM 2662 H HB3 . ALA B 1 8 ? 3.717 -2.345 -3.662 1.00 0.00 ? 30 ALA B HB3 3 8
ATOM 2663 N N . ILE B 1 9 ? 5.759 -3.450 -1.845 1.00 0.00 ? 31 ILE B N 3 9
ATOM 2664 C CA . ILE B 1 9 ? 5.776 -3.031 -0.463 1.00 0.00 ? 31 ILE B CA 3 9
ATOM 2665 C C . ILE B 1 9 ? 7.155 -2.638 0.037 1.00 0.00 ? 31 ILE B C 3 9
ATOM 2666 O O . ILE B 1 9 ? 7.262 -1.809 0.930 1.00 0.00 ? 31 ILE B O 3 9
ATOM 2667 C CB . ILE B 1 9 ? 5.169 -4.061 0.475 1.00 0.00 ? 31 ILE B CB 3 9
ATOM 2668 C CG1 . ILE B 1 9 ? 3.844 -4.658 0.039 1.00 0.00 ? 31 ILE B CG1 3 9
ATOM 2669 C CG2 . ILE B 1 9 ? 4.991 -3.508 1.879 1.00 0.00 ? 31 ILE B CG2 3 9
ATOM 2670 C CD1 . ILE B 1 9 ? 2.811 -3.633 -0.331 1.00 0.00 ? 31 ILE B CD1 3 9
ATOM 2671 H H . ILE B 1 9 ? 5.295 -4.307 -2.056 1.00 0.00 ? 31 ILE B H 3 9
ATOM 2672 H HA . ILE B 1 9 ? 5.176 -2.137 -0.379 1.00 0.00 ? 31 ILE B HA 3 9
ATOM 2673 H HB . ILE B 1 9 ? 5.908 -4.845 0.530 1.00 0.00 ? 31 ILE B HB 3 9
ATOM 2674 H HG12 . ILE B 1 9 ? 4.021 -5.303 -0.821 1.00 0.00 ? 31 ILE B HG12 3 9
ATOM 2675 H HG13 . ILE B 1 9 ? 3.441 -5.292 0.807 1.00 0.00 ? 31 ILE B HG13 3 9
ATOM 2676 H HG21 . ILE B 1 9 ? 4.536 -2.534 1.833 1.00 0.00 ? 31 ILE B HG21 3 9
ATOM 2677 H HG22 . ILE B 1 9 ? 4.318 -4.130 2.443 1.00 0.00 ? 31 ILE B HG22 3 9
ATOM 2678 H HG23 . ILE B 1 9 ? 5.927 -3.469 2.412 1.00 0.00 ? 31 ILE B HG23 3 9
ATOM 2679 H HD11 . ILE B 1 9 ? 3.117 -3.059 -0.990 1.00 0.00 ? 31 ILE B HD11 3 9
ATOM 2680 H HD12 . ILE B 1 9 ? 2.008 -4.010 -0.684 1.00 0.00 ? 31 ILE B HD12 3 9
ATOM 2681 H HD13 . ILE B 1 9 ? 2.593 -3.086 0.376 1.00 0.00 ? 31 ILE B HD13 3 9
ATOM 2682 N N . LYS B 1 10 ? 8.232 -3.185 -0.516 1.00 0.00 ? 32 LYS B N 3 10
ATOM 2683 C CA . LYS B 1 10 ? 9.574 -2.941 -0.038 1.00 0.00 ? 32 LYS B CA 3 10
ATOM 2684 C C . LYS B 1 10 ? 10.111 -1.607 -0.523 1.00 0.00 ? 32 LYS B C 3 10
ATOM 2685 O O . LYS B 1 10 ? 10.681 -0.872 0.265 1.00 0.00 ? 32 LYS B O 3 10
ATOM 2686 C CB . LYS B 1 10 ? 10.426 -4.126 -0.473 1.00 0.00 ? 32 LYS B CB 3 10
ATOM 2687 C CG . LYS B 1 10 ? 11.810 -4.267 0.136 1.00 0.00 ? 32 LYS B CG 3 10
ATOM 2688 C CD . LYS B 1 10 ? 12.819 -3.292 -0.399 1.00 0.00 ? 32 LYS B CD 3 10
ATOM 2689 C CE . LYS B 1 10 ? 14.202 -3.896 -0.475 1.00 0.00 ? 32 LYS B CE 3 10
ATOM 2690 N NZ . LYS B 1 10 ? 14.822 -4.115 0.783 1.00 0.00 ? 32 LYS B NZ 3 10
ATOM 2691 H H . LYS B 1 10 ? 8.066 -3.720 -1.345 1.00 0.00 ? 32 LYS B H 3 10
ATOM 2692 H HA . LYS B 1 10 ? 9.527 -2.862 1.042 1.00 0.00 ? 32 LYS B HA 3 10
ATOM 2693 H HB2 . LYS B 1 10 ? 9.870 -5.035 -0.245 1.00 0.00 ? 32 LYS B HB2 3 10
ATOM 2694 H HB3 . LYS B 1 10 ? 10.533 -4.095 -1.542 1.00 0.00 ? 32 LYS B HB3 3 10
ATOM 2695 H HG2 . LYS B 1 10 ? 11.750 -4.168 1.219 1.00 0.00 ? 32 LYS B HG2 3 10
ATOM 2696 H HG3 . LYS B 1 10 ? 12.118 -5.267 -0.107 1.00 0.00 ? 32 LYS B HG3 3 10
ATOM 2697 H HD2 . LYS B 1 10 ? 12.514 -2.988 -1.400 1.00 0.00 ? 32 LYS B HD2 3 10
ATOM 2698 H HD3 . LYS B 1 10 ? 12.831 -2.394 0.172 1.00 0.00 ? 32 LYS B HD3 3 10
ATOM 2699 H HE2 . LYS B 1 10 ? 14.154 -4.843 -1.014 1.00 0.00 ? 32 LYS B HE2 3 10
ATOM 2700 H HE3 . LYS B 1 10 ? 14.779 -3.232 -1.040 1.00 0.00 ? 32 LYS B HE3 3 10
ATOM 2701 H HZ1 . LYS B 1 10 ? 14.605 -4.019 1.293 1.00 0.00 ? 32 LYS B HZ1 3 10
ATOM 2702 H HZ2 . LYS B 1 10 ? 15.028 -4.600 0.976 1.00 0.00 ? 32 LYS B HZ2 3 10
ATOM 2703 H HZ3 . LYS B 1 10 ? 15.281 -3.895 0.998 1.00 0.00 ? 32 LYS B HZ3 3 10
ATOM 2704 N N . ALA B 1 11 ? 9.835 -1.234 -1.768 1.00 0.00 ? 33 ALA B N 3 11
ATOM 2705 C CA . ALA B 1 11 ? 9.968 0.107 -2.279 1.00 0.00 ? 33 ALA B CA 3 11
ATOM 2706 C C . ALA B 1 11 ? 8.977 1.042 -1.611 1.00 0.00 ? 33 ALA B C 3 11
ATOM 2707 O O . ALA B 1 11 ? 9.340 2.107 -1.137 1.00 0.00 ? 33 ALA B O 3 11
ATOM 2708 C CB . ALA B 1 11 ? 9.796 0.064 -3.788 1.00 0.00 ? 33 ALA B CB 3 11
ATOM 2709 H H . ALA B 1 11 ? 9.321 -1.881 -2.340 1.00 0.00 ? 33 ALA B H 3 11
ATOM 2710 H HA . ALA B 1 11 ? 10.966 0.460 -2.034 1.00 0.00 ? 33 ALA B HA 3 11
ATOM 2711 H HB1 . ALA B 1 11 ? 10.551 -0.520 -4.263 1.00 0.00 ? 33 ALA B HB1 3 11
ATOM 2712 H HB2 . ALA B 1 11 ? 8.856 -0.346 -4.067 1.00 0.00 ? 33 ALA B HB2 3 11
ATOM 2713 H HB3 . ALA B 1 11 ? 9.886 1.048 -4.193 1.00 0.00 ? 33 ALA B HB3 3 11
ATOM 2714 N N . ILE B 1 12 ? 7.727 0.627 -1.444 1.00 0.00 ? 34 ILE B N 3 12
ATOM 2715 C CA . ILE B 1 12 ? 6.651 1.501 -1.038 1.00 0.00 ? 34 ILE B CA 3 12
ATOM 2716 C C . ILE B 1 12 ? 6.778 1.872 0.427 1.00 0.00 ? 34 ILE B C 3 12
ATOM 2717 O O . ILE B 1 12 ? 6.616 3.045 0.730 1.00 0.00 ? 34 ILE B O 3 12
ATOM 2718 C CB . ILE B 1 12 ? 5.307 0.932 -1.440 1.00 0.00 ? 34 ILE B CB 3 12
ATOM 2719 C CG1 . ILE B 1 12 ? 5.014 1.155 -2.856 1.00 0.00 ? 34 ILE B CG1 3 12
ATOM 2720 C CG2 . ILE B 1 12 ? 4.154 1.324 -0.631 1.00 0.00 ? 34 ILE B CG2 3 12
ATOM 2721 C CD1 . ILE B 1 12 ? 5.265 1.617 -3.812 1.00 0.00 ? 34 ILE B CD1 3 12
ATOM 2722 H H . ILE B 1 12 ? 7.547 -0.343 -1.607 1.00 0.00 ? 34 ILE B H 3 12
ATOM 2723 H HA . ILE B 1 12 ? 6.759 2.458 -1.532 1.00 0.00 ? 34 ILE B HA 3 12
ATOM 2724 H HB . ILE B 1 12 ? 5.403 -0.096 -1.317 1.00 0.00 ? 34 ILE B HB 3 12
ATOM 2725 H HG12 . ILE B 1 12 ? 5.032 0.121 -3.198 1.00 0.00 ? 34 ILE B HG12 3 12
ATOM 2726 H HG13 . ILE B 1 12 ? 4.611 1.280 -2.996 1.00 0.00 ? 34 ILE B HG13 3 12
ATOM 2727 H HG21 . ILE B 1 12 ? 4.048 2.351 -0.685 1.00 0.00 ? 34 ILE B HG21 3 12
ATOM 2728 H HG22 . ILE B 1 12 ? 3.310 0.811 -1.022 1.00 0.00 ? 34 ILE B HG22 3 12
ATOM 2729 H HG23 . ILE B 1 12 ? 4.318 1.050 0.359 1.00 0.00 ? 34 ILE B HG23 3 12
ATOM 2730 H HD11 . ILE B 1 12 ? 5.618 1.509 -3.773 1.00 0.00 ? 34 ILE B HD11 3 12
ATOM 2731 H HD12 . ILE B 1 12 ? 5.106 1.736 -4.781 1.00 0.00 ? 34 ILE B HD12 3 12
ATOM 2732 H HD13 . ILE B 1 12 ? 5.250 1.930 -3.596 1.00 0.00 ? 34 ILE B HD13 3 12
ATOM 2733 N N . ALA B 1 13 ? 7.175 0.976 1.328 1.00 0.00 ? 35 ALA B N 3 13
ATOM 2734 C CA . ALA B 1 13 ? 7.323 1.342 2.719 1.00 0.00 ? 35 ALA B CA 3 13
ATOM 2735 C C . ALA B 1 13 ? 8.421 2.355 2.960 1.00 0.00 ? 35 ALA B C 3 13
ATOM 2736 O O . ALA B 1 13 ? 8.382 3.042 3.968 1.00 0.00 ? 35 ALA B O 3 13
ATOM 2737 C CB . ALA B 1 13 ? 7.592 0.073 3.507 1.00 0.00 ? 35 ALA B CB 3 13
ATOM 2738 H H . ALA B 1 13 ? 7.353 0.038 1.013 1.00 0.00 ? 35 ALA B H 3 13
ATOM 2739 H HA . ALA B 1 13 ? 6.402 1.783 3.075 1.00 0.00 ? 35 ALA B HA 3 13
ATOM 2740 H HB1 . ALA B 1 13 ? 6.814 -0.641 3.343 1.00 0.00 ? 35 ALA B HB1 3 13
ATOM 2741 H HB2 . ALA B 1 13 ? 8.527 -0.353 3.206 1.00 0.00 ? 35 ALA B HB2 3 13
ATOM 2742 H HB3 . ALA B 1 13 ? 7.640 0.297 4.556 1.00 0.00 ? 35 ALA B HB3 3 13
ATOM 2743 N N . ALA B 1 14 ? 9.336 2.526 2.010 1.00 0.00 ? 36 ALA B N 3 14
ATOM 2744 C CA . ALA B 1 14 ? 10.354 3.550 1.976 1.00 0.00 ? 36 ALA B CA 3 14
ATOM 2745 C C . ALA B 1 14 ? 9.905 4.820 1.273 1.00 0.00 ? 36 ALA B C 3 14
ATOM 2746 O O . ALA B 1 14 ? 10.159 5.904 1.767 1.00 0.00 ? 36 ALA B O 3 14
ATOM 2747 C CB . ALA B 1 14 ? 11.599 2.970 1.327 1.00 0.00 ? 36 ALA B CB 3 14
ATOM 2748 H H . ALA B 1 14 ? 9.201 1.935 1.226 1.00 0.00 ? 36 ALA B H 3 14
ATOM 2749 H HA . ALA B 1 14 ? 10.637 3.821 2.989 1.00 0.00 ? 36 ALA B HA 3 14
ATOM 2750 H HB1 . ALA B 1 14 ? 12.365 3.719 1.219 1.00 0.00 ? 36 ALA B HB1 3 14
ATOM 2751 H HB2 . ALA B 1 14 ? 12.006 2.173 1.909 1.00 0.00 ? 36 ALA B HB2 3 14
ATOM 2752 H HB3 . ALA B 1 14 ? 11.371 2.593 0.355 1.00 0.00 ? 36 ALA B HB3 3 14
ATOM 2753 N N . ILE B 1 15 ? 9.161 4.699 0.180 1.00 0.00 ? 37 ILE B N 3 15
ATOM 2754 C CA . ILE B 1 15 ? 8.490 5.766 -0.531 1.00 0.00 ? 37 ILE B CA 3 15
ATOM 2755 C C . ILE B 1 15 ? 7.436 6.408 0.352 1.00 0.00 ? 37 ILE B C 3 15
ATOM 2756 O O . ILE B 1 15 ? 7.228 7.608 0.290 1.00 0.00 ? 37 ILE B O 3 15
ATOM 2757 C CB . ILE B 1 15 ? 7.951 5.237 -1.854 1.00 0.00 ? 37 ILE B CB 3 15
ATOM 2758 C CG1 . ILE B 1 15 ? 9.052 4.901 -2.842 1.00 0.00 ? 37 ILE B CG1 3 15
ATOM 2759 C CG2 . ILE B 1 15 ? 6.928 6.137 -2.511 1.00 0.00 ? 37 ILE B CG2 3 15
ATOM 2760 C CD1 . ILE B 1 15 ? 8.659 3.919 -3.918 1.00 0.00 ? 37 ILE B CD1 3 15
ATOM 2761 H H . ILE B 1 15 ? 9.041 3.745 -0.111 1.00 0.00 ? 37 ILE B H 3 15
ATOM 2762 H HA . ILE B 1 15 ? 9.235 6.512 -0.781 1.00 0.00 ? 37 ILE B HA 3 15
ATOM 2763 H HB . ILE B 1 15 ? 7.392 4.349 -1.628 1.00 0.00 ? 37 ILE B HB 3 15
ATOM 2764 H HG12 . ILE B 1 15 ? 9.409 5.821 -3.304 1.00 0.00 ? 37 ILE B HG12 3 15
ATOM 2765 H HG13 . ILE B 1 15 ? 9.870 4.447 -2.309 1.00 0.00 ? 37 ILE B HG13 3 15
ATOM 2766 H HG21 . ILE B 1 15 ? 6.582 5.767 -3.455 1.00 0.00 ? 37 ILE B HG21 3 15
ATOM 2767 H HG22 . ILE B 1 15 ? 6.070 6.233 -1.879 1.00 0.00 ? 37 ILE B HG22 3 15
ATOM 2768 H HG23 . ILE B 1 15 ? 7.305 7.104 -2.697 1.00 0.00 ? 37 ILE B HG23 3 15
ATOM 2769 H HD11 . ILE B 1 15 ? 8.276 3.040 -3.468 1.00 0.00 ? 37 ILE B HD11 3 15
ATOM 2770 H HD12 . ILE B 1 15 ? 7.945 4.352 -4.578 1.00 0.00 ? 37 ILE B HD12 3 15
ATOM 2771 H HD13 . ILE B 1 15 ? 9.508 3.608 -4.479 1.00 0.00 ? 37 ILE B HD13 3 15
ATOM 2772 N N . ILE B 1 16 ? 6.808 5.667 1.257 1.00 0.00 ? 38 ILE B N 3 16
ATOM 2773 C CA . ILE B 1 16 ? 5.880 6.187 2.234 1.00 0.00 ? 38 ILE B CA 3 16
ATOM 2774 C C . ILE B 1 16 ? 6.547 7.198 3.147 1.00 0.00 ? 38 ILE B C 3 16
ATOM 2775 O O . ILE B 1 16 ? 6.097 8.324 3.268 1.00 0.00 ? 38 ILE B O 3 16
ATOM 2776 C CB . ILE B 1 16 ? 5.246 5.028 2.986 1.00 0.00 ? 38 ILE B CB 3 16
ATOM 2777 C CG1 . ILE B 1 16 ? 4.213 4.361 2.098 1.00 0.00 ? 38 ILE B CG1 3 16
ATOM 2778 C CG2 . ILE B 1 16 ? 4.604 5.514 4.273 1.00 0.00 ? 38 ILE B CG2 3 16
ATOM 2779 C CD1 . ILE B 1 16 ? 3.427 3.212 2.684 1.00 0.00 ? 38 ILE B CD1 3 16
ATOM 2780 H H . ILE B 1 16 ? 6.964 4.682 1.253 1.00 0.00 ? 38 ILE B H 3 16
ATOM 2781 H HA . ILE B 1 16 ? 5.082 6.715 1.724 1.00 0.00 ? 38 ILE B HA 3 16
ATOM 2782 H HB . ILE B 1 16 ? 6.038 4.316 3.189 1.00 0.00 ? 38 ILE B HB 3 16
ATOM 2783 H HG12 . ILE B 1 16 ? 3.491 5.127 1.816 1.00 0.00 ? 38 ILE B HG12 3 16
ATOM 2784 H HG13 . ILE B 1 16 ? 4.678 4.081 1.174 1.00 0.00 ? 38 ILE B HG13 3 16
ATOM 2785 H HG21 . ILE B 1 16 ? 4.163 4.724 4.834 1.00 0.00 ? 38 ILE B HG21 3 16
ATOM 2786 H HG22 . ILE B 1 16 ? 5.326 5.907 4.927 1.00 0.00 ? 38 ILE B HG22 3 16
ATOM 2787 H HG23 . ILE B 1 16 ? 3.860 6.249 4.076 1.00 0.00 ? 38 ILE B HG23 3 16
ATOM 2788 H HD11 . ILE B 1 16 ? 2.788 3.641 3.396 1.00 0.00 ? 38 ILE B HD11 3 16
ATOM 2789 H HD12 . ILE B 1 16 ? 2.875 2.746 1.916 1.00 0.00 ? 38 ILE B HD12 3 16
ATOM 2790 H HD13 . ILE B 1 16 ? 4.086 2.514 3.106 1.00 0.00 ? 38 ILE B HD13 3 16
ATOM 2791 N N . LYS B 1 17 ? 7.656 6.788 3.750 1.00 0.00 ? 39 LYS B N 3 17
ATOM 2792 C CA . LYS B 1 17 ? 8.509 7.563 4.617 1.00 0.00 ? 39 LYS B CA 3 17
ATOM 2793 C C . LYS B 1 17 ? 9.061 8.807 3.951 1.00 0.00 ? 39 LYS B C 3 17
ATOM 2794 O O . LYS B 1 17 ? 9.164 9.842 4.586 1.00 0.00 ? 39 LYS B O 3 17
ATOM 2795 C CB . LYS B 1 17 ? 9.612 6.634 5.097 1.00 0.00 ? 39 LYS B CB 3 17
ATOM 2796 C CG . LYS B 1 17 ? 9.224 5.637 6.169 1.00 0.00 ? 39 LYS B CG 3 17
ATOM 2797 C CD . LYS B 1 17 ? 10.401 4.729 6.391 1.00 0.00 ? 39 LYS B CD 3 17
ATOM 2798 C CE . LYS B 1 17 ? 10.070 3.693 7.407 1.00 0.00 ? 39 LYS B CE 3 17
ATOM 2799 N NZ . LYS B 1 17 ? 11.141 2.757 7.588 1.00 0.00 ? 39 LYS B NZ 3 17
ATOM 2800 H H . LYS B 1 17 ? 7.865 5.834 3.561 1.00 0.00 ? 39 LYS B H 3 17
ATOM 2801 H HA . LYS B 1 17 ? 7.941 7.897 5.477 1.00 0.00 ? 39 LYS B HA 3 17
ATOM 2802 H HB2 . LYS B 1 17 ? 10.008 6.089 4.239 1.00 0.00 ? 39 LYS B HB2 3 17
ATOM 2803 H HB3 . LYS B 1 17 ? 10.404 7.242 5.495 1.00 0.00 ? 39 LYS B HB3 3 17
ATOM 2804 H HG2 . LYS B 1 17 ? 8.943 6.144 7.092 1.00 0.00 ? 39 LYS B HG2 3 17
ATOM 2805 H HG3 . LYS B 1 17 ? 8.380 5.070 5.830 1.00 0.00 ? 39 LYS B HG3 3 17
ATOM 2806 H HD2 . LYS B 1 17 ? 10.686 4.254 5.452 1.00 0.00 ? 39 LYS B HD2 3 17
ATOM 2807 H HD3 . LYS B 1 17 ? 11.229 5.277 6.728 1.00 0.00 ? 39 LYS B HD3 3 17
ATOM 2808 H HE2 . LYS B 1 17 ? 9.836 4.174 8.357 1.00 0.00 ? 39 LYS B HE2 3 17
ATOM 2809 H HE3 . LYS B 1 17 ? 9.231 3.167 7.107 1.00 0.00 ? 39 LYS B HE3 3 17
ATOM 2810 H HZ1 . LYS B 1 17 ? 11.913 3.175 7.884 1.00 0.00 ? 39 LYS B HZ1 3 17
ATOM 2811 H HZ2 . LYS B 1 17 ? 10.947 2.089 8.246 1.00 0.00 ? 39 LYS B HZ2 3 17
ATOM 2812 H HZ3 . LYS B 1 17 ? 11.370 2.312 6.815 1.00 0.00 ? 39 LYS B HZ3 3 17
ATOM 2813 N N . ALA B 1 18 ? 9.371 8.767 2.662 1.00 0.00 ? 40 ALA B N 3 18
ATOM 2814 C CA . ALA B 1 18 ? 9.803 9.898 1.884 1.00 0.00 ? 40 ALA B CA 3 18
ATOM 2815 C C . ALA B 1 18 ? 8.671 10.770 1.403 1.00 0.00 ? 40 ALA B C 3 18
ATOM 2816 O O . ALA B 1 18 ? 8.842 11.951 1.238 1.00 0.00 ? 40 ALA B O 3 18
ATOM 2817 C CB . ALA B 1 18 ? 10.622 9.358 0.736 1.00 0.00 ? 40 ALA B CB 3 18
ATOM 2818 H H . ALA B 1 18 ? 9.267 7.873 2.228 1.00 0.00 ? 40 ALA B H 3 18
ATOM 2819 H HA . ALA B 1 18 ? 10.444 10.510 2.507 1.00 0.00 ? 40 ALA B HA 3 18
ATOM 2820 H HB1 . ALA B 1 18 ? 11.440 8.814 1.128 1.00 0.00 ? 40 ALA B HB1 3 18
ATOM 2821 H HB2 . ALA B 1 18 ? 10.021 8.732 0.111 1.00 0.00 ? 40 ALA B HB2 3 18
ATOM 2822 H HB3 . ALA B 1 18 ? 10.982 10.159 0.118 1.00 0.00 ? 40 ALA B HB3 3 18
ATOM 2823 N N . GLY B 1 19 ? 7.511 10.184 1.186 1.00 0.00 ? 41 GLY B N 3 19
ATOM 2824 C CA . GLY B 1 19 ? 6.298 10.778 0.681 1.00 0.00 ? 41 GLY B CA 3 19
ATOM 2825 C C . GLY B 1 19 ? 5.654 11.676 1.709 1.00 0.00 ? 41 GLY B C 3 19
ATOM 2826 O O . GLY B 1 19 ? 5.153 12.735 1.389 1.00 0.00 ? 41 GLY B O 3 19
ATOM 2827 H H . GLY B 1 19 ? 7.497 9.196 1.284 1.00 0.00 ? 41 GLY B H 3 19
ATOM 2828 H HA2 . GLY B 1 19 ? 6.477 11.354 -0.213 1.00 0.00 ? 41 GLY B HA2 3 19
ATOM 2829 H HA3 . GLY B 1 19 ? 5.593 10.001 0.426 1.00 0.00 ? 41 GLY B HA3 3 19
ATOM 2830 N N . GLY B 1 20 ? 5.676 11.225 2.955 1.00 0.00 ? 42 GLY B N 3 20
ATOM 2831 C CA . GLY B 1 20 ? 5.165 11.906 4.113 1.00 0.00 ? 42 GLY B CA 3 20
ATOM 2832 C C . GLY B 1 20 ? 3.701 11.670 4.369 1.00 0.00 ? 42 GLY B C 3 20
ATOM 2833 O O . GLY B 1 20 ? 3.039 12.555 4.896 1.00 0.00 ? 42 GLY B O 3 20
ATOM 2834 H H . GLY B 1 20 ? 6.122 10.344 3.090 1.00 0.00 ? 42 GLY B H 3 20
ATOM 2835 H HA2 . GLY B 1 20 ? 5.720 11.583 4.936 1.00 0.00 ? 42 GLY B HA2 3 20
ATOM 2836 H HA3 . GLY B 1 20 ? 5.295 12.947 3.994 1.00 0.00 ? 42 GLY B HA3 3 20
ATOM 2837 N N . TYR B 1 21 ? 3.181 10.516 3.976 1.00 0.00 ? 43 TYR B N 3 21
ATOM 2838 C CA . TYR B 1 21 ? 1.812 10.134 3.962 1.00 0.00 ? 43 TYR B CA 3 21
ATOM 2839 C C . TYR B 1 21 ? 1.116 10.273 5.276 1.00 0.00 ? 43 TYR B C 3 21
ATOM 2840 O O . TYR B 1 21 ? -0.043 10.538 5.334 1.00 0.00 ? 43 TYR B O 3 21
ATOM 2841 C CB . TYR B 1 21 ? 1.774 8.673 3.540 1.00 0.00 ? 43 TYR B CB 3 21
ATOM 2842 C CG . TYR B 1 21 ? 1.546 8.382 2.081 1.00 0.00 ? 43 TYR B CG 3 21
ATOM 2843 C CD1 . TYR B 1 21 ? 0.366 8.688 1.406 1.00 0.00 ? 43 TYR B CD1 3 21
ATOM 2844 C CD2 . TYR B 1 21 ? 2.513 7.610 1.457 1.00 0.00 ? 43 TYR B CD2 3 21
ATOM 2845 C CE1 . TYR B 1 21 ? 0.123 8.144 0.142 1.00 0.00 ? 43 TYR B CE1 3 21
ATOM 2846 C CE2 . TYR B 1 21 ? 2.283 7.022 0.214 1.00 0.00 ? 43 TYR B CE2 3 21
ATOM 2847 C CZ . TYR B 1 21 ? 1.071 7.288 -0.432 1.00 0.00 ? 43 TYR B CZ 3 21
ATOM 2848 O OH . TYR B 1 21 ? 0.883 6.791 -1.684 1.00 0.00 ? 43 TYR B OH 3 21
ATOM 2849 H H . TYR B 1 21 ? 3.828 9.819 3.669 1.00 0.00 ? 43 TYR B H 3 21
ATOM 2850 H HA . TYR B 1 21 ? 1.293 10.740 3.253 1.00 0.00 ? 43 TYR B HA 3 21
ATOM 2851 H HB2 . TYR B 1 21 ? 2.727 8.230 3.830 1.00 0.00 ? 43 TYR B HB2 3 21
ATOM 2852 H HB3 . TYR B 1 21 ? 1.016 8.098 4.037 1.00 0.00 ? 43 TYR B HB3 3 21
ATOM 2853 H HD1 . TYR B 1 21 ? -0.395 9.296 1.840 1.00 0.00 ? 43 TYR B HD1 3 21
ATOM 2854 H HD2 . TYR B 1 21 ? 3.408 7.424 2.016 1.00 0.00 ? 43 TYR B HD2 3 21
ATOM 2855 H HE1 . TYR B 1 21 ? -0.780 8.365 -0.395 1.00 0.00 ? 43 TYR B HE1 3 21
ATOM 2856 H HE2 . TYR B 1 21 ? 3.007 6.370 -0.232 1.00 0.00 ? 43 TYR B HE2 3 21
ATOM 2857 H HH . TYR B 1 21 ? 1.455 7.316 -2.226 1.00 0.00 ? 43 TYR B HH 3 21
HETATM 2858 N N . NH2 B 1 22 ? 1.772 10.150 6.378 1.00 0.00 ? 44 NH2 B N 3 22
HETATM 2859 H HN1 . NH2 B 1 22 ? 1.320 10.273 7.241 1.00 0.00 ? 44 NH2 B HN1 3 22
HETATM 2860 H HN2 . NH2 B 1 22 ? 2.734 9.942 6.310 1.00 0.00 ? 44 NH2 B HN2 3 22
HETATM 2861 C C . ACE C 1 1 ? -7.451 14.255 -2.584 1.00 0.00 ? 45 ACE C C 3 1
HETATM 2862 O O . ACE C 1 1 ? -7.084 14.875 -1.612 1.00 0.00 ? 45 ACE C O 3 1
HETATM 2863 C CH3 . ACE C 1 1 ? -8.453 14.863 -3.500 1.00 0.00 ? 45 ACE C CH3 3 1
HETATM 2864 H H1 . ACE C 1 1 ? -8.858 14.762 -3.772 1.00 0.00 ? 45 ACE C H1 3 1
HETATM 2865 H H2 . ACE C 1 1 ? -8.826 15.222 -3.515 1.00 0.00 ? 45 ACE C H2 3 1
HETATM 2866 H H3 . ACE C 1 1 ? -8.398 15.066 -3.862 1.00 0.00 ? 45 ACE C H3 3 1
ATOM 2867 N N . ALA C 1 2 ? -7.066 13.018 -2.873 1.00 0.00 ? 46 ALA C N 3 2
ATOM 2868 C CA . ALA C 1 2 ? -6.088 12.224 -2.182 1.00 0.00 ? 46 ALA C CA 3 2
ATOM 2869 C C . ALA C 1 2 ? -6.360 11.909 -0.730 1.00 0.00 ? 46 ALA C C 3 2
ATOM 2870 O O . ALA C 1 2 ? -5.544 11.273 -0.090 1.00 0.00 ? 46 ALA C O 3 2
ATOM 2871 C CB . ALA C 1 2 ? -4.711 12.769 -2.412 1.00 0.00 ? 46 ALA C CB 3 2
ATOM 2872 H H . ALA C 1 2 ? -7.430 12.618 -3.697 1.00 0.00 ? 46 ALA C H 3 2
ATOM 2873 H HA . ALA C 1 2 ? -6.091 11.277 -2.673 1.00 0.00 ? 46 ALA C HA 3 2
ATOM 2874 H HB1 . ALA C 1 2 ? -3.957 12.115 -2.027 1.00 0.00 ? 46 ALA C HB1 3 2
ATOM 2875 H HB2 . ALA C 1 2 ? -4.564 12.903 -3.469 1.00 0.00 ? 46 ALA C HB2 3 2
ATOM 2876 H HB3 . ALA C 1 2 ? -4.570 13.704 -1.925 1.00 0.00 ? 46 ALA C HB3 3 2
ATOM 2877 N N . LYS C 1 3 ? -7.514 12.253 -0.179 1.00 0.00 ? 47 LYS C N 3 3
ATOM 2878 C CA . LYS C 1 3 ? -7.902 12.034 1.189 1.00 0.00 ? 47 LYS C CA 3 3
ATOM 2879 C C . LYS C 1 3 ? -7.972 10.577 1.602 1.00 0.00 ? 47 LYS C C 3 3
ATOM 2880 O O . LYS C 1 3 ? -7.952 10.288 2.790 1.00 0.00 ? 47 LYS C O 3 3
ATOM 2881 C CB . LYS C 1 3 ? -9.225 12.680 1.480 1.00 0.00 ? 47 LYS C CB 3 3
ATOM 2882 C CG . LYS C 1 3 ? -9.294 14.162 1.278 1.00 0.00 ? 47 LYS C CG 3 3
ATOM 2883 C CD . LYS C 1 3 ? -10.634 14.696 1.653 1.00 0.00 ? 47 LYS C CD 3 3
ATOM 2884 C CE . LYS C 1 3 ? -10.762 16.156 1.640 1.00 0.00 ? 47 LYS C CE 3 3
ATOM 2885 N NZ . LYS C 1 3 ? -10.809 16.704 0.412 1.00 0.00 ? 47 LYS C NZ 3 3
ATOM 2886 H H . LYS C 1 3 ? -8.192 12.681 -0.756 1.00 0.00 ? 47 LYS C H 3 3
ATOM 2887 H HA . LYS C 1 3 ? -7.138 12.433 1.822 1.00 0.00 ? 47 LYS C HA 3 3
ATOM 2888 H HB2 . LYS C 1 3 ? -10.000 12.205 0.878 1.00 0.00 ? 47 LYS C HB2 3 3
ATOM 2889 H HB3 . LYS C 1 3 ? -9.404 12.474 2.502 1.00 0.00 ? 47 LYS C HB3 3 3
ATOM 2890 H HG2 . LYS C 1 3 ? -8.526 14.648 1.879 1.00 0.00 ? 47 LYS C HG2 3 3
ATOM 2891 H HG3 . LYS C 1 3 ? -9.095 14.400 0.282 1.00 0.00 ? 47 LYS C HG3 3 3
ATOM 2892 H HD2 . LYS C 1 3 ? -11.388 14.269 0.990 1.00 0.00 ? 47 LYS C HD2 3 3
ATOM 2893 H HD3 . LYS C 1 3 ? -10.811 14.361 2.608 1.00 0.00 ? 47 LYS C HD3 3 3
ATOM 2894 H HE2 . LYS C 1 3 ? -11.660 16.440 2.188 1.00 0.00 ? 47 LYS C HE2 3 3
ATOM 2895 H HE3 . LYS C 1 3 ? -9.999 16.527 2.111 1.00 0.00 ? 47 LYS C HE3 3 3
ATOM 2896 H HZ1 . LYS C 1 3 ? -10.780 16.632 0.031 1.00 0.00 ? 47 LYS C HZ1 3 3
ATOM 2897 H HZ2 . LYS C 1 3 ? -11.046 16.917 0.122 1.00 0.00 ? 47 LYS C HZ2 3 3
ATOM 2898 H HZ3 . LYS C 1 3 ? -10.662 17.020 0.155 1.00 0.00 ? 47 LYS C HZ3 3 3
ATOM 2899 N N . ALA C 1 4 ? -8.027 9.643 0.660 1.00 0.00 ? 48 ALA C N 3 4
ATOM 2900 C CA . ALA C 1 4 ? -7.839 8.227 0.836 1.00 0.00 ? 48 ALA C CA 3 4
ATOM 2901 C C . ALA C 1 4 ? -6.533 7.852 1.506 1.00 0.00 ? 48 ALA C C 3 4
ATOM 2902 O O . ALA C 1 4 ? -6.339 6.717 1.918 1.00 0.00 ? 48 ALA C O 3 4
ATOM 2903 C CB . ALA C 1 4 ? -7.896 7.586 -0.538 1.00 0.00 ? 48 ALA C CB 3 4
ATOM 2904 H H . ALA C 1 4 ? -8.123 10.010 -0.265 1.00 0.00 ? 48 ALA C H 3 4
ATOM 2905 H HA . ALA C 1 4 ? -8.660 7.847 1.433 1.00 0.00 ? 48 ALA C HA 3 4
ATOM 2906 H HB1 . ALA C 1 4 ? -7.104 7.983 -1.161 1.00 0.00 ? 48 ALA C HB1 3 4
ATOM 2907 H HB2 . ALA C 1 4 ? -7.766 6.518 -0.448 1.00 0.00 ? 48 ALA C HB2 3 4
ATOM 2908 H HB3 . ALA C 1 4 ? -8.840 7.790 -1.016 1.00 0.00 ? 48 ALA C HB3 3 4
ATOM 2909 N N . ALA C 1 5 ? -5.614 8.808 1.636 1.00 0.00 ? 49 ALA C N 3 5
ATOM 2910 C CA . ALA C 1 5 ? -4.225 8.645 1.971 1.00 0.00 ? 49 ALA C CA 3 5
ATOM 2911 C C . ALA C 1 5 ? -4.073 8.140 3.392 1.00 0.00 ? 49 ALA C C 3 5
ATOM 2912 O O . ALA C 1 5 ? -4.022 6.935 3.597 1.00 0.00 ? 49 ALA C O 3 5
ATOM 2913 C CB . ALA C 1 5 ? -3.447 9.893 1.595 1.00 0.00 ? 49 ALA C CB 3 5
ATOM 2914 H H . ALA C 1 5 ? -5.926 9.727 1.394 1.00 0.00 ? 49 ALA C H 3 5
ATOM 2915 H HA . ALA C 1 5 ? -3.819 7.851 1.358 1.00 0.00 ? 49 ALA C HA 3 5
ATOM 2916 H HB1 . ALA C 1 5 ? -3.436 9.941 0.518 1.00 0.00 ? 49 ALA C HB1 3 5
ATOM 2917 H HB2 . ALA C 1 5 ? -3.860 10.796 2.015 1.00 0.00 ? 49 ALA C HB2 3 5
ATOM 2918 H HB3 . ALA C 1 5 ? -2.436 9.786 1.933 1.00 0.00 ? 49 ALA C HB3 3 5
ATOM 2919 N N . ALA C 1 6 ? -4.015 8.999 4.402 1.00 0.00 ? 50 ALA C N 3 6
ATOM 2920 C CA . ALA C 1 6 ? -3.833 8.532 5.756 1.00 0.00 ? 50 ALA C CA 3 6
ATOM 2921 C C . ALA C 1 6 ? -4.911 7.573 6.225 1.00 0.00 ? 50 ALA C C 3 6
ATOM 2922 O O . ALA C 1 6 ? -4.648 6.643 6.969 1.00 0.00 ? 50 ALA C O 3 6
ATOM 2923 C CB . ALA C 1 6 ? -3.698 9.722 6.683 1.00 0.00 ? 50 ALA C CB 3 6
ATOM 2924 H H . ALA C 1 6 ? -4.040 9.983 4.216 1.00 0.00 ? 50 ALA C H 3 6
ATOM 2925 H HA . ALA C 1 6 ? -2.896 7.996 5.747 1.00 0.00 ? 50 ALA C HA 3 6
ATOM 2926 H HB1 . ALA C 1 6 ? -3.667 9.441 7.647 1.00 0.00 ? 50 ALA C HB1 3 6
ATOM 2927 H HB2 . ALA C 1 6 ? -2.842 10.246 6.509 1.00 0.00 ? 50 ALA C HB2 3 6
ATOM 2928 H HB3 . ALA C 1 6 ? -4.485 10.346 6.613 1.00 0.00 ? 50 ALA C HB3 3 6
ATOM 2929 N N . ALA C 1 7 ? -6.127 7.691 5.701 1.00 0.00 ? 51 ALA C N 3 7
ATOM 2930 C CA . ALA C 1 7 ? -7.238 6.810 5.956 1.00 0.00 ? 51 ALA C CA 3 7
ATOM 2931 C C . ALA C 1 7 ? -7.029 5.371 5.529 1.00 0.00 ? 51 ALA C C 3 7
ATOM 2932 O O . ALA C 1 7 ? -7.700 4.511 6.040 1.00 0.00 ? 51 ALA C O 3 7
ATOM 2933 C CB . ALA C 1 7 ? -8.488 7.397 5.327 1.00 0.00 ? 51 ALA C CB 3 7
ATOM 2934 H H . ALA C 1 7 ? -6.212 8.450 5.059 1.00 0.00 ? 51 ALA C H 3 7
ATOM 2935 H HA . ALA C 1 7 ? -7.367 6.771 7.026 1.00 0.00 ? 51 ALA C HA 3 7
ATOM 2936 H HB1 . ALA C 1 7 ? -9.351 6.825 5.611 1.00 0.00 ? 51 ALA C HB1 3 7
ATOM 2937 H HB2 . ALA C 1 7 ? -8.630 8.401 5.688 1.00 0.00 ? 51 ALA C HB2 3 7
ATOM 2938 H HB3 . ALA C 1 7 ? -8.396 7.375 4.260 1.00 0.00 ? 51 ALA C HB3 3 7
ATOM 2939 N N . ALA C 1 8 ? -6.067 5.061 4.684 1.00 0.00 ? 52 ALA C N 3 8
ATOM 2940 C CA . ALA C 1 8 ? -5.460 3.762 4.561 1.00 0.00 ? 52 ALA C CA 3 8
ATOM 2941 C C . ALA C 1 8 ? -4.100 3.753 5.220 1.00 0.00 ? 52 ALA C C 3 8
ATOM 2942 O O . ALA C 1 8 ? -3.858 2.995 6.144 1.00 0.00 ? 52 ALA C O 3 8
ATOM 2943 C CB . ALA C 1 8 ? -5.341 3.401 3.091 1.00 0.00 ? 52 ALA C CB 3 8
ATOM 2944 H H . ALA C 1 8 ? -5.613 5.834 4.250 1.00 0.00 ? 52 ALA C H 3 8
ATOM 2945 H HA . ALA C 1 8 ? -6.101 3.036 5.044 1.00 0.00 ? 52 ALA C HA 3 8
ATOM 2946 H HB1 . ALA C 1 8 ? -5.097 2.777 2.832 1.00 0.00 ? 52 ALA C HB1 3 8
ATOM 2947 H HB2 . ALA C 1 8 ? -5.866 3.389 2.729 1.00 0.00 ? 52 ALA C HB2 3 8
ATOM 2948 H HB3 . ALA C 1 8 ? -4.978 3.720 2.637 1.00 0.00 ? 52 ALA C HB3 3 8
ATOM 2949 N N . ILE C 1 9 ? -3.178 4.581 4.732 1.00 0.00 ? 53 ILE C N 3 9
ATOM 2950 C CA . ILE C 1 9 ? -1.751 4.441 4.900 1.00 0.00 ? 53 ILE C CA 3 9
ATOM 2951 C C . ILE C 1 9 ? -1.325 4.601 6.350 1.00 0.00 ? 53 ILE C C 3 9
ATOM 2952 O O . ILE C 1 9 ? -0.354 3.985 6.772 1.00 0.00 ? 53 ILE C O 3 9
ATOM 2953 C CB . ILE C 1 9 ? -0.994 5.424 4.019 1.00 0.00 ? 53 ILE C CB 3 9
ATOM 2954 C CG1 . ILE C 1 9 ? -1.362 5.391 2.545 1.00 0.00 ? 53 ILE C CG1 3 9
ATOM 2955 C CG2 . ILE C 1 9 ? 0.496 5.146 4.107 1.00 0.00 ? 53 ILE C CG2 3 9
ATOM 2956 C CD1 . ILE C 1 9 ? -1.441 4.016 1.918 1.00 0.00 ? 53 ILE C CD1 3 9
ATOM 2957 H H . ILE C 1 9 ? -3.475 5.255 4.072 1.00 0.00 ? 53 ILE C H 3 9
ATOM 2958 H HA . ILE C 1 9 ? -1.468 3.426 4.637 1.00 0.00 ? 53 ILE C HA 3 9
ATOM 2959 H HB . ILE C 1 9 ? -1.195 6.408 4.427 1.00 0.00 ? 53 ILE C HB 3 9
ATOM 2960 H HG12 . ILE C 1 9 ? -2.324 5.888 2.424 1.00 0.00 ? 53 ILE C HG12 3 9
ATOM 2961 H HG13 . ILE C 1 9 ? -0.651 5.932 1.950 1.00 0.00 ? 53 ILE C HG13 3 9
ATOM 2962 H HG21 . ILE C 1 9 ? 0.674 4.099 4.018 1.00 0.00 ? 53 ILE C HG21 3 9
ATOM 2963 H HG22 . ILE C 1 9 ? 1.036 5.641 3.339 1.00 0.00 ? 53 ILE C HG22 3 9
ATOM 2964 H HG23 . ILE C 1 9 ? 0.875 5.521 5.037 1.00 0.00 ? 53 ILE C HG23 3 9
ATOM 2965 H HD11 . ILE C 1 9 ? -1.584 3.478 2.224 1.00 0.00 ? 53 ILE C HD11 3 9
ATOM 2966 H HD12 . ILE C 1 9 ? -1.882 3.888 1.441 1.00 0.00 ? 53 ILE C HD12 3 9
ATOM 2967 H HD13 . ILE C 1 9 ? -0.926 3.743 1.615 1.00 0.00 ? 53 ILE C HD13 3 9
ATOM 2968 N N . LYS C 1 10 ? -2.069 5.351 7.157 1.00 0.00 ? 54 LYS C N 3 10
ATOM 2969 C CA . LYS C 1 10 ? -1.744 5.579 8.548 1.00 0.00 ? 54 LYS C CA 3 10
ATOM 2970 C C . LYS C 1 10 ? -1.982 4.354 9.411 1.00 0.00 ? 54 LYS C C 3 10
ATOM 2971 O O . LYS C 1 10 ? -1.142 4.010 10.224 1.00 0.00 ? 54 LYS C O 3 10
ATOM 2972 C CB . LYS C 1 10 ? -2.487 6.829 8.992 1.00 0.00 ? 54 LYS C CB 3 10
ATOM 2973 C CG . LYS C 1 10 ? -1.767 7.731 9.975 1.00 0.00 ? 54 LYS C CG 3 10
ATOM 2974 C CD . LYS C 1 10 ? -1.779 7.242 11.273 1.00 0.00 ? 54 LYS C CD 3 10
ATOM 2975 C CE . LYS C 1 10 ? -1.076 8.116 12.258 1.00 0.00 ? 54 LYS C CE 3 10
ATOM 2976 N NZ . LYS C 1 10 ? -1.726 9.177 12.631 1.00 0.00 ? 54 LYS C NZ 3 10
ATOM 2977 H H . LYS C 1 10 ? -2.952 5.711 6.848 1.00 0.00 ? 54 LYS C H 3 10
ATOM 2978 H HA . LYS C 1 10 ? -0.671 5.741 8.570 1.00 0.00 ? 54 LYS C HA 3 10
ATOM 2979 H HB2 . LYS C 1 10 ? -2.704 7.423 8.104 1.00 0.00 ? 54 LYS C HB2 3 10
ATOM 2980 H HB3 . LYS C 1 10 ? -3.448 6.515 9.367 1.00 0.00 ? 54 LYS C HB3 3 10
ATOM 2981 H HG2 . LYS C 1 10 ? -0.735 7.861 9.647 1.00 0.00 ? 54 LYS C HG2 3 10
ATOM 2982 H HG3 . LYS C 1 10 ? -2.196 8.652 9.991 1.00 0.00 ? 54 LYS C HG3 3 10
ATOM 2983 H HD2 . LYS C 1 10 ? -2.811 7.100 11.594 1.00 0.00 ? 54 LYS C HD2 3 10
ATOM 2984 H HD3 . LYS C 1 10 ? -1.353 6.381 11.261 1.00 0.00 ? 54 LYS C HD3 3 10
ATOM 2985 H HE2 . LYS C 1 10 ? -0.838 7.532 13.147 1.00 0.00 ? 54 LYS C HE2 3 10
ATOM 2986 H HE3 . LYS C 1 10 ? -0.255 8.346 11.837 1.00 0.00 ? 54 LYS C HE3 3 10
ATOM 2987 H HZ1 . LYS C 1 10 ? -1.645 9.678 12.661 1.00 0.00 ? 54 LYS C HZ1 3 10
ATOM 2988 H HZ2 . LYS C 1 10 ? -2.110 9.255 12.482 1.00 0.00 ? 54 LYS C HZ2 3 10
ATOM 2989 H HZ3 . LYS C 1 10 ? -1.915 9.426 13.050 1.00 0.00 ? 54 LYS C HZ3 3 10
ATOM 2990 N N . ALA C 1 11 ? -3.074 3.652 9.138 1.00 0.00 ? 55 ALA C N 3 11
ATOM 2991 C CA . ALA C 1 11 ? -3.271 2.318 9.646 1.00 0.00 ? 55 ALA C CA 3 11
ATOM 2992 C C . ALA C 1 11 ? -2.312 1.326 9.017 1.00 0.00 ? 55 ALA C C 3 11
ATOM 2993 O O . ALA C 1 11 ? -1.786 0.458 9.696 1.00 0.00 ? 55 ALA C O 3 11
ATOM 2994 C CB . ALA C 1 11 ? -4.715 1.895 9.466 1.00 0.00 ? 55 ALA C CB 3 11
ATOM 2995 H H . ALA C 1 11 ? -3.688 3.989 8.426 1.00 0.00 ? 55 ALA C H 3 11
ATOM 2996 H HA . ALA C 1 11 ? -3.062 2.309 10.708 1.00 0.00 ? 55 ALA C HA 3 11
ATOM 2997 H HB1 . ALA C 1 11 ? -4.843 0.917 9.875 1.00 0.00 ? 55 ALA C HB1 3 11
ATOM 2998 H HB2 . ALA C 1 11 ? -5.342 2.575 10.007 1.00 0.00 ? 55 ALA C HB2 3 11
ATOM 2999 H HB3 . ALA C 1 11 ? -5.002 1.889 8.429 1.00 0.00 ? 55 ALA C HB3 3 11
ATOM 3000 N N . ILE C 1 12 ? -2.057 1.448 7.720 1.00 0.00 ? 56 ILE C N 3 12
ATOM 3001 C CA . ILE C 1 12 ? -1.404 0.415 6.949 1.00 0.00 ? 56 ILE C CA 3 12
ATOM 3002 C C . ILE C 1 12 ? 0.093 0.448 7.185 1.00 0.00 ? 56 ILE C C 3 12
ATOM 3003 O O . ILE C 1 12 ? 0.667 -0.621 7.328 1.00 0.00 ? 56 ILE C O 3 12
ATOM 3004 C CB . ILE C 1 12 ? -1.886 0.410 5.512 1.00 0.00 ? 56 ILE C CB 3 12
ATOM 3005 C CG1 . ILE C 1 12 ? -3.267 -0.206 5.483 1.00 0.00 ? 56 ILE C CG1 3 12
ATOM 3006 C CG2 . ILE C 1 12 ? -0.961 -0.367 4.616 1.00 0.00 ? 56 ILE C CG2 3 12
ATOM 3007 C CD1 . ILE C 1 12 ? -4.011 -0.168 4.173 1.00 0.00 ? 56 ILE C CD1 3 12
ATOM 3008 H H . ILE C 1 12 ? -2.394 2.268 7.251 1.00 0.00 ? 56 ILE C H 3 12
ATOM 3009 H HA . ILE C 1 12 ? -1.682 -0.552 7.349 1.00 0.00 ? 56 ILE C HA 3 12
ATOM 3010 H HB . ILE C 1 12 ? -1.923 1.416 5.130 1.00 0.00 ? 56 ILE C HB 3 12
ATOM 3011 H HG12 . ILE C 1 12 ? -3.181 -1.244 5.803 1.00 0.00 ? 56 ILE C HG12 3 12
ATOM 3012 H HG13 . ILE C 1 12 ? -3.906 0.301 6.185 1.00 0.00 ? 56 ILE C HG13 3 12
ATOM 3013 H HG21 . ILE C 1 12 ? 0.015 0.066 4.577 1.00 0.00 ? 56 ILE C HG21 3 12
ATOM 3014 H HG22 . ILE C 1 12 ? -0.849 -1.365 4.969 1.00 0.00 ? 56 ILE C HG22 3 12
ATOM 3015 H HG23 . ILE C 1 12 ? -1.341 -0.393 3.613 1.00 0.00 ? 56 ILE C HG23 3 12
ATOM 3016 H HD11 . ILE C 1 12 ? -3.831 -0.009 3.586 1.00 0.00 ? 56 ILE C HD11 3 12
ATOM 3017 H HD12 . ILE C 1 12 ? -4.299 -0.650 3.916 1.00 0.00 ? 56 ILE C HD12 3 12
ATOM 3018 H HD13 . ILE C 1 12 ? -4.468 0.150 4.068 1.00 0.00 ? 56 ILE C HD13 3 12
ATOM 3019 N N . ALA C 1 13 ? 0.739 1.588 7.411 1.00 0.00 ? 57 ALA C N 3 13
ATOM 3020 C CA . ALA C 1 13 ? 2.125 1.638 7.820 1.00 0.00 ? 57 ALA C CA 3 13
ATOM 3021 C C . ALA C 1 13 ? 2.397 1.012 9.175 1.00 0.00 ? 57 ALA C C 3 13
ATOM 3022 O O . ALA C 1 13 ? 3.517 0.637 9.462 1.00 0.00 ? 57 ALA C O 3 13
ATOM 3023 C CB . ALA C 1 13 ? 2.627 3.070 7.719 1.00 0.00 ? 57 ALA C CB 3 13
ATOM 3024 H H . ALA C 1 13 ? 0.180 2.415 7.327 1.00 0.00 ? 57 ALA C H 3 13
ATOM 3025 H HA . ALA C 1 13 ? 2.705 1.079 7.098 1.00 0.00 ? 57 ALA C HA 3 13
ATOM 3026 H HB1 . ALA C 1 13 ? 2.436 3.437 6.727 1.00 0.00 ? 57 ALA C HB1 3 13
ATOM 3027 H HB2 . ALA C 1 13 ? 2.120 3.690 8.438 1.00 0.00 ? 57 ALA C HB2 3 13
ATOM 3028 H HB3 . ALA C 1 13 ? 3.684 3.086 7.918 1.00 0.00 ? 57 ALA C HB3 3 13
ATOM 3029 N N . ALA C 1 14 ? 1.366 0.841 9.977 1.00 0.00 ? 58 ALA C N 3 14
ATOM 3030 C CA . ALA C 1 14 ? 1.353 0.119 11.227 1.00 0.00 ? 58 ALA C CA 3 14
ATOM 3031 C C . ALA C 1 14 ? 1.005 -1.345 11.065 1.00 0.00 ? 58 ALA C C 3 14
ATOM 3032 O O . ALA C 1 14 ? 1.628 -2.183 11.689 1.00 0.00 ? 58 ALA C O 3 14
ATOM 3033 C CB . ALA C 1 14 ? 0.450 0.804 12.229 1.00 0.00 ? 58 ALA C CB 3 14
ATOM 3034 H H . ALA C 1 14 ? 0.500 1.177 9.611 1.00 0.00 ? 58 ALA C H 3 14
ATOM 3035 H HA . ALA C 1 14 ? 2.345 0.191 11.647 1.00 0.00 ? 58 ALA C HA 3 14
ATOM 3036 H HB1 . ALA C 1 14 ? 0.787 1.629 12.483 1.00 0.00 ? 58 ALA C HB1 3 14
ATOM 3037 H HB2 . ALA C 1 14 ? -0.462 0.947 11.979 1.00 0.00 ? 58 ALA C HB2 3 14
ATOM 3038 H HB3 . ALA C 1 14 ? 0.401 0.311 13.045 1.00 0.00 ? 58 ALA C HB3 3 14
ATOM 3039 N N . ILE C 1 15 ? 0.097 -1.687 10.159 1.00 0.00 ? 59 ILE C N 3 15
ATOM 3040 C CA . ILE C 1 15 ? -0.231 -3.027 9.726 1.00 0.00 ? 59 ILE C CA 3 15
ATOM 3041 C C . ILE C 1 15 ? 0.945 -3.682 9.028 1.00 0.00 ? 59 ILE C C 3 15
ATOM 3042 O O . ILE C 1 15 ? 1.216 -4.860 9.224 1.00 0.00 ? 59 ILE C O 3 15
ATOM 3043 C CB . ILE C 1 15 ? -1.499 -3.053 8.894 1.00 0.00 ? 59 ILE C CB 3 15
ATOM 3044 C CG1 . ILE C 1 15 ? -2.699 -2.735 9.769 1.00 0.00 ? 59 ILE C CG1 3 15
ATOM 3045 C CG2 . ILE C 1 15 ? -1.750 -4.329 8.111 1.00 0.00 ? 59 ILE C CG2 3 15
ATOM 3046 C CD1 . ILE C 1 15 ? -3.835 -2.064 9.022 1.00 0.00 ? 59 ILE C CD1 3 15
ATOM 3047 H H . ILE C 1 15 ? -0.373 -0.905 9.781 1.00 0.00 ? 59 ILE C H 3 15
ATOM 3048 H HA . ILE C 1 15 ? -0.415 -3.646 10.592 1.00 0.00 ? 59 ILE C HA 3 15
ATOM 3049 H HB . ILE C 1 15 ? -1.371 -2.275 8.162 1.00 0.00 ? 59 ILE C HB 3 15
ATOM 3050 H HG12 . ILE C 1 15 ? -3.065 -3.659 10.218 1.00 0.00 ? 59 ILE C HG12 3 15
ATOM 3051 H HG13 . ILE C 1 15 ? -2.388 -2.091 10.581 1.00 0.00 ? 59 ILE C HG13 3 15
ATOM 3052 H HG21 . ILE C 1 15 ? -1.857 -5.142 8.802 1.00 0.00 ? 59 ILE C HG21 3 15
ATOM 3053 H HG22 . ILE C 1 15 ? -2.660 -4.218 7.537 1.00 0.00 ? 59 ILE C HG22 3 15
ATOM 3054 H HG23 . ILE C 1 15 ? -0.931 -4.511 7.430 1.00 0.00 ? 59 ILE C HG23 3 15
ATOM 3055 H HD11 . ILE C 1 15 ? -3.941 -1.732 8.678 1.00 0.00 ? 59 ILE C HD11 3 15
ATOM 3056 H HD12 . ILE C 1 15 ? -4.212 -2.175 8.733 1.00 0.00 ? 59 ILE C HD12 3 15
ATOM 3057 H HD13 . ILE C 1 15 ? -4.217 -1.813 9.140 1.00 0.00 ? 59 ILE C HD13 3 15
ATOM 3058 N N . ILE C 1 16 ? 1.756 -2.944 8.272 1.00 0.00 ? 60 ILE C N 3 16
ATOM 3059 C CA . ILE C 1 16 ? 3.001 -3.381 7.681 1.00 0.00 ? 60 ILE C CA 3 16
ATOM 3060 C C . ILE C 1 16 ? 3.970 -3.887 8.733 1.00 0.00 ? 60 ILE C C 3 16
ATOM 3061 O O . ILE C 1 16 ? 4.484 -4.988 8.605 1.00 0.00 ? 60 ILE C O 3 16
ATOM 3062 C CB . ILE C 1 16 ? 3.550 -2.231 6.850 1.00 0.00 ? 60 ILE C CB 3 16
ATOM 3063 C CG1 . ILE C 1 16 ? 2.739 -2.203 5.570 1.00 0.00 ? 60 ILE C CG1 3 16
ATOM 3064 C CG2 . ILE C 1 16 ? 5.028 -2.349 6.520 1.00 0.00 ? 60 ILE C CG2 3 16
ATOM 3065 C CD1 . ILE C 1 16 ? 3.149 -1.197 4.513 1.00 0.00 ? 60 ILE C CD1 3 16
ATOM 3066 H H . ILE C 1 16 ? 1.486 -1.999 8.081 1.00 0.00 ? 60 ILE C H 3 16
ATOM 3067 H HA . ILE C 1 16 ? 2.811 -4.227 7.028 1.00 0.00 ? 60 ILE C HA 3 16
ATOM 3068 H HB . ILE C 1 16 ? 3.415 -1.327 7.430 1.00 0.00 ? 60 ILE C HB 3 16
ATOM 3069 H HG12 . ILE C 1 16 ? 2.797 -3.194 5.120 1.00 0.00 ? 60 ILE C HG12 3 16
ATOM 3070 H HG13 . ILE C 1 16 ? 1.705 -2.058 5.828 1.00 0.00 ? 60 ILE C HG13 3 16
ATOM 3071 H HG21 . ILE C 1 16 ? 5.391 -1.457 6.066 1.00 0.00 ? 60 ILE C HG21 3 16
ATOM 3072 H HG22 . ILE C 1 16 ? 5.653 -2.494 7.377 1.00 0.00 ? 60 ILE C HG22 3 16
ATOM 3073 H HG23 . ILE C 1 16 ? 5.188 -3.193 5.886 1.00 0.00 ? 60 ILE C HG23 3 16
ATOM 3074 H HD11 . ILE C 1 16 ? 3.950 -1.481 4.089 1.00 0.00 ? 60 ILE C HD11 3 16
ATOM 3075 H HD12 . ILE C 1 16 ? 2.517 -1.117 3.807 1.00 0.00 ? 60 ILE C HD12 3 16
ATOM 3076 H HD13 . ILE C 1 16 ? 3.276 -0.325 4.843 1.00 0.00 ? 60 ILE C HD13 3 16
ATOM 3077 N N . LYS C 1 17 ? 4.199 -3.053 9.745 1.00 0.00 ? 61 LYS C N 3 17
ATOM 3078 C CA . LYS C 1 17 ? 5.018 -3.334 10.895 1.00 0.00 ? 61 LYS C CA 3 17
ATOM 3079 C C . LYS C 1 17 ? 4.540 -4.532 11.691 1.00 0.00 ? 61 LYS C C 3 17
ATOM 3080 O O . LYS C 1 17 ? 5.345 -5.337 12.087 1.00 0.00 ? 61 LYS C O 3 17
ATOM 3081 C CB . LYS C 1 17 ? 5.048 -2.085 11.762 1.00 0.00 ? 61 LYS C CB 3 17
ATOM 3082 C CG . LYS C 1 17 ? 5.981 -1.041 11.196 1.00 0.00 ? 61 LYS C CG 3 17
ATOM 3083 C CD . LYS C 1 17 ? 5.925 0.227 12.020 1.00 0.00 ? 61 LYS C CD 3 17
ATOM 3084 C CE . LYS C 1 17 ? 6.738 1.342 11.430 1.00 0.00 ? 61 LYS C CE 3 17
ATOM 3085 N NZ . LYS C 1 17 ? 6.119 1.913 10.265 1.00 0.00 ? 61 LYS C NZ 3 17
ATOM 3086 H H . LYS C 1 17 ? 3.742 -2.166 9.694 1.00 0.00 ? 61 LYS C H 3 17
ATOM 3087 H HA . LYS C 1 17 ? 6.027 -3.557 10.569 1.00 0.00 ? 61 LYS C HA 3 17
ATOM 3088 H HB2 . LYS C 1 17 ? 4.043 -1.670 11.828 1.00 0.00 ? 61 LYS C HB2 3 17
ATOM 3089 H HB3 . LYS C 1 17 ? 5.331 -2.334 12.768 1.00 0.00 ? 61 LYS C HB3 3 17
ATOM 3090 H HG2 . LYS C 1 17 ? 7.002 -1.422 11.167 1.00 0.00 ? 61 LYS C HG2 3 17
ATOM 3091 H HG3 . LYS C 1 17 ? 5.676 -0.835 10.190 1.00 0.00 ? 61 LYS C HG3 3 17
ATOM 3092 H HD2 . LYS C 1 17 ? 4.888 0.549 12.122 1.00 0.00 ? 61 LYS C HD2 3 17
ATOM 3093 H HD3 . LYS C 1 17 ? 6.291 0.014 12.992 1.00 0.00 ? 61 LYS C HD3 3 17
ATOM 3094 H HE2 . LYS C 1 17 ? 6.878 2.123 12.178 1.00 0.00 ? 61 LYS C HE2 3 17
ATOM 3095 H HE3 . LYS C 1 17 ? 7.696 0.967 11.199 1.00 0.00 ? 61 LYS C HE3 3 17
ATOM 3096 H HZ1 . LYS C 1 17 ? 6.578 2.690 9.910 1.00 0.00 ? 61 LYS C HZ1 3 17
ATOM 3097 H HZ2 . LYS C 1 17 ? 6.033 1.278 9.546 1.00 0.00 ? 61 LYS C HZ2 3 17
ATOM 3098 H HZ3 . LYS C 1 17 ? 5.235 2.223 10.480 1.00 0.00 ? 61 LYS C HZ3 3 17
ATOM 3099 N N . ALA C 1 18 ? 3.238 -4.721 11.836 1.00 0.00 ? 62 ALA C N 3 18
ATOM 3100 C CA . ALA C 1 18 ? 2.619 -5.850 12.484 1.00 0.00 ? 62 ALA C CA 3 18
ATOM 3101 C C . ALA C 1 18 ? 2.630 -7.116 11.649 1.00 0.00 ? 62 ALA C C 3 18
ATOM 3102 O O . ALA C 1 18 ? 2.780 -8.198 12.158 1.00 0.00 ? 62 ALA C O 3 18
ATOM 3103 C CB . ALA C 1 18 ? 1.219 -5.525 12.947 1.00 0.00 ? 62 ALA C CB 3 18
ATOM 3104 H H . ALA C 1 18 ? 2.622 -4.035 11.458 1.00 0.00 ? 62 ALA C H 3 18
ATOM 3105 H HA . ALA C 1 18 ? 3.197 -6.050 13.371 1.00 0.00 ? 62 ALA C HA 3 18
ATOM 3106 H HB1 . ALA C 1 18 ? 0.966 -5.002 12.861 1.00 0.00 ? 62 ALA C HB1 3 18
ATOM 3107 H HB2 . ALA C 1 18 ? 0.646 -5.750 12.771 1.00 0.00 ? 62 ALA C HB2 3 18
ATOM 3108 H HB3 . ALA C 1 18 ? 0.970 -5.579 13.521 1.00 0.00 ? 62 ALA C HB3 3 18
ATOM 3109 N N . GLY C 1 19 ? 2.482 -6.984 10.354 1.00 0.00 ? 63 GLY C N 3 19
ATOM 3110 C CA . GLY C 1 19 ? 2.480 -8.041 9.370 1.00 0.00 ? 63 GLY C CA 3 19
ATOM 3111 C C . GLY C 1 19 ? 3.845 -8.624 9.093 1.00 0.00 ? 63 GLY C C 3 19
ATOM 3112 O O . GLY C 1 19 ? 3.944 -9.755 8.662 1.00 0.00 ? 63 GLY C O 3 19
ATOM 3113 H H . GLY C 1 19 ? 2.252 -6.070 10.071 1.00 0.00 ? 63 GLY C H 3 19
ATOM 3114 H HA2 . GLY C 1 19 ? 1.838 -8.835 9.698 1.00 0.00 ? 63 GLY C HA2 3 19
ATOM 3115 H HA3 . GLY C 1 19 ? 2.057 -7.656 8.453 1.00 0.00 ? 63 GLY C HA3 3 19
ATOM 3116 N N . GLY C 1 20 ? 4.908 -7.873 9.309 1.00 0.00 ? 64 GLY C N 3 20
ATOM 3117 C CA . GLY C 1 20 ? 6.257 -8.308 9.116 1.00 0.00 ? 64 GLY C CA 3 20
ATOM 3118 C C . GLY C 1 20 ? 6.676 -8.404 7.666 1.00 0.00 ? 64 GLY C C 3 20
ATOM 3119 O O . GLY C 1 20 ? 7.263 -9.390 7.256 1.00 0.00 ? 64 GLY C O 3 20
ATOM 3120 H H . GLY C 1 20 ? 4.700 -6.963 9.616 1.00 0.00 ? 64 GLY C H 3 20
ATOM 3121 H HA2 . GLY C 1 20 ? 6.902 -7.593 9.586 1.00 0.00 ? 64 GLY C HA2 3 20
ATOM 3122 H HA3 . GLY C 1 20 ? 6.414 -9.260 9.598 1.00 0.00 ? 64 GLY C HA3 3 20
ATOM 3123 N N . TYR C 1 21 ? 6.311 -7.444 6.820 1.00 0.00 ? 65 TYR C N 3 21
ATOM 3124 C CA . TYR C 1 21 ? 6.676 -7.315 5.435 1.00 0.00 ? 65 TYR C CA 3 21
ATOM 3125 C C . TYR C 1 21 ? 8.151 -7.113 5.226 1.00 0.00 ? 65 TYR C C 3 21
ATOM 3126 O O . TYR C 1 21 ? 8.670 -7.416 4.205 1.00 0.00 ? 65 TYR C O 3 21
ATOM 3127 C CB . TYR C 1 21 ? 5.903 -6.119 4.911 1.00 0.00 ? 65 TYR C CB 3 21
ATOM 3128 C CG . TYR C 1 21 ? 4.570 -6.428 4.289 1.00 0.00 ? 65 TYR C CG 3 21
ATOM 3129 C CD1 . TYR C 1 21 ? 4.407 -7.236 3.181 1.00 0.00 ? 65 TYR C CD1 3 21
ATOM 3130 C CD2 . TYR C 1 21 ? 3.472 -5.741 4.781 1.00 0.00 ? 65 TYR C CD2 3 21
ATOM 3131 C CE1 . TYR C 1 21 ? 3.147 -7.377 2.599 1.00 0.00 ? 65 TYR C CE1 3 21
ATOM 3132 C CE2 . TYR C 1 21 ? 2.220 -5.830 4.182 1.00 0.00 ? 65 TYR C CE2 3 21
ATOM 3133 C CZ . TYR C 1 21 ? 2.045 -6.672 3.082 1.00 0.00 ? 65 TYR C CZ 3 21
ATOM 3134 O OH . TYR C 1 21 ? 0.810 -6.849 2.567 1.00 0.00 ? 65 TYR C OH 3 21
ATOM 3135 H H . TYR C 1 21 ? 5.831 -6.675 7.248 1.00 0.00 ? 65 TYR C H 3 21
ATOM 3136 H HA . TYR C 1 21 ? 6.364 -8.183 4.875 1.00 0.00 ? 65 TYR C HA 3 21
ATOM 3137 H HB2 . TYR C 1 21 ? 5.741 -5.438 5.747 1.00 0.00 ? 65 TYR C HB2 3 21
ATOM 3138 H HB3 . TYR C 1 21 ? 6.457 -5.553 4.173 1.00 0.00 ? 65 TYR C HB3 3 21
ATOM 3139 H HD1 . TYR C 1 21 ? 5.215 -7.801 2.796 1.00 0.00 ? 65 TYR C HD1 3 21
ATOM 3140 H HD2 . TYR C 1 21 ? 3.616 -5.142 5.633 1.00 0.00 ? 65 TYR C HD2 3 21
ATOM 3141 H HE1 . TYR C 1 21 ? 2.994 -8.017 1.759 1.00 0.00 ? 65 TYR C HE1 3 21
ATOM 3142 H HE2 . TYR C 1 21 ? 1.414 -5.268 4.606 1.00 0.00 ? 65 TYR C HE2 3 21
ATOM 3143 H HH . TYR C 1 21 ? 0.254 -7.242 3.210 1.00 0.00 ? 65 TYR C HH 3 21
HETATM 3144 N N . NH2 C 1 22 ? 8.869 -6.609 6.158 1.00 0.00 ? 66 NH2 C N 3 22
HETATM 3145 H HN1 . NH2 C 1 22 ? 9.836 -6.494 5.988 1.00 0.00 ? 66 NH2 C HN1 3 22
HETATM 3146 H HN2 . NH2 C 1 22 ? 8.436 -6.266 6.939 1.00 0.00 ? 66 NH2 C HN2 3 22
HETATM 3147 C C . ACE D 1 1 ? 6.859 -11.385 3.643 1.00 0.00 ? 67 ACE D C 3 1
HETATM 3148 O O . ACE D 1 1 ? 6.701 -10.292 3.159 1.00 0.00 ? 67 ACE D O 3 1
HETATM 3149 C CH3 . ACE D 1 1 ? 8.099 -11.697 4.421 1.00 0.00 ? 67 ACE D CH3 3 1
HETATM 3150 H H1 . ACE D 1 1 ? 8.288 -12.154 4.620 1.00 0.00 ? 67 ACE D H1 3 1
HETATM 3151 H H2 . ACE D 1 1 ? 8.699 -11.651 4.378 1.00 0.00 ? 67 ACE D H2 3 1
HETATM 3152 H H3 . ACE D 1 1 ? 8.198 -11.497 4.837 1.00 0.00 ? 67 ACE D H3 3 1
ATOM 3153 N N . ALA D 1 2 ? 5.957 -12.338 3.551 1.00 0.00 ? 68 ALA D N 3 2
ATOM 3154 C CA . ALA D 1 2 ? 4.714 -12.241 2.841 1.00 0.00 ? 68 ALA D CA 3 2
ATOM 3155 C C . ALA D 1 2 ? 3.536 -12.840 3.578 1.00 0.00 ? 68 ALA D C 3 2
ATOM 3156 O O . ALA D 1 2 ? 2.493 -13.073 2.990 1.00 0.00 ? 68 ALA D O 3 2
ATOM 3157 C CB . ALA D 1 2 ? 4.906 -12.813 1.457 1.00 0.00 ? 68 ALA D CB 3 2
ATOM 3158 H H . ALA D 1 2 ? 6.195 -13.216 3.955 1.00 0.00 ? 68 ALA D H 3 2
ATOM 3159 H HA . ALA D 1 2 ? 4.491 -11.198 2.722 1.00 0.00 ? 68 ALA D HA 3 2
ATOM 3160 H HB1 . ALA D 1 2 ? 5.754 -12.353 0.989 1.00 0.00 ? 68 ALA D HB1 3 2
ATOM 3161 H HB2 . ALA D 1 2 ? 5.063 -13.870 1.518 1.00 0.00 ? 68 ALA D HB2 3 2
ATOM 3162 H HB3 . ALA D 1 2 ? 4.039 -12.638 0.845 1.00 0.00 ? 68 ALA D HB3 3 2
ATOM 3163 N N . LYS D 1 3 ? 3.631 -13.008 4.889 1.00 0.00 ? 69 LYS D N 3 3
ATOM 3164 C CA . LYS D 1 3 ? 2.527 -13.318 5.763 1.00 0.00 ? 69 LYS D CA 3 3
ATOM 3165 C C . LYS D 1 3 ? 1.430 -12.276 5.689 1.00 0.00 ? 69 LYS D C 3 3
ATOM 3166 O O . LYS D 1 3 ? 0.275 -12.589 5.545 1.00 0.00 ? 69 LYS D O 3 3
ATOM 3167 C CB . LYS D 1 3 ? 3.034 -13.325 7.186 1.00 0.00 ? 69 LYS D CB 3 3
ATOM 3168 C CG . LYS D 1 3 ? 4.083 -14.349 7.541 1.00 0.00 ? 69 LYS D CG 3 3
ATOM 3169 C CD . LYS D 1 3 ? 4.480 -14.396 8.976 1.00 0.00 ? 69 LYS D CD 3 3
ATOM 3170 C CE . LYS D 1 3 ? 5.183 -13.171 9.404 1.00 0.00 ? 69 LYS D CE 3 3
ATOM 3171 N NZ . LYS D 1 3 ? 5.689 -13.254 10.710 1.00 0.00 ? 69 LYS D NZ 3 3
ATOM 3172 H H . LYS D 1 3 ? 4.488 -12.731 5.297 1.00 0.00 ? 69 LYS D H 3 3
ATOM 3173 H HA . LYS D 1 3 ? 2.100 -14.281 5.539 1.00 0.00 ? 69 LYS D HA 3 3
ATOM 3174 H HB2 . LYS D 1 3 ? 3.434 -12.337 7.413 1.00 0.00 ? 69 LYS D HB2 3 3
ATOM 3175 H HB3 . LYS D 1 3 ? 2.180 -13.476 7.807 1.00 0.00 ? 69 LYS D HB3 3 3
ATOM 3176 H HG2 . LYS D 1 3 ? 3.704 -15.332 7.261 1.00 0.00 ? 69 LYS D HG2 3 3
ATOM 3177 H HG3 . LYS D 1 3 ? 4.953 -14.195 6.957 1.00 0.00 ? 69 LYS D HG3 3 3
ATOM 3178 H HD2 . LYS D 1 3 ? 3.603 -14.564 9.601 1.00 0.00 ? 69 LYS D HD2 3 3
ATOM 3179 H HD3 . LYS D 1 3 ? 5.167 -15.218 9.104 1.00 0.00 ? 69 LYS D HD3 3 3
ATOM 3180 H HE2 . LYS D 1 3 ? 5.998 -12.959 8.712 1.00 0.00 ? 69 LYS D HE2 3 3
ATOM 3181 H HE3 . LYS D 1 3 ? 4.520 -12.378 9.363 1.00 0.00 ? 69 LYS D HE3 3 3
ATOM 3182 H HZ1 . LYS D 1 3 ? 5.995 -12.459 11.062 1.00 0.00 ? 69 LYS D HZ1 3 3
ATOM 3183 H HZ2 . LYS D 1 3 ? 5.054 -13.498 11.294 1.00 0.00 ? 69 LYS D HZ2 3 3
ATOM 3184 H HZ3 . LYS D 1 3 ? 6.347 -13.873 10.792 1.00 0.00 ? 69 LYS D HZ3 3 3
ATOM 3185 N N . ALA D 1 4 ? 1.792 -11.006 5.676 1.00 0.00 ? 70 ALA D N 3 4
ATOM 3186 C CA . ALA D 1 4 ? 0.952 -9.832 5.610 1.00 0.00 ? 70 ALA D CA 3 4
ATOM 3187 C C . ALA D 1 4 ? 0.197 -9.672 4.308 1.00 0.00 ? 70 ALA D C 3 4
ATOM 3188 O O . ALA D 1 4 ? -0.607 -8.765 4.153 1.00 0.00 ? 70 ALA D O 3 4
ATOM 3189 C CB . ALA D 1 4 ? 1.876 -8.648 5.818 1.00 0.00 ? 70 ALA D CB 3 4
ATOM 3190 H H . ALA D 1 4 ? 2.763 -10.876 5.770 1.00 0.00 ? 70 ALA D H 3 4
ATOM 3191 H HA . ALA D 1 4 ? 0.256 -9.866 6.434 1.00 0.00 ? 70 ALA D HA 3 4
ATOM 3192 H HB1 . ALA D 1 4 ? 2.443 -8.796 6.711 1.00 0.00 ? 70 ALA D HB1 3 4
ATOM 3193 H HB2 . ALA D 1 4 ? 2.566 -8.601 4.993 1.00 0.00 ? 70 ALA D HB2 3 4
ATOM 3194 H HB3 . ALA D 1 4 ? 1.329 -7.718 5.895 1.00 0.00 ? 70 ALA D HB3 3 4
ATOM 3195 N N . ALA D 1 5 ? 0.516 -10.495 3.322 1.00 0.00 ? 71 ALA D N 3 5
ATOM 3196 C CA . ALA D 1 5 ? 0.298 -10.248 1.914 1.00 0.00 ? 71 ALA D CA 3 5
ATOM 3197 C C . ALA D 1 5 ? -1.038 -10.686 1.346 1.00 0.00 ? 71 ALA D C 3 5
ATOM 3198 O O . ALA D 1 5 ? -1.207 -10.673 0.133 1.00 0.00 ? 71 ALA D O 3 5
ATOM 3199 C CB . ALA D 1 5 ? 1.495 -10.745 1.122 1.00 0.00 ? 71 ALA D CB 3 5
ATOM 3200 H H . ALA D 1 5 ? 1.055 -11.282 3.629 1.00 0.00 ? 71 ALA D H 3 5
ATOM 3201 H HA . ALA D 1 5 ? 0.253 -9.174 1.790 1.00 0.00 ? 71 ALA D HA 3 5
ATOM 3202 H HB1 . ALA D 1 5 ? 2.404 -10.438 1.623 1.00 0.00 ? 71 ALA D HB1 3 5
ATOM 3203 H HB2 . ALA D 1 5 ? 1.441 -11.818 1.044 1.00 0.00 ? 71 ALA D HB2 3 5
ATOM 3204 H HB3 . ALA D 1 5 ? 1.475 -10.316 0.134 1.00 0.00 ? 71 ALA D HB3 3 5
ATOM 3205 N N . ALA D 1 6 ? -1.994 -11.027 2.196 1.00 0.00 ? 72 ALA D N 3 6
ATOM 3206 C CA . ALA D 1 6 ? -3.406 -10.936 1.910 1.00 0.00 ? 72 ALA D CA 3 6
ATOM 3207 C C . ALA D 1 6 ? -3.988 -9.818 2.753 1.00 0.00 ? 72 ALA D C 3 6
ATOM 3208 O O . ALA D 1 6 ? -4.512 -8.846 2.242 1.00 0.00 ? 72 ALA D O 3 6
ATOM 3209 C CB . ALA D 1 6 ? -4.071 -12.296 2.054 1.00 0.00 ? 72 ALA D CB 3 6
ATOM 3210 H H . ALA D 1 6 ? -1.744 -11.143 3.145 1.00 0.00 ? 72 ALA D H 3 6
ATOM 3211 H HA . ALA D 1 6 ? -3.519 -10.604 0.881 1.00 0.00 ? 72 ALA D HA 3 6
ATOM 3212 H HB1 . ALA D 1 6 ? -5.050 -12.265 1.728 1.00 0.00 ? 72 ALA D HB1 3 6
ATOM 3213 H HB2 . ALA D 1 6 ? -3.603 -13.023 1.504 1.00 0.00 ? 72 ALA D HB2 3 6
ATOM 3214 H HB3 . ALA D 1 6 ? -4.074 -12.605 3.045 1.00 0.00 ? 72 ALA D HB3 3 6
ATOM 3215 N N . ALA D 1 7 ? -3.880 -9.860 4.073 1.00 0.00 ? 73 ALA D N 3 7
ATOM 3216 C CA . ALA D 1 7 ? -4.598 -9.051 5.027 1.00 0.00 ? 73 ALA D CA 3 7
ATOM 3217 C C . ALA D 1 7 ? -4.442 -7.556 4.833 1.00 0.00 ? 73 ALA D C 3 7
ATOM 3218 O O . ALA D 1 7 ? -5.431 -6.852 4.898 1.00 0.00 ? 73 ALA D O 3 7
ATOM 3219 C CB . ALA D 1 7 ? -4.109 -9.456 6.394 1.00 0.00 ? 73 ALA D CB 3 7
ATOM 3220 H H . ALA D 1 7 ? -3.295 -10.602 4.408 1.00 0.00 ? 73 ALA D H 3 7
ATOM 3221 H HA . ALA D 1 7 ? -5.653 -9.264 4.943 1.00 0.00 ? 73 ALA D HA 3 7
ATOM 3222 H HB1 . ALA D 1 7 ? -3.050 -9.358 6.465 1.00 0.00 ? 73 ALA D HB1 3 7
ATOM 3223 H HB2 . ALA D 1 7 ? -4.591 -8.867 7.135 1.00 0.00 ? 73 ALA D HB2 3 7
ATOM 3224 H HB3 . ALA D 1 7 ? -4.325 -10.483 6.560 1.00 0.00 ? 73 ALA D HB3 3 7
ATOM 3225 N N . ALA D 1 8 ? -3.235 -7.078 4.569 1.00 0.00 ? 74 ALA D N 3 8
ATOM 3226 C CA . ALA D 1 8 ? -3.026 -5.665 4.350 1.00 0.00 ? 74 ALA D CA 3 8
ATOM 3227 C C . ALA D 1 8 ? -3.427 -5.238 2.953 1.00 0.00 ? 74 ALA D C 3 8
ATOM 3228 O O . ALA D 1 8 ? -3.873 -4.129 2.733 1.00 0.00 ? 74 ALA D O 3 8
ATOM 3229 C CB . ALA D 1 8 ? -1.569 -5.319 4.596 1.00 0.00 ? 74 ALA D CB 3 8
ATOM 3230 H H . ALA D 1 8 ? -2.499 -7.735 4.385 1.00 0.00 ? 74 ALA D H 3 8
ATOM 3231 H HA . ALA D 1 8 ? -3.648 -5.133 5.061 1.00 0.00 ? 74 ALA D HA 3 8
ATOM 3232 H HB1 . ALA D 1 8 ? -0.988 -5.553 3.742 1.00 0.00 ? 74 ALA D HB1 3 8
ATOM 3233 H HB2 . ALA D 1 8 ? -1.493 -4.280 4.771 1.00 0.00 ? 74 ALA D HB2 3 8
ATOM 3234 H HB3 . ALA D 1 8 ? -1.174 -5.834 5.451 1.00 0.00 ? 74 ALA D HB3 3 8
ATOM 3235 N N . ILE D 1 9 ? -3.254 -6.117 1.972 1.00 0.00 ? 75 ILE D N 3 9
ATOM 3236 C CA . ILE D 1 9 ? -3.604 -5.890 0.589 1.00 0.00 ? 75 ILE D CA 3 9
ATOM 3237 C C . ILE D 1 9 ? -5.109 -5.831 0.396 1.00 0.00 ? 75 ILE D C 3 9
ATOM 3238 O O . ILE D 1 9 ? -5.622 -5.012 -0.350 1.00 0.00 ? 75 ILE D O 3 9
ATOM 3239 C CB . ILE D 1 9 ? -3.051 -7.011 -0.275 1.00 0.00 ? 75 ILE D CB 3 9
ATOM 3240 C CG1 . ILE D 1 9 ? -1.561 -7.220 -0.056 1.00 0.00 ? 75 ILE D CG1 3 9
ATOM 3241 C CG2 . ILE D 1 9 ? -3.409 -6.804 -1.735 1.00 0.00 ? 75 ILE D CG2 3 9
ATOM 3242 C CD1 . ILE D 1 9 ? -0.724 -5.991 -0.335 1.00 0.00 ? 75 ILE D CD1 3 9
ATOM 3243 H H . ILE D 1 9 ? -2.956 -7.015 2.244 1.00 0.00 ? 75 ILE D H 3 9
ATOM 3244 H HA . ILE D 1 9 ? -3.190 -4.957 0.231 1.00 0.00 ? 75 ILE D HA 3 9
ATOM 3245 H HB . ILE D 1 9 ? -3.590 -7.905 0.020 1.00 0.00 ? 75 ILE D HB 3 9
ATOM 3246 H HG12 . ILE D 1 9 ? -1.391 -7.547 0.970 1.00 0.00 ? 75 ILE D HG12 3 9
ATOM 3247 H HG13 . ILE D 1 9 ? -1.229 -8.010 -0.714 1.00 0.00 ? 75 ILE D HG13 3 9
ATOM 3248 H HG21 . ILE D 1 9 ? -3.205 -5.793 -2.026 1.00 0.00 ? 75 ILE D HG21 3 9
ATOM 3249 H HG22 . ILE D 1 9 ? -2.854 -7.487 -2.335 1.00 0.00 ? 75 ILE D HG22 3 9
ATOM 3250 H HG23 . ILE D 1 9 ? -4.447 -7.045 -1.853 1.00 0.00 ? 75 ILE D HG23 3 9
ATOM 3251 H HD11 . ILE D 1 9 ? -0.928 -5.259 0.387 1.00 0.00 ? 75 ILE D HD11 3 9
ATOM 3252 H HD12 . ILE D 1 9 ? 0.308 -6.205 -0.324 1.00 0.00 ? 75 ILE D HD12 3 9
ATOM 3253 H HD13 . ILE D 1 9 ? -0.949 -5.593 -1.281 1.00 0.00 ? 75 ILE D HD13 3 9
ATOM 3254 N N . LYS D 1 10 ? -5.816 -6.692 1.119 1.00 0.00 ? 76 LYS D N 3 10
ATOM 3255 C CA . LYS D 1 10 ? -7.249 -6.846 1.043 1.00 0.00 ? 76 LYS D CA 3 10
ATOM 3256 C C . LYS D 1 10 ? -7.983 -5.678 1.668 1.00 0.00 ? 76 LYS D C 3 10
ATOM 3257 O O . LYS D 1 10 ? -9.023 -5.306 1.158 1.00 0.00 ? 76 LYS D O 3 10
ATOM 3258 C CB . LYS D 1 10 ? -7.588 -8.150 1.747 1.00 0.00 ? 76 LYS D CB 3 10
ATOM 3259 C CG . LYS D 1 10 ? -7.414 -9.358 0.855 1.00 0.00 ? 76 LYS D CG 3 10
ATOM 3260 C CD . LYS D 1 10 ? -7.662 -10.640 1.598 1.00 0.00 ? 76 LYS D CD 3 10
ATOM 3261 C CE . LYS D 1 10 ? -9.123 -10.788 1.943 1.00 0.00 ? 76 LYS D CE 3 10
ATOM 3262 N NZ . LYS D 1 10 ? -9.376 -12.046 2.582 1.00 0.00 ? 76 LYS D NZ 3 10
ATOM 3263 H H . LYS D 1 10 ? -5.294 -7.379 1.624 1.00 0.00 ? 76 LYS D H 3 10
ATOM 3264 H HA . LYS D 1 10 ? -7.559 -6.834 0.006 1.00 0.00 ? 76 LYS D HA 3 10
ATOM 3265 H HB2 . LYS D 1 10 ? -6.965 -8.261 2.635 1.00 0.00 ? 76 LYS D HB2 3 10
ATOM 3266 H HB3 . LYS D 1 10 ? -8.616 -8.089 2.068 1.00 0.00 ? 76 LYS D HB3 3 10
ATOM 3267 H HG2 . LYS D 1 10 ? -8.085 -9.286 -0.001 1.00 0.00 ? 76 LYS D HG2 3 10
ATOM 3268 H HG3 . LYS D 1 10 ? -6.399 -9.388 0.488 1.00 0.00 ? 76 LYS D HG3 3 10
ATOM 3269 H HD2 . LYS D 1 10 ? -7.345 -11.483 0.985 1.00 0.00 ? 76 LYS D HD2 3 10
ATOM 3270 H HD3 . LYS D 1 10 ? -7.076 -10.672 2.481 1.00 0.00 ? 76 LYS D HD3 3 10
ATOM 3271 H HE2 . LYS D 1 10 ? -9.445 -9.966 2.581 1.00 0.00 ? 76 LYS D HE2 3 10
ATOM 3272 H HE3 . LYS D 1 10 ? -9.685 -10.761 1.045 1.00 0.00 ? 76 LYS D HE3 3 10
ATOM 3273 H HZ1 . LYS D 1 10 ? -9.401 -12.678 2.118 1.00 0.00 ? 76 LYS D HZ1 3 10
ATOM 3274 H HZ2 . LYS D 1 10 ? -8.830 -12.347 3.172 1.00 0.00 ? 76 LYS D HZ2 3 10
ATOM 3275 H HZ3 . LYS D 1 10 ? -10.048 -12.073 2.952 1.00 0.00 ? 76 LYS D HZ3 3 10
ATOM 3276 N N . ALA D 1 11 ? -7.355 -5.076 2.674 1.00 0.00 ? 77 ALA D N 3 11
ATOM 3277 C CA . ALA D 1 11 ? -7.649 -3.732 3.104 1.00 0.00 ? 77 ALA D CA 3 11
ATOM 3278 C C . ALA D 1 11 ? -7.445 -2.732 1.980 1.00 0.00 ? 77 ALA D C 3 11
ATOM 3279 O O . ALA D 1 11 ? -8.405 -2.109 1.547 1.00 0.00 ? 77 ALA D O 3 11
ATOM 3280 C CB . ALA D 1 11 ? -6.852 -3.474 4.372 1.00 0.00 ? 77 ALA D CB 3 11
ATOM 3281 H H . ALA D 1 11 ? -6.588 -5.565 3.093 1.00 0.00 ? 77 ALA D H 3 11
ATOM 3282 H HA . ALA D 1 11 ? -8.701 -3.684 3.339 1.00 0.00 ? 77 ALA D HA 3 11
ATOM 3283 H HB1 . ALA D 1 11 ? -7.187 -2.547 4.785 1.00 0.00 ? 77 ALA D HB1 3 11
ATOM 3284 H HB2 . ALA D 1 11 ? -7.002 -4.257 5.069 1.00 0.00 ? 77 ALA D HB2 3 11
ATOM 3285 H HB3 . ALA D 1 11 ? -5.812 -3.390 4.195 1.00 0.00 ? 77 ALA D HB3 3 11
ATOM 3286 N N . ILE D 1 12 ? -6.228 -2.594 1.461 1.00 0.00 ? 78 ILE D N 3 12
ATOM 3287 C CA . ILE D 1 12 ? -5.860 -1.513 0.576 1.00 0.00 ? 78 ILE D CA 3 12
ATOM 3288 C C . ILE D 1 12 ? -6.566 -1.614 -0.764 1.00 0.00 ? 78 ILE D C 3 12
ATOM 3289 O O . ILE D 1 12 ? -7.100 -0.612 -1.221 1.00 0.00 ? 78 ILE D O 3 12
ATOM 3290 C CB . ILE D 1 12 ? -4.348 -1.359 0.500 1.00 0.00 ? 78 ILE D CB 3 12
ATOM 3291 C CG1 . ILE D 1 12 ? -4.028 0.118 0.431 1.00 0.00 ? 78 ILE D CG1 3 12
ATOM 3292 C CG2 . ILE D 1 12 ? -3.647 -2.112 -0.610 1.00 0.00 ? 78 ILE D CG2 3 12
ATOM 3293 C CD1 . ILE D 1 12 ? -2.565 0.488 0.419 1.00 0.00 ? 78 ILE D CD1 3 12
ATOM 3294 H H . ILE D 1 12 ? -5.532 -3.279 1.693 1.00 0.00 ? 78 ILE D H 3 12
ATOM 3295 H HA . ILE D 1 12 ? -6.224 -0.576 0.982 1.00 0.00 ? 78 ILE D HA 3 12
ATOM 3296 H HB . ILE D 1 12 ? -3.937 -1.695 1.439 1.00 0.00 ? 78 ILE D HB 3 12
ATOM 3297 H HG12 . ILE D 1 12 ? -4.496 0.534 -0.461 1.00 0.00 ? 78 ILE D HG12 3 12
ATOM 3298 H HG13 . ILE D 1 12 ? -4.492 0.574 1.286 1.00 0.00 ? 78 ILE D HG13 3 12
ATOM 3299 H HG21 . ILE D 1 12 ? -3.883 -1.660 -1.552 1.00 0.00 ? 78 ILE D HG21 3 12
ATOM 3300 H HG22 . ILE D 1 12 ? -2.583 -2.102 -0.444 1.00 0.00 ? 78 ILE D HG22 3 12
ATOM 3301 H HG23 . ILE D 1 12 ? -3.958 -3.135 -0.594 1.00 0.00 ? 78 ILE D HG23 3 12
ATOM 3302 H HD11 . ILE D 1 12 ? -2.111 0.231 -0.491 1.00 0.00 ? 78 ILE D HD11 3 12
ATOM 3303 H HD12 . ILE D 1 12 ? -2.463 1.533 0.550 1.00 0.00 ? 78 ILE D HD12 3 12
ATOM 3304 H HD13 . ILE D 1 12 ? -2.030 0.000 1.199 1.00 0.00 ? 78 ILE D HD13 3 12
ATOM 3305 N N . ALA D 1 13 ? -6.698 -2.789 -1.378 1.00 0.00 ? 79 ALA D N 3 13
ATOM 3306 C CA . ALA D 1 13 ? -7.338 -2.870 -2.671 1.00 0.00 ? 79 ALA D CA 3 13
ATOM 3307 C C . ALA D 1 13 ? -8.816 -2.524 -2.656 1.00 0.00 ? 79 ALA D C 3 13
ATOM 3308 O O . ALA D 1 13 ? -9.343 -2.141 -3.684 1.00 0.00 ? 79 ALA D O 3 13
ATOM 3309 C CB . ALA D 1 13 ? -7.061 -4.248 -3.251 1.00 0.00 ? 79 ALA D CB 3 13
ATOM 3310 H H . ALA D 1 13 ? -6.318 -3.579 -0.886 1.00 0.00 ? 79 ALA D H 3 13
ATOM 3311 H HA . ALA D 1 13 ? -6.870 -2.152 -3.335 1.00 0.00 ? 79 ALA D HA 3 13
ATOM 3312 H HB1 . ALA D 1 13 ? -7.612 -4.982 -2.702 1.00 0.00 ? 79 ALA D HB1 3 13
ATOM 3313 H HB2 . ALA D 1 13 ? -7.409 -4.249 -4.265 1.00 0.00 ? 79 ALA D HB2 3 13
ATOM 3314 H HB3 . ALA D 1 13 ? -6.003 -4.411 -3.210 1.00 0.00 ? 79 ALA D HB3 3 13
ATOM 3315 N N . ALA D 1 14 ? -9.449 -2.549 -1.486 1.00 0.00 ? 80 ALA D N 3 14
ATOM 3316 C CA . ALA D 1 14 ? -10.796 -2.076 -1.253 1.00 0.00 ? 80 ALA D CA 3 14
ATOM 3317 C C . ALA D 1 14 ? -10.828 -0.598 -0.914 1.00 0.00 ? 80 ALA D C 3 14
ATOM 3318 O O . ALA D 1 14 ? -11.627 0.135 -1.466 1.00 0.00 ? 80 ALA D O 3 14
ATOM 3319 C CB . ALA D 1 14 ? -11.409 -2.941 -0.169 1.00 0.00 ? 80 ALA D CB 3 14
ATOM 3320 H H . ALA D 1 14 ? -8.853 -2.751 -0.707 1.00 0.00 ? 80 ALA D H 3 14
ATOM 3321 H HA . ALA D 1 14 ? -11.382 -2.190 -2.155 1.00 0.00 ? 80 ALA D HA 3 14
ATOM 3322 H HB1 . ALA D 1 14 ? -10.900 -2.847 0.722 1.00 0.00 ? 80 ALA D HB1 3 14
ATOM 3323 H HB2 . ALA D 1 14 ? -12.421 -2.712 -0.047 1.00 0.00 ? 80 ALA D HB2 3 14
ATOM 3324 H HB3 . ALA D 1 14 ? -11.371 -3.946 -0.420 1.00 0.00 ? 80 ALA D HB3 3 14
ATOM 3325 N N . ILE D 1 15 ? -9.925 -0.151 -0.053 1.00 0.00 ? 81 ILE D N 3 15
ATOM 3326 C CA . ILE D 1 15 ? -9.744 1.220 0.366 1.00 0.00 ? 81 ILE D CA 3 15
ATOM 3327 C C . ILE D 1 15 ? -9.307 2.079 -0.807 1.00 0.00 ? 81 ILE D C 3 15
ATOM 3328 O O . ILE D 1 15 ? -9.691 3.236 -0.891 1.00 0.00 ? 81 ILE D O 3 15
ATOM 3329 C CB . ILE D 1 15 ? -8.823 1.300 1.571 1.00 0.00 ? 81 ILE D CB 3 15
ATOM 3330 C CG1 . ILE D 1 15 ? -9.398 0.590 2.790 1.00 0.00 ? 81 ILE D CG1 3 15
ATOM 3331 C CG2 . ILE D 1 15 ? -8.539 2.740 1.960 1.00 0.00 ? 81 ILE D CG2 3 15
ATOM 3332 C CD1 . ILE D 1 15 ? -8.393 0.214 3.863 1.00 0.00 ? 81 ILE D CD1 3 15
ATOM 3333 H H . ILE D 1 15 ? -9.275 -0.837 0.239 1.00 0.00 ? 81 ILE D H 3 15
ATOM 3334 H HA . ILE D 1 15 ? -10.716 1.580 0.684 1.00 0.00 ? 81 ILE D HA 3 15
ATOM 3335 H HB . ILE D 1 15 ? -7.879 0.827 1.333 1.00 0.00 ? 81 ILE D HB 3 15
ATOM 3336 H HG12 . ILE D 1 15 ? -10.155 1.236 3.235 1.00 0.00 ? 81 ILE D HG12 3 15
ATOM 3337 H HG13 . ILE D 1 15 ? -9.903 -0.318 2.490 1.00 0.00 ? 81 ILE D HG13 3 15
ATOM 3338 H HG21 . ILE D 1 15 ? -9.429 3.316 2.002 1.00 0.00 ? 81 ILE D HG21 3 15
ATOM 3339 H HG22 . ILE D 1 15 ? -8.020 2.854 2.880 1.00 0.00 ? 81 ILE D HG22 3 15
ATOM 3340 H HG23 . ILE D 1 15 ? -7.937 3.198 1.211 1.00 0.00 ? 81 ILE D HG23 3 15
ATOM 3341 H HD11 . ILE D 1 15 ? -7.571 -0.344 3.478 1.00 0.00 ? 81 ILE D HD11 3 15
ATOM 3342 H HD12 . ILE D 1 15 ? -8.004 1.066 4.383 1.00 0.00 ? 81 ILE D HD12 3 15
ATOM 3343 H HD13 . ILE D 1 15 ? -8.873 -0.394 4.594 1.00 0.00 ? 81 ILE D HD13 3 15
ATOM 3344 N N . ILE D 1 16 ? -8.582 1.519 -1.773 1.00 0.00 ? 82 ILE D N 3 16
ATOM 3345 C CA . ILE D 1 16 ? -8.233 2.190 -3.003 1.00 0.00 ? 82 ILE D CA 3 16
ATOM 3346 C C . ILE D 1 16 ? -9.486 2.562 -3.777 1.00 0.00 ? 82 ILE D C 3 16
ATOM 3347 O O . ILE D 1 16 ? -9.666 3.714 -4.143 1.00 0.00 ? 82 ILE D O 3 16
ATOM 3348 C CB . ILE D 1 16 ? -7.255 1.366 -3.828 1.00 0.00 ? 82 ILE D CB 3 16
ATOM 3349 C CG1 . ILE D 1 16 ? -5.874 1.383 -3.199 1.00 0.00 ? 82 ILE D CG1 3 16
ATOM 3350 C CG2 . ILE D 1 16 ? -7.201 1.861 -5.266 1.00 0.00 ? 82 ILE D CG2 3 16
ATOM 3351 C CD1 . ILE D 1 16 ? -4.859 0.445 -3.791 1.00 0.00 ? 82 ILE D CD1 3 16
ATOM 3352 H H . ILE D 1 16 ? -8.259 0.583 -1.662 1.00 0.00 ? 82 ILE D H 3 16
ATOM 3353 H HA . ILE D 1 16 ? -7.761 3.131 -2.736 1.00 0.00 ? 82 ILE D HA 3 16
ATOM 3354 H HB . ILE D 1 16 ? -7.624 0.344 -3.820 1.00 0.00 ? 82 ILE D HB 3 16
ATOM 3355 H HG12 . ILE D 1 16 ? -5.487 2.399 -3.282 1.00 0.00 ? 82 ILE D HG12 3 16
ATOM 3356 H HG13 . ILE D 1 16 ? -5.913 1.165 -2.145 1.00 0.00 ? 82 ILE D HG13 3 16
ATOM 3357 H HG21 . ILE D 1 16 ? -8.123 1.621 -5.756 1.00 0.00 ? 82 ILE D HG21 3 16
ATOM 3358 H HG22 . ILE D 1 16 ? -6.992 2.908 -5.334 1.00 0.00 ? 82 ILE D HG22 3 16
ATOM 3359 H HG23 . ILE D 1 16 ? -6.444 1.339 -5.820 1.00 0.00 ? 82 ILE D HG23 3 16
ATOM 3360 H HD11 . ILE D 1 16 ? -4.634 0.749 -4.750 1.00 0.00 ? 82 ILE D HD11 3 16
ATOM 3361 H HD12 . ILE D 1 16 ? -4.007 0.466 -3.190 1.00 0.00 ? 82 ILE D HD12 3 16
ATOM 3362 H HD13 . ILE D 1 16 ? -5.220 -0.493 -3.773 1.00 0.00 ? 82 ILE D HD13 3 16
ATOM 3363 N N . LYS D 1 17 ? -10.356 1.587 -4.003 1.00 0.00 ? 83 LYS D N 3 17
ATOM 3364 C CA . LYS D 1 17 ? -11.646 1.785 -4.620 1.00 0.00 ? 83 LYS D CA 3 17
ATOM 3365 C C . LYS D 1 17 ? -12.575 2.699 -3.845 1.00 0.00 ? 83 LYS D C 3 17
ATOM 3366 O O . LYS D 1 17 ? -13.200 3.566 -4.424 1.00 0.00 ? 83 LYS D O 3 17
ATOM 3367 C CB . LYS D 1 17 ? -12.290 0.437 -4.904 1.00 0.00 ? 83 LYS D CB 3 17
ATOM 3368 C CG . LYS D 1 17 ? -13.476 0.455 -5.840 1.00 0.00 ? 83 LYS D CG 3 17
ATOM 3369 C CD . LYS D 1 17 ? -13.862 -0.930 -6.307 1.00 0.00 ? 83 LYS D CD 3 17
ATOM 3370 C CE . LYS D 1 17 ? -14.388 -1.827 -5.223 1.00 0.00 ? 83 LYS D CE 3 17
ATOM 3371 N NZ . LYS D 1 17 ? -15.672 -1.627 -4.861 1.00 0.00 ? 83 LYS D NZ 3 17
ATOM 3372 H H . LYS D 1 17 ? -10.110 0.689 -3.628 1.00 0.00 ? 83 LYS D H 3 17
ATOM 3373 H HA . LYS D 1 17 ? -11.523 2.239 -5.597 1.00 0.00 ? 83 LYS D HA 3 17
ATOM 3374 H HB2 . LYS D 1 17 ? -11.534 -0.221 -5.333 1.00 0.00 ? 83 LYS D HB2 3 17
ATOM 3375 H HB3 . LYS D 1 17 ? -12.563 0.005 -3.956 1.00 0.00 ? 83 LYS D HB3 3 17
ATOM 3376 H HG2 . LYS D 1 17 ? -14.324 0.924 -5.341 1.00 0.00 ? 83 LYS D HG2 3 17
ATOM 3377 H HG3 . LYS D 1 17 ? -13.253 1.031 -6.710 1.00 0.00 ? 83 LYS D HG3 3 17
ATOM 3378 H HD2 . LYS D 1 17 ? -14.598 -0.851 -7.107 1.00 0.00 ? 83 LYS D HD2 3 17
ATOM 3379 H HD3 . LYS D 1 17 ? -12.984 -1.401 -6.687 1.00 0.00 ? 83 LYS D HD3 3 17
ATOM 3380 H HE2 . LYS D 1 17 ? -14.273 -2.863 -5.543 1.00 0.00 ? 83 LYS D HE2 3 17
ATOM 3381 H HE3 . LYS D 1 17 ? -13.850 -1.703 -4.419 1.00 0.00 ? 83 LYS D HE3 3 17
ATOM 3382 H HZ1 . LYS D 1 17 ? -16.172 -1.763 -5.520 1.00 0.00 ? 83 LYS D HZ1 3 17
ATOM 3383 H HZ2 . LYS D 1 17 ? -15.902 -2.160 -4.147 1.00 0.00 ? 83 LYS D HZ2 3 17
ATOM 3384 H HZ3 . LYS D 1 17 ? -15.827 -0.772 -4.632 1.00 0.00 ? 83 LYS D HZ3 3 17
ATOM 3385 N N . ALA D 1 18 ? -12.678 2.505 -2.539 1.00 0.00 ? 84 ALA D N 3 18
ATOM 3386 C CA . ALA D 1 18 ? -13.559 3.238 -1.666 1.00 0.00 ? 84 ALA D CA 3 18
ATOM 3387 C C . ALA D 1 18 ? -13.142 4.661 -1.397 1.00 0.00 ? 84 ALA D C 3 18
ATOM 3388 O O . ALA D 1 18 ? -13.966 5.564 -1.411 1.00 0.00 ? 84 ALA D O 3 18
ATOM 3389 C CB . ALA D 1 18 ? -13.733 2.479 -0.369 1.00 0.00 ? 84 ALA D CB 3 18
ATOM 3390 H H . ALA D 1 18 ? -12.074 1.798 -2.176 1.00 0.00 ? 84 ALA D H 3 18
ATOM 3391 H HA . ALA D 1 18 ? -14.546 3.268 -2.117 1.00 0.00 ? 84 ALA D HA 3 18
ATOM 3392 H HB1 . ALA D 1 18 ? -12.793 2.345 0.141 1.00 0.00 ? 84 ALA D HB1 3 18
ATOM 3393 H HB2 . ALA D 1 18 ? -14.405 3.004 0.276 1.00 0.00 ? 84 ALA D HB2 3 18
ATOM 3394 H HB3 . ALA D 1 18 ? -14.185 1.526 -0.568 1.00 0.00 ? 84 ALA D HB3 3 18
ATOM 3395 N N . GLY D 1 19 ? -11.839 4.842 -1.224 1.00 0.00 ? 85 GLY D N 3 19
ATOM 3396 C CA . GLY D 1 19 ? -11.140 6.081 -0.992 1.00 0.00 ? 85 GLY D CA 3 19
ATOM 3397 C C . GLY D 1 19 ? -11.046 6.925 -2.245 1.00 0.00 ? 85 GLY D C 3 19
ATOM 3398 O O . GLY D 1 19 ? -11.098 8.132 -2.143 1.00 0.00 ? 85 GLY D O 3 19
ATOM 3399 H H . GLY D 1 19 ? -11.298 4.003 -1.243 1.00 0.00 ? 85 GLY D H 3 19
ATOM 3400 H HA2 . GLY D 1 19 ? -11.571 6.656 -0.204 1.00 0.00 ? 85 GLY D HA2 3 19
ATOM 3401 H HA3 . GLY D 1 19 ? -10.138 5.830 -0.699 1.00 0.00 ? 85 GLY D HA3 3 19
ATOM 3402 N N . GLY D 1 20 ? -10.885 6.295 -3.399 1.00 0.00 ? 86 GLY D N 3 20
ATOM 3403 C CA . GLY D 1 20 ? -10.797 6.936 -4.682 1.00 0.00 ? 86 GLY D CA 3 20
ATOM 3404 C C . GLY D 1 20 ? -9.461 7.596 -4.956 1.00 0.00 ? 86 GLY D C 3 20
ATOM 3405 O O . GLY D 1 20 ? -9.419 8.765 -5.280 1.00 0.00 ? 86 GLY D O 3 20
ATOM 3406 H H . GLY D 1 20 ? -10.902 5.295 -3.396 1.00 0.00 ? 86 GLY D H 3 20
ATOM 3407 H HA2 . GLY D 1 20 ? -10.970 6.204 -5.446 1.00 0.00 ? 86 GLY D HA2 3 20
ATOM 3408 H HA3 . GLY D 1 20 ? -11.560 7.682 -4.772 1.00 0.00 ? 86 GLY D HA3 3 20
ATOM 3409 N N . TYR D 1 21 ? -8.363 6.870 -4.818 1.00 0.00 ? 87 TYR D N 3 21
ATOM 3410 C CA . TYR D 1 21 ? -7.040 7.330 -5.135 1.00 0.00 ? 87 TYR D CA 3 21
ATOM 3411 C C . TYR D 1 21 ? -6.802 7.701 -6.579 1.00 0.00 ? 87 TYR D C 3 21
ATOM 3412 O O . TYR D 1 21 ? -6.019 8.532 -6.850 1.00 0.00 ? 87 TYR D O 3 21
ATOM 3413 C CB . TYR D 1 21 ? -6.047 6.264 -4.710 1.00 0.00 ? 87 TYR D CB 3 21
ATOM 3414 C CG . TYR D 1 21 ? -5.685 6.188 -3.254 1.00 0.00 ? 87 TYR D CG 3 21
ATOM 3415 C CD1 . TYR D 1 21 ? -5.069 7.223 -2.561 1.00 0.00 ? 87 TYR D CD1 3 21
ATOM 3416 C CD2 . TYR D 1 21 ? -5.867 4.956 -2.634 1.00 0.00 ? 87 TYR D CD2 3 21
ATOM 3417 C CE1 . TYR D 1 21 ? -4.597 6.976 -1.270 1.00 0.00 ? 87 TYR D CE1 3 21
ATOM 3418 C CE2 . TYR D 1 21 ? -5.445 4.700 -1.333 1.00 0.00 ? 87 TYR D CE2 3 21
ATOM 3419 C CZ . TYR D 1 21 ? -4.776 5.727 -0.660 1.00 0.00 ? 87 TYR D CZ 3 21
ATOM 3420 O OH . TYR D 1 21 ? -4.339 5.520 0.610 1.00 0.00 ? 87 TYR D OH 3 21
ATOM 3421 H H . TYR D 1 21 ? -8.450 5.907 -4.575 1.00 0.00 ? 87 TYR D H 3 21
ATOM 3422 H HA . TYR D 1 21 ? -6.839 8.197 -4.525 1.00 0.00 ? 87 TYR D HA 3 21
ATOM 3423 H HB2 . TYR D 1 21 ? -6.451 5.298 -5.013 1.00 0.00 ? 87 TYR D HB2 3 21
ATOM 3424 H HB3 . TYR D 1 21 ? -5.106 6.386 -5.218 1.00 0.00 ? 87 TYR D HB3 3 21
ATOM 3425 H HD1 . TYR D 1 21 ? -4.904 8.179 -3.004 1.00 0.00 ? 87 TYR D HD1 3 21
ATOM 3426 H HD2 . TYR D 1 21 ? -6.263 4.177 -3.243 1.00 0.00 ? 87 TYR D HD2 3 21
ATOM 3427 H HE1 . TYR D 1 21 ? -4.049 7.721 -0.737 1.00 0.00 ? 87 TYR D HE1 3 21
ATOM 3428 H HE2 . TYR D 1 21 ? -5.564 3.725 -0.910 1.00 0.00 ? 87 TYR D HE2 3 21
ATOM 3429 H HH . TYR D 1 21 ? -4.943 5.857 1.222 1.00 0.00 ? 87 TYR D HH 3 21
HETATM 3430 N N . NH2 D 1 22 ? -7.445 7.143 -7.533 1.00 0.00 ? 88 NH2 D N 3 22
HETATM 3431 H HN1 . NH2 D 1 22 ? -7.337 7.398 -8.481 1.00 0.00 ? 88 NH2 D HN1 3 22
HETATM 3432 H HN2 . NH2 D 1 22 ? -8.087 6.472 -7.293 1.00 0.00 ? 88 NH2 D HN2 3 22
HETATM 3433 C C . ACE A 1 1 ? -0.936 16.233 0.787 1.00 0.00 ? 1 ACE A C 4 1
HETATM 3434 O O . ACE A 1 1 ? -1.316 16.630 -0.253 1.00 0.00 ? 1 ACE A O 4 1
HETATM 3435 C CH3 . ACE A 1 1 ? -0.466 17.200 1.794 1.00 0.00 ? 1 ACE A CH3 4 1
HETATM 3436 H H1 . ACE A 1 1 ? -0.402 17.509 2.025 1.00 0.00 ? 1 ACE A H1 4 1
HETATM 3437 H H2 . ACE A 1 1 ? -0.351 17.321 2.100 1.00 0.00 ? 1 ACE A H2 4 1
HETATM 3438 H H3 . ACE A 1 1 ? -0.281 17.457 1.953 1.00 0.00 ? 1 ACE A H3 4 1
ATOM 3439 N N . ALA A 1 2 ? -0.872 14.971 1.104 1.00 0.00 ? 2 ALA A N 4 2
ATOM 3440 C CA . ALA A 1 2 ? -1.171 13.805 0.337 1.00 0.00 ? 2 ALA A CA 4 2
ATOM 3441 C C . ALA A 1 2 ? -0.535 13.670 -1.023 1.00 0.00 ? 2 ALA A C 4 2
ATOM 3442 O O . ALA A 1 2 ? -0.866 12.781 -1.762 1.00 0.00 ? 2 ALA A O 4 2
ATOM 3443 C CB . ALA A 1 2 ? -2.656 13.641 0.275 1.00 0.00 ? 2 ALA A CB 4 2
ATOM 3444 H H . ALA A 1 2 ? -0.526 14.815 1.990 1.00 0.00 ? 2 ALA A H 4 2
ATOM 3445 H HA . ALA A 1 2 ? -0.803 13.006 0.931 1.00 0.00 ? 2 ALA A HA 4 2
ATOM 3446 H HB1 . ALA A 1 2 ? -2.871 12.728 -0.179 1.00 0.00 ? 2 ALA A HB1 4 2
ATOM 3447 H HB2 . ALA A 1 2 ? -3.080 13.649 1.255 1.00 0.00 ? 2 ALA A HB2 4 2
ATOM 3448 H HB3 . ALA A 1 2 ? -3.085 14.420 -0.273 1.00 0.00 ? 2 ALA A HB3 4 2
ATOM 3449 N N . LYS A 1 3 ? 0.422 14.482 -1.363 1.00 0.00 ? 3 LYS A N 4 3
ATOM 3450 C CA . LYS A 1 3 ? 1.162 14.434 -2.592 1.00 0.00 ? 3 LYS A CA 4 3
ATOM 3451 C C . LYS A 1 3 ? 1.975 13.187 -2.830 1.00 0.00 ? 3 LYS A C 4 3
ATOM 3452 O O . LYS A 1 3 ? 2.206 12.820 -3.952 1.00 0.00 ? 3 LYS A O 4 3
ATOM 3453 C CB . LYS A 1 3 ? 2.104 15.587 -2.714 1.00 0.00 ? 3 LYS A CB 4 3
ATOM 3454 C CG . LYS A 1 3 ? 1.596 16.983 -2.434 1.00 0.00 ? 3 LYS A CG 4 3
ATOM 3455 C CD . LYS A 1 3 ? 0.472 17.375 -3.322 1.00 0.00 ? 3 LYS A CD 4 3
ATOM 3456 C CE . LYS A 1 3 ? -0.010 18.749 -2.995 1.00 0.00 ? 3 LYS A CE 4 3
ATOM 3457 N NZ . LYS A 1 3 ? -1.000 18.861 -2.417 1.00 0.00 ? 3 LYS A NZ 4 3
ATOM 3458 H H . LYS A 1 3 ? 0.687 15.115 -0.667 1.00 0.00 ? 3 LYS A H 4 3
ATOM 3459 H HA . LYS A 1 3 ? 0.498 14.458 -3.413 1.00 0.00 ? 3 LYS A HA 4 3
ATOM 3460 H HB2 . LYS A 1 3 ? 2.948 15.401 -2.049 1.00 0.00 ? 3 LYS A HB2 4 3
ATOM 3461 H HB3 . LYS A 1 3 ? 2.475 15.571 -3.720 1.00 0.00 ? 3 LYS A HB3 4 3
ATOM 3462 H HG2 . LYS A 1 3 ? 1.271 17.044 -1.396 1.00 0.00 ? 3 LYS A HG2 4 3
ATOM 3463 H HG3 . LYS A 1 3 ? 2.385 17.678 -2.550 1.00 0.00 ? 3 LYS A HG3 4 3
ATOM 3464 H HD2 . LYS A 1 3 ? 0.790 17.330 -4.364 1.00 0.00 ? 3 LYS A HD2 4 3
ATOM 3465 H HD3 . LYS A 1 3 ? -0.330 16.697 -3.204 1.00 0.00 ? 3 LYS A HD3 4 3
ATOM 3466 H HE2 . LYS A 1 3 ? 0.775 19.226 -2.407 1.00 0.00 ? 3 LYS A HE2 4 3
ATOM 3467 H HE3 . LYS A 1 3 ? -0.163 19.300 -3.660 1.00 0.00 ? 3 LYS A HE3 4 3
ATOM 3468 H HZ1 . LYS A 1 3 ? -0.860 18.372 -1.837 1.00 0.00 ? 3 LYS A HZ1 4 3
ATOM 3469 H HZ2 . LYS A 1 3 ? -1.348 19.731 -2.172 1.00 0.00 ? 3 LYS A HZ2 4 3
ATOM 3470 H HZ3 . LYS A 1 3 ? -1.511 18.585 -2.816 1.00 0.00 ? 3 LYS A HZ3 4 3
ATOM 3471 N N . ALA A 1 4 ? 2.316 12.451 -1.782 1.00 0.00 ? 4 ALA A N 4 4
ATOM 3472 C CA . ALA A 1 4 ? 2.908 11.135 -1.803 1.00 0.00 ? 4 ALA A CA 4 4
ATOM 3473 C C . ALA A 1 4 ? 2.022 10.082 -2.443 1.00 0.00 ? 4 ALA A C 4 4
ATOM 3474 O O . ALA A 1 4 ? 2.470 8.963 -2.669 1.00 0.00 ? 4 ALA A O 4 4
ATOM 3475 C CB . ALA A 1 4 ? 3.226 10.759 -0.368 1.00 0.00 ? 4 ALA A CB 4 4
ATOM 3476 H H . ALA A 1 4 ? 2.150 12.888 -0.913 1.00 0.00 ? 4 ALA A H 4 4
ATOM 3477 H HA . ALA A 1 4 ? 3.818 11.173 -2.381 1.00 0.00 ? 4 ALA A HA 4 4
ATOM 3478 H HB1 . ALA A 1 4 ? 3.608 9.751 -0.318 1.00 0.00 ? 4 ALA A HB1 4 4
ATOM 3479 H HB2 . ALA A 1 4 ? 3.903 11.476 0.055 1.00 0.00 ? 4 ALA A HB2 4 4
ATOM 3480 H HB3 . ALA A 1 4 ? 2.323 10.825 0.200 1.00 0.00 ? 4 ALA A HB3 4 4
ATOM 3481 N N . ALA A 1 5 ? 0.767 10.403 -2.753 1.00 0.00 ? 5 ALA A N 4 5
ATOM 3482 C CA . ALA A 1 5 ? -0.263 9.477 -3.164 1.00 0.00 ? 5 ALA A CA 4 5
ATOM 3483 C C . ALA A 1 5 ? 0.038 8.780 -4.479 1.00 0.00 ? 5 ALA A C 4 5
ATOM 3484 O O . ALA A 1 5 ? 0.595 7.693 -4.446 1.00 0.00 ? 5 ALA A O 4 5
ATOM 3485 C CB . ALA A 1 5 ? -1.632 10.111 -2.996 1.00 0.00 ? 5 ALA A CB 4 5
ATOM 3486 H H . ALA A 1 5 ? 0.556 11.372 -2.700 1.00 0.00 ? 5 ALA A H 4 5
ATOM 3487 H HA . ALA A 1 5 ? -0.267 8.655 -2.458 1.00 0.00 ? 5 ALA A HA 4 5
ATOM 3488 H HB1 . ALA A 1 5 ? -1.791 10.342 -1.966 1.00 0.00 ? 5 ALA A HB1 4 5
ATOM 3489 H HB2 . ALA A 1 5 ? -1.694 11.013 -3.569 1.00 0.00 ? 5 ALA A HB2 4 5
ATOM 3490 H HB3 . ALA A 1 5 ? -2.405 9.450 -3.327 1.00 0.00 ? 5 ALA A HB3 4 5
ATOM 3491 N N . ALA A 1 6 ? -0.280 9.347 -5.640 1.00 0.00 ? 6 ALA A N 4 6
ATOM 3492 C CA . ALA A 1 6 ? -0.127 8.660 -6.899 1.00 0.00 ? 6 ALA A CA 4 6
ATOM 3493 C C . ALA A 1 6 ? 1.272 8.134 -7.155 1.00 0.00 ? 6 ALA A C 4 6
ATOM 3494 O O . ALA A 1 6 ? 1.428 7.062 -7.717 1.00 0.00 ? 6 ALA A O 4 6
ATOM 3495 C CB . ALA A 1 6 ? -0.655 9.577 -7.987 1.00 0.00 ? 6 ALA A CB 4 6
ATOM 3496 H H . ALA A 1 6 ? -0.738 10.228 -5.590 1.00 0.00 ? 6 ALA A H 4 6
ATOM 3497 H HA . ALA A 1 6 ? -0.763 7.791 -6.817 1.00 0.00 ? 6 ALA A HA 4 6
ATOM 3498 H HB1 . ALA A 1 6 ? -1.590 9.716 -7.962 1.00 0.00 ? 6 ALA A HB1 4 6
ATOM 3499 H HB2 . ALA A 1 6 ? -0.275 10.436 -7.985 1.00 0.00 ? 6 ALA A HB2 4 6
ATOM 3500 H HB3 . ALA A 1 6 ? -0.524 9.267 -8.852 1.00 0.00 ? 6 ALA A HB3 4 6
ATOM 3501 N N . ALA A 1 7 ? 2.313 8.802 -6.671 1.00 0.00 ? 7 ALA A N 4 7
ATOM 3502 C CA . ALA A 1 7 ? 3.695 8.388 -6.766 1.00 0.00 ? 7 ALA A CA 4 7
ATOM 3503 C C . ALA A 1 7 ? 4.057 7.052 -6.152 1.00 0.00 ? 7 ALA A C 4 7
ATOM 3504 O O . ALA A 1 7 ? 5.020 6.421 -6.550 1.00 0.00 ? 7 ALA A O 4 7
ATOM 3505 C CB . ALA A 1 7 ? 4.614 9.484 -6.268 1.00 0.00 ? 7 ALA A CB 4 7
ATOM 3506 H H . ALA A 1 7 ? 2.038 9.628 -6.190 1.00 0.00 ? 7 ALA A H 4 7
ATOM 3507 H HA . ALA A 1 7 ? 3.871 8.263 -7.823 1.00 0.00 ? 7 ALA A HA 4 7
ATOM 3508 H HB1 . ALA A 1 7 ? 4.467 10.389 -6.829 1.00 0.00 ? 7 ALA A HB1 4 7
ATOM 3509 H HB2 . ALA A 1 7 ? 4.442 9.650 -5.228 1.00 0.00 ? 7 ALA A HB2 4 7
ATOM 3510 H HB3 . ALA A 1 7 ? 5.638 9.210 -6.427 1.00 0.00 ? 7 ALA A HB3 4 7
ATOM 3511 N N . ALA A 1 8 ? 3.216 6.586 -5.241 1.00 0.00 ? 8 ALA A N 4 8
ATOM 3512 C CA . ALA A 1 8 ? 3.100 5.185 -4.925 1.00 0.00 ? 8 ALA A CA 4 8
ATOM 3513 C C . ALA A 1 8 ? 1.879 4.567 -5.576 1.00 0.00 ? 8 ALA A C 4 8
ATOM 3514 O O . ALA A 1 8 ? 1.979 3.659 -6.388 1.00 0.00 ? 8 ALA A O 4 8
ATOM 3515 C CB . ALA A 1 8 ? 3.082 4.957 -3.423 1.00 0.00 ? 8 ALA A CB 4 8
ATOM 3516 H H . ALA A 1 8 ? 2.409 7.129 -5.025 1.00 0.00 ? 8 ALA A H 4 8
ATOM 3517 H HA . ALA A 1 8 ? 3.967 4.672 -5.315 1.00 0.00 ? 8 ALA A HA 4 8
ATOM 3518 H HB1 . ALA A 1 8 ? 3.073 4.712 -3.082 1.00 0.00 ? 8 ALA A HB1 4 8
ATOM 3519 H HB2 . ALA A 1 8 ? 3.215 4.947 -3.030 1.00 0.00 ? 8 ALA A HB2 4 8
ATOM 3520 H HB3 . ALA A 1 8 ? 2.952 4.975 -3.067 1.00 0.00 ? 8 ALA A HB3 4 8
ATOM 3521 N N . ILE A 1 9 ? 0.692 5.005 -5.160 1.00 0.00 ? 9 ILE A N 4 9
ATOM 3522 C CA . ILE A 1 9 ? -0.550 4.289 -5.339 1.00 0.00 ? 9 ILE A CA 4 9
ATOM 3523 C C . ILE A 1 9 ? -0.893 4.015 -6.792 1.00 0.00 ? 9 ILE A C 4 9
ATOM 3524 O O . ILE A 1 9 ? -1.481 2.980 -7.077 1.00 0.00 ? 9 ILE A O 4 9
ATOM 3525 C CB . ILE A 1 9 ? -1.677 5.071 -4.679 1.00 0.00 ? 9 ILE A CB 4 9
ATOM 3526 C CG1 . ILE A 1 9 ? -1.394 5.484 -3.241 1.00 0.00 ? 9 ILE A CG1 4 9
ATOM 3527 C CG2 . ILE A 1 9 ? -2.978 4.298 -4.703 1.00 0.00 ? 9 ILE A CG2 4 9
ATOM 3528 C CD1 . ILE A 1 9 ? -1.106 4.364 -2.286 1.00 0.00 ? 9 ILE A CD1 4 9
ATOM 3529 H H . ILE A 1 9 ? 0.697 5.804 -4.559 1.00 0.00 ? 9 ILE A H 4 9
ATOM 3530 H HA . ILE A 1 9 ? -0.419 3.326 -4.857 1.00 0.00 ? 9 ILE A HA 4 9
ATOM 3531 H HB . ILE A 1 9 ? -1.836 5.950 -5.288 1.00 0.00 ? 9 ILE A HB 4 9
ATOM 3532 H HG12 . ILE A 1 9 ? -0.546 6.168 -3.241 1.00 0.00 ? 9 ILE A HG12 4 9
ATOM 3533 H HG13 . ILE A 1 9 ? -2.222 6.013 -2.854 1.00 0.00 ? 9 ILE A HG13 4 9
ATOM 3534 H HG21 . ILE A 1 9 ? -3.651 4.687 -3.983 1.00 0.00 ? 9 ILE A HG21 4 9
ATOM 3535 H HG22 . ILE A 1 9 ? -3.405 4.381 -5.668 1.00 0.00 ? 9 ILE A HG22 4 9
ATOM 3536 H HG23 . ILE A 1 9 ? -2.795 3.289 -4.424 1.00 0.00 ? 9 ILE A HG23 4 9
ATOM 3537 H HD11 . ILE A 1 9 ? -0.290 3.861 -2.618 1.00 0.00 ? 9 ILE A HD11 4 9
ATOM 3538 H HD12 . ILE A 1 9 ? -0.889 4.760 -1.340 1.00 0.00 ? 9 ILE A HD12 4 9
ATOM 3539 H HD13 . ILE A 1 9 ? -1.881 3.711 -2.255 1.00 0.00 ? 9 ILE A HD13 4 9
ATOM 3540 N N . LYS A 1 10 ? -0.470 4.887 -7.705 1.00 0.00 ? 10 LYS A N 4 10
ATOM 3541 C CA . LYS A 1 10 ? -0.783 4.780 -9.110 1.00 0.00 ? 10 LYS A CA 4 10
ATOM 3542 C C . LYS A 1 10 ? -0.009 3.661 -9.779 1.00 0.00 ? 10 LYS A C 4 10
ATOM 3543 O O . LYS A 1 10 ? -0.595 2.875 -10.506 1.00 0.00 ? 10 LYS A O 4 10
ATOM 3544 C CB . LYS A 1 10 ? -0.555 6.141 -9.749 1.00 0.00 ? 10 LYS A CB 4 10
ATOM 3545 C CG . LYS A 1 10 ? -1.357 6.463 -11.001 1.00 0.00 ? 10 LYS A CG 4 10
ATOM 3546 C CD . LYS A 1 10 ? -0.734 6.094 -12.317 1.00 0.00 ? 10 LYS A CD 4 10
ATOM 3547 C CE . LYS A 1 10 ? 0.440 6.907 -12.629 1.00 0.00 ? 10 LYS A CE 4 10
ATOM 3548 N NZ . LYS A 1 10 ? 1.101 6.492 -13.832 1.00 0.00 ? 10 LYS A NZ 4 10
ATOM 3549 H H . LYS A 1 10 ? 0.133 5.618 -7.374 1.00 0.00 ? 10 LYS A H 4 10
ATOM 3550 H HA . LYS A 1 10 ? -1.819 4.477 -9.197 1.00 0.00 ? 10 LYS A HA 4 10
ATOM 3551 H HB2 . LYS A 1 10 ? -0.801 6.895 -9.003 1.00 0.00 ? 10 LYS A HB2 4 10
ATOM 3552 H HB3 . LYS A 1 10 ? 0.502 6.280 -9.949 1.00 0.00 ? 10 LYS A HB3 4 10
ATOM 3553 H HG2 . LYS A 1 10 ? -2.330 5.977 -10.926 1.00 0.00 ? 10 LYS A HG2 4 10
ATOM 3554 H HG3 . LYS A 1 10 ? -1.509 7.522 -11.020 1.00 0.00 ? 10 LYS A HG3 4 10
ATOM 3555 H HD2 . LYS A 1 10 ? -0.461 5.039 -12.306 1.00 0.00 ? 10 LYS A HD2 4 10
ATOM 3556 H HD3 . LYS A 1 10 ? -1.432 6.243 -13.099 1.00 0.00 ? 10 LYS A HD3 4 10
ATOM 3557 H HE2 . LYS A 1 10 ? 0.158 7.956 -12.711 1.00 0.00 ? 10 LYS A HE2 4 10
ATOM 3558 H HE3 . LYS A 1 10 ? 1.089 6.795 -11.798 1.00 0.00 ? 10 LYS A HE3 4 10
ATOM 3559 H HZ1 . LYS A 1 10 ? 1.880 7.020 -14.034 1.00 0.00 ? 10 LYS A HZ1 4 10
ATOM 3560 H HZ2 . LYS A 1 10 ? 1.377 5.570 -13.731 1.00 0.00 ? 10 LYS A HZ2 4 10
ATOM 3561 H HZ3 . LYS A 1 10 ? 0.530 6.577 -14.618 1.00 0.00 ? 10 LYS A HZ3 4 10
ATOM 3562 N N . ALA A 1 11 ? 1.273 3.528 -9.450 1.00 0.00 ? 11 ALA A N 4 11
ATOM 3563 C CA . ALA A 1 11 ? 2.066 2.360 -9.765 1.00 0.00 ? 11 ALA A CA 4 11
ATOM 3564 C C . ALA A 1 11 ? 1.583 1.147 -8.996 1.00 0.00 ? 11 ALA A C 4 11
ATOM 3565 O O . ALA A 1 11 ? 1.435 0.090 -9.589 1.00 0.00 ? 11 ALA A O 4 11
ATOM 3566 C CB . ALA A 1 11 ? 3.526 2.641 -9.448 1.00 0.00 ? 11 ALA A CB 4 11
ATOM 3567 H H . ALA A 1 11 ? 1.663 4.212 -8.830 1.00 0.00 ? 11 ALA A H 4 11
ATOM 3568 H HA . ALA A 1 11 ? 1.993 2.119 -10.819 1.00 0.00 ? 11 ALA A HA 4 11
ATOM 3569 H HB1 . ALA A 1 11 ? 3.819 3.507 -9.990 1.00 0.00 ? 11 ALA A HB1 4 11
ATOM 3570 H HB2 . ALA A 1 11 ? 3.700 2.838 -8.424 1.00 0.00 ? 11 ALA A HB2 4 11
ATOM 3571 H HB3 . ALA A 1 11 ? 4.166 1.860 -9.756 1.00 0.00 ? 11 ALA A HB3 4 11
ATOM 3572 N N . ILE A 1 12 ? 1.267 1.265 -7.706 1.00 0.00 ? 12 ILE A N 4 12
ATOM 3573 C CA . ILE A 1 12 ? 0.996 0.153 -6.824 1.00 0.00 ? 12 ILE A CA 4 12
ATOM 3574 C C . ILE A 1 12 ? -0.342 -0.485 -7.159 1.00 0.00 ? 12 ILE A C 4 12
ATOM 3575 O O . ILE A 1 12 ? -0.394 -1.706 -7.233 1.00 0.00 ? 12 ILE A O 4 12
ATOM 3576 C CB . ILE A 1 12 ? 1.138 0.551 -5.364 1.00 0.00 ? 12 ILE A CB 4 12
ATOM 3577 C CG1 . ILE A 1 12 ? 2.576 0.860 -4.996 1.00 0.00 ? 12 ILE A CG1 4 12
ATOM 3578 C CG2 . ILE A 1 12 ? 0.566 -0.463 -4.403 1.00 0.00 ? 12 ILE A CG2 4 12
ATOM 3579 C CD1 . ILE A 1 12 ? 3.577 -0.201 -4.984 1.00 0.00 ? 12 ILE A CD1 4 12
ATOM 3580 H H . ILE A 1 12 ? 1.216 2.208 -7.381 1.00 0.00 ? 12 ILE A H 4 12
ATOM 3581 H HA . ILE A 1 12 ? 1.721 -0.632 -7.018 1.00 0.00 ? 12 ILE A HA 4 12
ATOM 3582 H HB . ILE A 1 12 ? 0.570 1.459 -5.233 1.00 0.00 ? 12 ILE A HB 4 12
ATOM 3583 H HG12 . ILE A 1 12 ? 2.929 1.630 -5.682 1.00 0.00 ? 12 ILE A HG12 4 12
ATOM 3584 H HG13 . ILE A 1 12 ? 2.568 1.273 -4.053 1.00 0.00 ? 12 ILE A HG13 4 12
ATOM 3585 H HG21 . ILE A 1 12 ? 0.893 -1.460 -4.624 1.00 0.00 ? 12 ILE A HG21 4 12
ATOM 3586 H HG22 . ILE A 1 12 ? 0.854 -0.199 -3.407 1.00 0.00 ? 12 ILE A HG22 4 12
ATOM 3587 H HG23 . ILE A 1 12 ? -0.500 -0.488 -4.480 1.00 0.00 ? 12 ILE A HG23 4 12
ATOM 3588 H HD11 . ILE A 1 12 ? 4.519 0.123 -4.664 1.00 0.00 ? 12 ILE A HD11 4 12
ATOM 3589 H HD12 . ILE A 1 12 ? 3.263 -0.935 -4.398 1.00 0.00 ? 12 ILE A HD12 4 12
ATOM 3590 H HD13 . ILE A 1 12 ? 3.657 -0.611 -5.893 1.00 0.00 ? 12 ILE A HD13 4 12
ATOM 3591 N N . ALA A 1 13 ? -1.397 0.266 -7.469 1.00 0.00 ? 13 ALA A N 4 13
ATOM 3592 C CA . ALA A 1 13 ? -2.648 -0.345 -7.855 1.00 0.00 ? 13 ALA A CA 4 13
ATOM 3593 C C . ALA A 1 13 ? -2.599 -1.110 -9.164 1.00 0.00 ? 13 ALA A C 4 13
ATOM 3594 O O . ALA A 1 13 ? -3.395 -2.014 -9.354 1.00 0.00 ? 13 ALA A O 4 13
ATOM 3595 C CB . ALA A 1 13 ? -3.698 0.740 -7.836 1.00 0.00 ? 13 ALA A CB 4 13
ATOM 3596 H H . ALA A 1 13 ? -1.276 1.259 -7.395 1.00 0.00 ? 13 ALA A H 4 13
ATOM 3597 H HA . ALA A 1 13 ? -2.904 -1.076 -7.097 1.00 0.00 ? 13 ALA A HA 4 13
ATOM 3598 H HB1 . ALA A 1 13 ? -3.454 1.514 -8.516 1.00 0.00 ? 13 ALA A HB1 4 13
ATOM 3599 H HB2 . ALA A 1 13 ? -4.646 0.327 -8.087 1.00 0.00 ? 13 ALA A HB2 4 13
ATOM 3600 H HB3 . ALA A 1 13 ? -3.773 1.139 -6.845 1.00 0.00 ? 13 ALA A HB3 4 13
ATOM 3601 N N . ALA A 1 14 ? -1.614 -0.837 -10.011 1.00 0.00 ? 14 ALA A N 4 14
ATOM 3602 C CA . ALA A 1 14 ? -1.277 -1.647 -11.159 1.00 0.00 ? 14 ALA A CA 4 14
ATOM 3603 C C . ALA A 1 14 ? -0.391 -2.830 -10.798 1.00 0.00 ? 14 ALA A C 4 14
ATOM 3604 O O . ALA A 1 14 ? -0.657 -3.949 -11.220 1.00 0.00 ? 14 ALA A O 4 14
ATOM 3605 C CB . ALA A 1 14 ? -0.643 -0.755 -12.217 1.00 0.00 ? 14 ALA A CB 4 14
ATOM 3606 H H . ALA A 1 14 ? -0.969 -0.160 -9.650 1.00 0.00 ? 14 ALA A H 4 14
ATOM 3607 H HA . ALA A 1 14 ? -2.191 -2.043 -11.586 1.00 0.00 ? 14 ALA A HA 4 14
ATOM 3608 H HB1 . ALA A 1 14 ? -1.294 0.032 -12.550 1.00 0.00 ? 14 ALA A HB1 4 14
ATOM 3609 H HB2 . ALA A 1 14 ? 0.304 -0.365 -11.876 1.00 0.00 ? 14 ALA A HB2 4 14
ATOM 3610 H HB3 . ALA A 1 14 ? -0.450 -1.344 -13.096 1.00 0.00 ? 14 ALA A HB3 4 14
ATOM 3611 N N . ILE A 1 15 ? 0.599 -2.643 -9.925 1.00 0.00 ? 15 ILE A N 4 15
ATOM 3612 C CA . ILE A 1 15 ? 1.528 -3.629 -9.425 1.00 0.00 ? 15 ILE A CA 4 15
ATOM 3613 C C . ILE A 1 15 ? 0.814 -4.649 -8.557 1.00 0.00 ? 15 ILE A C 4 15
ATOM 3614 O O . ILE A 1 15 ? 1.220 -5.790 -8.505 1.00 0.00 ? 15 ILE A O 4 15
ATOM 3615 C CB . ILE A 1 15 ? 2.683 -2.948 -8.707 1.00 0.00 ? 15 ILE A CB 4 15
ATOM 3616 C CG1 . ILE A 1 15 ? 3.632 -2.273 -9.681 1.00 0.00 ? 15 ILE A CG1 4 15
ATOM 3617 C CG2 . ILE A 1 15 ? 3.445 -3.824 -7.725 1.00 0.00 ? 15 ILE A CG2 4 15
ATOM 3618 C CD1 . ILE A 1 15 ? 4.514 -1.190 -9.086 1.00 0.00 ? 15 ILE A CD1 4 15
ATOM 3619 H H . ILE A 1 15 ? 0.721 -1.690 -9.647 1.00 0.00 ? 15 ILE A H 4 15
ATOM 3620 H HA . ILE A 1 15 ? 1.961 -4.180 -10.249 1.00 0.00 ? 15 ILE A HA 4 15
ATOM 3621 H HB . ILE A 1 15 ? 2.253 -2.184 -8.073 1.00 0.00 ? 15 ILE A HB 4 15
ATOM 3622 H HG12 . ILE A 1 15 ? 4.270 -3.036 -10.126 1.00 0.00 ? 15 ILE A HG12 4 15
ATOM 3623 H HG13 . ILE A 1 15 ? 3.058 -1.832 -10.483 1.00 0.00 ? 15 ILE A HG13 4 15
ATOM 3624 H HG21 . ILE A 1 15 ? 3.902 -4.633 -8.245 1.00 0.00 ? 15 ILE A HG21 4 15
ATOM 3625 H HG22 . ILE A 1 15 ? 4.235 -3.286 -7.241 1.00 0.00 ? 15 ILE A HG22 4 15
ATOM 3626 H HG23 . ILE A 1 15 ? 2.790 -4.195 -6.965 1.00 0.00 ? 15 ILE A HG23 4 15
ATOM 3627 H HD11 . ILE A 1 15 ? 5.191 -1.601 -8.363 1.00 0.00 ? 15 ILE A HD11 4 15
ATOM 3628 H HD12 . ILE A 1 15 ? 5.043 -0.678 -9.872 1.00 0.00 ? 15 ILE A HD12 4 15
ATOM 3629 H HD13 . ILE A 1 15 ? 3.891 -0.466 -8.599 1.00 0.00 ? 15 ILE A HD13 4 15
ATOM 3630 N N . ILE A 1 16 ? -0.298 -4.305 -7.921 1.00 0.00 ? 16 ILE A N 4 16
ATOM 3631 C CA . ILE A 1 16 ? -1.155 -5.248 -7.238 1.00 0.00 ? 16 ILE A CA 4 16
ATOM 3632 C C . ILE A 1 16 ? -1.673 -6.325 -8.173 1.00 0.00 ? 16 ILE A C 4 16
ATOM 3633 O O . ILE A 1 16 ? -1.504 -7.505 -7.902 1.00 0.00 ? 16 ILE A O 4 16
ATOM 3634 C CB . ILE A 1 16 ? -2.241 -4.474 -6.501 1.00 0.00 ? 16 ILE A CB 4 16
ATOM 3635 C CG1 . ILE A 1 16 ? -1.692 -3.847 -5.232 1.00 0.00 ? 16 ILE A CG1 4 16
ATOM 3636 C CG2 . ILE A 1 16 ? -3.402 -5.391 -6.147 1.00 0.00 ? 16 ILE A CG2 4 16
ATOM 3637 C CD1 . ILE A 1 16 ? -2.673 -3.165 -4.313 1.00 0.00 ? 16 ILE A CD1 4 16
ATOM 3638 H H . ILE A 1 16 ? -0.476 -3.320 -7.878 1.00 0.00 ? 16 ILE A H 4 16
ATOM 3639 H HA . ILE A 1 16 ? -0.550 -5.756 -6.493 1.00 0.00 ? 16 ILE A HA 4 16
ATOM 3640 H HB . ILE A 1 16 ? -2.542 -3.650 -7.137 1.00 0.00 ? 16 ILE A HB 4 16
ATOM 3641 H HG12 . ILE A 1 16 ? -1.178 -4.625 -4.666 1.00 0.00 ? 16 ILE A HG12 4 16
ATOM 3642 H HG13 . ILE A 1 16 ? -0.958 -3.115 -5.510 1.00 0.00 ? 16 ILE A HG13 4 16
ATOM 3643 H HG21 . ILE A 1 16 ? -4.171 -4.885 -5.588 1.00 0.00 ? 16 ILE A HG21 4 16
ATOM 3644 H HG22 . ILE A 1 16 ? -3.898 -5.731 -7.033 1.00 0.00 ? 16 ILE A HG22 4 16
ATOM 3645 H HG23 . ILE A 1 16 ? -3.064 -6.249 -5.602 1.00 0.00 ? 16 ILE A HG23 4 16
ATOM 3646 H HD11 . ILE A 1 16 ? -3.263 -3.885 -3.791 1.00 0.00 ? 16 ILE A HD11 4 16
ATOM 3647 H HD12 . ILE A 1 16 ? -2.154 -2.596 -3.578 1.00 0.00 ? 16 ILE A HD12 4 16
ATOM 3648 H HD13 . ILE A 1 16 ? -3.226 -2.456 -4.884 1.00 0.00 ? 16 ILE A HD13 4 16
ATOM 3649 N N . LYS A 1 17 ? -2.226 -5.892 -9.300 1.00 0.00 ? 17 LYS A N 4 17
ATOM 3650 C CA . LYS A 1 17 ? -2.696 -6.740 -10.369 1.00 0.00 ? 17 LYS A CA 4 17
ATOM 3651 C C . LYS A 1 17 ? -1.599 -7.558 -11.020 1.00 0.00 ? 17 LYS A C 4 17
ATOM 3652 O O . LYS A 1 17 ? -1.738 -8.761 -11.165 1.00 0.00 ? 17 LYS A O 4 17
ATOM 3653 C CB . LYS A 1 17 ? -3.462 -5.899 -11.374 1.00 0.00 ? 17 LYS A CB 4 17
ATOM 3654 C CG . LYS A 1 17 ? -4.132 -6.672 -12.476 1.00 0.00 ? 17 LYS A CG 4 17
ATOM 3655 C CD . LYS A 1 17 ? -5.159 -7.663 -12.080 1.00 0.00 ? 17 LYS A CD 4 17
ATOM 3656 C CE . LYS A 1 17 ? -6.353 -7.013 -11.509 1.00 0.00 ? 17 LYS A CE 4 17
ATOM 3657 N NZ . LYS A 1 17 ? -7.374 -7.935 -11.114 1.00 0.00 ? 17 LYS A NZ 4 17
ATOM 3658 H H . LYS A 1 17 ? -2.203 -4.900 -9.411 1.00 0.00 ? 17 LYS A H 4 17
ATOM 3659 H HA . LYS A 1 17 ? -3.397 -7.450 -9.957 1.00 0.00 ? 17 LYS A HA 4 17
ATOM 3660 H HB2 . LYS A 1 17 ? -4.212 -5.309 -10.847 1.00 0.00 ? 17 LYS A HB2 4 17
ATOM 3661 H HB3 . LYS A 1 17 ? -2.765 -5.226 -11.826 1.00 0.00 ? 17 LYS A HB3 4 17
ATOM 3662 H HG2 . LYS A 1 17 ? -4.609 -5.951 -13.140 1.00 0.00 ? 17 LYS A HG2 4 17
ATOM 3663 H HG3 . LYS A 1 17 ? -3.403 -7.156 -13.059 1.00 0.00 ? 17 LYS A HG3 4 17
ATOM 3664 H HD2 . LYS A 1 17 ? -5.461 -8.222 -12.966 1.00 0.00 ? 17 LYS A HD2 4 17
ATOM 3665 H HD3 . LYS A 1 17 ? -4.761 -8.393 -11.433 1.00 0.00 ? 17 LYS A HD3 4 17
ATOM 3666 H HE2 . LYS A 1 17 ? -6.046 -6.429 -10.641 1.00 0.00 ? 17 LYS A HE2 4 17
ATOM 3667 H HE3 . LYS A 1 17 ? -6.796 -6.342 -12.170 1.00 0.00 ? 17 LYS A HE3 4 17
ATOM 3668 H HZ1 . LYS A 1 17 ? -7.010 -8.557 -10.442 1.00 0.00 ? 17 LYS A HZ1 4 17
ATOM 3669 H HZ2 . LYS A 1 17 ? -8.140 -7.458 -10.731 1.00 0.00 ? 17 LYS A HZ2 4 17
ATOM 3670 H HZ3 . LYS A 1 17 ? -7.736 -8.452 -11.852 1.00 0.00 ? 17 LYS A HZ3 4 17
ATOM 3671 N N . ALA A 1 18 ? -0.481 -6.931 -11.374 1.00 0.00 ? 18 ALA A N 4 18
ATOM 3672 C CA . ALA A 1 18 ? 0.627 -7.558 -12.052 1.00 0.00 ? 18 ALA A CA 4 18
ATOM 3673 C C . ALA A 1 18 ? 1.462 -8.444 -11.150 1.00 0.00 ? 18 ALA A C 4 18
ATOM 3674 O O . ALA A 1 18 ? 1.908 -9.495 -11.563 1.00 0.00 ? 18 ALA A O 4 18
ATOM 3675 C CB . ALA A 1 18 ? 1.461 -6.469 -12.694 1.00 0.00 ? 18 ALA A CB 4 18
ATOM 3676 H H . ALA A 1 18 ? -0.428 -5.963 -11.128 1.00 0.00 ? 18 ALA A H 4 18
ATOM 3677 H HA . ALA A 1 18 ? 0.196 -8.161 -12.839 1.00 0.00 ? 18 ALA A HA 4 18
ATOM 3678 H HB1 . ALA A 1 18 ? 2.065 -6.260 -12.519 1.00 0.00 ? 18 ALA A HB1 4 18
ATOM 3679 H HB2 . ALA A 1 18 ? 1.664 -6.459 -13.284 1.00 0.00 ? 18 ALA A HB2 4 18
ATOM 3680 H HB3 . ALA A 1 18 ? 1.295 -5.922 -12.773 1.00 0.00 ? 18 ALA A HB3 4 18
ATOM 3681 N N . GLY A 1 19 ? 1.631 -8.047 -9.898 1.00 0.00 ? 19 GLY A N 4 19
ATOM 3682 C CA . GLY A 1 19 ? 2.243 -8.809 -8.840 1.00 0.00 ? 19 GLY A CA 4 19
ATOM 3683 C C . GLY A 1 19 ? 1.449 -10.051 -8.493 1.00 0.00 ? 19 GLY A C 4 19
ATOM 3684 O O . GLY A 1 19 ? 2.042 -11.089 -8.298 1.00 0.00 ? 19 GLY A O 4 19
ATOM 3685 H H . GLY A 1 19 ? 1.234 -7.163 -9.685 1.00 0.00 ? 19 GLY A H 4 19
ATOM 3686 H HA2 . GLY A 1 19 ? 3.251 -9.122 -9.079 1.00 0.00 ? 19 GLY A HA2 4 19
ATOM 3687 H HA3 . GLY A 1 19 ? 2.225 -8.182 -7.958 1.00 0.00 ? 19 GLY A HA3 4 19
ATOM 3688 N N . GLY A 1 20 ? 0.133 -9.950 -8.411 1.00 0.00 ? 20 GLY A N 4 20
ATOM 3689 C CA . GLY A 1 20 ? -0.779 -11.046 -8.228 1.00 0.00 ? 20 GLY A CA 4 20
ATOM 3690 C C . GLY A 1 20 ? -1.141 -11.296 -6.787 1.00 0.00 ? 20 GLY A C 4 20
ATOM 3691 O O . GLY A 1 20 ? -1.122 -12.423 -6.338 1.00 0.00 ? 20 GLY A O 4 20
ATOM 3692 H H . GLY A 1 20 ? -0.262 -9.057 -8.577 1.00 0.00 ? 20 GLY A H 4 20
ATOM 3693 H HA2 . GLY A 1 20 ? -1.691 -10.838 -8.745 1.00 0.00 ? 20 GLY A HA2 4 20
ATOM 3694 H HA3 . GLY A 1 20 ? -0.317 -11.923 -8.623 1.00 0.00 ? 20 GLY A HA3 4 20
ATOM 3695 N N . TYR A 1 21 ? -1.415 -10.254 -6.011 1.00 0.00 ? 21 TYR A N 4 21
ATOM 3696 C CA . TYR A 1 21 ? -1.750 -10.317 -4.613 1.00 0.00 ? 21 TYR A CA 4 21
ATOM 3697 C C . TYR A 1 21 ? -3.045 -11.025 -4.300 1.00 0.00 ? 21 TYR A C 4 21
ATOM 3698 O O . TYR A 1 21 ? -3.203 -11.562 -3.232 1.00 0.00 ? 21 TYR A O 4 21
ATOM 3699 C CB . TYR A 1 21 ? -1.777 -8.899 -4.076 1.00 0.00 ? 21 TYR A CB 4 21
ATOM 3700 C CG . TYR A 1 21 ? -0.475 -8.278 -3.646 1.00 0.00 ? 21 TYR A CG 4 21
ATOM 3701 C CD1 . TYR A 1 21 ? 0.380 -8.826 -2.710 1.00 0.00 ? 21 TYR A CD1 4 21
ATOM 3702 C CD2 . TYR A 1 21 ? -0.184 -7.030 -4.169 1.00 0.00 ? 21 TYR A CD2 4 21
ATOM 3703 C CE1 . TYR A 1 21 ? 1.482 -8.095 -2.256 1.00 0.00 ? 21 TYR A CE1 4 21
ATOM 3704 C CE2 . TYR A 1 21 ? 0.907 -6.280 -3.719 1.00 0.00 ? 21 TYR A CE2 4 21
ATOM 3705 C CZ . TYR A 1 21 ? 1.740 -6.820 -2.747 1.00 0.00 ? 21 TYR A CZ 4 21
ATOM 3706 O OH . TYR A 1 21 ? 2.825 -6.110 -2.336 1.00 0.00 ? 21 TYR A OH 4 21
ATOM 3707 H H . TYR A 1 21 ? -1.423 -9.319 -6.359 1.00 0.00 ? 21 TYR A H 4 21
ATOM 3708 H HA . TYR A 1 21 ? -0.960 -10.854 -4.117 1.00 0.00 ? 21 TYR A HA 4 21
ATOM 3709 H HB2 . TYR A 1 21 ? -2.200 -8.271 -4.859 1.00 0.00 ? 21 TYR A HB2 4 21
ATOM 3710 H HB3 . TYR A 1 21 ? -2.437 -8.794 -3.231 1.00 0.00 ? 21 TYR A HB3 4 21
ATOM 3711 H HD1 . TYR A 1 21 ? 0.157 -9.770 -2.277 1.00 0.00 ? 21 TYR A HD1 4 21
ATOM 3712 H HD2 . TYR A 1 21 ? -0.896 -6.639 -4.854 1.00 0.00 ? 21 TYR A HD2 4 21
ATOM 3713 H HE1 . TYR A 1 21 ? 2.103 -8.509 -1.498 1.00 0.00 ? 21 TYR A HE1 4 21
ATOM 3714 H HE2 . TYR A 1 21 ? 1.091 -5.301 -4.089 1.00 0.00 ? 21 TYR A HE2 4 21
ATOM 3715 H HH . TYR A 1 21 ? 3.533 -6.341 -2.925 1.00 0.00 ? 21 TYR A HH 4 21
HETATM 3716 N N . NH2 A 1 22 ? -3.998 -11.079 -5.198 1.00 0.00 ? 22 NH2 A N 4 22
HETATM 3717 H HN1 . NH2 A 1 22 ? -4.832 -11.539 -4.901 1.00 0.00 ? 22 NH2 A HN1 4 22
HETATM 3718 H HN2 . NH2 A 1 22 ? -3.894 -10.658 -6.094 1.00 0.00 ? 22 NH2 A HN2 4 22
HETATM 3719 C C . ACE B 1 1 ? 2.888 -14.605 -0.555 1.00 0.00 ? 23 ACE B C 4 1
HETATM 3720 O O . ACE B 1 1 ? 2.256 -14.787 0.436 1.00 0.00 ? 23 ACE B O 4 1
HETATM 3721 C CH3 . ACE B 1 1 ? 4.310 -14.945 -0.605 1.00 0.00 ? 23 ACE B CH3 4 1
HETATM 3722 H H1 . ACE B 1 1 ? 4.623 -15.392 0.165 1.00 0.00 ? 23 ACE B H1 4 1
HETATM 3723 H H2 . ACE B 1 1 ? 4.516 -15.479 -1.267 1.00 0.00 ? 23 ACE B H2 4 1
HETATM 3724 H H3 . ACE B 1 1 ? 4.878 -14.210 -0.673 1.00 0.00 ? 23 ACE B H3 4 1
ATOM 3725 N N . ALA B 1 2 ? 2.331 -14.067 -1.577 1.00 0.00 ? 24 ALA B N 4 2
ATOM 3726 C CA . ALA B 1 2 ? 2.828 -13.928 -2.874 1.00 0.00 ? 24 ALA B CA 4 2
ATOM 3727 C C . ALA B 1 2 ? 4.004 -13.000 -2.998 1.00 0.00 ? 24 ALA B C 4 2
ATOM 3728 O O . ALA B 1 2 ? 4.120 -12.038 -2.267 1.00 0.00 ? 24 ALA B O 4 2
ATOM 3729 C CB . ALA B 1 2 ? 1.713 -13.517 -3.721 1.00 0.00 ? 24 ALA B CB 4 2
ATOM 3730 H H . ALA B 1 2 ? 1.389 -13.882 -1.447 1.00 0.00 ? 24 ALA B H 4 2
ATOM 3731 H HA . ALA B 1 2 ? 3.134 -14.874 -3.188 1.00 0.00 ? 24 ALA B HA 4 2
ATOM 3732 H HB1 . ALA B 1 2 ? 0.971 -14.245 -3.691 1.00 0.00 ? 24 ALA B HB1 4 2
ATOM 3733 H HB2 . ALA B 1 2 ? 1.326 -12.593 -3.423 1.00 0.00 ? 24 ALA B HB2 4 2
ATOM 3734 H HB3 . ALA B 1 2 ? 2.061 -13.410 -4.696 1.00 0.00 ? 24 ALA B HB3 4 2
ATOM 3735 N N . LYS B 1 3 ? 4.855 -13.237 -3.971 1.00 0.00 ? 25 LYS B N 4 3
ATOM 3736 C CA . LYS B 1 3 ? 6.068 -12.499 -4.208 1.00 0.00 ? 25 LYS B CA 4 3
ATOM 3737 C C . LYS B 1 3 ? 5.897 -11.071 -4.650 1.00 0.00 ? 25 LYS B C 4 3
ATOM 3738 O O . LYS B 1 3 ? 6.831 -10.294 -4.569 1.00 0.00 ? 25 LYS B O 4 3
ATOM 3739 C CB . LYS B 1 3 ? 6.877 -13.208 -5.262 1.00 0.00 ? 25 LYS B CB 4 3
ATOM 3740 C CG . LYS B 1 3 ? 7.498 -14.520 -4.879 1.00 0.00 ? 25 LYS B CG 4 3
ATOM 3741 C CD . LYS B 1 3 ? 8.619 -14.448 -3.894 1.00 0.00 ? 25 LYS B CD 4 3
ATOM 3742 C CE . LYS B 1 3 ? 9.759 -13.631 -4.384 1.00 0.00 ? 25 LYS B CE 4 3
ATOM 3743 N NZ . LYS B 1 3 ? 10.861 -13.880 -3.975 1.00 0.00 ? 25 LYS B NZ 4 3
ATOM 3744 H H . LYS B 1 3 ? 4.657 -14.009 -4.562 1.00 0.00 ? 25 LYS B H 4 3
ATOM 3745 H HA . LYS B 1 3 ? 6.633 -12.443 -3.297 1.00 0.00 ? 25 LYS B HA 4 3
ATOM 3746 H HB2 . LYS B 1 3 ? 6.213 -13.401 -6.105 1.00 0.00 ? 25 LYS B HB2 4 3
ATOM 3747 H HB3 . LYS B 1 3 ? 7.628 -12.537 -5.651 1.00 0.00 ? 25 LYS B HB3 4 3
ATOM 3748 H HG2 . LYS B 1 3 ? 6.721 -15.164 -4.467 1.00 0.00 ? 25 LYS B HG2 4 3
ATOM 3749 H HG3 . LYS B 1 3 ? 7.846 -14.981 -5.771 1.00 0.00 ? 25 LYS B HG3 4 3
ATOM 3750 H HD2 . LYS B 1 3 ? 8.249 -14.020 -2.963 1.00 0.00 ? 25 LYS B HD2 4 3
ATOM 3751 H HD3 . LYS B 1 3 ? 8.953 -15.422 -3.663 1.00 0.00 ? 25 LYS B HD3 4 3
ATOM 3752 H HE2 . LYS B 1 3 ? 9.778 -13.724 -5.470 1.00 0.00 ? 25 LYS B HE2 4 3
ATOM 3753 H HE3 . LYS B 1 3 ? 9.688 -12.771 -4.216 1.00 0.00 ? 25 LYS B HE3 4 3
ATOM 3754 H HZ1 . LYS B 1 3 ? 11.288 -13.336 -4.395 1.00 0.00 ? 25 LYS B HZ1 4 3
ATOM 3755 H HZ2 . LYS B 1 3 ? 11.251 -14.767 -3.992 1.00 0.00 ? 25 LYS B HZ2 4 3
ATOM 3756 H HZ3 . LYS B 1 3 ? 10.893 -13.619 -3.242 1.00 0.00 ? 25 LYS B HZ3 4 3
ATOM 3757 N N . ALA B 1 4 ? 4.687 -10.661 -5.011 1.00 0.00 ? 26 ALA B N 4 4
ATOM 3758 C CA . ALA B 1 4 ? 4.295 -9.276 -5.077 1.00 0.00 ? 26 ALA B CA 4 4
ATOM 3759 C C . ALA B 1 4 ? 4.632 -8.463 -3.842 1.00 0.00 ? 26 ALA B C 4 4
ATOM 3760 O O . ALA B 1 4 ? 4.718 -7.246 -3.898 1.00 0.00 ? 26 ALA B O 4 4
ATOM 3761 C CB . ALA B 1 4 ? 2.795 -9.242 -5.292 1.00 0.00 ? 26 ALA B CB 4 4
ATOM 3762 H H . ALA B 1 4 ? 3.976 -11.358 -5.050 1.00 0.00 ? 26 ALA B H 4 4
ATOM 3763 H HA . ALA B 1 4 ? 4.802 -8.810 -5.911 1.00 0.00 ? 26 ALA B HA 4 4
ATOM 3764 H HB1 . ALA B 1 4 ? 2.536 -9.825 -6.164 1.00 0.00 ? 26 ALA B HB1 4 4
ATOM 3765 H HB2 . ALA B 1 4 ? 2.307 -9.647 -4.428 1.00 0.00 ? 26 ALA B HB2 4 4
ATOM 3766 H HB3 . ALA B 1 4 ? 2.437 -8.234 -5.442 1.00 0.00 ? 26 ALA B HB3 4 4
ATOM 3767 N N . ALA B 1 5 ? 4.883 -9.127 -2.719 1.00 0.00 ? 27 ALA B N 4 5
ATOM 3768 C CA . ALA B 1 5 ? 5.043 -8.545 -1.412 1.00 0.00 ? 27 ALA B CA 4 5
ATOM 3769 C C . ALA B 1 5 ? 6.288 -7.683 -1.338 1.00 0.00 ? 27 ALA B C 4 5
ATOM 3770 O O . ALA B 1 5 ? 6.218 -6.491 -1.576 1.00 0.00 ? 27 ALA B O 4 5
ATOM 3771 C CB . ALA B 1 5 ? 4.912 -9.648 -0.379 1.00 0.00 ? 27 ALA B CB 4 5
ATOM 3772 H H . ALA B 1 5 ? 4.981 -10.119 -2.801 1.00 0.00 ? 27 ALA B H 4 5
ATOM 3773 H HA . ALA B 1 5 ? 4.226 -7.868 -1.201 1.00 0.00 ? 27 ALA B HA 4 5
ATOM 3774 H HB1 . ALA B 1 5 ? 3.958 -10.147 -0.474 1.00 0.00 ? 27 ALA B HB1 4 5
ATOM 3775 H HB2 . ALA B 1 5 ? 5.688 -10.384 -0.482 1.00 0.00 ? 27 ALA B HB2 4 5
ATOM 3776 H HB3 . ALA B 1 5 ? 4.968 -9.234 0.609 1.00 0.00 ? 27 ALA B HB3 4 5
ATOM 3777 N N . ALA B 1 6 ? 7.438 -8.263 -1.030 1.00 0.00 ? 28 ALA B N 4 6
ATOM 3778 C CA . ALA B 1 6 ? 8.646 -7.522 -0.749 1.00 0.00 ? 28 ALA B CA 4 6
ATOM 3779 C C . ALA B 1 6 ? 9.263 -6.834 -1.951 1.00 0.00 ? 28 ALA B C 4 6
ATOM 3780 O O . ALA B 1 6 ? 10.344 -6.288 -1.882 1.00 0.00 ? 28 ALA B O 4 6
ATOM 3781 C CB . ALA B 1 6 ? 9.616 -8.426 -0.010 1.00 0.00 ? 28 ALA B CB 4 6
ATOM 3782 H H . ALA B 1 6 ? 7.428 -9.247 -0.874 1.00 0.00 ? 28 ALA B H 4 6
ATOM 3783 H HA . ALA B 1 6 ? 8.327 -6.730 -0.083 1.00 0.00 ? 28 ALA B HA 4 6
ATOM 3784 H HB1 . ALA B 1 6 ? 9.751 -9.131 -0.164 1.00 0.00 ? 28 ALA B HB1 4 6
ATOM 3785 H HB2 . ALA B 1 6 ? 10.288 -8.254 0.051 1.00 0.00 ? 28 ALA B HB2 4 6
ATOM 3786 H HB3 . ALA B 1 6 ? 9.544 -8.557 0.697 1.00 0.00 ? 28 ALA B HB3 4 6
ATOM 3787 N N . ALA B 1 7 ? 8.605 -6.808 -3.101 1.00 0.00 ? 29 ALA B N 4 7
ATOM 3788 C CA . ALA B 1 7 ? 8.875 -5.968 -4.238 1.00 0.00 ? 29 ALA B CA 4 7
ATOM 3789 C C . ALA B 1 7 ? 8.063 -4.691 -4.239 1.00 0.00 ? 29 ALA B C 4 7
ATOM 3790 O O . ALA B 1 7 ? 8.589 -3.619 -4.418 1.00 0.00 ? 29 ALA B O 4 7
ATOM 3791 C CB . ALA B 1 7 ? 8.578 -6.788 -5.475 1.00 0.00 ? 29 ALA B CB 4 7
ATOM 3792 H H . ALA B 1 7 ? 7.741 -7.287 -3.077 1.00 0.00 ? 29 ALA B H 4 7
ATOM 3793 H HA . ALA B 1 7 ? 9.930 -5.713 -4.273 1.00 0.00 ? 29 ALA B HA 4 7
ATOM 3794 H HB1 . ALA B 1 7 ? 7.552 -7.092 -5.509 1.00 0.00 ? 29 ALA B HB1 4 7
ATOM 3795 H HB2 . ALA B 1 7 ? 8.769 -6.228 -6.350 1.00 0.00 ? 29 ALA B HB2 4 7
ATOM 3796 H HB3 . ALA B 1 7 ? 9.195 -7.646 -5.480 1.00 0.00 ? 29 ALA B HB3 4 7
ATOM 3797 N N . ALA B 1 8 ? 6.761 -4.778 -4.016 1.00 0.00 ? 30 ALA B N 4 8
ATOM 3798 C CA . ALA B 1 8 ? 5.875 -3.638 -4.080 1.00 0.00 ? 30 ALA B CA 4 8
ATOM 3799 C C . ALA B 1 8 ? 5.785 -2.943 -2.739 1.00 0.00 ? 30 ALA B C 4 8
ATOM 3800 O O . ALA B 1 8 ? 5.762 -1.723 -2.699 1.00 0.00 ? 30 ALA B O 4 8
ATOM 3801 C CB . ALA B 1 8 ? 4.489 -4.084 -4.500 1.00 0.00 ? 30 ALA B CB 4 8
ATOM 3802 H H . ALA B 1 8 ? 6.378 -5.673 -3.771 1.00 0.00 ? 30 ALA B H 4 8
ATOM 3803 H HA . ALA B 1 8 ? 6.237 -2.910 -4.794 1.00 0.00 ? 30 ALA B HA 4 8
ATOM 3804 H HB1 . ALA B 1 8 ? 3.969 -3.229 -4.856 1.00 0.00 ? 30 ALA B HB1 4 8
ATOM 3805 H HB2 . ALA B 1 8 ? 4.504 -4.857 -5.231 1.00 0.00 ? 30 ALA B HB2 4 8
ATOM 3806 H HB3 . ALA B 1 8 ? 3.956 -4.412 -3.644 1.00 0.00 ? 30 ALA B HB3 4 8
ATOM 3807 N N . ILE B 1 9 ? 5.795 -3.703 -1.645 1.00 0.00 ? 31 ILE B N 4 9
ATOM 3808 C CA . ILE B 1 9 ? 5.813 -3.187 -0.297 1.00 0.00 ? 31 ILE B CA 4 9
ATOM 3809 C C . ILE B 1 9 ? 7.049 -2.344 -0.051 1.00 0.00 ? 31 ILE B C 4 9
ATOM 3810 O O . ILE B 1 9 ? 6.960 -1.297 0.567 1.00 0.00 ? 31 ILE B O 4 9
ATOM 3811 C CB . ILE B 1 9 ? 5.781 -4.305 0.737 1.00 0.00 ? 31 ILE B CB 4 9
ATOM 3812 C CG1 . ILE B 1 9 ? 4.536 -5.169 0.667 1.00 0.00 ? 31 ILE B CG1 4 9
ATOM 3813 C CG2 . ILE B 1 9 ? 5.956 -3.768 2.147 1.00 0.00 ? 31 ILE B CG2 4 9
ATOM 3814 C CD1 . ILE B 1 9 ? 3.246 -4.530 1.116 1.00 0.00 ? 31 ILE B CD1 4 9
ATOM 3815 H H . ILE B 1 9 ? 5.771 -4.695 -1.754 1.00 0.00 ? 31 ILE B H 4 9
ATOM 3816 H HA . ILE B 1 9 ? 4.950 -2.540 -0.220 1.00 0.00 ? 31 ILE B HA 4 9
ATOM 3817 H HB . ILE B 1 9 ? 6.680 -4.880 0.564 1.00 0.00 ? 31 ILE B HB 4 9
ATOM 3818 H HG12 . ILE B 1 9 ? 4.404 -5.484 -0.368 1.00 0.00 ? 31 ILE B HG12 4 9
ATOM 3819 H HG13 . ILE B 1 9 ? 4.733 -6.070 1.224 1.00 0.00 ? 31 ILE B HG13 4 9
ATOM 3820 H HG21 . ILE B 1 9 ? 5.741 -4.569 2.831 1.00 0.00 ? 31 ILE B HG21 4 9
ATOM 3821 H HG22 . ILE B 1 9 ? 6.953 -3.393 2.290 1.00 0.00 ? 31 ILE B HG22 4 9
ATOM 3822 H HG23 . ILE B 1 9 ? 5.254 -2.973 2.299 1.00 0.00 ? 31 ILE B HG23 4 9
ATOM 3823 H HD11 . ILE B 1 9 ? 3.144 -3.564 0.676 1.00 0.00 ? 31 ILE B HD11 4 9
ATOM 3824 H HD12 . ILE B 1 9 ? 2.460 -5.187 0.829 1.00 0.00 ? 31 ILE B HD12 4 9
ATOM 3825 H HD13 . ILE B 1 9 ? 3.241 -4.439 2.178 1.00 0.00 ? 31 ILE B HD13 4 9
ATOM 3826 N N . LYS B 1 10 ? 8.201 -2.804 -0.530 1.00 0.00 ? 32 LYS B N 4 10
ATOM 3827 C CA . LYS B 1 10 ? 9.428 -2.040 -0.518 1.00 0.00 ? 32 LYS B CA 4 10
ATOM 3828 C C . LYS B 1 10 ? 9.286 -0.703 -1.217 1.00 0.00 ? 32 LYS B C 4 10
ATOM 3829 O O . LYS B 1 10 ? 9.535 0.330 -0.629 1.00 0.00 ? 32 LYS B O 4 10
ATOM 3830 C CB . LYS B 1 10 ? 10.548 -2.900 -1.088 1.00 0.00 ? 32 LYS B CB 4 10
ATOM 3831 C CG . LYS B 1 10 ? 11.193 -3.740 -0.002 1.00 0.00 ? 32 LYS B CG 4 10
ATOM 3832 C CD . LYS B 1 10 ? 12.477 -4.370 -0.511 1.00 0.00 ? 32 LYS B CD 4 10
ATOM 3833 C CE . LYS B 1 10 ? 12.948 -5.399 0.452 1.00 0.00 ? 32 LYS B CE 4 10
ATOM 3834 N NZ . LYS B 1 10 ? 14.061 -6.174 -0.040 1.00 0.00 ? 32 LYS B NZ 4 10
ATOM 3835 H H . LYS B 1 10 ? 8.164 -3.700 -0.974 1.00 0.00 ? 32 LYS B H 4 10
ATOM 3836 H HA . LYS B 1 10 ? 9.645 -1.752 0.502 1.00 0.00 ? 32 LYS B HA 4 10
ATOM 3837 H HB2 . LYS B 1 10 ? 10.162 -3.535 -1.886 1.00 0.00 ? 32 LYS B HB2 4 10
ATOM 3838 H HB3 . LYS B 1 10 ? 11.340 -2.289 -1.491 1.00 0.00 ? 32 LYS B HB3 4 10
ATOM 3839 H HG2 . LYS B 1 10 ? 11.400 -3.128 0.876 1.00 0.00 ? 32 LYS B HG2 4 10
ATOM 3840 H HG3 . LYS B 1 10 ? 10.492 -4.509 0.291 1.00 0.00 ? 32 LYS B HG3 4 10
ATOM 3841 H HD2 . LYS B 1 10 ? 12.320 -4.810 -1.496 1.00 0.00 ? 32 LYS B HD2 4 10
ATOM 3842 H HD3 . LYS B 1 10 ? 13.228 -3.630 -0.591 1.00 0.00 ? 32 LYS B HD3 4 10
ATOM 3843 H HE2 . LYS B 1 10 ? 13.239 -4.911 1.383 1.00 0.00 ? 32 LYS B HE2 4 10
ATOM 3844 H HE3 . LYS B 1 10 ? 12.164 -6.029 0.673 1.00 0.00 ? 32 LYS B HE3 4 10
ATOM 3845 H HZ1 . LYS B 1 10 ? 14.806 -5.633 -0.141 1.00 0.00 ? 32 LYS B HZ1 4 10
ATOM 3846 H HZ2 . LYS B 1 10 ? 14.328 -6.884 0.528 1.00 0.00 ? 32 LYS B HZ2 4 10
ATOM 3847 H HZ3 . LYS B 1 10 ? 13.852 -6.534 -0.860 1.00 0.00 ? 32 LYS B HZ3 4 10
ATOM 3848 N N . ALA B 1 11 ? 8.737 -0.714 -2.422 1.00 0.00 ? 33 ALA B N 4 11
ATOM 3849 C CA . ALA B 1 11 ? 8.349 0.449 -3.188 1.00 0.00 ? 33 ALA B CA 4 11
ATOM 3850 C C . ALA B 1 11 ? 7.179 1.242 -2.641 1.00 0.00 ? 33 ALA B C 4 11
ATOM 3851 O O . ALA B 1 11 ? 6.843 2.273 -3.206 1.00 0.00 ? 33 ALA B O 4 11
ATOM 3852 C CB . ALA B 1 11 ? 8.091 -0.001 -4.615 1.00 0.00 ? 33 ALA B CB 4 11
ATOM 3853 H H . ALA B 1 11 ? 8.548 -1.632 -2.742 1.00 0.00 ? 33 ALA B H 4 11
ATOM 3854 H HA . ALA B 1 11 ? 9.183 1.137 -3.149 1.00 0.00 ? 33 ALA B HA 4 11
ATOM 3855 H HB1 . ALA B 1 11 ? 8.899 -0.609 -4.963 1.00 0.00 ? 33 ALA B HB1 4 11
ATOM 3856 H HB2 . ALA B 1 11 ? 7.229 -0.613 -4.655 1.00 0.00 ? 33 ALA B HB2 4 11
ATOM 3857 H HB3 . ALA B 1 11 ? 7.962 0.860 -5.231 1.00 0.00 ? 33 ALA B HB3 4 11
ATOM 3858 N N . ILE B 1 12 ? 6.588 0.838 -1.520 1.00 0.00 ? 34 ILE B N 4 12
ATOM 3859 C CA . ILE B 1 12 ? 5.688 1.608 -0.693 1.00 0.00 ? 34 ILE B CA 4 12
ATOM 3860 C C . ILE B 1 12 ? 6.321 2.061 0.608 1.00 0.00 ? 34 ILE B C 4 12
ATOM 3861 O O . ILE B 1 12 ? 6.415 3.266 0.803 1.00 0.00 ? 34 ILE B O 4 12
ATOM 3862 C CB . ILE B 1 12 ? 4.336 0.914 -0.609 1.00 0.00 ? 34 ILE B CB 4 12
ATOM 3863 C CG1 . ILE B 1 12 ? 3.281 1.821 -1.204 1.00 0.00 ? 34 ILE B CG1 4 12
ATOM 3864 C CG2 . ILE B 1 12 ? 3.927 0.350 0.734 1.00 0.00 ? 34 ILE B CG2 4 12
ATOM 3865 C CD1 . ILE B 1 12 ? 2.804 2.987 -0.380 1.00 0.00 ? 34 ILE B CD1 4 12
ATOM 3866 H H . ILE B 1 12 ? 6.721 -0.103 -1.200 1.00 0.00 ? 34 ILE B H 4 12
ATOM 3867 H HA . ILE B 1 12 ? 5.536 2.566 -1.182 1.00 0.00 ? 34 ILE B HA 4 12
ATOM 3868 H HB . ILE B 1 12 ? 4.372 0.078 -1.291 1.00 0.00 ? 34 ILE B HB 4 12
ATOM 3869 H HG12 . ILE B 1 12 ? 3.673 2.216 -2.142 1.00 0.00 ? 34 ILE B HG12 4 12
ATOM 3870 H HG13 . ILE B 1 12 ? 2.435 1.211 -1.456 1.00 0.00 ? 34 ILE B HG13 4 12
ATOM 3871 H HG21 . ILE B 1 12 ? 3.866 1.093 1.515 1.00 0.00 ? 34 ILE B HG21 4 12
ATOM 3872 H HG22 . ILE B 1 12 ? 2.984 -0.163 0.622 1.00 0.00 ? 34 ILE B HG22 4 12
ATOM 3873 H HG23 . ILE B 1 12 ? 4.649 -0.384 1.055 1.00 0.00 ? 34 ILE B HG23 4 12
ATOM 3874 H HD11 . ILE B 1 12 ? 2.435 2.638 0.559 1.00 0.00 ? 34 ILE B HD11 4 12
ATOM 3875 H HD12 . ILE B 1 12 ? 3.576 3.708 -0.241 1.00 0.00 ? 34 ILE B HD12 4 12
ATOM 3876 H HD13 . ILE B 1 12 ? 2.002 3.479 -0.876 1.00 0.00 ? 34 ILE B HD13 4 12
ATOM 3877 N N . ALA B 1 13 ? 6.852 1.223 1.495 1.00 0.00 ? 35 ALA B N 4 13
ATOM 3878 C CA . ALA B 1 13 ? 7.317 1.615 2.804 1.00 0.00 ? 35 ALA B CA 4 13
ATOM 3879 C C . ALA B 1 13 ? 8.414 2.660 2.775 1.00 0.00 ? 35 ALA B C 4 13
ATOM 3880 O O . ALA B 1 13 ? 8.459 3.574 3.584 1.00 0.00 ? 35 ALA B O 4 13
ATOM 3881 C CB . ALA B 1 13 ? 7.768 0.398 3.586 1.00 0.00 ? 35 ALA B CB 4 13
ATOM 3882 H H . ALA B 1 13 ? 6.860 0.254 1.243 1.00 0.00 ? 35 ALA B H 4 13
ATOM 3883 H HA . ALA B 1 13 ? 6.476 2.065 3.309 1.00 0.00 ? 35 ALA B HA 4 13
ATOM 3884 H HB1 . ALA B 1 13 ? 8.568 -0.096 3.085 1.00 0.00 ? 35 ALA B HB1 4 13
ATOM 3885 H HB2 . ALA B 1 13 ? 8.055 0.657 4.568 1.00 0.00 ? 35 ALA B HB2 4 13
ATOM 3886 H HB3 . ALA B 1 13 ? 6.963 -0.276 3.679 1.00 0.00 ? 35 ALA B HB3 4 13
ATOM 3887 N N . ALA B 1 14 ? 9.267 2.587 1.759 1.00 0.00 ? 36 ALA B N 4 14
ATOM 3888 C CA . ALA B 1 14 ? 10.261 3.584 1.454 1.00 0.00 ? 36 ALA B CA 4 14
ATOM 3889 C C . ALA B 1 14 ? 9.634 4.893 1.024 1.00 0.00 ? 36 ALA B C 4 14
ATOM 3890 O O . ALA B 1 14 ? 10.070 5.945 1.453 1.00 0.00 ? 36 ALA B O 4 14
ATOM 3891 C CB . ALA B 1 14 ? 11.234 3.019 0.434 1.00 0.00 ? 36 ALA B CB 4 14
ATOM 3892 H H . ALA B 1 14 ? 9.118 1.806 1.146 1.00 0.00 ? 36 ALA B H 4 14
ATOM 3893 H HA . ALA B 1 14 ? 10.803 3.805 2.361 1.00 0.00 ? 36 ALA B HA 4 14
ATOM 3894 H HB1 . ALA B 1 14 ? 11.730 2.164 0.826 1.00 0.00 ? 36 ALA B HB1 4 14
ATOM 3895 H HB2 . ALA B 1 14 ? 10.727 2.759 -0.449 1.00 0.00 ? 36 ALA B HB2 4 14
ATOM 3896 H HB3 . ALA B 1 14 ? 11.985 3.724 0.216 1.00 0.00 ? 36 ALA B HB3 4 14
ATOM 3897 N N . ILE B 1 15 ? 8.614 4.841 0.181 1.00 0.00 ? 37 ILE B N 4 15
ATOM 3898 C CA . ILE B 1 15 ? 7.874 5.942 -0.394 1.00 0.00 ? 37 ILE B CA 4 15
ATOM 3899 C C . ILE B 1 15 ? 6.956 6.559 0.647 1.00 0.00 ? 37 ILE B C 4 15
ATOM 3900 O O . ILE B 1 15 ? 6.794 7.767 0.645 1.00 0.00 ? 37 ILE B O 4 15
ATOM 3901 C CB . ILE B 1 15 ? 7.146 5.470 -1.647 1.00 0.00 ? 37 ILE B CB 4 15
ATOM 3902 C CG1 . ILE B 1 15 ? 8.043 5.403 -2.872 1.00 0.00 ? 37 ILE B CG1 4 15
ATOM 3903 C CG2 . ILE B 1 15 ? 5.959 6.335 -2.037 1.00 0.00 ? 37 ILE B CG2 4 15
ATOM 3904 C CD1 . ILE B 1 15 ? 9.197 4.420 -2.788 1.00 0.00 ? 37 ILE B CD1 4 15
ATOM 3905 H H . ILE B 1 15 ? 8.263 3.921 -0.008 1.00 0.00 ? 37 ILE B H 4 15
ATOM 3906 H HA . ILE B 1 15 ? 8.546 6.739 -0.686 1.00 0.00 ? 37 ILE B HA 4 15
ATOM 3907 H HB . ILE B 1 15 ? 6.737 4.479 -1.486 1.00 0.00 ? 37 ILE B HB 4 15
ATOM 3908 H HG12 . ILE B 1 15 ? 7.424 5.126 -3.725 1.00 0.00 ? 37 ILE B HG12 4 15
ATOM 3909 H HG13 . ILE B 1 15 ? 8.433 6.376 -3.101 1.00 0.00 ? 37 ILE B HG13 4 15
ATOM 3910 H HG21 . ILE B 1 15 ? 6.257 7.352 -2.139 1.00 0.00 ? 37 ILE B HG21 4 15
ATOM 3911 H HG22 . ILE B 1 15 ? 5.582 6.026 -2.987 1.00 0.00 ? 37 ILE B HG22 4 15
ATOM 3912 H HG23 . ILE B 1 15 ? 5.162 6.284 -1.334 1.00 0.00 ? 37 ILE B HG23 4 15
ATOM 3913 H HD11 . ILE B 1 15 ? 9.617 4.220 -3.760 1.00 0.00 ? 37 ILE B HD11 4 15
ATOM 3914 H HD12 . ILE B 1 15 ? 9.965 4.838 -2.167 1.00 0.00 ? 37 ILE B HD12 4 15
ATOM 3915 H HD13 . ILE B 1 15 ? 8.857 3.495 -2.362 1.00 0.00 ? 37 ILE B HD13 4 15
ATOM 3916 N N . ILE B 1 16 ? 6.402 5.815 1.599 1.00 0.00 ? 38 ILE B N 4 16
ATOM 3917 C CA . ILE B 1 16 ? 5.689 6.341 2.741 1.00 0.00 ? 38 ILE B CA 4 16
ATOM 3918 C C . ILE B 1 16 ? 6.540 7.370 3.460 1.00 0.00 ? 38 ILE B C 4 16
ATOM 3919 O O . ILE B 1 16 ? 6.108 8.481 3.704 1.00 0.00 ? 38 ILE B O 4 16
ATOM 3920 C CB . ILE B 1 16 ? 5.235 5.218 3.661 1.00 0.00 ? 38 ILE B CB 4 16
ATOM 3921 C CG1 . ILE B 1 16 ? 4.201 4.333 2.982 1.00 0.00 ? 38 ILE B CG1 4 16
ATOM 3922 C CG2 . ILE B 1 16 ? 4.709 5.789 4.972 1.00 0.00 ? 38 ILE B CG2 4 16
ATOM 3923 C CD1 . ILE B 1 16 ? 3.597 3.273 3.874 1.00 0.00 ? 38 ILE B CD1 4 16
ATOM 3924 H H . ILE B 1 16 ? 6.488 4.823 1.486 1.00 0.00 ? 38 ILE B H 4 16
ATOM 3925 H HA . ILE B 1 16 ? 4.831 6.894 2.374 1.00 0.00 ? 38 ILE B HA 4 16
ATOM 3926 H HB . ILE B 1 16 ? 6.115 4.598 3.814 1.00 0.00 ? 38 ILE B HB 4 16
ATOM 3927 H HG12 . ILE B 1 16 ? 3.401 4.968 2.602 1.00 0.00 ? 38 ILE B HG12 4 16
ATOM 3928 H HG13 . ILE B 1 16 ? 4.630 3.835 2.123 1.00 0.00 ? 38 ILE B HG13 4 16
ATOM 3929 H HG21 . ILE B 1 16 ? 4.471 5.004 5.666 1.00 0.00 ? 38 ILE B HG21 4 16
ATOM 3930 H HG22 . ILE B 1 16 ? 5.485 6.304 5.508 1.00 0.00 ? 38 ILE B HG22 4 16
ATOM 3931 H HG23 . ILE B 1 16 ? 3.837 6.404 4.844 1.00 0.00 ? 38 ILE B HG23 4 16
ATOM 3932 H HD11 . ILE B 1 16 ? 2.952 3.709 4.612 1.00 0.00 ? 38 ILE B HD11 4 16
ATOM 3933 H HD12 . ILE B 1 16 ? 2.999 2.633 3.254 1.00 0.00 ? 38 ILE B HD12 4 16
ATOM 3934 H HD13 . ILE B 1 16 ? 4.365 2.724 4.374 1.00 0.00 ? 38 ILE B HD13 4 16
ATOM 3935 N N . LYS B 1 17 ? 7.778 6.995 3.739 1.00 0.00 ? 39 LYS B N 4 17
ATOM 3936 C CA . LYS B 1 17 ? 8.765 7.793 4.424 1.00 0.00 ? 39 LYS B CA 4 17
ATOM 3937 C C . LYS B 1 17 ? 9.296 8.916 3.559 1.00 0.00 ? 39 LYS B C 4 17
ATOM 3938 O O . LYS B 1 17 ? 9.363 10.044 3.999 1.00 0.00 ? 39 LYS B O 4 17
ATOM 3939 C CB . LYS B 1 17 ? 9.874 6.878 4.901 1.00 0.00 ? 39 LYS B CB 4 17
ATOM 3940 C CG . LYS B 1 17 ? 9.473 6.089 6.128 1.00 0.00 ? 39 LYS B CG 4 17
ATOM 3941 C CD . LYS B 1 17 ? 10.554 5.159 6.621 1.00 0.00 ? 39 LYS B CD 4 17
ATOM 3942 C CE . LYS B 1 17 ? 10.716 3.935 5.784 1.00 0.00 ? 39 LYS B CE 4 17
ATOM 3943 N NZ . LYS B 1 17 ? 11.755 3.070 6.181 1.00 0.00 ? 39 LYS B NZ 4 17
ATOM 3944 H H . LYS B 1 17 ? 8.005 6.044 3.531 1.00 0.00 ? 39 LYS B H 4 17
ATOM 3945 H HA . LYS B 1 17 ? 8.292 8.284 5.262 1.00 0.00 ? 39 LYS B HA 4 17
ATOM 3946 H HB2 . LYS B 1 17 ? 10.155 6.196 4.099 1.00 0.00 ? 39 LYS B HB2 4 17
ATOM 3947 H HB3 . LYS B 1 17 ? 10.746 7.463 5.155 1.00 0.00 ? 39 LYS B HB3 4 17
ATOM 3948 H HG2 . LYS B 1 17 ? 9.211 6.785 6.924 1.00 0.00 ? 39 LYS B HG2 4 17
ATOM 3949 H HG3 . LYS B 1 17 ? 8.600 5.504 5.930 1.00 0.00 ? 39 LYS B HG3 4 17
ATOM 3950 H HD2 . LYS B 1 17 ? 11.500 5.699 6.668 1.00 0.00 ? 39 LYS B HD2 4 17
ATOM 3951 H HD3 . LYS B 1 17 ? 10.314 4.828 7.593 1.00 0.00 ? 39 LYS B HD3 4 17
ATOM 3952 H HE2 . LYS B 1 17 ? 9.780 3.377 5.798 1.00 0.00 ? 39 LYS B HE2 4 17
ATOM 3953 H HE3 . LYS B 1 17 ? 10.872 4.222 4.827 1.00 0.00 ? 39 LYS B HE3 4 17
ATOM 3954 H HZ1 . LYS B 1 17 ? 12.469 3.499 6.152 1.00 0.00 ? 39 LYS B HZ1 4 17
ATOM 3955 H HZ2 . LYS B 1 17 ? 11.658 2.747 6.976 1.00 0.00 ? 39 LYS B HZ2 4 17
ATOM 3956 H HZ3 . LYS B 1 17 ? 11.918 2.338 5.691 1.00 0.00 ? 39 LYS B HZ3 4 17
ATOM 3957 N N . ALA B 1 18 ? 9.654 8.658 2.311 1.00 0.00 ? 40 ALA B N 4 18
ATOM 3958 C CA . ALA B 1 18 ? 10.271 9.611 1.427 1.00 0.00 ? 40 ALA B CA 4 18
ATOM 3959 C C . ALA B 1 18 ? 9.274 10.566 0.815 1.00 0.00 ? 40 ALA B C 4 18
ATOM 3960 O O . ALA B 1 18 ? 9.528 11.739 0.685 1.00 0.00 ? 40 ALA B O 4 18
ATOM 3961 C CB . ALA B 1 18 ? 11.028 8.884 0.340 1.00 0.00 ? 40 ALA B CB 4 18
ATOM 3962 H H . ALA B 1 18 ? 9.506 7.722 1.983 1.00 0.00 ? 40 ALA B H 4 18
ATOM 3963 H HA . ALA B 1 18 ? 11.016 10.188 1.960 1.00 0.00 ? 40 ALA B HA 4 18
ATOM 3964 H HB1 . ALA B 1 18 ? 11.539 9.562 -0.310 1.00 0.00 ? 40 ALA B HB1 4 18
ATOM 3965 H HB2 . ALA B 1 18 ? 11.750 8.223 0.776 1.00 0.00 ? 40 ALA B HB2 4 18
ATOM 3966 H HB3 . ALA B 1 18 ? 10.350 8.288 -0.242 1.00 0.00 ? 40 ALA B HB3 4 18
ATOM 3967 N N . GLY B 1 19 ? 8.113 10.072 0.447 1.00 0.00 ? 41 GLY B N 4 19
ATOM 3968 C CA . GLY B 1 19 ? 6.970 10.854 0.041 1.00 0.00 ? 41 GLY B CA 4 19
ATOM 3969 C C . GLY B 1 19 ? 6.417 11.678 1.179 1.00 0.00 ? 41 GLY B C 4 19
ATOM 3970 O O . GLY B 1 19 ? 6.088 12.816 1.010 1.00 0.00 ? 41 GLY B O 4 19
ATOM 3971 H H . GLY B 1 19 ? 7.972 9.096 0.579 1.00 0.00 ? 41 GLY B H 4 19
ATOM 3972 H HA2 . GLY B 1 19 ? 7.248 11.519 -0.757 1.00 0.00 ? 41 GLY B HA2 4 19
ATOM 3973 H HA3 . GLY B 1 19 ? 6.195 10.201 -0.330 1.00 0.00 ? 41 GLY B HA3 4 19
ATOM 3974 N N . GLY B 1 20 ? 6.307 11.083 2.346 1.00 0.00 ? 42 GLY B N 4 20
ATOM 3975 C CA . GLY B 1 20 ? 5.927 11.713 3.581 1.00 0.00 ? 42 GLY B CA 4 20
ATOM 3976 C C . GLY B 1 20 ? 4.443 11.725 3.871 1.00 0.00 ? 42 GLY B C 4 20
ATOM 3977 O O . GLY B 1 20 ? 3.877 12.757 4.142 1.00 0.00 ? 42 GLY B O 4 20
ATOM 3978 H H . GLY B 1 20 ? 6.556 10.126 2.377 1.00 0.00 ? 42 GLY B H 4 20
ATOM 3979 H HA2 . GLY B 1 20 ? 6.420 11.219 4.400 1.00 0.00 ? 42 GLY B HA2 4 20
ATOM 3980 H HA3 . GLY B 1 20 ? 6.254 12.733 3.617 1.00 0.00 ? 42 GLY B HA3 4 20
ATOM 3981 N N . TYR B 1 21 ? 3.773 10.601 3.805 1.00 0.00 ? 43 TYR B N 4 21
ATOM 3982 C CA . TYR B 1 21 ? 2.385 10.471 4.131 1.00 0.00 ? 43 TYR B CA 4 21
ATOM 3983 C C . TYR B 1 21 ? 2.038 10.857 5.529 1.00 0.00 ? 43 TYR B C 4 21
ATOM 3984 O O . TYR B 1 21 ? 0.972 11.284 5.751 1.00 0.00 ? 43 TYR B O 4 21
ATOM 3985 C CB . TYR B 1 21 ? 1.896 9.078 3.842 1.00 0.00 ? 43 TYR B CB 4 21
ATOM 3986 C CG . TYR B 1 21 ? 1.684 8.601 2.439 1.00 0.00 ? 43 TYR B CG 4 21
ATOM 3987 C CD1 . TYR B 1 21 ? 0.797 9.219 1.563 1.00 0.00 ? 43 TYR B CD1 4 21
ATOM 3988 C CD2 . TYR B 1 21 ? 2.323 7.413 2.078 1.00 0.00 ? 43 TYR B CD2 4 21
ATOM 3989 C CE1 . TYR B 1 21 ? 0.610 8.650 0.302 1.00 0.00 ? 43 TYR B CE1 4 21
ATOM 3990 C CE2 . TYR B 1 21 ? 2.162 6.858 0.809 1.00 0.00 ? 43 TYR B CE2 4 21
ATOM 3991 C CZ . TYR B 1 21 ? 1.319 7.510 -0.106 1.00 0.00 ? 43 TYR B CZ 4 21
ATOM 3992 O OH . TYR B 1 21 ? 1.169 6.993 -1.351 1.00 0.00 ? 43 TYR B OH 4 21
ATOM 3993 H H . TYR B 1 21 ? 4.289 9.792 3.526 1.00 0.00 ? 43 TYR B H 4 21
ATOM 3994 H HA . TYR B 1 21 ? 1.839 11.131 3.494 1.00 0.00 ? 43 TYR B HA 4 21
ATOM 3995 H HB2 . TYR B 1 21 ? 2.610 8.395 4.304 1.00 0.00 ? 43 TYR B HB2 4 21
ATOM 3996 H HB3 . TYR B 1 21 ? 0.967 8.932 4.346 1.00 0.00 ? 43 TYR B HB3 4 21
ATOM 3997 H HD1 . TYR B 1 21 ? 0.261 10.115 1.785 1.00 0.00 ? 43 TYR B HD1 4 21
ATOM 3998 H HD2 . TYR B 1 21 ? 2.928 6.924 2.823 1.00 0.00 ? 43 TYR B HD2 4 21
ATOM 3999 H HE1 . TYR B 1 21 ? -0.083 9.113 -0.367 1.00 0.00 ? 43 TYR B HE1 4 21
ATOM 4000 H HE2 . TYR B 1 21 ? 2.661 5.950 0.537 1.00 0.00 ? 43 TYR B HE2 4 21
ATOM 4001 H HH . TYR B 1 21 ? 1.604 7.574 -1.956 1.00 0.00 ? 43 TYR B HH 4 21
HETATM 4002 N N . NH2 B 1 22 ? 2.900 10.731 6.487 1.00 0.00 ? 44 NH2 B N 4 22
HETATM 4003 H HN1 . NH2 B 1 22 ? 2.633 10.930 7.405 1.00 0.00 ? 44 NH2 B HN1 4 22
HETATM 4004 H HN2 . NH2 B 1 22 ? 3.765 10.398 6.282 1.00 0.00 ? 44 NH2 B HN2 4 22
HETATM 4005 C C . ACE C 1 1 ? -8.482 10.991 -3.180 1.00 0.00 ? 45 ACE C C 4 1
HETATM 4006 O O . ACE C 1 1 ? -8.544 10.128 -2.320 1.00 0.00 ? 45 ACE C O 4 1
HETATM 4007 C CH3 . ACE C 1 1 ? -9.719 11.386 -3.935 1.00 0.00 ? 45 ACE C CH3 4 1
HETATM 4008 H H1 . ACE C 1 1 ? -10.188 11.629 -3.695 1.00 0.00 ? 45 ACE C H1 4 1
HETATM 4009 H H2 . ACE C 1 1 ? -9.733 11.731 -4.380 1.00 0.00 ? 45 ACE C H2 4 1
HETATM 4010 H H3 . ACE C 1 1 ? -10.034 11.007 -4.202 1.00 0.00 ? 45 ACE C H3 4 1
ATOM 4011 N N . ALA C 1 2 ? -7.362 11.648 -3.438 1.00 0.00 ? 46 ALA C N 4 2
ATOM 4012 C CA . ALA C 1 2 ? -6.066 11.342 -2.884 1.00 0.00 ? 46 ALA C CA 4 2
ATOM 4013 C C . ALA C 1 2 ? -5.956 11.418 -1.376 1.00 0.00 ? 46 ALA C C 4 2
ATOM 4014 O O . ALA C 1 2 ? -5.107 10.768 -0.788 1.00 0.00 ? 46 ALA C O 4 2
ATOM 4015 C CB . ALA C 1 2 ? -5.046 12.216 -3.572 1.00 0.00 ? 46 ALA C CB 4 2
ATOM 4016 H H . ALA C 1 2 ? -7.377 12.367 -4.133 1.00 0.00 ? 46 ALA C H 4 2
ATOM 4017 H HA . ALA C 1 2 ? -5.864 10.316 -3.134 1.00 0.00 ? 46 ALA C HA 4 2
ATOM 4018 H HB1 . ALA C 1 2 ? -5.162 13.253 -3.331 1.00 0.00 ? 46 ALA C HB1 4 2
ATOM 4019 H HB2 . ALA C 1 2 ? -4.059 11.927 -3.256 1.00 0.00 ? 46 ALA C HB2 4 2
ATOM 4020 H HB3 . ALA C 1 2 ? -5.142 12.103 -4.637 1.00 0.00 ? 46 ALA C HB3 4 2
ATOM 4021 N N . LYS C 1 3 ? -6.865 12.139 -0.737 1.00 0.00 ? 47 LYS C N 4 3
ATOM 4022 C CA . LYS C 1 3 ? -7.055 12.203 0.686 1.00 0.00 ? 47 LYS C CA 4 3
ATOM 4023 C C . LYS C 1 3 ? -7.423 10.897 1.361 1.00 0.00 ? 47 LYS C C 4 3
ATOM 4024 O O . LYS C 1 3 ? -7.347 10.781 2.565 1.00 0.00 ? 47 LYS C O 4 3
ATOM 4025 C CB . LYS C 1 3 ? -8.120 13.218 1.046 1.00 0.00 ? 47 LYS C CB 4 3
ATOM 4026 C CG . LYS C 1 3 ? -7.764 14.641 0.674 1.00 0.00 ? 47 LYS C CG 4 3
ATOM 4027 C CD . LYS C 1 3 ? -8.809 15.629 1.100 1.00 0.00 ? 47 LYS C CD 4 3
ATOM 4028 C CE . LYS C 1 3 ? -8.389 17.007 0.735 1.00 0.00 ? 47 LYS C CE 4 3
ATOM 4029 N NZ . LYS C 1 3 ? -9.283 18.021 1.175 1.00 0.00 ? 47 LYS C NZ 4 3
ATOM 4030 H H . LYS C 1 3 ? -7.452 12.686 -1.336 1.00 0.00 ? 47 LYS C H 4 3
ATOM 4031 H HA . LYS C 1 3 ? -6.125 12.500 1.134 1.00 0.00 ? 47 LYS C HA 4 3
ATOM 4032 H HB2 . LYS C 1 3 ? -9.073 12.943 0.594 1.00 0.00 ? 47 LYS C HB2 4 3
ATOM 4033 H HB3 . LYS C 1 3 ? -8.193 13.171 2.124 1.00 0.00 ? 47 LYS C HB3 4 3
ATOM 4034 H HG2 . LYS C 1 3 ? -6.812 14.904 1.136 1.00 0.00 ? 47 LYS C HG2 4 3
ATOM 4035 H HG3 . LYS C 1 3 ? -7.629 14.714 -0.376 1.00 0.00 ? 47 LYS C HG3 4 3
ATOM 4036 H HD2 . LYS C 1 3 ? -9.767 15.391 0.637 1.00 0.00 ? 47 LYS C HD2 4 3
ATOM 4037 H HD3 . LYS C 1 3 ? -8.927 15.566 2.149 1.00 0.00 ? 47 LYS C HD3 4 3
ATOM 4038 H HE2 . LYS C 1 3 ? -7.404 17.201 1.160 1.00 0.00 ? 47 LYS C HE2 4 3
ATOM 4039 H HE3 . LYS C 1 3 ? -8.288 17.052 -0.281 1.00 0.00 ? 47 LYS C HE3 4 3
ATOM 4040 H HZ1 . LYS C 1 3 ? -8.976 18.920 0.911 1.00 0.00 ? 47 LYS C HZ1 4 3
ATOM 4041 H HZ2 . LYS C 1 3 ? -10.156 17.922 0.795 1.00 0.00 ? 47 LYS C HZ2 4 3
ATOM 4042 H HZ3 . LYS C 1 3 ? -9.353 18.058 2.101 1.00 0.00 ? 47 LYS C HZ3 4 3
ATOM 4043 N N . ALA C 1 4 ? -7.732 9.853 0.607 1.00 0.00 ? 48 ALA C N 4 4
ATOM 4044 C CA . ALA C 1 4 ? -7.682 8.465 0.998 1.00 0.00 ? 48 ALA C CA 4 4
ATOM 4045 C C . ALA C 1 4 ? -6.361 8.017 1.592 1.00 0.00 ? 48 ALA C C 4 4
ATOM 4046 O O . ALA C 1 4 ? -6.279 6.927 2.143 1.00 0.00 ? 48 ALA C O 4 4
ATOM 4047 C CB . ALA C 1 4 ? -7.997 7.652 -0.247 1.00 0.00 ? 48 ALA C CB 4 4
ATOM 4048 H H . ALA C 1 4 ? -7.867 10.082 -0.358 1.00 0.00 ? 48 ALA C H 4 4
ATOM 4049 H HA . ALA C 1 4 ? -8.469 8.309 1.725 1.00 0.00 ? 48 ALA C HA 4 4
ATOM 4050 H HB1 . ALA C 1 4 ? -8.968 7.963 -0.617 1.00 0.00 ? 48 ALA C HB1 4 4
ATOM 4051 H HB2 . ALA C 1 4 ? -7.286 7.832 -1.042 1.00 0.00 ? 48 ALA C HB2 4 4
ATOM 4052 H HB3 . ALA C 1 4 ? -8.043 6.594 -0.034 1.00 0.00 ? 48 ALA C HB3 4 4
ATOM 4053 N N . ALA C 1 5 ? -5.316 8.835 1.501 1.00 0.00 ? 49 ALA C N 4 5
ATOM 4054 C CA . ALA C 1 5 ? -3.956 8.576 1.905 1.00 0.00 ? 49 ALA C CA 4 5
ATOM 4055 C C . ALA C 1 5 ? -3.854 8.310 3.395 1.00 0.00 ? 49 ALA C C 4 5
ATOM 4056 O O . ALA C 1 5 ? -3.886 7.169 3.833 1.00 0.00 ? 49 ALA C O 4 5
ATOM 4057 C CB . ALA C 1 5 ? -3.090 9.696 1.355 1.00 0.00 ? 49 ALA C CB 4 5
ATOM 4058 H H . ALA C 1 5 ? -5.501 9.732 1.088 1.00 0.00 ? 49 ALA C H 4 5
ATOM 4059 H HA . ALA C 1 5 ? -3.615 7.671 1.415 1.00 0.00 ? 49 ALA C HA 4 5
ATOM 4060 H HB1 . ALA C 1 5 ? -2.087 9.538 1.643 1.00 0.00 ? 49 ALA C HB1 4 5
ATOM 4061 H HB2 . ALA C 1 5 ? -3.151 9.682 0.280 1.00 0.00 ? 49 ALA C HB2 4 5
ATOM 4062 H HB3 . ALA C 1 5 ? -3.375 10.653 1.723 1.00 0.00 ? 49 ALA C HB3 4 5
ATOM 4063 N N . ALA C 1 6 ? -3.865 9.341 4.232 1.00 0.00 ? 50 ALA C N 4 6
ATOM 4064 C CA . ALA C 1 6 ? -3.574 9.242 5.631 1.00 0.00 ? 50 ALA C CA 4 6
ATOM 4065 C C . ALA C 1 6 ? -4.687 8.651 6.458 1.00 0.00 ? 50 ALA C C 4 6
ATOM 4066 O O . ALA C 1 6 ? -4.627 8.684 7.663 1.00 0.00 ? 50 ALA C O 4 6
ATOM 4067 C CB . ALA C 1 6 ? -3.128 10.573 6.154 1.00 0.00 ? 50 ALA C CB 4 6
ATOM 4068 H H . ALA C 1 6 ? -3.960 10.246 3.824 1.00 0.00 ? 50 ALA C H 4 6
ATOM 4069 H HA . ALA C 1 6 ? -2.781 8.515 5.669 1.00 0.00 ? 50 ALA C HA 4 6
ATOM 4070 H HB1 . ALA C 1 6 ? -3.934 11.277 6.100 1.00 0.00 ? 50 ALA C HB1 4 6
ATOM 4071 H HB2 . ALA C 1 6 ? -2.848 10.481 7.173 1.00 0.00 ? 50 ALA C HB2 4 6
ATOM 4072 H HB3 . ALA C 1 6 ? -2.288 10.915 5.594 1.00 0.00 ? 50 ALA C HB3 4 6
ATOM 4073 N N . ALA C 1 7 ? -5.700 8.081 5.849 1.00 0.00 ? 51 ALA C N 4 7
ATOM 4074 C CA . ALA C 1 7 ? -6.596 7.110 6.410 1.00 0.00 ? 51 ALA C CA 4 7
ATOM 4075 C C . ALA C 1 7 ? -6.096 5.698 6.192 1.00 0.00 ? 51 ALA C C 4 7
ATOM 4076 O O . ALA C 1 7 ? -5.919 4.976 7.133 1.00 0.00 ? 51 ALA C O 4 7
ATOM 4077 C CB . ALA C 1 7 ? -7.971 7.306 5.834 1.00 0.00 ? 51 ALA C CB 4 7
ATOM 4078 H H . ALA C 1 7 ? -5.671 8.073 4.866 1.00 0.00 ? 51 ALA C H 4 7
ATOM 4079 H HA . ALA C 1 7 ? -6.675 7.267 7.471 1.00 0.00 ? 51 ALA C HA 4 7
ATOM 4080 H HB1 . ALA C 1 7 ? -8.639 6.704 6.369 1.00 0.00 ? 51 ALA C HB1 4 7
ATOM 4081 H HB2 . ALA C 1 7 ? -8.248 8.319 5.975 1.00 0.00 ? 51 ALA C HB2 4 7
ATOM 4082 H HB3 . ALA C 1 7 ? -8.018 7.074 4.827 1.00 0.00 ? 51 ALA C HB3 4 7
ATOM 4083 N N . ALA C 1 8 ? -5.832 5.298 4.957 1.00 0.00 ? 52 ALA C N 4 8
ATOM 4084 C CA . ALA C 1 8 ? -5.554 3.926 4.593 1.00 0.00 ? 52 ALA C CA 4 8
ATOM 4085 C C . ALA C 1 8 ? -4.103 3.578 4.833 1.00 0.00 ? 52 ALA C C 4 8
ATOM 4086 O O . ALA C 1 8 ? -3.809 2.529 5.384 1.00 0.00 ? 52 ALA C O 4 8
ATOM 4087 C CB . ALA C 1 8 ? -5.888 3.775 3.126 1.00 0.00 ? 52 ALA C CB 4 8
ATOM 4088 H H . ALA C 1 8 ? -5.748 5.967 4.219 1.00 0.00 ? 52 ALA C H 4 8
ATOM 4089 H HA . ALA C 1 8 ? -6.157 3.233 5.164 1.00 0.00 ? 52 ALA C HA 4 8
ATOM 4090 H HB1 . ALA C 1 8 ? -5.810 2.758 2.841 1.00 0.00 ? 52 ALA C HB1 4 8
ATOM 4091 H HB2 . ALA C 1 8 ? -6.864 4.114 2.951 1.00 0.00 ? 52 ALA C HB2 4 8
ATOM 4092 H HB3 . ALA C 1 8 ? -5.200 4.337 2.559 1.00 0.00 ? 52 ALA C HB3 4 8
ATOM 4093 N N . ILE C 1 9 ? -3.206 4.499 4.492 1.00 0.00 ? 53 ILE C N 4 9
ATOM 4094 C CA . ILE C 1 9 ? -1.797 4.429 4.802 1.00 0.00 ? 53 ILE C CA 4 9
ATOM 4095 C C . ILE C 1 9 ? -1.550 4.309 6.292 1.00 0.00 ? 53 ILE C C 4 9
ATOM 4096 O O . ILE C 1 9 ? -0.690 3.545 6.699 1.00 0.00 ? 53 ILE C O 4 9
ATOM 4097 C CB . ILE C 1 9 ? -1.048 5.647 4.288 1.00 0.00 ? 53 ILE C CB 4 9
ATOM 4098 C CG1 . ILE C 1 9 ? -1.151 5.886 2.791 1.00 0.00 ? 53 ILE C CG1 4 9
ATOM 4099 C CG2 . ILE C 1 9 ? 0.404 5.617 4.701 1.00 0.00 ? 53 ILE C CG2 4 9
ATOM 4100 C CD1 . ILE C 1 9 ? -0.719 4.730 1.918 1.00 0.00 ? 53 ILE C CD1 4 9
ATOM 4101 H H . ILE C 1 9 ? -3.559 5.317 4.048 1.00 0.00 ? 53 ILE C H 4 9
ATOM 4102 H HA . ILE C 1 9 ? -1.401 3.532 4.347 1.00 0.00 ? 53 ILE C HA 4 9
ATOM 4103 H HB . ILE C 1 9 ? -1.458 6.484 4.829 1.00 0.00 ? 53 ILE C HB 4 9
ATOM 4104 H HG12 . ILE C 1 9 ? -2.188 6.122 2.550 1.00 0.00 ? 53 ILE C HG12 4 9
ATOM 4105 H HG13 . ILE C 1 9 ? -0.579 6.774 2.565 1.00 0.00 ? 53 ILE C HG13 4 9
ATOM 4106 H HG21 . ILE C 1 9 ? 0.894 6.408 4.182 1.00 0.00 ? 53 ILE C HG21 4 9
ATOM 4107 H HG22 . ILE C 1 9 ? 0.522 5.791 5.757 1.00 0.00 ? 53 ILE C HG22 4 9
ATOM 4108 H HG23 . ILE C 1 9 ? 0.816 4.672 4.427 1.00 0.00 ? 53 ILE C HG23 4 9
ATOM 4109 H HD11 . ILE C 1 9 ? -1.260 3.986 1.978 1.00 0.00 ? 53 ILE C HD11 4 9
ATOM 4110 H HD12 . ILE C 1 9 ? -0.722 5.000 1.005 1.00 0.00 ? 53 ILE C HD12 4 9
ATOM 4111 H HD13 . ILE C 1 9 ? 0.140 4.437 2.074 1.00 0.00 ? 53 ILE C HD13 4 9
ATOM 4112 N N . LYS C 1 10 ? -2.290 5.042 7.108 1.00 0.00 ? 54 LYS C N 4 10
ATOM 4113 C CA . LYS C 1 10 ? -2.104 4.997 8.535 1.00 0.00 ? 54 LYS C CA 4 10
ATOM 4114 C C . LYS C 1 10 ? -2.394 3.623 9.106 1.00 0.00 ? 54 LYS C C 4 10
ATOM 4115 O O . LYS C 1 10 ? -1.633 3.140 9.920 1.00 0.00 ? 54 LYS C O 4 10
ATOM 4116 C CB . LYS C 1 10 ? -2.980 6.038 9.198 1.00 0.00 ? 54 LYS C CB 4 10
ATOM 4117 C CG . LYS C 1 10 ? -2.291 7.354 9.407 1.00 0.00 ? 54 LYS C CG 4 10
ATOM 4118 C CD . LYS C 1 10 ? -3.047 8.228 10.367 1.00 0.00 ? 54 LYS C CD 4 10
ATOM 4119 C CE . LYS C 1 10 ? -2.392 9.567 10.471 1.00 0.00 ? 54 LYS C CE 4 10
ATOM 4120 N NZ . LYS C 1 10 ? -3.095 10.421 11.317 1.00 0.00 ? 54 LYS C NZ 4 10
ATOM 4121 H H . LYS C 1 10 ? -2.970 5.651 6.718 1.00 0.00 ? 54 LYS C H 4 10
ATOM 4122 H HA . LYS C 1 10 ? -1.063 5.155 8.769 1.00 0.00 ? 54 LYS C HA 4 10
ATOM 4123 H HB2 . LYS C 1 10 ? -3.871 6.194 8.589 1.00 0.00 ? 54 LYS C HB2 4 10
ATOM 4124 H HB3 . LYS C 1 10 ? -3.306 5.676 10.138 1.00 0.00 ? 54 LYS C HB3 4 10
ATOM 4125 H HG2 . LYS C 1 10 ? -1.281 7.185 9.782 1.00 0.00 ? 54 LYS C HG2 4 10
ATOM 4126 H HG3 . LYS C 1 10 ? -2.207 7.847 8.478 1.00 0.00 ? 54 LYS C HG3 4 10
ATOM 4127 H HD2 . LYS C 1 10 ? -4.090 8.329 10.066 1.00 0.00 ? 54 LYS C HD2 4 10
ATOM 4128 H HD3 . LYS C 1 10 ? -2.991 7.747 11.312 1.00 0.00 ? 54 LYS C HD3 4 10
ATOM 4129 H HE2 . LYS C 1 10 ? -1.377 9.435 10.848 1.00 0.00 ? 54 LYS C HE2 4 10
ATOM 4130 H HE3 . LYS C 1 10 ? -2.301 10.044 9.559 1.00 0.00 ? 54 LYS C HE3 4 10
ATOM 4131 H HZ1 . LYS C 1 10 ? -3.000 10.641 11.873 1.00 0.00 ? 54 LYS C HZ1 4 10
ATOM 4132 H HZ2 . LYS C 1 10 ? -3.166 10.840 11.119 1.00 0.00 ? 54 LYS C HZ2 4 10
ATOM 4133 H HZ3 . LYS C 1 10 ? -3.654 10.435 11.607 1.00 0.00 ? 54 LYS C HZ3 4 10
ATOM 4134 N N . ALA C 1 11 ? -3.431 2.954 8.625 1.00 0.00 ? 55 ALA C N 4 11
ATOM 4135 C CA . ALA C 1 11 ? -3.631 1.540 8.801 1.00 0.00 ? 55 ALA C CA 4 11
ATOM 4136 C C . ALA C 1 11 ? -2.481 0.722 8.259 1.00 0.00 ? 55 ALA C C 4 11
ATOM 4137 O O . ALA C 1 11 ? -1.904 -0.087 8.969 1.00 0.00 ? 55 ALA C O 4 11
ATOM 4138 C CB . ALA C 1 11 ? -4.962 1.141 8.247 1.00 0.00 ? 55 ALA C CB 4 11
ATOM 4139 H H . ALA C 1 11 ? -3.998 3.456 7.989 1.00 0.00 ? 55 ALA C H 4 11
ATOM 4140 H HA . ALA C 1 11 ? -3.644 1.390 9.859 1.00 0.00 ? 55 ALA C HA 4 11
ATOM 4141 H HB1 . ALA C 1 11 ? -5.130 0.115 8.487 1.00 0.00 ? 55 ALA C HB1 4 11
ATOM 4142 H HB2 . ALA C 1 11 ? -5.716 1.740 8.677 1.00 0.00 ? 55 ALA C HB2 4 11
ATOM 4143 H HB3 . ALA C 1 11 ? -4.960 1.225 7.209 1.00 0.00 ? 55 ALA C HB3 4 11
ATOM 4144 N N . ILE C 1 12 ? -2.075 0.874 7.003 1.00 0.00 ? 56 ILE C N 4 12
ATOM 4145 C CA . ILE C 1 12 ? -1.109 0.028 6.344 1.00 0.00 ? 56 ILE C CA 4 12
ATOM 4146 C C . ILE C 1 12 ? 0.260 0.119 6.989 1.00 0.00 ? 56 ILE C C 4 12
ATOM 4147 O O . ILE C 1 12 ? 0.893 -0.893 7.232 1.00 0.00 ? 56 ILE C O 4 12
ATOM 4148 C CB . ILE C 1 12 ? -1.076 0.225 4.837 1.00 0.00 ? 56 ILE C CB 4 12
ATOM 4149 C CG1 . ILE C 1 12 ? -1.046 -1.145 4.192 1.00 0.00 ? 56 ILE C CG1 4 12
ATOM 4150 C CG2 . ILE C 1 12 ? 0.045 1.117 4.335 1.00 0.00 ? 56 ILE C CG2 4 12
ATOM 4151 C CD1 . ILE C 1 12 ? -0.860 -1.151 2.692 1.00 0.00 ? 56 ILE C CD1 4 12
ATOM 4152 H H . ILE C 1 12 ? -2.410 1.687 6.519 1.00 0.00 ? 56 ILE C H 4 12
ATOM 4153 H HA . ILE C 1 12 ? -1.402 -1.001 6.535 1.00 0.00 ? 56 ILE C HA 4 12
ATOM 4154 H HB . ILE C 1 12 ? -2.017 0.684 4.562 1.00 0.00 ? 56 ILE C HB 4 12
ATOM 4155 H HG12 . ILE C 1 12 ? -0.239 -1.726 4.639 1.00 0.00 ? 56 ILE C HG12 4 12
ATOM 4156 H HG13 . ILE C 1 12 ? -1.971 -1.623 4.466 1.00 0.00 ? 56 ILE C HG13 4 12
ATOM 4157 H HG21 . ILE C 1 12 ? 0.969 0.578 4.395 1.00 0.00 ? 56 ILE C HG21 4 12
ATOM 4158 H HG22 . ILE C 1 12 ? -0.126 1.372 3.306 1.00 0.00 ? 56 ILE C HG22 4 12
ATOM 4159 H HG23 . ILE C 1 12 ? 0.120 2.018 4.916 1.00 0.00 ? 56 ILE C HG23 4 12
ATOM 4160 H HD11 . ILE C 1 12 ? 0.142 -0.916 2.404 1.00 0.00 ? 56 ILE C HD11 4 12
ATOM 4161 H HD12 . ILE C 1 12 ? -1.066 -2.133 2.324 1.00 0.00 ? 56 ILE C HD12 4 12
ATOM 4162 H HD13 . ILE C 1 12 ? -1.509 -0.452 2.200 1.00 0.00 ? 56 ILE C HD13 4 12
ATOM 4163 N N . ALA C 1 13 ? 0.726 1.300 7.374 1.00 0.00 ? 57 ALA C N 4 13
ATOM 4164 C CA . ALA C 1 13 ? 2.034 1.426 7.979 1.00 0.00 ? 57 ALA C CA 4 13
ATOM 4165 C C . ALA C 1 13 ? 2.127 0.754 9.332 1.00 0.00 ? 57 ALA C C 4 13
ATOM 4166 O O . ALA C 1 13 ? 3.202 0.402 9.761 1.00 0.00 ? 57 ALA C O 4 13
ATOM 4167 C CB . ALA C 1 13 ? 2.395 2.884 8.057 1.00 0.00 ? 57 ALA C CB 4 13
ATOM 4168 H H . ALA C 1 13 ? 0.119 2.085 7.209 1.00 0.00 ? 57 ALA C H 4 13
ATOM 4169 H HA . ALA C 1 13 ? 2.754 0.926 7.347 1.00 0.00 ? 57 ALA C HA 4 13
ATOM 4170 H HB1 . ALA C 1 13 ? 2.822 3.155 7.905 1.00 0.00 ? 57 ALA C HB1 4 13
ATOM 4171 H HB2 . ALA C 1 13 ? 2.173 3.262 7.875 1.00 0.00 ? 57 ALA C HB2 4 13
ATOM 4172 H HB3 . ALA C 1 13 ? 2.486 3.239 8.463 1.00 0.00 ? 57 ALA C HB3 4 13
ATOM 4173 N N . ALA C 1 14 ? 1.014 0.529 10.018 1.00 0.00 ? 58 ALA C N 4 14
ATOM 4174 C CA . ALA C 1 14 ? 0.948 -0.224 11.249 1.00 0.00 ? 58 ALA C CA 4 14
ATOM 4175 C C . ALA C 1 14 ? 0.769 -1.706 11.024 1.00 0.00 ? 58 ALA C C 4 14
ATOM 4176 O O . ALA C 1 14 ? 1.447 -2.522 11.637 1.00 0.00 ? 58 ALA C O 4 14
ATOM 4177 C CB . ALA C 1 14 ? -0.127 0.342 12.153 1.00 0.00 ? 58 ALA C CB 4 14
ATOM 4178 H H . ALA C 1 14 ? 0.199 0.720 9.483 1.00 0.00 ? 58 ALA C H 4 14
ATOM 4179 H HA . ALA C 1 14 ? 1.870 -0.104 11.800 1.00 0.00 ? 58 ALA C HA 4 14
ATOM 4180 H HB1 . ALA C 1 14 ? 0.151 1.342 12.392 1.00 0.00 ? 58 ALA C HB1 4 14
ATOM 4181 H HB2 . ALA C 1 14 ? -1.074 0.335 11.656 1.00 0.00 ? 58 ALA C HB2 4 14
ATOM 4182 H HB3 . ALA C 1 14 ? -0.222 -0.217 13.060 1.00 0.00 ? 58 ALA C HB3 4 14
ATOM 4183 N N . ILE C 1 15 ? -0.089 -2.058 10.072 1.00 0.00 ? 59 ILE C N 4 15
ATOM 4184 C CA . ILE C 1 15 ? -0.323 -3.404 9.600 1.00 0.00 ? 59 ILE C CA 4 15
ATOM 4185 C C . ILE C 1 15 ? 0.928 -4.001 8.982 1.00 0.00 ? 59 ILE C C 4 15
ATOM 4186 O O . ILE C 1 15 ? 1.167 -5.191 9.126 1.00 0.00 ? 59 ILE C O 4 15
ATOM 4187 C CB . ILE C 1 15 ? -1.511 -3.430 8.653 1.00 0.00 ? 59 ILE C CB 4 15
ATOM 4188 C CG1 . ILE C 1 15 ? -2.826 -3.086 9.333 1.00 0.00 ? 59 ILE C CG1 4 15
ATOM 4189 C CG2 . ILE C 1 15 ? -1.649 -4.766 7.949 1.00 0.00 ? 59 ILE C CG2 4 15
ATOM 4190 C CD1 . ILE C 1 15 ? -3.905 -2.578 8.395 1.00 0.00 ? 59 ILE C CD1 4 15
ATOM 4191 H H . ILE C 1 15 ? -0.504 -1.303 9.567 1.00 0.00 ? 59 ILE C H 4 15
ATOM 4192 H HA . ILE C 1 15 ? -0.578 -4.021 10.454 1.00 0.00 ? 59 ILE C HA 4 15
ATOM 4193 H HB . ILE C 1 15 ? -1.322 -2.679 7.898 1.00 0.00 ? 59 ILE C HB 4 15
ATOM 4194 H HG12 . ILE C 1 15 ? -3.191 -3.975 9.848 1.00 0.00 ? 59 ILE C HG12 4 15
ATOM 4195 H HG13 . ILE C 1 15 ? -2.692 -2.320 10.083 1.00 0.00 ? 59 ILE C HG13 4 15
ATOM 4196 H HG21 . ILE C 1 15 ? -0.760 -4.955 7.362 1.00 0.00 ? 59 ILE C HG21 4 15
ATOM 4197 H HG22 . ILE C 1 15 ? -1.760 -5.565 8.666 1.00 0.00 ? 59 ILE C HG22 4 15
ATOM 4198 H HG23 . ILE C 1 15 ? -2.518 -4.786 7.306 1.00 0.00 ? 59 ILE C HG23 4 15
ATOM 4199 H HD11 . ILE C 1 15 ? -3.537 -1.788 7.784 1.00 0.00 ? 59 ILE C HD11 4 15
ATOM 4200 H HD12 . ILE C 1 15 ? -4.278 -3.367 7.778 1.00 0.00 ? 59 ILE C HD12 4 15
ATOM 4201 H HD13 . ILE C 1 15 ? -4.720 -2.196 8.960 1.00 0.00 ? 59 ILE C HD13 4 15
ATOM 4202 N N . ILE C 1 16 ? 1.786 -3.215 8.342 1.00 0.00 ? 60 ILE C N 4 16
ATOM 4203 C CA . ILE C 1 16 ? 3.052 -3.659 7.799 1.00 0.00 ? 60 ILE C CA 4 16
ATOM 4204 C C . ILE C 1 16 ? 3.944 -4.170 8.914 1.00 0.00 ? 60 ILE C C 4 16
ATOM 4205 O O . ILE C 1 16 ? 4.491 -5.252 8.835 1.00 0.00 ? 60 ILE C O 4 16
ATOM 4206 C CB . ILE C 1 16 ? 3.675 -2.562 6.949 1.00 0.00 ? 60 ILE C CB 4 16
ATOM 4207 C CG1 . ILE C 1 16 ? 2.932 -2.549 5.629 1.00 0.00 ? 60 ILE C CG1 4 16
ATOM 4208 C CG2 . ILE C 1 16 ? 5.169 -2.744 6.737 1.00 0.00 ? 60 ILE C CG2 4 16
ATOM 4209 C CD1 . ILE C 1 16 ? 3.337 -1.491 4.624 1.00 0.00 ? 60 ILE C CD1 4 16
ATOM 4210 H H . ILE C 1 16 ? 1.535 -2.261 8.187 1.00 0.00 ? 60 ILE C H 4 16
ATOM 4211 H HA . ILE C 1 16 ? 2.859 -4.528 7.180 1.00 0.00 ? 60 ILE C HA 4 16
ATOM 4212 H HB . ILE C 1 16 ? 3.492 -1.638 7.488 1.00 0.00 ? 60 ILE C HB 4 16
ATOM 4213 H HG12 . ILE C 1 16 ? 3.062 -3.525 5.162 1.00 0.00 ? 60 ILE C HG12 4 16
ATOM 4214 H HG13 . ILE C 1 16 ? 1.871 -2.441 5.830 1.00 0.00 ? 60 ILE C HG13 4 16
ATOM 4215 H HG21 . ILE C 1 16 ? 5.564 -1.981 6.097 1.00 0.00 ? 60 ILE C HG21 4 16
ATOM 4216 H HG22 . ILE C 1 16 ? 5.690 -2.665 7.661 1.00 0.00 ? 60 ILE C HG22 4 16
ATOM 4217 H HG23 . ILE C 1 16 ? 5.402 -3.690 6.312 1.00 0.00 ? 60 ILE C HG23 4 16
ATOM 4218 H HD11 . ILE C 1 16 ? 2.665 -1.518 3.793 1.00 0.00 ? 60 ILE C HD11 4 16
ATOM 4219 H HD12 . ILE C 1 16 ? 3.303 -0.529 5.085 1.00 0.00 ? 60 ILE C HD12 4 16
ATOM 4220 H HD13 . ILE C 1 16 ? 4.328 -1.734 4.277 1.00 0.00 ? 60 ILE C HD13 4 16
ATOM 4221 N N . LYS C 1 17 ? 4.098 -3.373 9.957 1.00 0.00 ? 61 LYS C N 4 17
ATOM 4222 C CA . LYS C 1 17 ? 4.848 -3.674 11.153 1.00 0.00 ? 61 LYS C CA 4 17
ATOM 4223 C C . LYS C 1 17 ? 4.359 -4.908 11.886 1.00 0.00 ? 61 LYS C C 4 17
ATOM 4224 O O . LYS C 1 17 ? 5.140 -5.723 12.348 1.00 0.00 ? 61 LYS C O 4 17
ATOM 4225 C CB . LYS C 1 17 ? 4.859 -2.424 12.022 1.00 0.00 ? 61 LYS C CB 4 17
ATOM 4226 C CG . LYS C 1 17 ? 5.924 -2.443 13.066 1.00 0.00 ? 61 LYS C CG 4 17
ATOM 4227 C CD . LYS C 1 17 ? 6.184 -1.093 13.697 1.00 0.00 ? 61 LYS C CD 4 17
ATOM 4228 C CE . LYS C 1 17 ? 5.065 -0.574 14.418 1.00 0.00 ? 61 LYS C CE 4 17
ATOM 4229 N NZ . LYS C 1 17 ? 5.233 0.731 14.973 1.00 0.00 ? 61 LYS C NZ 4 17
ATOM 4230 H H . LYS C 1 17 ? 3.597 -2.515 9.878 1.00 0.00 ? 61 LYS C H 4 17
ATOM 4231 H HA . LYS C 1 17 ? 5.858 -3.921 10.861 1.00 0.00 ? 61 LYS C HA 4 17
ATOM 4232 H HB2 . LYS C 1 17 ? 5.008 -1.556 11.381 1.00 0.00 ? 61 LYS C HB2 4 17
ATOM 4233 H HB3 . LYS C 1 17 ? 3.923 -2.278 12.499 1.00 0.00 ? 61 LYS C HB3 4 17
ATOM 4234 H HG2 . LYS C 1 17 ? 5.657 -3.158 13.844 1.00 0.00 ? 61 LYS C HG2 4 17
ATOM 4235 H HG3 . LYS C 1 17 ? 6.814 -2.779 12.604 1.00 0.00 ? 61 LYS C HG3 4 17
ATOM 4236 H HD2 . LYS C 1 17 ? 7.032 -1.175 14.377 1.00 0.00 ? 61 LYS C HD2 4 17
ATOM 4237 H HD3 . LYS C 1 17 ? 6.459 -0.451 12.966 1.00 0.00 ? 61 LYS C HD3 4 17
ATOM 4238 H HE2 . LYS C 1 17 ? 4.203 -0.561 13.751 1.00 0.00 ? 61 LYS C HE2 4 17
ATOM 4239 H HE3 . LYS C 1 17 ? 4.846 -1.169 15.164 1.00 0.00 ? 61 LYS C HE3 4 17
ATOM 4240 H HZ1 . LYS C 1 17 ? 5.864 0.755 15.647 1.00 0.00 ? 61 LYS C HZ1 4 17
ATOM 4241 H HZ2 . LYS C 1 17 ? 5.477 1.328 14.332 1.00 0.00 ? 61 LYS C HZ2 4 17
ATOM 4242 H HZ3 . LYS C 1 17 ? 4.445 1.069 15.401 1.00 0.00 ? 61 LYS C HZ3 4 17
ATOM 4243 N N . ALA C 1 18 ? 3.047 -5.081 11.961 1.00 0.00 ? 62 ALA C N 4 18
ATOM 4244 C CA . ALA C 1 18 ? 2.384 -6.205 12.576 1.00 0.00 ? 62 ALA C CA 4 18
ATOM 4245 C C . ALA C 1 18 ? 2.436 -7.474 11.756 1.00 0.00 ? 62 ALA C C 4 18
ATOM 4246 O O . ALA C 1 18 ? 2.675 -8.533 12.254 1.00 0.00 ? 62 ALA C O 4 18
ATOM 4247 C CB . ALA C 1 18 ? 0.957 -5.810 12.886 1.00 0.00 ? 62 ALA C CB 4 18
ATOM 4248 H H . ALA C 1 18 ? 2.503 -4.366 11.522 1.00 0.00 ? 62 ALA C H 4 18
ATOM 4249 H HA . ALA C 1 18 ? 2.878 -6.411 13.512 1.00 0.00 ? 62 ALA C HA 4 18
ATOM 4250 H HB1 . ALA C 1 18 ? 0.424 -5.614 11.983 1.00 0.00 ? 62 ALA C HB1 4 18
ATOM 4251 H HB2 . ALA C 1 18 ? 0.449 -6.588 13.420 1.00 0.00 ? 62 ALA C HB2 4 18
ATOM 4252 H HB3 . ALA C 1 18 ? 0.976 -4.926 13.492 1.00 0.00 ? 62 ALA C HB3 4 18
ATOM 4253 N N . GLY C 1 19 ? 2.316 -7.343 10.449 1.00 0.00 ? 63 GLY C N 4 19
ATOM 4254 C CA . GLY C 1 19 ? 2.419 -8.374 9.443 1.00 0.00 ? 63 GLY C CA 4 19
ATOM 4255 C C . GLY C 1 19 ? 3.815 -8.950 9.309 1.00 0.00 ? 63 GLY C C 4 19
ATOM 4256 O O . GLY C 1 19 ? 3.993 -10.141 9.182 1.00 0.00 ? 63 GLY C O 4 19
ATOM 4257 H H . GLY C 1 19 ? 2.122 -6.420 10.170 1.00 0.00 ? 63 GLY C H 4 19
ATOM 4258 H HA2 . GLY C 1 19 ? 1.736 -9.183 9.662 1.00 0.00 ? 63 GLY C HA2 4 19
ATOM 4259 H HA3 . GLY C 1 19 ? 2.112 -7.931 8.505 1.00 0.00 ? 63 GLY C HA3 4 19
ATOM 4260 N N . GLY C 1 20 ? 4.818 -8.085 9.362 1.00 0.00 ? 64 GLY C N 4 20
ATOM 4261 C CA . GLY C 1 20 ? 6.215 -8.422 9.330 1.00 0.00 ? 64 GLY C CA 4 20
ATOM 4262 C C . GLY C 1 20 ? 6.766 -8.577 7.937 1.00 0.00 ? 64 GLY C C 4 20
ATOM 4263 O O . GLY C 1 20 ? 7.631 -9.380 7.723 1.00 0.00 ? 64 GLY C O 4 20
ATOM 4264 H H . GLY C 1 20 ? 4.542 -7.150 9.518 1.00 0.00 ? 64 GLY C H 4 20
ATOM 4265 H HA2 . GLY C 1 20 ? 6.761 -7.631 9.798 1.00 0.00 ? 64 GLY C HA2 4 20
ATOM 4266 H HA3 . GLY C 1 20 ? 6.376 -9.340 9.863 1.00 0.00 ? 64 GLY C HA3 4 20
ATOM 4267 N N . TYR C 1 21 ? 6.255 -7.830 6.972 1.00 0.00 ? 65 TYR C N 4 21
ATOM 4268 C CA . TYR C 1 21 ? 6.442 -7.897 5.555 1.00 0.00 ? 65 TYR C CA 4 21
ATOM 4269 C C . TYR C 1 21 ? 7.855 -7.861 5.105 1.00 0.00 ? 65 TYR C C 4 21
ATOM 4270 O O . TYR C 1 21 ? 8.180 -8.277 4.054 1.00 0.00 ? 65 TYR C O 4 21
ATOM 4271 C CB . TYR C 1 21 ? 5.721 -6.710 4.959 1.00 0.00 ? 65 TYR C CB 4 21
ATOM 4272 C CG . TYR C 1 21 ? 4.336 -6.948 4.434 1.00 0.00 ? 65 TYR C CG 4 21
ATOM 4273 C CD1 . TYR C 1 21 ? 4.011 -7.801 3.390 1.00 0.00 ? 65 TYR C CD1 4 21
ATOM 4274 C CD2 . TYR C 1 21 ? 3.340 -6.179 4.997 1.00 0.00 ? 65 TYR C CD2 4 21
ATOM 4275 C CE1 . TYR C 1 21 ? 2.717 -7.808 2.869 1.00 0.00 ? 65 TYR C CE1 4 21
ATOM 4276 C CE2 . TYR C 1 21 ? 2.046 -6.124 4.475 1.00 0.00 ? 65 TYR C CE2 4 21
ATOM 4277 C CZ . TYR C 1 21 ? 1.741 -6.967 3.409 1.00 0.00 ? 65 TYR C CZ 4 21
ATOM 4278 O OH . TYR C 1 21 ? 0.470 -6.993 2.930 1.00 0.00 ? 65 TYR C OH 4 21
ATOM 4279 H H . TYR C 1 21 ? 5.630 -7.130 7.246 1.00 0.00 ? 65 TYR C H 4 21
ATOM 4280 H HA . TYR C 1 21 ? 6.000 -8.775 5.191 1.00 0.00 ? 65 TYR C HA 4 21
ATOM 4281 H HB2 . TYR C 1 21 ? 5.686 -5.918 5.708 1.00 0.00 ? 65 TYR C HB2 4 21
ATOM 4282 H HB3 . TYR C 1 21 ? 6.257 -6.345 4.104 1.00 0.00 ? 65 TYR C HB3 4 21
ATOM 4283 H HD1 . TYR C 1 21 ? 4.757 -8.422 2.953 1.00 0.00 ? 65 TYR C HD1 4 21
ATOM 4284 H HD2 . TYR C 1 21 ? 3.611 -5.532 5.800 1.00 0.00 ? 65 TYR C HD2 4 21
ATOM 4285 H HE1 . TYR C 1 21 ? 2.544 -8.456 2.040 1.00 0.00 ? 65 TYR C HE1 4 21
ATOM 4286 H HE2 . TYR C 1 21 ? 1.333 -5.441 4.883 1.00 0.00 ? 65 TYR C HE2 4 21
ATOM 4287 H HH . TYR C 1 21 ? -0.017 -7.642 3.377 1.00 0.00 ? 65 TYR C HH 4 21
HETATM 4288 N N . NH2 C 1 22 ? 8.760 -7.371 5.863 1.00 0.00 ? 66 NH2 C N 4 22
HETATM 4289 H HN1 . NH2 C 1 22 ? 9.691 -7.406 5.582 1.00 0.00 ? 66 NH2 C HN1 4 22
HETATM 4290 H HN2 . NH2 C 1 22 ? 8.496 -7.026 6.729 1.00 0.00 ? 66 NH2 C HN2 4 22
HETATM 4291 C C . ACE D 1 1 ? 5.918 -11.891 5.581 1.00 0.00 ? 67 ACE D C 4 1
HETATM 4292 O O . ACE D 1 1 ? 4.853 -11.334 5.794 1.00 0.00 ? 67 ACE D O 4 1
HETATM 4293 C CH3 . ACE D 1 1 ? 6.814 -12.335 6.709 1.00 0.00 ? 67 ACE D CH3 4 1
HETATM 4294 H H1 . ACE D 1 1 ? 7.565 -12.143 6.743 1.00 0.00 ? 67 ACE D H1 4 1
HETATM 4295 H H2 . ACE D 1 1 ? 6.651 -12.080 7.372 1.00 0.00 ? 67 ACE D H2 4 1
HETATM 4296 H H3 . ACE D 1 1 ? 6.886 -13.067 6.812 1.00 0.00 ? 67 ACE D H3 4 1
ATOM 4297 N N . ALA D 1 2 ? 6.338 -12.157 4.359 1.00 0.00 ? 68 ALA D N 4 2
ATOM 4298 C CA . ALA D 1 2 ? 5.629 -11.832 3.143 1.00 0.00 ? 68 ALA D CA 4 2
ATOM 4299 C C . ALA D 1 2 ? 4.207 -12.341 3.066 1.00 0.00 ? 68 ALA D C 4 2
ATOM 4300 O O . ALA D 1 2 ? 3.397 -11.757 2.362 1.00 0.00 ? 68 ALA D O 4 2
ATOM 4301 C CB . ALA D 1 2 ? 6.454 -12.337 1.980 1.00 0.00 ? 68 ALA D CB 4 2
ATOM 4302 H H . ALA D 1 2 ? 7.209 -12.617 4.256 1.00 0.00 ? 68 ALA D H 4 2
ATOM 4303 H HA . ALA D 1 2 ? 5.569 -10.756 3.055 1.00 0.00 ? 68 ALA D HA 4 2
ATOM 4304 H HB1 . ALA D 1 2 ? 7.427 -11.915 1.991 1.00 0.00 ? 68 ALA D HB1 4 2
ATOM 4305 H HB2 . ALA D 1 2 ? 6.519 -13.390 2.048 1.00 0.00 ? 68 ALA D HB2 4 2
ATOM 4306 H HB3 . ALA D 1 2 ? 5.982 -12.112 1.041 1.00 0.00 ? 68 ALA D HB3 4 2
ATOM 4307 N N . LYS D 1 3 ? 3.844 -13.389 3.801 1.00 0.00 ? 69 LYS D N 4 3
ATOM 4308 C CA . LYS D 1 3 ? 2.502 -13.907 3.911 1.00 0.00 ? 69 LYS D CA 4 3
ATOM 4309 C C . LYS D 1 3 ? 1.464 -12.945 4.461 1.00 0.00 ? 69 LYS D C 4 3
ATOM 4310 O O . LYS D 1 3 ? 0.279 -13.211 4.358 1.00 0.00 ? 69 LYS D O 4 3
ATOM 4311 C CB . LYS D 1 3 ? 2.469 -15.189 4.723 1.00 0.00 ? 69 LYS D CB 4 3
ATOM 4312 C CG . LYS D 1 3 ? 3.168 -16.342 4.103 1.00 0.00 ? 69 LYS D CG 4 3
ATOM 4313 C CD . LYS D 1 3 ? 3.052 -17.627 4.802 1.00 0.00 ? 69 LYS D CD 4 3
ATOM 4314 C CE . LYS D 1 3 ? 1.761 -18.151 4.724 1.00 0.00 ? 69 LYS D CE 4 3
ATOM 4315 N NZ . LYS D 1 3 ? 1.714 -19.405 5.313 1.00 0.00 ? 69 LYS D NZ 4 3
ATOM 4316 H H . LYS D 1 3 ? 4.547 -13.839 4.346 1.00 0.00 ? 69 LYS D H 4 3
ATOM 4317 H HA . LYS D 1 3 ? 2.157 -14.127 2.915 1.00 0.00 ? 69 LYS D HA 4 3
ATOM 4318 H HB2 . LYS D 1 3 ? 2.888 -15.004 5.712 1.00 0.00 ? 69 LYS D HB2 4 3
ATOM 4319 H HB3 . LYS D 1 3 ? 1.457 -15.437 4.824 1.00 0.00 ? 69 LYS D HB3 4 3
ATOM 4320 H HG2 . LYS D 1 3 ? 2.798 -16.464 3.085 1.00 0.00 ? 69 LYS D HG2 4 3
ATOM 4321 H HG3 . LYS D 1 3 ? 4.153 -16.132 4.050 1.00 0.00 ? 69 LYS D HG3 4 3
ATOM 4322 H HD2 . LYS D 1 3 ? 3.754 -18.339 4.366 1.00 0.00 ? 69 LYS D HD2 4 3
ATOM 4323 H HD3 . LYS D 1 3 ? 3.325 -17.510 5.772 1.00 0.00 ? 69 LYS D HD3 4 3
ATOM 4324 H HE2 . LYS D 1 3 ? 1.040 -17.473 5.181 1.00 0.00 ? 69 LYS D HE2 4 3
ATOM 4325 H HE3 . LYS D 1 3 ? 1.531 -18.292 3.759 1.00 0.00 ? 69 LYS D HE3 4 3
ATOM 4326 H HZ1 . LYS D 1 3 ? 2.098 -20.017 4.895 1.00 0.00 ? 69 LYS D HZ1 4 3
ATOM 4327 H HZ2 . LYS D 1 3 ? 0.971 -19.675 5.408 1.00 0.00 ? 69 LYS D HZ2 4 3
ATOM 4328 H HZ3 . LYS D 1 3 ? 2.049 -19.430 6.053 1.00 0.00 ? 69 LYS D HZ3 4 3
ATOM 4329 N N . ALA D 1 4 ? 1.877 -11.787 4.957 1.00 0.00 ? 70 ALA D N 4 4
ATOM 4330 C CA . ALA D 1 4 ? 1.040 -10.645 5.241 1.00 0.00 ? 70 ALA D CA 4 4
ATOM 4331 C C . ALA D 1 4 ? 0.276 -10.106 4.044 1.00 0.00 ? 70 ALA D C 4 4
ATOM 4332 O O . ALA D 1 4 ? -0.499 -9.167 4.145 1.00 0.00 ? 70 ALA D O 4 4
ATOM 4333 C CB . ALA D 1 4 ? 1.959 -9.596 5.852 1.00 0.00 ? 70 ALA D CB 4 4
ATOM 4334 H H . ALA D 1 4 ? 2.861 -11.719 5.065 1.00 0.00 ? 70 ALA D H 4 4
ATOM 4335 H HA . ALA D 1 4 ? 0.314 -10.941 5.993 1.00 0.00 ? 70 ALA D HA 4 4
ATOM 4336 H HB1 . ALA D 1 4 ? 2.783 -9.367 5.192 1.00 0.00 ? 70 ALA D HB1 4 4
ATOM 4337 H HB2 . ALA D 1 4 ? 1.412 -8.705 6.111 1.00 0.00 ? 70 ALA D HB2 4 4
ATOM 4338 H HB3 . ALA D 1 4 ? 2.409 -10.002 6.747 1.00 0.00 ? 70 ALA D HB3 4 4
ATOM 4339 N N . ALA D 1 5 ? 0.460 -10.683 2.860 1.00 0.00 ? 71 ALA D N 4 5
ATOM 4340 C CA . ALA D 1 5 ? 0.062 -10.210 1.559 1.00 0.00 ? 71 ALA D CA 4 5
ATOM 4341 C C . ALA D 1 5 ? -1.394 -10.299 1.152 1.00 0.00 ? 71 ALA D C 4 5
ATOM 4342 O O . ALA D 1 5 ? -1.760 -9.791 0.116 1.00 0.00 ? 71 ALA D O 4 5
ATOM 4343 C CB . ALA D 1 5 ? 0.969 -10.910 0.577 1.00 0.00 ? 71 ALA D CB 4 5
ATOM 4344 H H . ALA D 1 5 ? 1.081 -11.472 2.895 1.00 0.00 ? 71 ALA D H 4 5
ATOM 4345 H HA . ALA D 1 5 ? 0.275 -9.153 1.509 1.00 0.00 ? 71 ALA D HA 4 5
ATOM 4346 H HB1 . ALA D 1 5 ? 0.950 -11.947 0.685 1.00 0.00 ? 71 ALA D HB1 4 5
ATOM 4347 H HB2 . ALA D 1 5 ? 0.680 -10.691 -0.422 1.00 0.00 ? 71 ALA D HB2 4 5
ATOM 4348 H HB3 . ALA D 1 5 ? 1.953 -10.563 0.715 1.00 0.00 ? 71 ALA D HB3 4 5
ATOM 4349 N N . ALA D 1 6 ? -2.278 -10.777 2.007 1.00 0.00 ? 72 ALA D N 4 6
ATOM 4350 C CA . ALA D 1 6 ? -3.688 -10.466 1.995 1.00 0.00 ? 72 ALA D CA 4 6
ATOM 4351 C C . ALA D 1 6 ? -4.075 -9.651 3.210 1.00 0.00 ? 72 ALA D C 4 6
ATOM 4352 O O . ALA D 1 6 ? -4.851 -8.710 3.103 1.00 0.00 ? 72 ALA D O 4 6
ATOM 4353 C CB . ALA D 1 6 ? -4.492 -11.734 1.802 1.00 0.00 ? 72 ALA D CB 4 6
ATOM 4354 H H . ALA D 1 6 ? -1.983 -11.366 2.750 1.00 0.00 ? 72 ALA D H 4 6
ATOM 4355 H HA . ALA D 1 6 ? -3.849 -9.801 1.158 1.00 0.00 ? 72 ALA D HA 4 6
ATOM 4356 H HB1 . ALA D 1 6 ? -4.816 -12.051 2.337 1.00 0.00 ? 72 ALA D HB1 4 6
ATOM 4357 H HB2 . ALA D 1 6 ? -4.216 -12.288 1.546 1.00 0.00 ? 72 ALA D HB2 4 6
ATOM 4358 H HB3 . ALA D 1 6 ? -5.034 -11.747 1.393 1.00 0.00 ? 72 ALA D HB3 4 6
ATOM 4359 N N . ALA D 1 7 ? -3.457 -9.874 4.363 1.00 0.00 ? 73 ALA D N 4 7
ATOM 4360 C CA . ALA D 1 7 ? -3.763 -9.267 5.635 1.00 0.00 ? 73 ALA D CA 4 7
ATOM 4361 C C . ALA D 1 7 ? -3.549 -7.772 5.721 1.00 0.00 ? 73 ALA D C 4 7
ATOM 4362 O O . ALA D 1 7 ? -4.059 -7.172 6.646 1.00 0.00 ? 73 ALA D O 4 7
ATOM 4363 C CB . ALA D 1 7 ? -2.968 -10.010 6.689 1.00 0.00 ? 73 ALA D CB 4 7
ATOM 4364 H H . ALA D 1 7 ? -2.848 -10.666 4.398 1.00 0.00 ? 73 ALA D H 4 7
ATOM 4365 H HA . ALA D 1 7 ? -4.814 -9.437 5.817 1.00 0.00 ? 73 ALA D HA 4 7
ATOM 4366 H HB1 . ALA D 1 7 ? -1.922 -9.888 6.537 1.00 0.00 ? 73 ALA D HB1 4 7
ATOM 4367 H HB2 . ALA D 1 7 ? -3.218 -9.637 7.653 1.00 0.00 ? 73 ALA D HB2 4 7
ATOM 4368 H HB3 . ALA D 1 7 ? -3.183 -11.054 6.673 1.00 0.00 ? 73 ALA D HB3 4 7
ATOM 4369 N N . ALA D 1 8 ? -2.901 -7.143 4.746 1.00 0.00 ? 74 ALA D N 4 8
ATOM 4370 C CA . ALA D 1 8 ? -3.144 -5.754 4.447 1.00 0.00 ? 74 ALA D CA 4 8
ATOM 4371 C C . ALA D 1 8 ? -3.889 -5.563 3.145 1.00 0.00 ? 74 ALA D C 4 8
ATOM 4372 O O . ALA D 1 8 ? -4.893 -4.869 3.066 1.00 0.00 ? 74 ALA D O 4 8
ATOM 4373 C CB . ALA D 1 8 ? -1.835 -4.993 4.422 1.00 0.00 ? 74 ALA D CB 4 8
ATOM 4374 H H . ALA D 1 8 ? -2.426 -7.713 4.075 1.00 0.00 ? 74 ALA D H 4 8
ATOM 4375 H HA . ALA D 1 8 ? -3.771 -5.327 5.220 1.00 0.00 ? 74 ALA D HA 4 8
ATOM 4376 H HB1 . ALA D 1 8 ? -1.268 -5.088 4.002 1.00 0.00 ? 74 ALA D HB1 4 8
ATOM 4377 H HB2 . ALA D 1 8 ? -1.442 -4.978 4.952 1.00 0.00 ? 74 ALA D HB2 4 8
ATOM 4378 H HB3 . ALA D 1 8 ? -1.848 -4.316 4.226 1.00 0.00 ? 74 ALA D HB3 4 8
ATOM 4379 N N . ILE D 1 9 ? -3.359 -6.117 2.058 1.00 0.00 ? 75 ILE D N 4 9
ATOM 4380 C CA . ILE D 1 9 ? -3.733 -5.811 0.700 1.00 0.00 ? 75 ILE D CA 4 9
ATOM 4381 C C . ILE D 1 9 ? -5.196 -6.073 0.393 1.00 0.00 ? 75 ILE D C 4 9
ATOM 4382 O O . ILE D 1 9 ? -5.791 -5.347 -0.389 1.00 0.00 ? 75 ILE D O 4 9
ATOM 4383 C CB . ILE D 1 9 ? -2.888 -6.571 -0.308 1.00 0.00 ? 75 ILE D CB 4 9
ATOM 4384 C CG1 . ILE D 1 9 ? -1.403 -6.555 0.027 1.00 0.00 ? 75 ILE D CG1 4 9
ATOM 4385 C CG2 . ILE D 1 9 ? -3.099 -6.067 -1.721 1.00 0.00 ? 75 ILE D CG2 4 9
ATOM 4386 C CD1 . ILE D 1 9 ? -0.807 -5.181 0.159 1.00 0.00 ? 75 ILE D CD1 4 9
ATOM 4387 H H . ILE D 1 9 ? -2.547 -6.685 2.211 1.00 0.00 ? 75 ILE D H 4 9
ATOM 4388 H HA . ILE D 1 9 ? -3.556 -4.761 0.528 1.00 0.00 ? 75 ILE D HA 4 9
ATOM 4389 H HB . ILE D 1 9 ? -3.239 -7.591 -0.270 1.00 0.00 ? 75 ILE D HB 4 9
ATOM 4390 H HG12 . ILE D 1 9 ? -1.259 -7.081 0.970 1.00 0.00 ? 75 ILE D HG12 4 9
ATOM 4391 H HG13 . ILE D 1 9 ? -0.863 -7.129 -0.713 1.00 0.00 ? 75 ILE D HG13 4 9
ATOM 4392 H HG21 . ILE D 1 9 ? -3.036 -4.996 -1.748 1.00 0.00 ? 75 ILE D HG21 4 9
ATOM 4393 H HG22 . ILE D 1 9 ? -2.339 -6.503 -2.348 1.00 0.00 ? 75 ILE D HG22 4 9
ATOM 4394 H HG23 . ILE D 1 9 ? -4.068 -6.381 -2.074 1.00 0.00 ? 75 ILE D HG23 4 9
ATOM 4395 H HD11 . ILE D 1 9 ? -0.792 -4.707 -0.775 1.00 0.00 ? 75 ILE D HD11 4 9
ATOM 4396 H HD12 . ILE D 1 9 ? -1.403 -4.618 0.811 1.00 0.00 ? 75 ILE D HD12 4 9
ATOM 4397 H HD13 . ILE D 1 9 ? 0.183 -5.183 0.540 1.00 0.00 ? 75 ILE D HD13 4 9
ATOM 4398 N N . LYS D 1 10 ? -5.812 -7.078 1.007 1.00 0.00 ? 76 LYS D N 4 10
ATOM 4399 C CA . LYS D 1 10 ? -7.155 -7.519 0.711 1.00 0.00 ? 76 LYS D CA 4 10
ATOM 4400 C C . LYS D 1 10 ? -8.201 -6.549 1.230 1.00 0.00 ? 76 LYS D C 4 10
ATOM 4401 O O . LYS D 1 10 ? -9.167 -6.301 0.528 1.00 0.00 ? 76 LYS D O 4 10
ATOM 4402 C CB . LYS D 1 10 ? -7.230 -8.910 1.329 1.00 0.00 ? 76 LYS D CB 4 10
ATOM 4403 C CG . LYS D 1 10 ? -8.249 -9.920 0.837 1.00 0.00 ? 76 LYS D CG 4 10
ATOM 4404 C CD . LYS D 1 10 ? -9.560 -9.729 1.524 1.00 0.00 ? 76 LYS D CD 4 10
ATOM 4405 C CE . LYS D 1 10 ? -10.493 -10.843 1.122 1.00 0.00 ? 76 LYS D CE 4 10
ATOM 4406 N NZ . LYS D 1 10 ? -11.678 -10.932 1.912 1.00 0.00 ? 76 LYS D NZ 4 10
ATOM 4407 H H . LYS D 1 10 ? -5.303 -7.518 1.750 1.00 0.00 ? 76 LYS D H 4 10
ATOM 4408 H HA . LYS D 1 10 ? -7.262 -7.541 -0.371 1.00 0.00 ? 76 LYS D HA 4 10
ATOM 4409 H HB2 . LYS D 1 10 ? -6.254 -9.368 1.170 1.00 0.00 ? 76 LYS D HB2 4 10
ATOM 4410 H HB3 . LYS D 1 10 ? -7.295 -8.790 2.402 1.00 0.00 ? 76 LYS D HB3 4 10
ATOM 4411 H HG2 . LYS D 1 10 ? -8.378 -9.839 -0.243 1.00 0.00 ? 76 LYS D HG2 4 10
ATOM 4412 H HG3 . LYS D 1 10 ? -7.841 -10.883 1.059 1.00 0.00 ? 76 LYS D HG3 4 10
ATOM 4413 H HD2 . LYS D 1 10 ? -9.421 -9.715 2.605 1.00 0.00 ? 76 LYS D HD2 4 10
ATOM 4414 H HD3 . LYS D 1 10 ? -10.014 -8.813 1.246 1.00 0.00 ? 76 LYS D HD3 4 10
ATOM 4415 H HE2 . LYS D 1 10 ? -10.766 -10.715 0.075 1.00 0.00 ? 76 LYS D HE2 4 10
ATOM 4416 H HE3 . LYS D 1 10 ? -10.010 -11.761 1.216 1.00 0.00 ? 76 LYS D HE3 4 10
ATOM 4417 H HZ1 . LYS D 1 10 ? -11.491 -10.991 2.855 1.00 0.00 ? 76 LYS D HZ1 4 10
ATOM 4418 H HZ2 . LYS D 1 10 ? -12.214 -10.147 1.791 1.00 0.00 ? 76 LYS D HZ2 4 10
ATOM 4419 H HZ3 . LYS D 1 10 ? -12.235 -11.724 1.701 1.00 0.00 ? 76 LYS D HZ3 4 10
ATOM 4420 N N . ALA D 1 11 ? -7.975 -5.924 2.385 1.00 0.00 ? 77 ALA D N 4 11
ATOM 4421 C CA . ALA D 1 11 ? -8.679 -4.726 2.781 1.00 0.00 ? 77 ALA D CA 4 11
ATOM 4422 C C . ALA D 1 11 ? -8.311 -3.543 1.909 1.00 0.00 ? 77 ALA D C 4 11
ATOM 4423 O O . ALA D 1 11 ? -9.168 -2.844 1.382 1.00 0.00 ? 77 ALA D O 4 11
ATOM 4424 C CB . ALA D 1 11 ? -8.455 -4.481 4.259 1.00 0.00 ? 77 ALA D CB 4 11
ATOM 4425 H H . ALA D 1 11 ? -7.196 -6.229 2.924 1.00 0.00 ? 77 ALA D H 4 11
ATOM 4426 H HA . ALA D 1 11 ? -9.744 -4.857 2.633 1.00 0.00 ? 77 ALA D HA 4 11
ATOM 4427 H HB1 . ALA D 1 11 ? -9.038 -3.654 4.595 1.00 0.00 ? 77 ALA D HB1 4 11
ATOM 4428 H HB2 . ALA D 1 11 ? -8.745 -5.343 4.816 1.00 0.00 ? 77 ALA D HB2 4 11
ATOM 4429 H HB3 . ALA D 1 11 ? -7.429 -4.251 4.462 1.00 0.00 ? 77 ALA D HB3 4 11
ATOM 4430 N N . ILE D 1 12 ? -7.026 -3.326 1.640 1.00 0.00 ? 78 ILE D N 4 12
ATOM 4431 C CA . ILE D 1 12 ? -6.525 -2.100 1.065 1.00 0.00 ? 78 ILE D CA 4 12
ATOM 4432 C C . ILE D 1 12 ? -6.922 -1.941 -0.390 1.00 0.00 ? 78 ILE D C 4 12
ATOM 4433 O O . ILE D 1 12 ? -7.360 -0.869 -0.775 1.00 0.00 ? 78 ILE D O 4 12
ATOM 4434 C CB . ILE D 1 12 ? -5.035 -1.937 1.328 1.00 0.00 ? 78 ILE D CB 4 12
ATOM 4435 C CG1 . ILE D 1 12 ? -4.744 -1.605 2.782 1.00 0.00 ? 78 ILE D CG1 4 12
ATOM 4436 C CG2 . ILE D 1 12 ? -4.325 -0.985 0.382 1.00 0.00 ? 78 ILE D CG2 4 12
ATOM 4437 C CD1 . ILE D 1 12 ? -4.982 -0.182 3.211 1.00 0.00 ? 78 ILE D CD1 4 12
ATOM 4438 H H . ILE D 1 12 ? -6.369 -4.043 1.886 1.00 0.00 ? 78 ILE D H 4 12
ATOM 4439 H HA . ILE D 1 12 ? -6.999 -1.246 1.545 1.00 0.00 ? 78 ILE D HA 4 12
ATOM 4440 H HB . ILE D 1 12 ? -4.591 -2.901 1.116 1.00 0.00 ? 78 ILE D HB 4 12
ATOM 4441 H HG12 . ILE D 1 12 ? -5.346 -2.260 3.413 1.00 0.00 ? 78 ILE D HG12 4 12
ATOM 4442 H HG13 . ILE D 1 12 ? -3.711 -1.834 2.966 1.00 0.00 ? 78 ILE D HG13 4 12
ATOM 4443 H HG21 . ILE D 1 12 ? -4.759 -0.011 0.407 1.00 0.00 ? 78 ILE D HG21 4 12
ATOM 4444 H HG22 . ILE D 1 12 ? -3.290 -0.891 0.636 1.00 0.00 ? 78 ILE D HG22 4 12
ATOM 4445 H HG23 . ILE D 1 12 ? -4.317 -1.360 -0.625 1.00 0.00 ? 78 ILE D HG23 4 12
ATOM 4446 H HD11 . ILE D 1 12 ? -4.405 0.390 3.077 1.00 0.00 ? 78 ILE D HD11 4 12
ATOM 4447 H HD12 . ILE D 1 12 ? -5.044 -0.121 3.993 1.00 0.00 ? 78 ILE D HD12 4 12
ATOM 4448 H HD13 . ILE D 1 12 ? -5.629 0.217 2.967 1.00 0.00 ? 78 ILE D HD13 4 12
ATOM 4449 N N . ALA D 1 13 ? -6.933 -3.000 -1.198 1.00 0.00 ? 79 ALA D N 4 13
ATOM 4450 C CA . ALA D 1 13 ? -7.406 -2.910 -2.557 1.00 0.00 ? 79 ALA D CA 4 13
ATOM 4451 C C . ALA D 1 13 ? -8.883 -2.631 -2.691 1.00 0.00 ? 79 ALA D C 4 13
ATOM 4452 O O . ALA D 1 13 ? -9.296 -2.249 -3.739 1.00 0.00 ? 79 ALA D O 4 13
ATOM 4453 C CB . ALA D 1 13 ? -6.979 -4.171 -3.272 1.00 0.00 ? 79 ALA D CB 4 13
ATOM 4454 H H . ALA D 1 13 ? -6.628 -3.870 -0.802 1.00 0.00 ? 79 ALA D H 4 13
ATOM 4455 H HA . ALA D 1 13 ? -6.900 -2.098 -3.044 1.00 0.00 ? 79 ALA D HA 4 13
ATOM 4456 H HB1 . ALA D 1 13 ? -7.447 -5.003 -2.829 1.00 0.00 ? 79 ALA D HB1 4 13
ATOM 4457 H HB2 . ALA D 1 13 ? -7.269 -4.088 -4.287 1.00 0.00 ? 79 ALA D HB2 4 13
ATOM 4458 H HB3 . ALA D 1 13 ? -5.934 -4.296 -3.186 1.00 0.00 ? 79 ALA D HB3 4 13
ATOM 4459 N N . ALA D 1 14 ? -9.678 -2.761 -1.649 1.00 0.00 ? 80 ALA D N 4 14
ATOM 4460 C CA . ALA D 1 14 ? -11.074 -2.387 -1.568 1.00 0.00 ? 80 ALA D CA 4 14
ATOM 4461 C C . ALA D 1 14 ? -11.225 -0.988 -1.009 1.00 0.00 ? 80 ALA D C 4 14
ATOM 4462 O O . ALA D 1 14 ? -12.018 -0.198 -1.485 1.00 0.00 ? 80 ALA D O 4 14
ATOM 4463 C CB . ALA D 1 14 ? -11.815 -3.431 -0.760 1.00 0.00 ? 80 ALA D CB 4 14
ATOM 4464 H H . ALA D 1 14 ? -9.181 -2.988 -0.823 1.00 0.00 ? 80 ALA D H 4 14
ATOM 4465 H HA . ALA D 1 14 ? -11.480 -2.351 -2.576 1.00 0.00 ? 80 ALA D HA 4 14
ATOM 4466 H HB1 . ALA D 1 14 ? -11.750 -4.358 -1.253 1.00 0.00 ? 80 ALA D HB1 4 14
ATOM 4467 H HB2 . ALA D 1 14 ? -11.388 -3.487 0.203 1.00 0.00 ? 80 ALA D HB2 4 14
ATOM 4468 H HB3 . ALA D 1 14 ? -12.834 -3.185 -0.663 1.00 0.00 ? 80 ALA D HB3 4 14
ATOM 4469 N N . ILE D 1 15 ? -10.416 -0.621 -0.025 1.00 0.00 ? 81 ILE D N 4 15
ATOM 4470 C CA . ILE D 1 15 ? -10.273 0.694 0.558 1.00 0.00 ? 81 ILE D CA 4 15
ATOM 4471 C C . ILE D 1 15 ? -9.778 1.677 -0.490 1.00 0.00 ? 81 ILE D C 4 15
ATOM 4472 O O . ILE D 1 15 ? -10.215 2.819 -0.477 1.00 0.00 ? 81 ILE D O 4 15
ATOM 4473 C CB . ILE D 1 15 ? -9.376 0.620 1.786 1.00 0.00 ? 81 ILE D CB 4 15
ATOM 4474 C CG1 . ILE D 1 15 ? -10.068 -0.090 2.938 1.00 0.00 ? 81 ILE D CG1 4 15
ATOM 4475 C CG2 . ILE D 1 15 ? -8.881 1.963 2.288 1.00 0.00 ? 81 ILE D CG2 4 15
ATOM 4476 C CD1 . ILE D 1 15 ? -9.132 -0.579 4.023 1.00 0.00 ? 81 ILE D CD1 4 15
ATOM 4477 H H . ILE D 1 15 ? -9.815 -1.340 0.315 1.00 0.00 ? 81 ILE D H 4 15
ATOM 4478 H HA . ILE D 1 15 ? -11.254 1.024 0.878 1.00 0.00 ? 81 ILE D HA 4 15
ATOM 4479 H HB . ILE D 1 15 ? -8.482 0.086 1.494 1.00 0.00 ? 81 ILE D HB 4 15
ATOM 4480 H HG12 . ILE D 1 15 ? -10.805 0.582 3.376 1.00 0.00 ? 81 ILE D HG12 4 15
ATOM 4481 H HG13 . ILE D 1 15 ? -10.591 -0.957 2.568 1.00 0.00 ? 81 ILE D HG13 4 15
ATOM 4482 H HG21 . ILE D 1 15 ? -9.668 2.598 2.574 1.00 0.00 ? 81 ILE D HG21 4 15
ATOM 4483 H HG22 . ILE D 1 15 ? -8.276 1.821 3.148 1.00 0.00 ? 81 ILE D HG22 4 15
ATOM 4484 H HG23 . ILE D 1 15 ? -8.288 2.413 1.531 1.00 0.00 ? 81 ILE D HG23 4 15
ATOM 4485 H HD11 . ILE D 1 15 ? -8.722 0.244 4.551 1.00 0.00 ? 81 ILE D HD11 4 15
ATOM 4486 H HD12 . ILE D 1 15 ? -9.655 -1.186 4.735 1.00 0.00 ? 81 ILE D HD12 4 15
ATOM 4487 H HD13 . ILE D 1 15 ? -8.336 -1.139 3.569 1.00 0.00 ? 81 ILE D HD13 4 15
ATOM 4488 N N . ILE D 1 16 ? -8.899 1.268 -1.399 1.00 0.00 ? 82 ILE D N 4 16
ATOM 4489 C CA . ILE D 1 16 ? -8.452 2.066 -2.513 1.00 0.00 ? 82 ILE D CA 4 16
ATOM 4490 C C . ILE D 1 16 ? -9.597 2.472 -3.417 1.00 0.00 ? 82 ILE D C 4 16
ATOM 4491 O O . ILE D 1 16 ? -9.782 3.648 -3.676 1.00 0.00 ? 82 ILE D O 4 16
ATOM 4492 C CB . ILE D 1 16 ? -7.312 1.368 -3.243 1.00 0.00 ? 82 ILE D CB 4 16
ATOM 4493 C CG1 . ILE D 1 16 ? -6.067 1.572 -2.399 1.00 0.00 ? 82 ILE D CG1 4 16
ATOM 4494 C CG2 . ILE D 1 16 ? -7.083 1.884 -4.652 1.00 0.00 ? 82 ILE D CG2 4 16
ATOM 4495 C CD1 . ILE D 1 16 ? -4.761 1.058 -2.976 1.00 0.00 ? 82 ILE D CD1 4 16
ATOM 4496 H H . ILE D 1 16 ? -8.479 0.364 -1.259 1.00 0.00 ? 82 ILE D H 4 16
ATOM 4497 H HA . ILE D 1 16 ? -8.063 3.003 -2.135 1.00 0.00 ? 82 ILE D HA 4 16
ATOM 4498 H HB . ILE D 1 16 ? -7.565 0.315 -3.291 1.00 0.00 ? 82 ILE D HB 4 16
ATOM 4499 H HG12 . ILE D 1 16 ? -5.955 2.641 -2.214 1.00 0.00 ? 82 ILE D HG12 4 16
ATOM 4500 H HG13 . ILE D 1 16 ? -6.236 1.109 -1.435 1.00 0.00 ? 82 ILE D HG13 4 16
ATOM 4501 H HG21 . ILE D 1 16 ? -6.831 2.933 -4.669 1.00 0.00 ? 82 ILE D HG21 4 16
ATOM 4502 H HG22 . ILE D 1 16 ? -6.314 1.303 -5.135 1.00 0.00 ? 82 ILE D HG22 4 16
ATOM 4503 H HG23 . ILE D 1 16 ? -7.956 1.769 -5.272 1.00 0.00 ? 82 ILE D HG23 4 16
ATOM 4504 H HD11 . ILE D 1 16 ? -3.980 1.153 -2.253 1.00 0.00 ? 82 ILE D HD11 4 16
ATOM 4505 H HD12 . ILE D 1 16 ? -4.819 0.028 -3.225 1.00 0.00 ? 82 ILE D HD12 4 16
ATOM 4506 H HD13 . ILE D 1 16 ? -4.491 1.650 -3.807 1.00 0.00 ? 82 ILE D HD13 4 16
ATOM 4507 N N . LYS D 1 17 ? -10.390 1.493 -3.842 1.00 0.00 ? 83 LYS D N 4 17
ATOM 4508 C CA . LYS D 1 17 ? -11.592 1.682 -4.615 1.00 0.00 ? 83 LYS D CA 4 17
ATOM 4509 C C . LYS D 1 17 ? -12.583 2.610 -3.941 1.00 0.00 ? 83 LYS D C 4 17
ATOM 4510 O O . LYS D 1 17 ? -13.167 3.447 -4.601 1.00 0.00 ? 83 LYS D O 4 17
ATOM 4511 C CB . LYS D 1 17 ? -12.183 0.323 -4.926 1.00 0.00 ? 83 LYS D CB 4 17
ATOM 4512 C CG . LYS D 1 17 ? -13.301 0.351 -5.938 1.00 0.00 ? 83 LYS D CG 4 17
ATOM 4513 C CD . LYS D 1 17 ? -12.941 0.732 -7.350 1.00 0.00 ? 83 LYS D CD 4 17
ATOM 4514 C CE . LYS D 1 17 ? -12.022 -0.241 -7.934 1.00 0.00 ? 83 LYS D CE 4 17
ATOM 4515 N NZ . LYS D 1 17 ? -11.843 -0.046 -9.314 1.00 0.00 ? 83 LYS D NZ 4 17
ATOM 4516 H H . LYS D 1 17 ? -10.098 0.587 -3.526 1.00 0.00 ? 83 LYS D H 4 17
ATOM 4517 H HA . LYS D 1 17 ? -11.288 2.140 -5.546 1.00 0.00 ? 83 LYS D HA 4 17
ATOM 4518 H HB2 . LYS D 1 17 ? -11.391 -0.334 -5.286 1.00 0.00 ? 83 LYS D HB2 4 17
ATOM 4519 H HB3 . LYS D 1 17 ? -12.577 -0.107 -4.018 1.00 0.00 ? 83 LYS D HB3 4 17
ATOM 4520 H HG2 . LYS D 1 17 ? -13.752 -0.641 -5.964 1.00 0.00 ? 83 LYS D HG2 4 17
ATOM 4521 H HG3 . LYS D 1 17 ? -14.057 1.017 -5.593 1.00 0.00 ? 83 LYS D HG3 4 17
ATOM 4522 H HD2 . LYS D 1 17 ? -13.846 0.787 -7.956 1.00 0.00 ? 83 LYS D HD2 4 17
ATOM 4523 H HD3 . LYS D 1 17 ? -12.519 1.684 -7.358 1.00 0.00 ? 83 LYS D HD3 4 17
ATOM 4524 H HE2 . LYS D 1 17 ? -11.059 -0.181 -7.428 1.00 0.00 ? 83 LYS D HE2 4 17
ATOM 4525 H HE3 . LYS D 1 17 ? -12.393 -1.199 -7.785 1.00 0.00 ? 83 LYS D HE3 4 17
ATOM 4526 H HZ1 . LYS D 1 17 ? -12.648 -0.120 -9.783 1.00 0.00 ? 83 LYS D HZ1 4 17
ATOM 4527 H HZ2 . LYS D 1 17 ? -11.556 0.808 -9.534 1.00 0.00 ? 83 LYS D HZ2 4 17
ATOM 4528 H HZ3 . LYS D 1 17 ? -11.237 -0.652 -9.683 1.00 0.00 ? 83 LYS D HZ3 4 17
ATOM 4529 N N . ALA D 1 18 ? -12.791 2.508 -2.633 1.00 0.00 ? 84 ALA D N 4 18
ATOM 4530 C CA . ALA D 1 18 ? -13.669 3.330 -1.836 1.00 0.00 ? 84 ALA D CA 4 18
ATOM 4531 C C . ALA D 1 18 ? -13.107 4.707 -1.563 1.00 0.00 ? 84 ALA D C 4 18
ATOM 4532 O O . ALA D 1 18 ? -13.840 5.646 -1.393 1.00 0.00 ? 84 ALA D O 4 18
ATOM 4533 C CB . ALA D 1 18 ? -13.985 2.595 -0.554 1.00 0.00 ? 84 ALA D CB 4 18
ATOM 4534 H H . ALA D 1 18 ? -12.249 1.788 -2.201 1.00 0.00 ? 84 ALA D H 4 18
ATOM 4535 H HA . ALA D 1 18 ? -14.596 3.454 -2.373 1.00 0.00 ? 84 ALA D HA 4 18
ATOM 4536 H HB1 . ALA D 1 18 ? -13.101 2.445 -0.003 1.00 0.00 ? 84 ALA D HB1 4 18
ATOM 4537 H HB2 . ALA D 1 18 ? -14.661 3.149 0.036 1.00 0.00 ? 84 ALA D HB2 4 18
ATOM 4538 H HB3 . ALA D 1 18 ? -14.358 1.653 -0.805 1.00 0.00 ? 84 ALA D HB3 4 18
ATOM 4539 N N . GLY D 1 19 ? -11.806 4.866 -1.453 1.00 0.00 ? 85 GLY D N 4 19
ATOM 4540 C CA . GLY D 1 19 ? -11.075 6.035 -1.076 1.00 0.00 ? 85 GLY D CA 4 19
ATOM 4541 C C . GLY D 1 19 ? -11.087 7.073 -2.160 1.00 0.00 ? 85 GLY D C 4 19
ATOM 4542 O O . GLY D 1 19 ? -11.305 8.217 -1.909 1.00 0.00 ? 85 GLY D O 4 19
ATOM 4543 H H . GLY D 1 19 ? -11.276 4.045 -1.596 1.00 0.00 ? 85 GLY D H 4 19
ATOM 4544 H HA2 . GLY D 1 19 ? -11.460 6.449 -0.166 1.00 0.00 ? 85 GLY D HA2 4 19
ATOM 4545 H HA3 . GLY D 1 19 ? -10.053 5.740 -0.909 1.00 0.00 ? 85 GLY D HA3 4 19
ATOM 4546 N N . GLY D 1 20 ? -10.901 6.670 -3.380 1.00 0.00 ? 86 GLY D N 4 20
ATOM 4547 C CA . GLY D 1 20 ? -10.860 7.522 -4.517 1.00 0.00 ? 86 GLY D CA 4 20
ATOM 4548 C C . GLY D 1 20 ? -9.496 7.867 -5.043 1.00 0.00 ? 86 GLY D C 4 20
ATOM 4549 O O . GLY D 1 20 ? -9.358 8.773 -5.819 1.00 0.00 ? 86 GLY D O 4 20
ATOM 4550 H H . GLY D 1 20 ? -10.757 5.713 -3.507 1.00 0.00 ? 86 GLY D H 4 20
ATOM 4551 H HA2 . GLY D 1 20 ? -11.360 7.044 -5.294 1.00 0.00 ? 86 GLY D HA2 4 20
ATOM 4552 H HA3 . GLY D 1 20 ? -11.350 8.427 -4.310 1.00 0.00 ? 86 GLY D HA3 4 20
ATOM 4553 N N . TYR D 1 21 ? -8.503 7.133 -4.608 1.00 0.00 ? 87 TYR D N 4 21
ATOM 4554 C CA . TYR D 1 21 ? -7.141 7.239 -5.045 1.00 0.00 ? 87 TYR D CA 4 21
ATOM 4555 C C . TYR D 1 21 ? -7.035 7.225 -6.539 1.00 0.00 ? 87 TYR D C 4 21
ATOM 4556 O O . TYR D 1 21 ? -7.429 6.362 -7.168 1.00 0.00 ? 87 TYR D O 4 21
ATOM 4557 C CB . TYR D 1 21 ? -6.337 6.087 -4.466 1.00 0.00 ? 87 TYR D CB 4 21
ATOM 4558 C CG . TYR D 1 21 ? -5.893 6.159 -3.030 1.00 0.00 ? 87 TYR D CG 4 21
ATOM 4559 C CD1 . TYR D 1 21 ? -4.900 7.002 -2.570 1.00 0.00 ? 87 TYR D CD1 4 21
ATOM 4560 C CD2 . TYR D 1 21 ? -6.426 5.218 -2.162 1.00 0.00 ? 87 TYR D CD2 4 21
ATOM 4561 C CE1 . TYR D 1 21 ? -4.380 6.822 -1.288 1.00 0.00 ? 87 TYR D CE1 4 21
ATOM 4562 C CE2 . TYR D 1 21 ? -5.876 4.986 -0.899 1.00 0.00 ? 87 TYR D CE2 4 21
ATOM 4563 C CZ . TYR D 1 21 ? -4.823 5.786 -0.464 1.00 0.00 ? 87 TYR D CZ 4 21
ATOM 4564 O OH . TYR D 1 21 ? -4.285 5.570 0.762 1.00 0.00 ? 87 TYR D OH 4 21
ATOM 4565 H H . TYR D 1 21 ? -8.682 6.393 -3.981 1.00 0.00 ? 87 TYR D H 4 21
ATOM 4566 H HA . TYR D 1 21 ? -6.742 8.175 -4.713 1.00 0.00 ? 87 TYR D HA 4 21
ATOM 4567 H HB2 . TYR D 1 21 ? -6.953 5.193 -4.570 1.00 0.00 ? 87 TYR D HB2 4 21
ATOM 4568 H HB3 . TYR D 1 21 ? -5.445 5.890 -5.041 1.00 0.00 ? 87 TYR D HB3 4 21
ATOM 4569 H HD1 . TYR D 1 21 ? -4.508 7.765 -3.193 1.00 0.00 ? 87 TYR D HD1 4 21
ATOM 4570 H HD2 . TYR D 1 21 ? -7.182 4.592 -2.572 1.00 0.00 ? 87 TYR D HD2 4 21
ATOM 4571 H HE1 . TYR D 1 21 ? -3.598 7.460 -0.941 1.00 0.00 ? 87 TYR D HE1 4 21
ATOM 4572 H HE2 . TYR D 1 21 ? -6.250 4.198 -0.279 1.00 0.00 ? 87 TYR D HE2 4 21
ATOM 4573 H HH . TYR D 1 21 ? -4.917 5.838 1.408 1.00 0.00 ? 87 TYR D HH 4 21
HETATM 4574 N N . NH2 D 1 22 ? -6.540 8.187 -7.149 1.00 0.00 ? 88 NH2 D N 4 22
HETATM 4575 H HN1 . NH2 D 1 22 ? -6.497 8.164 -8.128 1.00 0.00 ? 88 NH2 D HN1 4 22
HETATM 4576 H HN2 . NH2 D 1 22 ? -6.256 8.884 -6.593 1.00 0.00 ? 88 NH2 D HN2 4 22
HETATM 4577 C C . ACE A 1 1 ? -0.515 12.548 1.097 1.00 0.00 ? 1 ACE A C 5 1
HETATM 4578 O O . ACE A 1 1 ? -0.538 11.662 0.341 1.00 0.00 ? 1 ACE A O 5 1
HETATM 4579 C CH3 . ACE A 1 1 ? -0.051 12.282 2.478 1.00 0.00 ? 1 ACE A CH3 5 1
HETATM 4580 H H1 . ACE A 1 1 ? 0.025 12.370 2.768 1.00 0.00 ? 1 ACE A H1 5 1
HETATM 4581 H H2 . ACE A 1 1 ? -0.054 12.136 2.813 1.00 0.00 ? 1 ACE A H2 5 1
HETATM 4582 H H3 . ACE A 1 1 ? 0.175 12.121 2.796 1.00 0.00 ? 1 ACE A H3 5 1
ATOM 4583 N N . ALA A 1 2 ? -0.870 13.769 0.789 1.00 0.00 ? 2 ALA A N 5 2
ATOM 4584 C CA . ALA A 1 2 ? -1.360 14.231 -0.432 1.00 0.00 ? 2 ALA A CA 5 2
ATOM 4585 C C . ALA A 1 2 ? -0.505 13.911 -1.628 1.00 0.00 ? 2 ALA A C 5 2
ATOM 4586 O O . ALA A 1 2 ? -0.962 13.413 -2.618 1.00 0.00 ? 2 ALA A O 5 2
ATOM 4587 C CB . ALA A 1 2 ? -1.580 15.668 -0.265 1.00 0.00 ? 2 ALA A CB 5 2
ATOM 4588 H H . ALA A 1 2 ? -0.792 14.406 1.454 1.00 0.00 ? 2 ALA A H 5 2
ATOM 4589 H HA . ALA A 1 2 ? -2.266 13.765 -0.619 1.00 0.00 ? 2 ALA A HA 5 2
ATOM 4590 H HB1 . ALA A 1 2 ? -0.703 16.117 -0.028 1.00 0.00 ? 2 ALA A HB1 5 2
ATOM 4591 H HB2 . ALA A 1 2 ? -1.963 16.097 -1.105 1.00 0.00 ? 2 ALA A HB2 5 2
ATOM 4592 H HB3 . ALA A 1 2 ? -2.223 15.862 0.525 1.00 0.00 ? 2 ALA A HB3 5 2
ATOM 4593 N N . LYS A 1 3 ? 0.749 14.272 -1.584 1.00 0.00 ? 3 LYS A N 5 3
ATOM 4594 C CA . LYS A 1 3 ? 1.692 14.077 -2.654 1.00 0.00 ? 3 LYS A CA 5 3
ATOM 4595 C C . LYS A 1 3 ? 2.265 12.677 -2.728 1.00 0.00 ? 3 LYS A C 5 3
ATOM 4596 O O . LYS A 1 3 ? 2.543 12.206 -3.812 1.00 0.00 ? 3 LYS A O 5 3
ATOM 4597 C CB . LYS A 1 3 ? 2.878 14.997 -2.472 1.00 0.00 ? 3 LYS A CB 5 3
ATOM 4598 C CG . LYS A 1 3 ? 2.537 16.441 -2.517 1.00 0.00 ? 3 LYS A CG 5 3
ATOM 4599 C CD . LYS A 1 3 ? 3.750 17.329 -2.469 1.00 0.00 ? 3 LYS A CD 5 3
ATOM 4600 C CE . LYS A 1 3 ? 3.318 18.743 -2.371 1.00 0.00 ? 3 LYS A CE 5 3
ATOM 4601 N NZ . LYS A 1 3 ? 4.406 19.674 -2.431 1.00 0.00 ? 3 LYS A NZ 5 3
ATOM 4602 H H . LYS A 1 3 ? 1.053 14.671 -0.743 1.00 0.00 ? 3 LYS A H 5 3
ATOM 4603 H HA . LYS A 1 3 ? 1.234 14.301 -3.603 1.00 0.00 ? 3 LYS A HA 5 3
ATOM 4604 H HB2 . LYS A 1 3 ? 3.370 14.771 -1.525 1.00 0.00 ? 3 LYS A HB2 5 3
ATOM 4605 H HB3 . LYS A 1 3 ? 3.563 14.803 -3.256 1.00 0.00 ? 3 LYS A HB3 5 3
ATOM 4606 H HG2 . LYS A 1 3 ? 1.966 16.655 -3.421 1.00 0.00 ? 3 LYS A HG2 5 3
ATOM 4607 H HG3 . LYS A 1 3 ? 1.923 16.649 -1.690 1.00 0.00 ? 3 LYS A HG3 5 3
ATOM 4608 H HD2 . LYS A 1 3 ? 4.365 17.074 -1.605 1.00 0.00 ? 3 LYS A HD2 5 3
ATOM 4609 H HD3 . LYS A 1 3 ? 4.350 17.136 -3.325 1.00 0.00 ? 3 LYS A HD3 5 3
ATOM 4610 H HE2 . LYS A 1 3 ? 2.627 18.959 -3.185 1.00 0.00 ? 3 LYS A HE2 5 3
ATOM 4611 H HE3 . LYS A 1 3 ? 2.785 18.874 -1.494 1.00 0.00 ? 3 LYS A HE3 5 3
ATOM 4612 H HZ1 . LYS A 1 3 ? 4.143 20.588 -2.305 1.00 0.00 ? 3 LYS A HZ1 5 3
ATOM 4613 H HZ2 . LYS A 1 3 ? 5.025 19.488 -1.770 1.00 0.00 ? 3 LYS A HZ2 5 3
ATOM 4614 H HZ3 . LYS A 1 3 ? 4.850 19.660 -3.254 1.00 0.00 ? 3 LYS A HZ3 5 3
ATOM 4615 N N . ALA A 1 4 ? 2.460 12.050 -1.576 1.00 0.00 ? 4 ALA A N 5 4
ATOM 4616 C CA . ALA A 1 4 ? 2.871 10.686 -1.368 1.00 0.00 ? 4 ALA A CA 5 4
ATOM 4617 C C . ALA A 1 4 ? 1.997 9.671 -2.078 1.00 0.00 ? 4 ALA A C 5 4
ATOM 4618 O O . ALA A 1 4 ? 2.416 8.566 -2.391 1.00 0.00 ? 4 ALA A O 5 4
ATOM 4619 C CB . ALA A 1 4 ? 2.823 10.435 0.127 1.00 0.00 ? 4 ALA A CB 5 4
ATOM 4620 H H . ALA A 1 4 ? 2.232 12.578 -0.784 1.00 0.00 ? 4 ALA A H 5 4
ATOM 4621 H HA . ALA A 1 4 ? 3.874 10.570 -1.745 1.00 0.00 ? 4 ALA A HA 5 4
ATOM 4622 H HB1 . ALA A 1 4 ? 3.444 11.180 0.580 1.00 0.00 ? 4 ALA A HB1 5 4
ATOM 4623 H HB2 . ALA A 1 4 ? 1.849 10.546 0.546 1.00 0.00 ? 4 ALA A HB2 5 4
ATOM 4624 H HB3 . ALA A 1 4 ? 3.221 9.465 0.380 1.00 0.00 ? 4 ALA A HB3 5 4
ATOM 4625 N N . ALA A 1 5 ? 0.757 10.062 -2.313 1.00 0.00 ? 5 ALA A N 5 5
ATOM 4626 C CA . ALA A 1 5 ? -0.342 9.208 -2.701 1.00 0.00 ? 5 ALA A CA 5 5
ATOM 4627 C C . ALA A 1 5 ? -0.130 8.595 -4.072 1.00 0.00 ? 5 ALA A C 5 5
ATOM 4628 O O . ALA A 1 5 ? 0.411 7.504 -4.170 1.00 0.00 ? 5 ALA A O 5 5
ATOM 4629 C CB . ALA A 1 5 ? -1.685 9.865 -2.424 1.00 0.00 ? 5 ALA A CB 5 5
ATOM 4630 H H . ALA A 1 5 ? 0.614 11.032 -2.163 1.00 0.00 ? 5 ALA A H 5 5
ATOM 4631 H HA . ALA A 1 5 ? -0.361 8.339 -2.053 1.00 0.00 ? 5 ALA A HA 5 5
ATOM 4632 H HB1 . ALA A 1 5 ? -2.448 9.163 -2.649 1.00 0.00 ? 5 ALA A HB1 5 5
ATOM 4633 H HB2 . ALA A 1 5 ? -1.759 10.126 -1.394 1.00 0.00 ? 5 ALA A HB2 5 5
ATOM 4634 H HB3 . ALA A 1 5 ? -1.815 10.751 -2.994 1.00 0.00 ? 5 ALA A HB3 5 5
ATOM 4635 N N . ALA A 1 6 ? -0.424 9.285 -5.168 1.00 0.00 ? 6 ALA A N 5 6
ATOM 4636 C CA . ALA A 1 6 ? -0.205 8.744 -6.488 1.00 0.00 ? 6 ALA A CA 5 6
ATOM 4637 C C . ALA A 1 6 ? 1.208 8.405 -6.831 1.00 0.00 ? 6 ALA A C 5 6
ATOM 4638 O O . ALA A 1 6 ? 1.421 7.700 -7.692 1.00 0.00 ? 6 ALA A O 5 6
ATOM 4639 C CB . ALA A 1 6 ? -0.828 9.659 -7.476 1.00 0.00 ? 6 ALA A CB 5 6
ATOM 4640 H H . ALA A 1 6 ? -0.850 10.181 -5.076 1.00 0.00 ? 6 ALA A H 5 6
ATOM 4641 H HA . ALA A 1 6 ? -0.751 7.824 -6.489 1.00 0.00 ? 6 ALA A HA 5 6
ATOM 4642 H HB1 . ALA A 1 6 ? -0.734 9.286 -8.444 1.00 0.00 ? 6 ALA A HB1 5 6
ATOM 4643 H HB2 . ALA A 1 6 ? -1.820 9.769 -7.306 1.00 0.00 ? 6 ALA A HB2 5 6
ATOM 4644 H HB3 . ALA A 1 6 ? -0.363 10.594 -7.405 1.00 0.00 ? 6 ALA A HB3 5 6
ATOM 4645 N N . ALA A 1 7 ? 2.220 8.829 -6.107 1.00 0.00 ? 7 ALA A N 5 7
ATOM 4646 C CA . ALA A 1 7 ? 3.580 8.382 -6.237 1.00 0.00 ? 7 ALA A CA 5 7
ATOM 4647 C C . ALA A 1 7 ? 3.802 6.988 -5.710 1.00 0.00 ? 7 ALA A C 5 7
ATOM 4648 O O . ALA A 1 7 ? 4.679 6.385 -6.150 1.00 0.00 ? 7 ALA A O 5 7
ATOM 4649 C CB . ALA A 1 7 ? 4.523 9.361 -5.586 1.00 0.00 ? 7 ALA A CB 5 7
ATOM 4650 H H . ALA A 1 7 ? 1.958 9.433 -5.421 1.00 0.00 ? 7 ALA A H 5 7
ATOM 4651 H HA . ALA A 1 7 ? 3.780 8.306 -7.298 1.00 0.00 ? 7 ALA A HA 5 7
ATOM 4652 H HB1 . ALA A 1 7 ? 5.536 9.039 -5.700 1.00 0.00 ? 7 ALA A HB1 5 7
ATOM 4653 H HB2 . ALA A 1 7 ? 4.417 10.305 -6.046 1.00 0.00 ? 7 ALA A HB2 5 7
ATOM 4654 H HB3 . ALA A 1 7 ? 4.291 9.459 -4.554 1.00 0.00 ? 7 ALA A HB3 5 7
ATOM 4655 N N . ALA A 1 8 ? 3.002 6.427 -4.861 1.00 0.00 ? 8 ALA A N 5 8
ATOM 4656 C CA . ALA A 1 8 ? 3.054 5.060 -4.441 1.00 0.00 ? 8 ALA A CA 5 8
ATOM 4657 C C . ALA A 1 8 ? 1.862 4.275 -4.924 1.00 0.00 ? 8 ALA A C 5 8
ATOM 4658 O O . ALA A 1 8 ? 2.012 3.257 -5.581 1.00 0.00 ? 8 ALA A O 5 8
ATOM 4659 C CB . ALA A 1 8 ? 3.178 4.993 -2.941 1.00 0.00 ? 8 ALA A CB 5 8
ATOM 4660 H H . ALA A 1 8 ? 2.290 7.009 -4.510 1.00 0.00 ? 8 ALA A H 5 8
ATOM 4661 H HA . ALA A 1 8 ? 3.916 4.575 -4.873 1.00 0.00 ? 8 ALA A HA 5 8
ATOM 4662 H HB1 . ALA A 1 8 ? 3.500 5.454 -2.513 1.00 0.00 ? 8 ALA A HB1 5 8
ATOM 4663 H HB2 . ALA A 1 8 ? 2.617 4.955 -2.592 1.00 0.00 ? 8 ALA A HB2 5 8
ATOM 4664 H HB3 . ALA A 1 8 ? 3.526 4.498 -2.584 1.00 0.00 ? 8 ALA A HB3 5 8
ATOM 4665 N N . ILE A 1 9 ? 0.660 4.785 -4.708 1.00 0.00 ? 9 ILE A N 5 9
ATOM 4666 C CA . ILE A 1 9 ? -0.589 4.120 -4.999 1.00 0.00 ? 9 ILE A CA 5 9
ATOM 4667 C C . ILE A 1 9 ? -0.799 3.902 -6.485 1.00 0.00 ? 9 ILE A C 5 9
ATOM 4668 O O . ILE A 1 9 ? -1.355 2.885 -6.866 1.00 0.00 ? 9 ILE A O 5 9
ATOM 4669 C CB . ILE A 1 9 ? -1.780 4.855 -4.410 1.00 0.00 ? 9 ILE A CB 5 9
ATOM 4670 C CG1 . ILE A 1 9 ? -1.614 5.271 -2.961 1.00 0.00 ? 9 ILE A CG1 5 9
ATOM 4671 C CG2 . ILE A 1 9 ? -3.056 4.037 -4.538 1.00 0.00 ? 9 ILE A CG2 5 9
ATOM 4672 C CD1 . ILE A 1 9 ? -1.206 4.158 -2.037 1.00 0.00 ? 9 ILE A CD1 5 9
ATOM 4673 H H . ILE A 1 9 ? 0.612 5.660 -4.222 1.00 0.00 ? 9 ILE A H 5 9
ATOM 4674 H HA . ILE A 1 9 ? -0.527 3.150 -4.531 1.00 0.00 ? 9 ILE A HA 5 9
ATOM 4675 H HB . ILE A 1 9 ? -1.922 5.720 -5.043 1.00 0.00 ? 9 ILE A HB 5 9
ATOM 4676 H HG12 . ILE A 1 9 ? -0.858 6.055 -2.911 1.00 0.00 ? 9 ILE A HG12 5 9
ATOM 4677 H HG13 . ILE A 1 9 ? -2.532 5.715 -2.612 1.00 0.00 ? 9 ILE A HG13 5 9
ATOM 4678 H HG21 . ILE A 1 9 ? -3.365 4.040 -5.535 1.00 0.00 ? 9 ILE A HG21 5 9
ATOM 4679 H HG22 . ILE A 1 9 ? -2.917 3.073 -4.223 1.00 0.00 ? 9 ILE A HG22 5 9
ATOM 4680 H HG23 . ILE A 1 9 ? -3.814 4.462 -3.950 1.00 0.00 ? 9 ILE A HG23 5 9
ATOM 4681 H HD11 . ILE A 1 9 ? -0.320 3.712 -2.373 1.00 0.00 ? 9 ILE A HD11 5 9
ATOM 4682 H HD12 . ILE A 1 9 ? -1.042 4.583 -1.092 1.00 0.00 ? 9 ILE A HD12 5 9
ATOM 4683 H HD13 . ILE A 1 9 ? -1.983 3.487 -1.982 1.00 0.00 ? 9 ILE A HD13 5 9
ATOM 4684 N N . LYS A 1 10 ? -0.342 4.813 -7.337 1.00 0.00 ? 10 LYS A N 5 10
ATOM 4685 C CA . LYS A 1 10 ? -0.563 4.716 -8.761 1.00 0.00 ? 10 LYS A CA 5 10
ATOM 4686 C C . LYS A 1 10 ? 0.276 3.603 -9.359 1.00 0.00 ? 10 LYS A C 5 10
ATOM 4687 O O . LYS A 1 10 ? -0.220 2.855 -10.185 1.00 0.00 ? 10 LYS A O 5 10
ATOM 4688 C CB . LYS A 1 10 ? -0.254 6.080 -9.354 1.00 0.00 ? 10 LYS A CB 5 10
ATOM 4689 C CG . LYS A 1 10 ? -1.094 6.520 -10.528 1.00 0.00 ? 10 LYS A CG 5 10
ATOM 4690 C CD . LYS A 1 10 ? -0.628 6.130 -11.806 1.00 0.00 ? 10 LYS A CD 5 10
ATOM 4691 C CE . LYS A 1 10 ? -1.491 6.586 -12.917 1.00 0.00 ? 10 LYS A CE 5 10
ATOM 4692 N NZ . LYS A 1 10 ? -1.079 6.293 -14.176 1.00 0.00 ? 10 LYS A NZ 5 10
ATOM 4693 H H . LYS A 1 10 ? 0.239 5.532 -6.967 1.00 0.00 ? 10 LYS A H 5 10
ATOM 4694 H HA . LYS A 1 10 ? -1.601 4.442 -8.924 1.00 0.00 ? 10 LYS A HA 5 10
ATOM 4695 H HB2 . LYS A 1 10 ? -0.402 6.814 -8.561 1.00 0.00 ? 10 LYS A HB2 5 10
ATOM 4696 H HB3 . LYS A 1 10 ? 0.778 6.164 -9.596 1.00 0.00 ? 10 LYS A HB3 5 10
ATOM 4697 H HG2 . LYS A 1 10 ? -2.108 6.144 -10.395 1.00 0.00 ? 10 LYS A HG2 5 10
ATOM 4698 H HG3 . LYS A 1 10 ? -1.128 7.526 -10.519 1.00 0.00 ? 10 LYS A HG3 5 10
ATOM 4699 H HD2 . LYS A 1 10 ? 0.382 6.513 -11.952 1.00 0.00 ? 10 LYS A HD2 5 10
ATOM 4700 H HD3 . LYS A 1 10 ? -0.589 5.175 -11.840 1.00 0.00 ? 10 LYS A HD3 5 10
ATOM 4701 H HE2 . LYS A 1 10 ? -2.483 6.157 -12.776 1.00 0.00 ? 10 LYS A HE2 5 10
ATOM 4702 H HE3 . LYS A 1 10 ? -1.588 7.542 -12.872 1.00 0.00 ? 10 LYS A HE3 5 10
ATOM 4703 H HZ1 . LYS A 1 10 ? -1.694 6.544 -14.882 1.00 0.00 ? 10 LYS A HZ1 5 10
ATOM 4704 H HZ2 . LYS A 1 10 ? -0.319 6.674 -14.346 1.00 0.00 ? 10 LYS A HZ2 5 10
ATOM 4705 H HZ3 . LYS A 1 10 ? -0.931 5.415 -14.261 1.00 0.00 ? 10 LYS A HZ3 5 10
ATOM 4706 N N . ALA A 1 11 ? 1.483 3.380 -8.849 1.00 0.00 ? 11 ALA A N 5 11
ATOM 4707 C CA . ALA A 1 11 ? 2.254 2.170 -9.013 1.00 0.00 ? 11 ALA A CA 5 11
ATOM 4708 C C . ALA A 1 11 ? 1.545 0.974 -8.412 1.00 0.00 ? 11 ALA A C 5 11
ATOM 4709 O O . ALA A 1 11 ? 1.325 -0.009 -9.102 1.00 0.00 ? 11 ALA A O 5 11
ATOM 4710 C CB . ALA A 1 11 ? 3.667 2.369 -8.490 1.00 0.00 ? 11 ALA A CB 5 11
ATOM 4711 H H . ALA A 1 11 ? 1.821 4.080 -8.222 1.00 0.00 ? 11 ALA A H 5 11
ATOM 4712 H HA . ALA A 1 11 ? 2.342 1.984 -10.076 1.00 0.00 ? 11 ALA A HA 5 11
ATOM 4713 H HB1 . ALA A 1 11 ? 4.107 3.093 -8.984 1.00 0.00 ? 11 ALA A HB1 5 11
ATOM 4714 H HB2 . ALA A 1 11 ? 3.710 2.609 -7.543 1.00 0.00 ? 11 ALA A HB2 5 11
ATOM 4715 H HB3 . ALA A 1 11 ? 4.271 1.579 -8.596 1.00 0.00 ? 11 ALA A HB3 5 11
ATOM 4716 N N . ILE A 1 12 ? 1.168 1.009 -7.137 1.00 0.00 ? 12 ILE A N 5 12
ATOM 4717 C CA . ILE A 1 12 ? 0.759 -0.168 -6.402 1.00 0.00 ? 12 ILE A CA 5 12
ATOM 4718 C C . ILE A 1 12 ? -0.547 -0.715 -6.948 1.00 0.00 ? 12 ILE A C 5 12
ATOM 4719 O O . ILE A 1 12 ? -0.627 -1.911 -7.187 1.00 0.00 ? 12 ILE A O 5 12
ATOM 4720 C CB . ILE A 1 12 ? 0.785 0.039 -4.900 1.00 0.00 ? 12 ILE A CB 5 12
ATOM 4721 C CG1 . ILE A 1 12 ? 1.384 -1.197 -4.263 1.00 0.00 ? 12 ILE A CG1 5 12
ATOM 4722 C CG2 . ILE A 1 12 ? -0.571 0.338 -4.285 1.00 0.00 ? 12 ILE A CG2 5 12
ATOM 4723 C CD1 . ILE A 1 12 ? 1.443 -1.204 -2.752 1.00 0.00 ? 12 ILE A CD1 5 12
ATOM 4724 H H . ILE A 1 12 ? 1.179 1.881 -6.636 1.00 0.00 ? 12 ILE A H 5 12
ATOM 4725 H HA . ILE A 1 12 ? 1.464 -0.955 -6.647 1.00 0.00 ? 12 ILE A HA 5 12
ATOM 4726 H HB . ILE A 1 12 ? 1.452 0.861 -4.671 1.00 0.00 ? 12 ILE A HB 5 12
ATOM 4727 H HG12 . ILE A 1 12 ? 0.821 -2.071 -4.592 1.00 0.00 ? 12 ILE A HG12 5 12
ATOM 4728 H HG13 . ILE A 1 12 ? 2.390 -1.282 -4.652 1.00 0.00 ? 12 ILE A HG13 5 12
ATOM 4729 H HG21 . ILE A 1 12 ? -1.170 -0.554 -4.275 1.00 0.00 ? 12 ILE A HG21 5 12
ATOM 4730 H HG22 . ILE A 1 12 ? -0.482 0.693 -3.281 1.00 0.00 ? 12 ILE A HG22 5 12
ATOM 4731 H HG23 . ILE A 1 12 ? -1.108 1.071 -4.872 1.00 0.00 ? 12 ILE A HG23 5 12
ATOM 4732 H HD11 . ILE A 1 12 ? 2.184 -1.914 -2.433 1.00 0.00 ? 12 ILE A HD11 5 12
ATOM 4733 H HD12 . ILE A 1 12 ? 1.722 -0.243 -2.365 1.00 0.00 ? 12 ILE A HD12 5 12
ATOM 4734 H HD13 . ILE A 1 12 ? 0.495 -1.489 -2.341 1.00 0.00 ? 12 ILE A HD13 5 12
ATOM 4735 N N . ALA A 1 13 ? -1.504 0.143 -7.296 1.00 0.00 ? 13 ALA A N 5 13
ATOM 4736 C CA . ALA A 1 13 ? -2.747 -0.334 -7.857 1.00 0.00 ? 13 ALA A CA 5 13
ATOM 4737 C C . ALA A 1 13 ? -2.624 -0.975 -9.229 1.00 0.00 ? 13 ALA A C 5 13
ATOM 4738 O O . ALA A 1 13 ? -3.486 -1.740 -9.613 1.00 0.00 ? 13 ALA A O 5 13
ATOM 4739 C CB . ALA A 1 13 ? -3.751 0.800 -7.860 1.00 0.00 ? 13 ALA A CB 5 13
ATOM 4740 H H . ALA A 1 13 ? -1.327 1.120 -7.170 1.00 0.00 ? 13 ALA A H 5 13
ATOM 4741 H HA . ALA A 1 13 ? -3.100 -1.124 -7.211 1.00 0.00 ? 13 ALA A HA 5 13
ATOM 4742 H HB1 . ALA A 1 13 ? -4.691 0.388 -8.108 1.00 0.00 ? 13 ALA A HB1 5 13
ATOM 4743 H HB2 . ALA A 1 13 ? -3.811 1.220 -6.881 1.00 0.00 ? 13 ALA A HB2 5 13
ATOM 4744 H HB3 . ALA A 1 13 ? -3.472 1.593 -8.512 1.00 0.00 ? 13 ALA A HB3 5 13
ATOM 4745 N N . ALA A 1 14 ? -1.535 -0.754 -9.944 1.00 0.00 ? 14 ALA A N 5 14
ATOM 4746 C CA . ALA A 1 14 ? -1.191 -1.470 -11.144 1.00 0.00 ? 14 ALA A CA 5 14
ATOM 4747 C C . ALA A 1 14 ? -0.385 -2.719 -10.869 1.00 0.00 ? 14 ALA A C 5 14
ATOM 4748 O O . ALA A 1 14 ? -0.640 -3.739 -11.454 1.00 0.00 ? 14 ALA A O 5 14
ATOM 4749 C CB . ALA A 1 14 ? -0.453 -0.517 -12.064 1.00 0.00 ? 14 ALA A CB 5 14
ATOM 4750 H H . ALA A 1 14 ? -0.838 -0.231 -9.468 1.00 0.00 ? 14 ALA A H 5 14
ATOM 4751 H HA . ALA A 1 14 ? -2.090 -1.783 -11.659 1.00 0.00 ? 14 ALA A HA 5 14
ATOM 4752 H HB1 . ALA A 1 14 ? -1.026 0.345 -12.272 1.00 0.00 ? 14 ALA A HB1 5 14
ATOM 4753 H HB2 . ALA A 1 14 ? 0.473 -0.220 -11.646 1.00 0.00 ? 14 ALA A HB2 5 14
ATOM 4754 H HB3 . ALA A 1 14 ? -0.291 -1.008 -12.992 1.00 0.00 ? 14 ALA A HB3 5 14
ATOM 4755 N N . ILE A 1 15 ? 0.559 -2.648 -9.941 1.00 0.00 ? 15 ILE A N 5 15
ATOM 4756 C CA . ILE A 1 15 ? 1.388 -3.722 -9.455 1.00 0.00 ? 15 ILE A CA 5 15
ATOM 4757 C C . ILE A 1 15 ? 0.598 -4.762 -8.688 1.00 0.00 ? 15 ILE A C 5 15
ATOM 4758 O O . ILE A 1 15 ? 0.934 -5.932 -8.706 1.00 0.00 ? 15 ILE A O 5 15
ATOM 4759 C CB . ILE A 1 15 ? 2.566 -3.180 -8.669 1.00 0.00 ? 15 ILE A CB 5 15
ATOM 4760 C CG1 . ILE A 1 15 ? 3.506 -2.345 -9.506 1.00 0.00 ? 15 ILE A CG1 5 15
ATOM 4761 C CG2 . ILE A 1 15 ? 3.356 -4.301 -8.030 1.00 0.00 ? 15 ILE A CG2 5 15
ATOM 4762 C CD1 . ILE A 1 15 ? 4.402 -1.393 -8.749 1.00 0.00 ? 15 ILE A CD1 5 15
ATOM 4763 H H . ILE A 1 15 ? 0.591 -1.777 -9.458 1.00 0.00 ? 15 ILE A H 5 15
ATOM 4764 H HA . ILE A 1 15 ? 1.818 -4.238 -10.305 1.00 0.00 ? 15 ILE A HA 5 15
ATOM 4765 H HB . ILE A 1 15 ? 2.154 -2.575 -7.872 1.00 0.00 ? 15 ILE A HB 5 15
ATOM 4766 H HG12 . ILE A 1 15 ? 4.121 -3.011 -10.111 1.00 0.00 ? 15 ILE A HG12 5 15
ATOM 4767 H HG13 . ILE A 1 15 ? 2.926 -1.719 -10.162 1.00 0.00 ? 15 ILE A HG13 5 15
ATOM 4768 H HG21 . ILE A 1 15 ? 2.832 -4.673 -7.170 1.00 0.00 ? 15 ILE A HG21 5 15
ATOM 4769 H HG22 . ILE A 1 15 ? 3.586 -5.057 -8.754 1.00 0.00 ? 15 ILE A HG22 5 15
ATOM 4770 H HG23 . ILE A 1 15 ? 4.282 -3.927 -7.652 1.00 0.00 ? 15 ILE A HG23 5 15
ATOM 4771 H HD11 . ILE A 1 15 ? 4.456 -0.617 -8.972 1.00 0.00 ? 15 ILE A HD11 5 15
ATOM 4772 H HD12 . ILE A 1 15 ? 5.109 -1.595 -8.752 1.00 0.00 ? 15 ILE A HD12 5 15
ATOM 4773 H HD13 . ILE A 1 15 ? 4.272 -1.255 -7.972 1.00 0.00 ? 15 ILE A HD13 5 15
ATOM 4774 N N . ILE A 1 16 ? -0.489 -4.412 -8.007 1.00 0.00 ? 16 ILE A N 5 16
ATOM 4775 C CA . ILE A 1 16 ? -1.395 -5.340 -7.373 1.00 0.00 ? 16 ILE A CA 5 16
ATOM 4776 C C . ILE A 1 16 ? -1.954 -6.343 -8.367 1.00 0.00 ? 16 ILE A C 5 16
ATOM 4777 O O . ILE A 1 16 ? -1.928 -7.540 -8.124 1.00 0.00 ? 16 ILE A O 5 16
ATOM 4778 C CB . ILE A 1 16 ? -2.474 -4.585 -6.610 1.00 0.00 ? 16 ILE A CB 5 16
ATOM 4779 C CG1 . ILE A 1 16 ? -1.870 -4.051 -5.326 1.00 0.00 ? 16 ILE A CG1 5 16
ATOM 4780 C CG2 . ILE A 1 16 ? -3.651 -5.506 -6.326 1.00 0.00 ? 16 ILE A CG2 5 16
ATOM 4781 C CD1 . ILE A 1 16 ? -2.764 -3.178 -4.478 1.00 0.00 ? 16 ILE A CD1 5 16
ATOM 4782 H H . ILE A 1 16 ? -0.700 -3.435 -7.958 1.00 0.00 ? 16 ILE A H 5 16
ATOM 4783 H HA . ILE A 1 16 ? -0.830 -5.939 -6.665 1.00 0.00 ? 16 ILE A HA 5 16
ATOM 4784 H HB . ILE A 1 16 ? -2.815 -3.765 -7.233 1.00 0.00 ? 16 ILE A HB 5 16
ATOM 4785 H HG12 . ILE A 1 16 ? -1.531 -4.894 -4.724 1.00 0.00 ? 16 ILE A HG12 5 16
ATOM 4786 H HG13 . ILE A 1 16 ? -1.017 -3.464 -5.587 1.00 0.00 ? 16 ILE A HG13 5 16
ATOM 4787 H HG21 . ILE A 1 16 ? -4.201 -5.717 -7.223 1.00 0.00 ? 16 ILE A HG21 5 16
ATOM 4788 H HG22 . ILE A 1 16 ? -3.326 -6.427 -5.870 1.00 0.00 ? 16 ILE A HG22 5 16
ATOM 4789 H HG23 . ILE A 1 16 ? -4.378 -5.067 -5.679 1.00 0.00 ? 16 ILE A HG23 5 16
ATOM 4790 H HD11 . ILE A 1 16 ? -3.523 -3.783 -4.036 1.00 0.00 ? 16 ILE A HD11 5 16
ATOM 4791 H HD12 . ILE A 1 16 ? -2.162 -2.740 -3.709 1.00 0.00 ? 16 ILE A HD12 5 16
ATOM 4792 H HD13 . ILE A 1 16 ? -3.202 -2.408 -5.060 1.00 0.00 ? 16 ILE A HD13 5 16
ATOM 4793 N N . LYS A 1 17 ? -2.399 -5.852 -9.515 1.00 0.00 ? 17 LYS A N 5 17
ATOM 4794 C CA . LYS A 1 17 ? -2.900 -6.622 -10.624 1.00 0.00 ? 17 LYS A CA 5 17
ATOM 4795 C C . LYS A 1 17 ? -1.807 -7.337 -11.389 1.00 0.00 ? 17 LYS A C 5 17
ATOM 4796 O O . LYS A 1 17 ? -1.959 -8.488 -11.736 1.00 0.00 ? 17 LYS A O 5 17
ATOM 4797 C CB . LYS A 1 17 ? -3.685 -5.712 -11.535 1.00 0.00 ? 17 LYS A CB 5 17
ATOM 4798 C CG . LYS A 1 17 ? -4.685 -6.438 -12.370 1.00 0.00 ? 17 LYS A CG 5 17
ATOM 4799 C CD . LYS A 1 17 ? -5.508 -5.539 -13.248 1.00 0.00 ? 17 LYS A CD 5 17
ATOM 4800 C CE . LYS A 1 17 ? -4.791 -5.068 -14.416 1.00 0.00 ? 17 LYS A CE 5 17
ATOM 4801 N NZ . LYS A 1 17 ? -5.552 -4.260 -15.284 1.00 0.00 ? 17 LYS A NZ 5 17
ATOM 4802 H H . LYS A 1 17 ? -2.376 -4.851 -9.565 1.00 0.00 ? 17 LYS A H 5 17
ATOM 4803 H HA . LYS A 1 17 ? -3.553 -7.394 -10.252 1.00 0.00 ? 17 LYS A HA 5 17
ATOM 4804 H HB2 . LYS A 1 17 ? -4.207 -4.975 -10.924 1.00 0.00 ? 17 LYS A HB2 5 17
ATOM 4805 H HB3 . LYS A 1 17 ? -3.055 -5.163 -12.163 1.00 0.00 ? 17 LYS A HB3 5 17
ATOM 4806 H HG2 . LYS A 1 17 ? -4.172 -7.171 -12.993 1.00 0.00 ? 17 LYS A HG2 5 17
ATOM 4807 H HG3 . LYS A 1 17 ? -5.312 -6.964 -11.708 1.00 0.00 ? 17 LYS A HG3 5 17
ATOM 4808 H HD2 . LYS A 1 17 ? -6.404 -6.070 -13.570 1.00 0.00 ? 17 LYS A HD2 5 17
ATOM 4809 H HD3 . LYS A 1 17 ? -5.811 -4.744 -12.683 1.00 0.00 ? 17 LYS A HD3 5 17
ATOM 4810 H HE2 . LYS A 1 17 ? -3.918 -4.505 -14.089 1.00 0.00 ? 17 LYS A HE2 5 17
ATOM 4811 H HE3 . LYS A 1 17 ? -4.459 -5.847 -14.923 1.00 0.00 ? 17 LYS A HE3 5 17
ATOM 4812 H HZ1 . LYS A 1 17 ? -6.164 -4.638 -15.684 1.00 0.00 ? 17 LYS A HZ1 5 17
ATOM 4813 H HZ2 . LYS A 1 17 ? -5.143 -3.896 -15.966 1.00 0.00 ? 17 LYS A HZ2 5 17
ATOM 4814 H HZ3 . LYS A 1 17 ? -5.886 -3.652 -14.864 1.00 0.00 ? 17 LYS A HZ3 5 17
ATOM 4815 N N . ALA A 1 18 ? -0.679 -6.678 -11.625 1.00 0.00 ? 18 ALA A N 5 18
ATOM 4816 C CA . ALA A 1 18 ? 0.395 -7.164 -12.453 1.00 0.00 ? 18 ALA A CA 5 18
ATOM 4817 C C . ALA A 1 18 ? 1.390 -8.041 -11.733 1.00 0.00 ? 18 ALA A C 5 18
ATOM 4818 O O . ALA A 1 18 ? 1.719 -9.104 -12.211 1.00 0.00 ? 18 ALA A O 5 18
ATOM 4819 C CB . ALA A 1 18 ? 1.056 -6.009 -13.143 1.00 0.00 ? 18 ALA A CB 5 18
ATOM 4820 H H . ALA A 1 18 ? -0.629 -5.732 -11.318 1.00 0.00 ? 18 ALA A H 5 18
ATOM 4821 H HA . ALA A 1 18 ? -0.049 -7.747 -13.241 1.00 0.00 ? 18 ALA A HA 5 18
ATOM 4822 H HB1 . ALA A 1 18 ? 1.617 -5.427 -12.453 1.00 0.00 ? 18 ALA A HB1 5 18
ATOM 4823 H HB2 . ALA A 1 18 ? 1.684 -6.396 -13.900 1.00 0.00 ? 18 ALA A HB2 5 18
ATOM 4824 H HB3 . ALA A 1 18 ? 0.335 -5.345 -13.575 1.00 0.00 ? 18 ALA A HB3 5 18
ATOM 4825 N N . GLY A 1 19 ? 1.788 -7.658 -10.538 1.00 0.00 ? 19 GLY A N 5 19
ATOM 4826 C CA . GLY A 1 19 ? 2.511 -8.423 -9.557 1.00 0.00 ? 19 GLY A CA 5 19
ATOM 4827 C C . GLY A 1 19 ? 1.690 -9.608 -9.105 1.00 0.00 ? 19 GLY A C 5 19
ATOM 4828 O O . GLY A 1 19 ? 2.199 -10.693 -8.983 1.00 0.00 ? 19 GLY A O 5 19
ATOM 4829 H H . GLY A 1 19 ? 1.442 -6.768 -10.246 1.00 0.00 ? 19 GLY A H 5 19
ATOM 4830 H HA2 . GLY A 1 19 ? 3.451 -8.799 -9.932 1.00 0.00 ? 19 GLY A HA2 5 19
ATOM 4831 H HA3 . GLY A 1 19 ? 2.711 -7.781 -8.708 1.00 0.00 ? 19 GLY A HA3 5 19
ATOM 4832 N N . GLY A 1 20 ? 0.396 -9.425 -8.919 1.00 0.00 ? 20 GLY A N 5 20
ATOM 4833 C CA . GLY A 1 20 ? -0.605 -10.449 -8.735 1.00 0.00 ? 20 GLY A CA 5 20
ATOM 4834 C C . GLY A 1 20 ? -0.824 -10.863 -7.302 1.00 0.00 ? 20 GLY A C 5 20
ATOM 4835 O O . GLY A 1 20 ? -0.795 -12.014 -7.015 1.00 0.00 ? 20 GLY A O 5 20
ATOM 4836 H H . GLY A 1 20 ? 0.076 -8.483 -8.937 1.00 0.00 ? 20 GLY A H 5 20
ATOM 4837 H HA2 . GLY A 1 20 ? -1.553 -10.133 -9.127 1.00 0.00 ? 20 GLY A HA2 5 20
ATOM 4838 H HA3 . GLY A 1 20 ? -0.351 -11.318 -9.315 1.00 0.00 ? 20 GLY A HA3 5 20
ATOM 4839 N N . TYR A 1 21 ? -1.087 -9.935 -6.407 1.00 0.00 ? 21 TYR A N 5 21
ATOM 4840 C CA . TYR A 1 21 ? -1.591 -10.248 -5.100 1.00 0.00 ? 21 TYR A CA 5 21
ATOM 4841 C C . TYR A 1 21 ? -2.911 -10.974 -5.166 1.00 0.00 ? 21 TYR A C 5 21
ATOM 4842 O O . TYR A 1 21 ? -3.717 -10.702 -6.000 1.00 0.00 ? 21 TYR A O 5 21
ATOM 4843 C CB . TYR A 1 21 ? -1.717 -9.004 -4.239 1.00 0.00 ? 21 TYR A CB 5 21
ATOM 4844 C CG . TYR A 1 21 ? -0.455 -8.312 -3.799 1.00 0.00 ? 21 TYR A CG 5 21
ATOM 4845 C CD1 . TYR A 1 21 ? 0.419 -8.767 -2.835 1.00 0.00 ? 21 TYR A CD1 5 21
ATOM 4846 C CD2 . TYR A 1 21 ? -0.214 -7.078 -4.369 1.00 0.00 ? 21 TYR A CD2 5 21
ATOM 4847 C CE1 . TYR A 1 21 ? 1.538 -8.002 -2.495 1.00 0.00 ? 21 TYR A CE1 5 21
ATOM 4848 C CE2 . TYR A 1 21 ? 0.903 -6.303 -4.050 1.00 0.00 ? 21 TYR A CE2 5 21
ATOM 4849 C CZ . TYR A 1 21 ? 1.800 -6.780 -3.115 1.00 0.00 ? 21 TYR A CZ 5 21
ATOM 4850 O OH . TYR A 1 21 ? 2.940 -6.093 -2.837 1.00 0.00 ? 21 TYR A OH 5 21
ATOM 4851 H H . TYR A 1 21 ? -1.119 -9.005 -6.717 1.00 0.00 ? 21 TYR A H 5 21
ATOM 4852 H HA . TYR A 1 21 ? -0.892 -10.902 -4.603 1.00 0.00 ? 21 TYR A HA 5 21
ATOM 4853 H HB2 . TYR A 1 21 ? -2.325 -8.285 -4.787 1.00 0.00 ? 21 TYR A HB2 5 21
ATOM 4854 H HB3 . TYR A 1 21 ? -2.236 -9.227 -3.328 1.00 0.00 ? 21 TYR A HB3 5 21
ATOM 4855 H HD1 . TYR A 1 21 ? 0.259 -9.701 -2.347 1.00 0.00 ? 21 TYR A HD1 5 21
ATOM 4856 H HD2 . TYR A 1 21 ? -0.939 -6.758 -5.038 1.00 0.00 ? 21 TYR A HD2 5 21
ATOM 4857 H HE1 . TYR A 1 21 ? 2.206 -8.367 -1.754 1.00 0.00 ? 21 TYR A HE1 5 21
ATOM 4858 H HE2 . TYR A 1 21 ? 1.075 -5.376 -4.532 1.00 0.00 ? 21 TYR A HE2 5 21
ATOM 4859 H HH . TYR A 1 21 ? 3.637 -6.432 -3.385 1.00 0.00 ? 21 TYR A HH 5 21
HETATM 4860 N N . NH2 A 1 22 ? -3.206 -11.899 -4.303 1.00 0.00 ? 22 NH2 A N 5 22
HETATM 4861 H HN1 . NH2 A 1 22 ? -4.059 -12.339 -4.423 1.00 0.00 ? 22 NH2 A HN1 5 22
HETATM 4862 H HN2 . NH2 A 1 22 ? -2.577 -12.113 -3.591 1.00 0.00 ? 22 NH2 A HN2 5 22
HETATM 4863 C C . ACE B 1 1 ? 1.202 -13.531 -4.030 1.00 0.00 ? 23 ACE B C 5 1
HETATM 4864 O O . ACE B 1 1 ? 1.667 -12.538 -4.554 1.00 0.00 ? 23 ACE B O 5 1
HETATM 4865 C CH3 . ACE B 1 1 ? 0.259 -14.381 -4.831 1.00 0.00 ? 23 ACE B CH3 5 1
HETATM 4866 H H1 . ACE B 1 1 ? 0.100 -15.017 -4.706 1.00 0.00 ? 23 ACE B H1 5 1
HETATM 4867 H H2 . ACE B 1 1 ? -0.359 -14.200 -4.878 1.00 0.00 ? 23 ACE B H2 5 1
HETATM 4868 H H3 . ACE B 1 1 ? 0.377 -14.520 -5.480 1.00 0.00 ? 23 ACE B H3 5 1
ATOM 4869 N N . ALA B 1 2 ? 1.540 -13.927 -2.809 1.00 0.00 ? 24 ALA B N 5 2
ATOM 4870 C CA . ALA B 1 2 ? 2.358 -13.179 -1.888 1.00 0.00 ? 24 ALA B CA 5 2
ATOM 4871 C C . ALA B 1 2 ? 3.752 -12.827 -2.345 1.00 0.00 ? 24 ALA B C 5 2
ATOM 4872 O O . ALA B 1 2 ? 4.340 -11.944 -1.755 1.00 0.00 ? 24 ALA B O 5 2
ATOM 4873 C CB . ALA B 1 2 ? 2.396 -13.950 -0.586 1.00 0.00 ? 24 ALA B CB 5 2
ATOM 4874 H H . ALA B 1 2 ? 1.131 -14.781 -2.515 1.00 0.00 ? 24 ALA B H 5 2
ATOM 4875 H HA . ALA B 1 2 ? 1.842 -12.259 -1.688 1.00 0.00 ? 24 ALA B HA 5 2
ATOM 4876 H HB1 . ALA B 1 2 ? 2.901 -13.394 0.186 1.00 0.00 ? 24 ALA B HB1 5 2
ATOM 4877 H HB2 . ALA B 1 2 ? 1.390 -14.155 -0.287 1.00 0.00 ? 24 ALA B HB2 5 2
ATOM 4878 H HB3 . ALA B 1 2 ? 2.949 -14.857 -0.728 1.00 0.00 ? 24 ALA B HB3 5 2
ATOM 4879 N N . LYS B 1 3 ? 4.310 -13.408 -3.397 1.00 0.00 ? 25 LYS B N 5 3
ATOM 4880 C CA . LYS B 1 3 ? 5.577 -13.014 -3.956 1.00 0.00 ? 25 LYS B CA 5 3
ATOM 4881 C C . LYS B 1 3 ? 5.556 -11.616 -4.539 1.00 0.00 ? 25 LYS B C 5 3
ATOM 4882 O O . LYS B 1 3 ? 6.598 -11.001 -4.674 1.00 0.00 ? 25 LYS B O 5 3
ATOM 4883 C CB . LYS B 1 3 ? 5.969 -13.952 -5.085 1.00 0.00 ? 25 LYS B CB 5 3
ATOM 4884 C CG . LYS B 1 3 ? 6.379 -15.342 -4.652 1.00 0.00 ? 25 LYS B CG 5 3
ATOM 4885 C CD . LYS B 1 3 ? 6.907 -16.242 -5.738 1.00 0.00 ? 25 LYS B CD 5 3
ATOM 4886 C CE . LYS B 1 3 ? 5.916 -16.600 -6.784 1.00 0.00 ? 25 LYS B CE 5 3
ATOM 4887 N NZ . LYS B 1 3 ? 4.953 -17.535 -6.391 1.00 0.00 ? 25 LYS B NZ 5 3
ATOM 4888 H H . LYS B 1 3 ? 3.775 -14.101 -3.850 1.00 0.00 ? 25 LYS B H 5 3
ATOM 4889 H HA . LYS B 1 3 ? 6.335 -13.031 -3.192 1.00 0.00 ? 25 LYS B HA 5 3
ATOM 4890 H HB2 . LYS B 1 3 ? 5.157 -14.020 -5.809 1.00 0.00 ? 25 LYS B HB2 5 3
ATOM 4891 H HB3 . LYS B 1 3 ? 6.826 -13.486 -5.536 1.00 0.00 ? 25 LYS B HB3 5 3
ATOM 4892 H HG2 . LYS B 1 3 ? 7.147 -15.246 -3.884 1.00 0.00 ? 25 LYS B HG2 5 3
ATOM 4893 H HG3 . LYS B 1 3 ? 5.550 -15.832 -4.193 1.00 0.00 ? 25 LYS B HG3 5 3
ATOM 4894 H HD2 . LYS B 1 3 ? 7.745 -15.737 -6.218 1.00 0.00 ? 25 LYS B HD2 5 3
ATOM 4895 H HD3 . LYS B 1 3 ? 7.309 -17.144 -5.325 1.00 0.00 ? 25 LYS B HD3 5 3
ATOM 4896 H HE2 . LYS B 1 3 ? 5.418 -15.690 -7.119 1.00 0.00 ? 25 LYS B HE2 5 3
ATOM 4897 H HE3 . LYS B 1 3 ? 6.365 -17.021 -7.590 1.00 0.00 ? 25 LYS B HE3 5 3
ATOM 4898 H HZ1 . LYS B 1 3 ? 4.821 -17.671 -6.214 1.00 0.00 ? 25 LYS B HZ1 5 3
ATOM 4899 H HZ2 . LYS B 1 3 ? 4.584 -17.719 -6.336 1.00 0.00 ? 25 LYS B HZ2 5 3
ATOM 4900 H HZ3 . LYS B 1 3 ? 4.686 -17.942 -6.347 1.00 0.00 ? 25 LYS B HZ3 5 3
ATOM 4901 N N . ALA B 1 4 ? 4.391 -11.068 -4.862 1.00 0.00 ? 26 ALA B N 5 4
ATOM 4902 C CA . ALA B 1 4 ? 4.212 -9.676 -5.193 1.00 0.00 ? 26 ALA B CA 5 4
ATOM 4903 C C . ALA B 1 4 ? 4.643 -8.709 -4.105 1.00 0.00 ? 26 ALA B C 5 4
ATOM 4904 O O . ALA B 1 4 ? 4.698 -7.511 -4.330 1.00 0.00 ? 26 ALA B O 5 4
ATOM 4905 C CB . ALA B 1 4 ? 2.742 -9.488 -5.527 1.00 0.00 ? 26 ALA B CB 5 4
ATOM 4906 H H . ALA B 1 4 ? 3.604 -11.658 -4.727 1.00 0.00 ? 26 ALA B H 5 4
ATOM 4907 H HA . ALA B 1 4 ? 4.823 -9.433 -6.052 1.00 0.00 ? 26 ALA B HA 5 4
ATOM 4908 H HB1 . ALA B 1 4 ? 2.401 -10.159 -6.298 1.00 0.00 ? 26 ALA B HB1 5 4
ATOM 4909 H HB2 . ALA B 1 4 ? 2.156 -9.749 -4.669 1.00 0.00 ? 26 ALA B HB2 5 4
ATOM 4910 H HB3 . ALA B 1 4 ? 2.526 -8.477 -5.818 1.00 0.00 ? 26 ALA B HB3 5 4
ATOM 4911 N N . ALA B 1 5 ? 4.945 -9.203 -2.909 1.00 0.00 ? 27 ALA B N 5 5
ATOM 4912 C CA . ALA B 1 5 ? 5.192 -8.420 -1.720 1.00 0.00 ? 27 ALA B CA 5 5
ATOM 4913 C C . ALA B 1 5 ? 6.480 -7.627 -1.793 1.00 0.00 ? 27 ALA B C 5 5
ATOM 4914 O O . ALA B 1 5 ? 6.451 -6.495 -2.247 1.00 0.00 ? 27 ALA B O 5 5
ATOM 4915 C CB . ALA B 1 5 ? 5.010 -9.281 -0.481 1.00 0.00 ? 27 ALA B CB 5 5
ATOM 4916 H H . ALA B 1 5 ? 4.973 -10.205 -2.852 1.00 0.00 ? 27 ALA B H 5 5
ATOM 4917 H HA . ALA B 1 5 ? 4.415 -7.672 -1.637 1.00 0.00 ? 27 ALA B HA 5 5
ATOM 4918 H HB1 . ALA B 1 5 ? 5.115 -8.699 0.418 1.00 0.00 ? 27 ALA B HB1 5 5
ATOM 4919 H HB2 . ALA B 1 5 ? 4.011 -9.688 -0.514 1.00 0.00 ? 27 ALA B HB2 5 5
ATOM 4920 H HB3 . ALA B 1 5 ? 5.738 -10.081 -0.433 1.00 0.00 ? 27 ALA B HB3 5 5
ATOM 4921 N N . ALA B 1 6 ? 7.604 -8.200 -1.382 1.00 0.00 ? 28 ALA B N 5 6
ATOM 4922 C CA . ALA B 1 6 ? 8.863 -7.515 -1.197 1.00 0.00 ? 28 ALA B CA 5 6
ATOM 4923 C C . ALA B 1 6 ? 9.561 -7.166 -2.496 1.00 0.00 ? 28 ALA B C 5 6
ATOM 4924 O O . ALA B 1 6 ? 10.754 -6.902 -2.504 1.00 0.00 ? 28 ALA B O 5 6
ATOM 4925 C CB . ALA B 1 6 ? 9.689 -8.325 -0.228 1.00 0.00 ? 28 ALA B CB 5 6
ATOM 4926 H H . ALA B 1 6 ? 7.532 -9.162 -1.112 1.00 0.00 ? 28 ALA B H 5 6
ATOM 4927 H HA . ALA B 1 6 ? 8.546 -6.604 -0.721 1.00 0.00 ? 28 ALA B HA 5 6
ATOM 4928 H HB1 . ALA B 1 6 ? 10.537 -7.756 0.068 1.00 0.00 ? 28 ALA B HB1 5 6
ATOM 4929 H HB2 . ALA B 1 6 ? 9.160 -8.595 0.650 1.00 0.00 ? 28 ALA B HB2 5 6
ATOM 4930 H HB3 . ALA B 1 6 ? 10.022 -9.199 -0.710 1.00 0.00 ? 28 ALA B HB3 5 6
ATOM 4931 N N . ALA B 1 7 ? 8.824 -7.067 -3.597 1.00 0.00 ? 29 ALA B N 5 7
ATOM 4932 C CA . ALA B 1 7 ? 9.128 -6.562 -4.916 1.00 0.00 ? 29 ALA B CA 5 7
ATOM 4933 C C . ALA B 1 7 ? 8.351 -5.308 -5.257 1.00 0.00 ? 29 ALA B C 5 7
ATOM 4934 O O . ALA B 1 7 ? 8.778 -4.530 -6.077 1.00 0.00 ? 29 ALA B O 5 7
ATOM 4935 C CB . ALA B 1 7 ? 8.887 -7.648 -5.934 1.00 0.00 ? 29 ALA B CB 5 7
ATOM 4936 H H . ALA B 1 7 ? 7.853 -7.227 -3.420 1.00 0.00 ? 29 ALA B H 5 7
ATOM 4937 H HA . ALA B 1 7 ? 10.175 -6.305 -4.966 1.00 0.00 ? 29 ALA B HA 5 7
ATOM 4938 H HB1 . ALA B 1 7 ? 9.075 -7.292 -6.913 1.00 0.00 ? 29 ALA B HB1 5 7
ATOM 4939 H HB2 . ALA B 1 7 ? 9.536 -8.462 -5.790 1.00 0.00 ? 29 ALA B HB2 5 7
ATOM 4940 H HB3 . ALA B 1 7 ? 7.893 -7.996 -5.896 1.00 0.00 ? 29 ALA B HB3 5 7
ATOM 4941 N N . ALA B 1 8 ? 7.234 -5.069 -4.607 1.00 0.00 ? 30 ALA B N 5 8
ATOM 4942 C CA . ALA B 1 8 ? 6.472 -3.844 -4.683 1.00 0.00 ? 30 ALA B CA 5 8
ATOM 4943 C C . ALA B 1 8 ? 6.578 -3.073 -3.382 1.00 0.00 ? 30 ALA B C 5 8
ATOM 4944 O O . ALA B 1 8 ? 7.065 -1.952 -3.362 1.00 0.00 ? 30 ALA B O 5 8
ATOM 4945 C CB . ALA B 1 8 ? 5.018 -4.138 -4.970 1.00 0.00 ? 30 ALA B CB 5 8
ATOM 4946 H H . ALA B 1 8 ? 6.905 -5.789 -4.000 1.00 0.00 ? 30 ALA B H 5 8
ATOM 4947 H HA . ALA B 1 8 ? 6.837 -3.212 -5.482 1.00 0.00 ? 30 ALA B HA 5 8
ATOM 4948 H HB1 . ALA B 1 8 ? 4.937 -4.829 -5.781 1.00 0.00 ? 30 ALA B HB1 5 8
ATOM 4949 H HB2 . ALA B 1 8 ? 4.535 -4.502 -4.107 1.00 0.00 ? 30 ALA B HB2 5 8
ATOM 4950 H HB3 . ALA B 1 8 ? 4.542 -3.232 -5.226 1.00 0.00 ? 30 ALA B HB3 5 8
ATOM 4951 N N . ILE B 1 9 ? 6.234 -3.691 -2.257 1.00 0.00 ? 31 ILE B N 5 9
ATOM 4952 C CA . ILE B 1 9 ? 6.283 -3.180 -0.909 1.00 0.00 ? 31 ILE B CA 5 9
ATOM 4953 C C . ILE B 1 9 ? 7.625 -2.533 -0.616 1.00 0.00 ? 31 ILE B C 5 9
ATOM 4954 O O . ILE B 1 9 ? 7.665 -1.492 0.028 1.00 0.00 ? 31 ILE B O 5 9
ATOM 4955 C CB . ILE B 1 9 ? 5.981 -4.250 0.127 1.00 0.00 ? 31 ILE B CB 5 9
ATOM 4956 C CG1 . ILE B 1 9 ? 4.647 -4.952 -0.077 1.00 0.00 ? 31 ILE B CG1 5 9
ATOM 4957 C CG2 . ILE B 1 9 ? 6.042 -3.670 1.527 1.00 0.00 ? 31 ILE B CG2 5 9
ATOM 4958 C CD1 . ILE B 1 9 ? 3.422 -4.107 0.056 1.00 0.00 ? 31 ILE B CD1 5 9
ATOM 4959 H H . ILE B 1 9 ? 5.935 -4.638 -2.372 1.00 0.00 ? 31 ILE B H 5 9
ATOM 4960 H HA . ILE B 1 9 ? 5.517 -2.423 -0.776 1.00 0.00 ? 31 ILE B HA 5 9
ATOM 4961 H HB . ILE B 1 9 ? 6.783 -4.970 0.067 1.00 0.00 ? 31 ILE B HB 5 9
ATOM 4962 H HG12 . ILE B 1 9 ? 4.648 -5.401 -1.071 1.00 0.00 ? 31 ILE B HG12 5 9
ATOM 4963 H HG13 . ILE B 1 9 ? 4.564 -5.751 0.628 1.00 0.00 ? 31 ILE B HG13 5 9
ATOM 4964 H HG21 . ILE B 1 9 ? 5.645 -4.390 2.211 1.00 0.00 ? 31 ILE B HG21 5 9
ATOM 4965 H HG22 . ILE B 1 9 ? 7.061 -3.475 1.808 1.00 0.00 ? 31 ILE B HG22 5 9
ATOM 4966 H HG23 . ILE B 1 9 ? 5.473 -2.753 1.574 1.00 0.00 ? 31 ILE B HG23 5 9
ATOM 4967 H HD11 . ILE B 1 9 ? 3.334 -3.735 1.011 1.00 0.00 ? 31 ILE B HD11 5 9
ATOM 4968 H HD12 . ILE B 1 9 ? 3.489 -3.334 -0.611 1.00 0.00 ? 31 ILE B HD12 5 9
ATOM 4969 H HD13 . ILE B 1 9 ? 2.550 -4.666 -0.147 1.00 0.00 ? 31 ILE B HD13 5 9
ATOM 4970 N N . LYS B 1 10 ? 8.728 -3.067 -1.135 1.00 0.00 ? 32 LYS B N 5 10
ATOM 4971 C CA . LYS B 1 10 ? 10.034 -2.466 -1.007 1.00 0.00 ? 32 LYS B CA 5 10
ATOM 4972 C C . LYS B 1 10 ? 10.100 -1.003 -1.402 1.00 0.00 ? 32 LYS B C 5 10
ATOM 4973 O O . LYS B 1 10 ? 10.315 -0.121 -0.594 1.00 0.00 ? 32 LYS B O 5 10
ATOM 4974 C CB . LYS B 1 10 ? 10.999 -3.341 -1.794 1.00 0.00 ? 32 LYS B CB 5 10
ATOM 4975 C CG . LYS B 1 10 ? 10.804 -3.683 -3.261 1.00 0.00 ? 32 LYS B CG 5 10
ATOM 4976 C CD . LYS B 1 10 ? 12.074 -4.201 -3.907 1.00 0.00 ? 32 LYS B CD 5 10
ATOM 4977 C CE . LYS B 1 10 ? 13.086 -3.116 -4.153 1.00 0.00 ? 32 LYS B CE 5 10
ATOM 4978 N NZ . LYS B 1 10 ? 14.297 -3.598 -4.782 1.00 0.00 ? 32 LYS B NZ 5 10
ATOM 4979 H H . LYS B 1 10 ? 8.614 -3.908 -1.668 1.00 0.00 ? 32 LYS B H 5 10
ATOM 4980 H HA . LYS B 1 10 ? 10.275 -2.454 0.050 1.00 0.00 ? 32 LYS B HA 5 10
ATOM 4981 H HB2 . LYS B 1 10 ? 11.992 -2.905 -1.688 1.00 0.00 ? 32 LYS B HB2 5 10
ATOM 4982 H HB3 . LYS B 1 10 ? 10.973 -4.309 -1.310 1.00 0.00 ? 32 LYS B HB3 5 10
ATOM 4983 H HG2 . LYS B 1 10 ? 10.010 -4.423 -3.361 1.00 0.00 ? 32 LYS B HG2 5 10
ATOM 4984 H HG3 . LYS B 1 10 ? 10.509 -2.799 -3.804 1.00 0.00 ? 32 LYS B HG3 5 10
ATOM 4985 H HD2 . LYS B 1 10 ? 12.521 -4.971 -3.278 1.00 0.00 ? 32 LYS B HD2 5 10
ATOM 4986 H HD3 . LYS B 1 10 ? 11.776 -4.665 -4.820 1.00 0.00 ? 32 LYS B HD3 5 10
ATOM 4987 H HE2 . LYS B 1 10 ? 12.642 -2.332 -4.765 1.00 0.00 ? 32 LYS B HE2 5 10
ATOM 4988 H HE3 . LYS B 1 10 ? 13.350 -2.700 -3.216 1.00 0.00 ? 32 LYS B HE3 5 10
ATOM 4989 H HZ1 . LYS B 1 10 ? 14.098 -3.987 -5.639 1.00 0.00 ? 32 LYS B HZ1 5 10
ATOM 4990 H HZ2 . LYS B 1 10 ? 14.938 -2.888 -4.953 1.00 0.00 ? 32 LYS B HZ2 5 10
ATOM 4991 H HZ3 . LYS B 1 10 ? 14.768 -4.277 -4.288 1.00 0.00 ? 32 LYS B HZ3 5 10
ATOM 4992 N N . ALA B 1 11 ? 9.785 -0.779 -2.672 1.00 0.00 ? 33 ALA B N 5 11
ATOM 4993 C CA . ALA B 1 11 ? 9.556 0.455 -3.372 1.00 0.00 ? 33 ALA B CA 5 11
ATOM 4994 C C . ALA B 1 11 ? 8.305 1.193 -2.934 1.00 0.00 ? 33 ALA B C 5 11
ATOM 4995 O O . ALA B 1 11 ? 7.876 2.131 -3.587 1.00 0.00 ? 33 ALA B O 5 11
ATOM 4996 C CB . ALA B 1 11 ? 9.579 0.176 -4.861 1.00 0.00 ? 33 ALA B CB 5 11
ATOM 4997 H H . ALA B 1 11 ? 9.658 -1.657 -3.133 1.00 0.00 ? 33 ALA B H 5 11
ATOM 4998 H HA . ALA B 1 11 ? 10.380 1.109 -3.151 1.00 0.00 ? 33 ALA B HA 5 11
ATOM 4999 H HB1 . ALA B 1 11 ? 8.774 -0.474 -5.123 1.00 0.00 ? 33 ALA B HB1 5 11
ATOM 5000 H HB2 . ALA B 1 11 ? 9.526 1.086 -5.414 1.00 0.00 ? 33 ALA B HB2 5 11
ATOM 5001 H HB3 . ALA B 1 11 ? 10.503 -0.303 -5.120 1.00 0.00 ? 33 ALA B HB3 5 11
ATOM 5002 N N . ILE B 1 12 ? 7.692 0.780 -1.830 1.00 0.00 ? 34 ILE B N 5 12
ATOM 5003 C CA . ILE B 1 12 ? 6.585 1.456 -1.196 1.00 0.00 ? 34 ILE B CA 5 12
ATOM 5004 C C . ILE B 1 12 ? 6.959 1.832 0.224 1.00 0.00 ? 34 ILE B C 5 12
ATOM 5005 O O . ILE B 1 12 ? 6.903 3.018 0.514 1.00 0.00 ? 34 ILE B O 5 12
ATOM 5006 C CB . ILE B 1 12 ? 5.267 0.703 -1.325 1.00 0.00 ? 34 ILE B CB 5 12
ATOM 5007 C CG1 . ILE B 1 12 ? 4.814 0.468 -2.757 1.00 0.00 ? 34 ILE B CG1 5 12
ATOM 5008 C CG2 . ILE B 1 12 ? 4.166 1.325 -0.490 1.00 0.00 ? 34 ILE B CG2 5 12
ATOM 5009 C CD1 . ILE B 1 12 ? 4.274 1.669 -3.500 1.00 0.00 ? 34 ILE B CD1 5 12
ATOM 5010 H H . ILE B 1 12 ? 8.050 -0.021 -1.392 1.00 0.00 ? 34 ILE B H 5 12
ATOM 5011 H HA . ILE B 1 12 ? 6.435 2.434 -1.647 1.00 0.00 ? 34 ILE B HA 5 12
ATOM 5012 H HB . ILE B 1 12 ? 5.445 -0.277 -0.891 1.00 0.00 ? 34 ILE B HB 5 12
ATOM 5013 H HG12 . ILE B 1 12 ? 5.659 0.077 -3.324 1.00 0.00 ? 34 ILE B HG12 5 12
ATOM 5014 H HG13 . ILE B 1 12 ? 4.083 -0.318 -2.716 1.00 0.00 ? 34 ILE B HG13 5 12
ATOM 5015 H HG21 . ILE B 1 12 ? 3.247 0.809 -0.677 1.00 0.00 ? 34 ILE B HG21 5 12
ATOM 5016 H HG22 . ILE B 1 12 ? 4.381 1.217 0.546 1.00 0.00 ? 34 ILE B HG22 5 12
ATOM 5017 H HG23 . ILE B 1 12 ? 4.080 2.373 -0.677 1.00 0.00 ? 34 ILE B HG23 5 12
ATOM 5018 H HD11 . ILE B 1 12 ? 3.370 1.982 -3.041 1.00 0.00 ? 34 ILE B HD11 5 12
ATOM 5019 H HD12 . ILE B 1 12 ? 4.952 2.478 -3.562 1.00 0.00 ? 34 ILE B HD12 5 12
ATOM 5020 H HD13 . ILE B 1 12 ? 4.048 1.391 -4.491 1.00 0.00 ? 34 ILE B HD13 5 12
ATOM 5021 N N . ALA B 1 13 ? 7.428 0.963 1.117 1.00 0.00 ? 35 ALA B N 5 13
ATOM 5022 C CA . ALA B 1 13 ? 7.757 1.309 2.476 1.00 0.00 ? 35 ALA B CA 5 13
ATOM 5023 C C . ALA B 1 13 ? 8.844 2.347 2.631 1.00 0.00 ? 35 ALA B C 5 13
ATOM 5024 O O . ALA B 1 13 ? 8.849 3.119 3.571 1.00 0.00 ? 35 ALA B O 5 13
ATOM 5025 C CB . ALA B 1 13 ? 8.058 0.013 3.194 1.00 0.00 ? 35 ALA B CB 5 13
ATOM 5026 H H . ALA B 1 13 ? 7.573 0.026 0.786 1.00 0.00 ? 35 ALA B H 5 13
ATOM 5027 H HA . ALA B 1 13 ? 6.876 1.724 2.948 1.00 0.00 ? 35 ALA B HA 5 13
ATOM 5028 H HB1 . ALA B 1 13 ? 8.265 0.225 4.228 1.00 0.00 ? 35 ALA B HB1 5 13
ATOM 5029 H HB2 . ALA B 1 13 ? 7.227 -0.648 3.130 1.00 0.00 ? 35 ALA B HB2 5 13
ATOM 5030 H HB3 . ALA B 1 13 ? 8.892 -0.463 2.716 1.00 0.00 ? 35 ALA B HB3 5 13
ATOM 5031 N N . ALA B 1 14 ? 9.740 2.417 1.655 1.00 0.00 ? 36 ALA B N 5 14
ATOM 5032 C CA . ALA B 1 14 ? 10.713 3.463 1.497 1.00 0.00 ? 36 ALA B CA 5 14
ATOM 5033 C C . ALA B 1 14 ? 10.080 4.770 1.059 1.00 0.00 ? 36 ALA B C 5 14
ATOM 5034 O O . ALA B 1 14 ? 10.378 5.835 1.540 1.00 0.00 ? 36 ALA B O 5 14
ATOM 5035 C CB . ALA B 1 14 ? 11.780 3.010 0.529 1.00 0.00 ? 36 ALA B CB 5 14
ATOM 5036 H H . ALA B 1 14 ? 9.592 1.730 0.945 1.00 0.00 ? 36 ALA B H 5 14
ATOM 5037 H HA . ALA B 1 14 ? 11.160 3.622 2.456 1.00 0.00 ? 36 ALA B HA 5 14
ATOM 5038 H HB1 . ALA B 1 14 ? 12.554 3.748 0.514 1.00 0.00 ? 36 ALA B HB1 5 14
ATOM 5039 H HB2 . ALA B 1 14 ? 12.187 2.070 0.808 1.00 0.00 ? 36 ALA B HB2 5 14
ATOM 5040 H HB3 . ALA B 1 14 ? 11.397 2.953 -0.464 1.00 0.00 ? 36 ALA B HB3 5 14
ATOM 5041 N N . ILE B 1 15 ? 9.140 4.711 0.139 1.00 0.00 ? 37 ILE B N 5 15
ATOM 5042 C CA . ILE B 1 15 ? 8.384 5.803 -0.435 1.00 0.00 ? 37 ILE B CA 5 15
ATOM 5043 C C . ILE B 1 15 ? 7.405 6.384 0.570 1.00 0.00 ? 37 ILE B C 5 15
ATOM 5044 O O . ILE B 1 15 ? 7.229 7.586 0.642 1.00 0.00 ? 37 ILE B O 5 15
ATOM 5045 C CB . ILE B 1 15 ? 7.738 5.322 -1.724 1.00 0.00 ? 37 ILE B CB 5 15
ATOM 5046 C CG1 . ILE B 1 15 ? 8.669 5.386 -2.924 1.00 0.00 ? 37 ILE B CG1 5 15
ATOM 5047 C CG2 . ILE B 1 15 ? 6.467 6.065 -2.088 1.00 0.00 ? 37 ILE B CG2 5 15
ATOM 5048 C CD1 . ILE B 1 15 ? 9.910 4.507 -2.922 1.00 0.00 ? 37 ILE B CD1 5 15
ATOM 5049 H H . ILE B 1 15 ? 8.879 3.792 -0.136 1.00 0.00 ? 37 ILE B H 5 15
ATOM 5050 H HA . ILE B 1 15 ? 9.055 6.621 -0.669 1.00 0.00 ? 37 ILE B HA 5 15
ATOM 5051 H HB . ILE B 1 15 ? 7.498 4.273 -1.627 1.00 0.00 ? 37 ILE B HB 5 15
ATOM 5052 H HG12 . ILE B 1 15 ? 8.080 5.119 -3.801 1.00 0.00 ? 37 ILE B HG12 5 15
ATOM 5053 H HG13 . ILE B 1 15 ? 9.000 6.405 -3.091 1.00 0.00 ? 37 ILE B HG13 5 15
ATOM 5054 H HG21 . ILE B 1 15 ? 6.636 7.117 -2.156 1.00 0.00 ? 37 ILE B HG21 5 15
ATOM 5055 H HG22 . ILE B 1 15 ? 6.107 5.676 -3.016 1.00 0.00 ? 37 ILE B HG22 5 15
ATOM 5056 H HG23 . ILE B 1 15 ? 5.727 5.909 -1.328 1.00 0.00 ? 37 ILE B HG23 5 15
ATOM 5057 H HD11 . ILE B 1 15 ? 9.677 3.514 -2.583 1.00 0.00 ? 37 ILE B HD11 5 15
ATOM 5058 H HD12 . ILE B 1 15 ? 10.328 4.436 -3.910 1.00 0.00 ? 37 ILE B HD12 5 15
ATOM 5059 H HD13 . ILE B 1 15 ? 10.661 4.926 -2.284 1.00 0.00 ? 37 ILE B HD13 5 15
ATOM 5060 N N . ILE B 1 16 ? 6.821 5.564 1.437 1.00 0.00 ? 38 ILE B N 5 16
ATOM 5061 C CA . ILE B 1 16 ? 6.015 5.986 2.559 1.00 0.00 ? 38 ILE B CA 5 16
ATOM 5062 C C . ILE B 1 16 ? 6.755 6.964 3.445 1.00 0.00 ? 38 ILE B C 5 16
ATOM 5063 O O . ILE B 1 16 ? 6.264 8.035 3.738 1.00 0.00 ? 38 ILE B O 5 16
ATOM 5064 C CB . ILE B 1 16 ? 5.525 4.779 3.348 1.00 0.00 ? 38 ILE B CB 5 16
ATOM 5065 C CG1 . ILE B 1 16 ? 4.481 4.040 2.527 1.00 0.00 ? 38 ILE B CG1 5 16
ATOM 5066 C CG2 . ILE B 1 16 ? 4.951 5.177 4.696 1.00 0.00 ? 38 ILE B CG2 5 16
ATOM 5067 C CD1 . ILE B 1 16 ? 3.835 2.828 3.172 1.00 0.00 ? 38 ILE B CD1 5 16
ATOM 5068 H H . ILE B 1 16 ? 6.906 4.588 1.225 1.00 0.00 ? 38 ILE B H 5 16
ATOM 5069 H HA . ILE B 1 16 ? 5.170 6.564 2.202 1.00 0.00 ? 38 ILE B HA 5 16
ATOM 5070 H HB . ILE B 1 16 ? 6.377 4.124 3.489 1.00 0.00 ? 38 ILE B HB 5 16
ATOM 5071 H HG12 . ILE B 1 16 ? 3.695 4.742 2.249 1.00 0.00 ? 38 ILE B HG12 5 16
ATOM 5072 H HG13 . ILE B 1 16 ? 4.979 3.720 1.626 1.00 0.00 ? 38 ILE B HG13 5 16
ATOM 5073 H HG21 . ILE B 1 16 ? 4.130 5.856 4.592 1.00 0.00 ? 38 ILE B HG21 5 16
ATOM 5074 H HG22 . ILE B 1 16 ? 4.592 4.342 5.242 1.00 0.00 ? 38 ILE B HG22 5 16
ATOM 5075 H HG23 . ILE B 1 16 ? 5.681 5.594 5.349 1.00 0.00 ? 38 ILE B HG23 5 16
ATOM 5076 H HD11 . ILE B 1 16 ? 3.152 3.149 3.930 1.00 0.00 ? 38 ILE B HD11 5 16
ATOM 5077 H HD12 . ILE B 1 16 ? 3.313 2.293 2.401 1.00 0.00 ? 38 ILE B HD12 5 16
ATOM 5078 H HD13 . ILE B 1 16 ? 4.573 2.173 3.599 1.00 0.00 ? 38 ILE B HD13 5 16
ATOM 5079 N N . LYS B 1 17 ? 7.938 6.567 3.888 1.00 0.00 ? 39 LYS B N 5 17
ATOM 5080 C CA . LYS B 1 17 ? 8.819 7.382 4.682 1.00 0.00 ? 39 LYS B CA 5 17
ATOM 5081 C C . LYS B 1 17 ? 9.202 8.677 4.021 1.00 0.00 ? 39 LYS B C 5 17
ATOM 5082 O O . LYS B 1 17 ? 9.115 9.695 4.669 1.00 0.00 ? 39 LYS B O 5 17
ATOM 5083 C CB . LYS B 1 17 ? 10.015 6.555 5.081 1.00 0.00 ? 39 LYS B CB 5 17
ATOM 5084 C CG . LYS B 1 17 ? 11.101 7.194 5.855 1.00 0.00 ? 39 LYS B CG 5 17
ATOM 5085 C CD . LYS B 1 17 ? 10.732 7.735 7.169 1.00 0.00 ? 39 LYS B CD 5 17
ATOM 5086 C CE . LYS B 1 17 ? 10.494 6.722 8.156 1.00 0.00 ? 39 LYS B CE 5 17
ATOM 5087 N NZ . LYS B 1 17 ? 10.318 7.289 9.423 1.00 0.00 ? 39 LYS B NZ 5 17
ATOM 5088 H H . LYS B 1 17 ? 8.292 5.690 3.574 1.00 0.00 ? 39 LYS B H 5 17
ATOM 5089 H HA . LYS B 1 17 ? 8.290 7.640 5.581 1.00 0.00 ? 39 LYS B HA 5 17
ATOM 5090 H HB2 . LYS B 1 17 ? 9.659 5.690 5.641 1.00 0.00 ? 39 LYS B HB2 5 17
ATOM 5091 H HB3 . LYS B 1 17 ? 10.475 6.217 4.195 1.00 0.00 ? 39 LYS B HB3 5 17
ATOM 5092 H HG2 . LYS B 1 17 ? 11.908 6.475 5.991 1.00 0.00 ? 39 LYS B HG2 5 17
ATOM 5093 H HG3 . LYS B 1 17 ? 11.449 7.956 5.258 1.00 0.00 ? 39 LYS B HG3 5 17
ATOM 5094 H HD2 . LYS B 1 17 ? 11.539 8.380 7.519 1.00 0.00 ? 39 LYS B HD2 5 17
ATOM 5095 H HD3 . LYS B 1 17 ? 9.913 8.330 7.093 1.00 0.00 ? 39 LYS B HD3 5 17
ATOM 5096 H HE2 . LYS B 1 17 ? 9.610 6.145 7.886 1.00 0.00 ? 39 LYS B HE2 5 17
ATOM 5097 H HE3 . LYS B 1 17 ? 11.272 6.086 8.164 1.00 0.00 ? 39 LYS B HE3 5 17
ATOM 5098 H HZ1 . LYS B 1 17 ? 10.233 6.657 10.064 1.00 0.00 ? 39 LYS B HZ1 5 17
ATOM 5099 H HZ2 . LYS B 1 17 ? 11.046 7.811 9.667 1.00 0.00 ? 39 LYS B HZ2 5 17
ATOM 5100 H HZ3 . LYS B 1 17 ? 9.614 7.874 9.453 1.00 0.00 ? 39 LYS B HZ3 5 17
ATOM 5101 N N . ALA B 1 18 ? 9.514 8.685 2.739 1.00 0.00 ? 40 ALA B N 5 18
ATOM 5102 C CA . ALA B 1 18 ? 9.868 9.865 1.999 1.00 0.00 ? 40 ALA B CA 5 18
ATOM 5103 C C . ALA B 1 18 ? 8.709 10.761 1.670 1.00 0.00 ? 40 ALA B C 5 18
ATOM 5104 O O . ALA B 1 18 ? 8.882 11.956 1.641 1.00 0.00 ? 40 ALA B O 5 18
ATOM 5105 C CB . ALA B 1 18 ? 10.621 9.446 0.771 1.00 0.00 ? 40 ALA B CB 5 18
ATOM 5106 H H . ALA B 1 18 ? 9.488 7.808 2.257 1.00 0.00 ? 40 ALA B H 5 18
ATOM 5107 H HA . ALA B 1 18 ? 10.535 10.440 2.619 1.00 0.00 ? 40 ALA B HA 5 18
ATOM 5108 H HB1 . ALA B 1 18 ? 10.907 10.289 0.182 1.00 0.00 ? 40 ALA B HB1 5 18
ATOM 5109 H HB2 . ALA B 1 18 ? 11.499 8.943 1.079 1.00 0.00 ? 40 ALA B HB2 5 18
ATOM 5110 H HB3 . ALA B 1 18 ? 10.044 8.767 0.193 1.00 0.00 ? 40 ALA B HB3 5 18
ATOM 5111 N N . GLY B 1 19 ? 7.551 10.195 1.402 1.00 0.00 ? 41 GLY B N 5 19
ATOM 5112 C CA . GLY B 1 19 ? 6.295 10.825 1.085 1.00 0.00 ? 41 GLY B CA 5 19
ATOM 5113 C C . GLY B 1 19 ? 5.635 11.522 2.252 1.00 0.00 ? 41 GLY B C 5 19
ATOM 5114 O O . GLY B 1 19 ? 5.051 12.550 2.061 1.00 0.00 ? 41 GLY B O 5 19
ATOM 5115 H H . GLY B 1 19 ? 7.573 9.201 1.415 1.00 0.00 ? 41 GLY B H 5 19
ATOM 5116 H HA2 . GLY B 1 19 ? 6.424 11.526 0.279 1.00 0.00 ? 41 GLY B HA2 5 19
ATOM 5117 H HA3 . GLY B 1 19 ? 5.598 10.093 0.730 1.00 0.00 ? 41 GLY B HA3 5 19
ATOM 5118 N N . GLY B 1 20 ? 5.701 10.984 3.453 1.00 0.00 ? 42 GLY B N 5 20
ATOM 5119 C CA . GLY B 1 20 ? 5.134 11.584 4.637 1.00 0.00 ? 42 GLY B CA 5 20
ATOM 5120 C C . GLY B 1 20 ? 3.666 11.300 4.858 1.00 0.00 ? 42 GLY B C 5 20
ATOM 5121 O O . GLY B 1 20 ? 2.963 12.184 5.257 1.00 0.00 ? 42 GLY B O 5 20
ATOM 5122 H H . GLY B 1 20 ? 6.221 10.179 3.590 1.00 0.00 ? 42 GLY B H 5 20
ATOM 5123 H HA2 . GLY B 1 20 ? 5.675 11.194 5.487 1.00 0.00 ? 42 GLY B HA2 5 20
ATOM 5124 H HA3 . GLY B 1 20 ? 5.289 12.655 4.626 1.00 0.00 ? 42 GLY B HA3 5 20
ATOM 5125 N N . TYR B 1 21 ? 3.212 10.091 4.581 1.00 0.00 ? 43 TYR B N 5 21
ATOM 5126 C CA . TYR B 1 21 ? 1.876 9.613 4.801 1.00 0.00 ? 43 TYR B CA 5 21
ATOM 5127 C C . TYR B 1 21 ? 1.422 9.597 6.229 1.00 0.00 ? 43 TYR B C 5 21
ATOM 5128 O O . TYR B 1 21 ? 0.274 9.572 6.507 1.00 0.00 ? 43 TYR B O 5 21
ATOM 5129 C CB . TYR B 1 21 ? 1.835 8.213 4.235 1.00 0.00 ? 43 TYR B CB 5 21
ATOM 5130 C CG . TYR B 1 21 ? 1.674 8.023 2.754 1.00 0.00 ? 43 TYR B CG 5 21
ATOM 5131 C CD1 . TYR B 1 21 ? 0.582 8.481 2.016 1.00 0.00 ? 43 TYR B CD1 5 21
ATOM 5132 C CD2 . TYR B 1 21 ? 2.576 7.162 2.134 1.00 0.00 ? 43 TYR B CD2 5 21
ATOM 5133 C CE1 . TYR B 1 21 ? 0.344 8.027 0.717 1.00 0.00 ? 43 TYR B CE1 5 21
ATOM 5134 C CE2 . TYR B 1 21 ? 2.388 6.706 0.830 1.00 0.00 ? 43 TYR B CE2 5 21
ATOM 5135 C CZ . TYR B 1 21 ? 1.226 7.097 0.149 1.00 0.00 ? 43 TYR B CZ 5 21
ATOM 5136 O OH . TYR B 1 21 ? 1.012 6.634 -1.107 1.00 0.00 ? 43 TYR B OH 5 21
ATOM 5137 H H . TYR B 1 21 ? 3.829 9.388 4.272 1.00 0.00 ? 43 TYR B H 5 21
ATOM 5138 H HA . TYR B 1 21 ? 1.179 10.212 4.239 1.00 0.00 ? 43 TYR B HA 5 21
ATOM 5139 H HB2 . TYR B 1 21 ? 2.761 7.722 4.534 1.00 0.00 ? 43 TYR B HB2 5 21
ATOM 5140 H HB3 . TYR B 1 21 ? 1.040 7.641 4.652 1.00 0.00 ? 43 TYR B HB3 5 21
ATOM 5141 H HD1 . TYR B 1 21 ? -0.161 9.124 2.425 1.00 0.00 ? 43 TYR B HD1 5 21
ATOM 5142 H HD2 . TYR B 1 21 ? 3.370 6.793 2.726 1.00 0.00 ? 43 TYR B HD2 5 21
ATOM 5143 H HE1 . TYR B 1 21 ? -0.513 8.333 0.154 1.00 0.00 ? 43 TYR B HE1 5 21
ATOM 5144 H HE2 . TYR B 1 21 ? 3.096 6.030 0.392 1.00 0.00 ? 43 TYR B HE2 5 21
ATOM 5145 H HH . TYR B 1 21 ? 1.473 7.232 -1.672 1.00 0.00 ? 43 TYR B HH 5 21
HETATM 5146 N N . NH2 B 1 22 ? 2.263 9.560 7.216 1.00 0.00 ? 44 NH2 B N 5 22
HETATM 5147 H HN1 . NH2 B 1 22 ? 1.902 9.486 8.137 1.00 0.00 ? 44 NH2 B HN1 5 22
HETATM 5148 H HN2 . NH2 B 1 22 ? 3.195 9.625 7.007 1.00 0.00 ? 44 NH2 B HN2 5 22
HETATM 5149 C C . ACE C 1 1 ? -7.783 10.811 -3.584 1.00 0.00 ? 45 ACE C C 5 1
HETATM 5150 O O . ACE C 1 1 ? -8.045 9.993 -2.735 1.00 0.00 ? 45 ACE C O 5 1
HETATM 5151 C CH3 . ACE C 1 1 ? -8.760 11.057 -4.680 1.00 0.00 ? 45 ACE C CH3 5 1
HETATM 5152 H H1 . ACE C 1 1 ? -8.970 10.891 -5.072 1.00 0.00 ? 45 ACE C H1 5 1
HETATM 5153 H H2 . ACE C 1 1 ? -9.204 11.109 -4.728 1.00 0.00 ? 45 ACE C H2 5 1
HETATM 5154 H H3 . ACE C 1 1 ? -8.861 11.316 -4.959 1.00 0.00 ? 45 ACE C H3 5 1
ATOM 5155 N N . ALA C 1 2 ? -6.702 11.570 -3.546 1.00 0.00 ? 46 ALA C N 5 2
ATOM 5156 C CA . ALA C 1 2 ? -5.691 11.537 -2.529 1.00 0.00 ? 46 ALA C CA 5 2
ATOM 5157 C C . ALA C 1 2 ? -6.181 11.893 -1.149 1.00 0.00 ? 46 ALA C C 5 2
ATOM 5158 O O . ALA C 1 2 ? -5.412 11.758 -0.228 1.00 0.00 ? 46 ALA C O 5 2
ATOM 5159 C CB . ALA C 1 2 ? -4.552 12.431 -2.940 1.00 0.00 ? 46 ALA C CB 5 2
ATOM 5160 H H . ALA C 1 2 ? -6.603 12.246 -4.260 1.00 0.00 ? 46 ALA C H 5 2
ATOM 5161 H HA . ALA C 1 2 ? -5.308 10.533 -2.483 1.00 0.00 ? 46 ALA C HA 5 2
ATOM 5162 H HB1 . ALA C 1 2 ? -4.214 12.122 -3.875 1.00 0.00 ? 46 ALA C HB1 5 2
ATOM 5163 H HB2 . ALA C 1 2 ? -4.880 13.432 -2.989 1.00 0.00 ? 46 ALA C HB2 5 2
ATOM 5164 H HB3 . ALA C 1 2 ? -3.738 12.351 -2.273 1.00 0.00 ? 46 ALA C HB3 5 2
ATOM 5165 N N . LYS C 1 3 ? -7.432 12.275 -0.953 1.00 0.00 ? 47 LYS C N 5 3
ATOM 5166 C CA . LYS C 1 3 ? -8.096 12.313 0.322 1.00 0.00 ? 47 LYS C CA 5 3
ATOM 5167 C C . LYS C 1 3 ? -8.111 10.973 1.013 1.00 0.00 ? 47 LYS C C 5 3
ATOM 5168 O O . LYS C 1 3 ? -8.071 10.911 2.224 1.00 0.00 ? 47 LYS C O 5 3
ATOM 5169 C CB . LYS C 1 3 ? -9.540 12.712 0.151 1.00 0.00 ? 47 LYS C CB 5 3
ATOM 5170 C CG . LYS C 1 3 ? -9.856 13.980 -0.613 1.00 0.00 ? 47 LYS C CG 5 3
ATOM 5171 C CD . LYS C 1 3 ? -9.448 15.267 0.046 1.00 0.00 ? 47 LYS C CD 5 3
ATOM 5172 C CE . LYS C 1 3 ? -8.028 15.638 -0.117 1.00 0.00 ? 47 LYS C CE 5 3
ATOM 5173 N NZ . LYS C 1 3 ? -7.754 16.941 0.397 1.00 0.00 ? 47 LYS C NZ 5 3
ATOM 5174 H H . LYS C 1 3 ? -7.978 12.343 -1.768 1.00 0.00 ? 47 LYS C H 5 3
ATOM 5175 H HA . LYS C 1 3 ? -7.607 13.002 0.986 1.00 0.00 ? 47 LYS C HA 5 3
ATOM 5176 H HB2 . LYS C 1 3 ? -10.046 11.898 -0.369 1.00 0.00 ? 47 LYS C HB2 5 3
ATOM 5177 H HB3 . LYS C 1 3 ? -9.949 12.718 1.132 1.00 0.00 ? 47 LYS C HB3 5 3
ATOM 5178 H HG2 . LYS C 1 3 ? -9.393 13.919 -1.598 1.00 0.00 ? 47 LYS C HG2 5 3
ATOM 5179 H HG3 . LYS C 1 3 ? -10.915 14.058 -0.739 1.00 0.00 ? 47 LYS C HG3 5 3
ATOM 5180 H HD2 . LYS C 1 3 ? -10.051 16.067 -0.384 1.00 0.00 ? 47 LYS C HD2 5 3
ATOM 5181 H HD3 . LYS C 1 3 ? -9.708 15.249 1.065 1.00 0.00 ? 47 LYS C HD3 5 3
ATOM 5182 H HE2 . LYS C 1 3 ? -7.402 14.910 0.400 1.00 0.00 ? 47 LYS C HE2 5 3
ATOM 5183 H HE3 . LYS C 1 3 ? -7.777 15.581 -1.136 1.00 0.00 ? 47 LYS C HE3 5 3
ATOM 5184 H HZ1 . LYS C 1 3 ? -8.169 17.584 -0.065 1.00 0.00 ? 47 LYS C HZ1 5 3
ATOM 5185 H HZ2 . LYS C 1 3 ? -7.980 17.034 1.263 1.00 0.00 ? 47 LYS C HZ2 5 3
ATOM 5186 H HZ3 . LYS C 1 3 ? -6.853 17.202 0.378 1.00 0.00 ? 47 LYS C HZ3 5 3
ATOM 5187 N N . ALA C 1 4 ? -8.105 9.885 0.252 1.00 0.00 ? 48 ALA C N 5 4
ATOM 5188 C CA . ALA C 1 4 ? -8.073 8.515 0.700 1.00 0.00 ? 48 ALA C CA 5 4
ATOM 5189 C C . ALA C 1 4 ? -6.795 8.117 1.406 1.00 0.00 ? 48 ALA C C 5 4
ATOM 5190 O O . ALA C 1 4 ? -6.679 6.991 1.867 1.00 0.00 ? 48 ALA C O 5 4
ATOM 5191 C CB . ALA C 1 4 ? -8.291 7.645 -0.527 1.00 0.00 ? 48 ALA C CB 5 4
ATOM 5192 H H . ALA C 1 4 ? -8.119 10.068 -0.716 1.00 0.00 ? 48 ALA C H 5 4
ATOM 5193 H HA . ALA C 1 4 ? -8.888 8.367 1.399 1.00 0.00 ? 48 ALA C HA 5 4
ATOM 5194 H HB1 . ALA C 1 4 ? -9.232 7.894 -0.984 1.00 0.00 ? 48 ALA C HB1 5 4
ATOM 5195 H HB2 . ALA C 1 4 ? -7.509 7.783 -1.250 1.00 0.00 ? 48 ALA C HB2 5 4
ATOM 5196 H HB3 . ALA C 1 4 ? -8.332 6.613 -0.239 1.00 0.00 ? 48 ALA C HB3 5 4
ATOM 5197 N N . ALA C 1 5 ? -5.802 9.002 1.449 1.00 0.00 ? 49 ALA C N 5 5
ATOM 5198 C CA . ALA C 1 5 ? -4.427 8.721 1.779 1.00 0.00 ? 49 ALA C CA 5 5
ATOM 5199 C C . ALA C 1 5 ? -4.254 8.247 3.208 1.00 0.00 ? 49 ALA C C 5 5
ATOM 5200 O O . ALA C 1 5 ? -4.222 7.053 3.464 1.00 0.00 ? 49 ALA C O 5 5
ATOM 5201 C CB . ALA C 1 5 ? -3.512 9.820 1.281 1.00 0.00 ? 49 ALA C CB 5 5
ATOM 5202 H H . ALA C 1 5 ? -6.075 9.937 1.259 1.00 0.00 ? 49 ALA C H 5 5
ATOM 5203 H HA . ALA C 1 5 ? -4.107 7.849 1.218 1.00 0.00 ? 49 ALA C HA 5 5
ATOM 5204 H HB1 . ALA C 1 5 ? -3.609 9.884 0.213 1.00 0.00 ? 49 ALA C HB1 5 5
ATOM 5205 H HB2 . ALA C 1 5 ? -3.683 10.743 1.763 1.00 0.00 ? 49 ALA C HB2 5 5
ATOM 5206 H HB3 . ALA C 1 5 ? -2.512 9.549 1.503 1.00 0.00 ? 49 ALA C HB3 5 5
ATOM 5207 N N . ALA C 1 6 ? -4.082 9.155 4.167 1.00 0.00 ? 50 ALA C N 5 6
ATOM 5208 C CA . ALA C 1 6 ? -3.807 8.758 5.524 1.00 0.00 ? 50 ALA C CA 5 6
ATOM 5209 C C . ALA C 1 6 ? -4.900 7.942 6.169 1.00 0.00 ? 50 ALA C C 5 6
ATOM 5210 O O . ALA C 1 6 ? -4.638 7.130 7.026 1.00 0.00 ? 50 ALA C O 5 6
ATOM 5211 C CB . ALA C 1 6 ? -3.426 9.974 6.328 1.00 0.00 ? 50 ALA C CB 5 6
ATOM 5212 H H . ALA C 1 6 ? -4.100 10.116 3.918 1.00 0.00 ? 50 ALA C H 5 6
ATOM 5213 H HA . ALA C 1 6 ? -2.951 8.112 5.466 1.00 0.00 ? 50 ALA C HA 5 6
ATOM 5214 H HB1 . ALA C 1 6 ? -4.259 10.619 6.394 1.00 0.00 ? 50 ALA C HB1 5 6
ATOM 5215 H HB2 . ALA C 1 6 ? -3.146 9.647 7.308 1.00 0.00 ? 50 ALA C HB2 5 6
ATOM 5216 H HB3 . ALA C 1 6 ? -2.605 10.491 5.889 1.00 0.00 ? 50 ALA C HB3 5 6
ATOM 5217 N N . ALA C 1 7 ? -6.132 8.024 5.697 1.00 0.00 ? 51 ALA C N 5 7
ATOM 5218 C CA . ALA C 1 7 ? -7.250 7.198 6.080 1.00 0.00 ? 51 ALA C CA 5 7
ATOM 5219 C C . ALA C 1 7 ? -7.168 5.749 5.643 1.00 0.00 ? 51 ALA C C 5 7
ATOM 5220 O O . ALA C 1 7 ? -7.983 4.933 6.049 1.00 0.00 ? 51 ALA C O 5 7
ATOM 5221 C CB . ALA C 1 7 ? -8.519 7.841 5.561 1.00 0.00 ? 51 ALA C CB 5 7
ATOM 5222 H H . ALA C 1 7 ? -6.219 8.676 4.958 1.00 0.00 ? 51 ALA C H 5 7
ATOM 5223 H HA . ALA C 1 7 ? -7.245 7.165 7.161 1.00 0.00 ? 51 ALA C HA 5 7
ATOM 5224 H HB1 . ALA C 1 7 ? -8.436 8.042 4.522 1.00 0.00 ? 51 ALA C HB1 5 7
ATOM 5225 H HB2 . ALA C 1 7 ? -9.337 7.198 5.732 1.00 0.00 ? 51 ALA C HB2 5 7
ATOM 5226 H HB3 . ALA C 1 7 ? -8.678 8.761 6.079 1.00 0.00 ? 51 ALA C HB3 5 7
ATOM 5227 N N . ALA C 1 8 ? -6.137 5.393 4.883 1.00 0.00 ? 52 ALA C N 5 8
ATOM 5228 C CA . ALA C 1 8 ? -5.715 4.029 4.690 1.00 0.00 ? 52 ALA C CA 5 8
ATOM 5229 C C . ALA C 1 8 ? -4.281 3.838 5.107 1.00 0.00 ? 52 ALA C C 5 8
ATOM 5230 O O . ALA C 1 8 ? -3.969 3.001 5.936 1.00 0.00 ? 52 ALA C O 5 8
ATOM 5231 C CB . ALA C 1 8 ? -5.950 3.659 3.257 1.00 0.00 ? 52 ALA C CB 5 8
ATOM 5232 H H . ALA C 1 8 ? -5.565 6.120 4.491 1.00 0.00 ? 52 ALA C H 5 8
ATOM 5233 H HA . ALA C 1 8 ? -6.346 3.382 5.274 1.00 0.00 ? 52 ALA C HA 5 8
ATOM 5234 H HB1 . ALA C 1 8 ? -6.928 3.921 2.960 1.00 0.00 ? 52 ALA C HB1 5 8
ATOM 5235 H HB2 . ALA C 1 8 ? -5.287 4.166 2.646 1.00 0.00 ? 52 ALA C HB2 5 8
ATOM 5236 H HB3 . ALA C 1 8 ? -5.768 2.633 3.119 1.00 0.00 ? 52 ALA C HB3 5 8
ATOM 5237 N N . ILE C 1 9 ? -3.365 4.594 4.512 1.00 0.00 ? 53 ILE C N 5 9
ATOM 5238 C CA . ILE C 1 9 ? -1.941 4.384 4.592 1.00 0.00 ? 53 ILE C CA 5 9
ATOM 5239 C C . ILE C 1 9 ? -1.410 4.539 6.007 1.00 0.00 ? 53 ILE C C 5 9
ATOM 5240 O O . ILE C 1 9 ? -0.427 3.914 6.376 1.00 0.00 ? 53 ILE C O 5 9
ATOM 5241 C CB . ILE C 1 9 ? -1.213 5.286 3.607 1.00 0.00 ? 53 ILE C CB 5 9
ATOM 5242 C CG1 . ILE C 1 9 ? -1.747 5.275 2.184 1.00 0.00 ? 53 ILE C CG1 5 9
ATOM 5243 C CG2 . ILE C 1 9 ? 0.256 4.898 3.556 1.00 0.00 ? 53 ILE C CG2 5 9
ATOM 5244 C CD1 . ILE C 1 9 ? -2.052 3.904 1.636 1.00 0.00 ? 53 ILE C CD1 5 9
ATOM 5245 H H . ILE C 1 9 ? -3.712 5.320 3.913 1.00 0.00 ? 53 ILE C H 5 9
ATOM 5246 H HA . ILE C 1 9 ? -1.757 3.351 4.310 1.00 0.00 ? 53 ILE C HA 5 9
ATOM 5247 H HB . ILE C 1 9 ? -1.276 6.304 3.979 1.00 0.00 ? 53 ILE C HB 5 9
ATOM 5248 H HG12 . ILE C 1 9 ? -2.658 5.871 2.152 1.00 0.00 ? 53 ILE C HG12 5 9
ATOM 5249 H HG13 . ILE C 1 9 ? -1.045 5.756 1.536 1.00 0.00 ? 53 ILE C HG13 5 9
ATOM 5250 H HG21 . ILE C 1 9 ? 0.715 5.451 2.765 1.00 0.00 ? 53 ILE C HG21 5 9
ATOM 5251 H HG22 . ILE C 1 9 ? 0.752 5.159 4.475 1.00 0.00 ? 53 ILE C HG22 5 9
ATOM 5252 H HG23 . ILE C 1 9 ? 0.359 3.840 3.444 1.00 0.00 ? 53 ILE C HG23 5 9
ATOM 5253 H HD11 . ILE C 1 9 ? -2.838 3.461 2.190 1.00 0.00 ? 53 ILE C HD11 5 9
ATOM 5254 H HD12 . ILE C 1 9 ? -2.385 3.960 0.633 1.00 0.00 ? 53 ILE C HD12 5 9
ATOM 5255 H HD13 . ILE C 1 9 ? -1.194 3.280 1.701 1.00 0.00 ? 53 ILE C HD13 5 9
ATOM 5256 N N . LYS C 1 10 ? -2.070 5.313 6.861 1.00 0.00 ? 54 LYS C N 5 10
ATOM 5257 C CA . LYS C 1 10 ? -1.556 5.583 8.183 1.00 0.00 ? 54 LYS C CA 5 10
ATOM 5258 C C . LYS C 1 10 ? -1.759 4.407 9.113 1.00 0.00 ? 54 LYS C C 5 10
ATOM 5259 O O . LYS C 1 10 ? -0.868 4.117 9.886 1.00 0.00 ? 54 LYS C O 5 10
ATOM 5260 C CB . LYS C 1 10 ? -2.208 6.870 8.667 1.00 0.00 ? 54 LYS C CB 5 10
ATOM 5261 C CG . LYS C 1 10 ? -1.402 7.800 9.556 1.00 0.00 ? 54 LYS C CG 5 10
ATOM 5262 C CD . LYS C 1 10 ? -1.211 7.356 10.989 1.00 0.00 ? 54 LYS C CD 5 10
ATOM 5263 C CE . LYS C 1 10 ? -2.490 7.324 11.770 1.00 0.00 ? 54 LYS C CE 5 10
ATOM 5264 N NZ . LYS C 1 10 ? -2.267 7.109 13.176 1.00 0.00 ? 54 LYS C NZ 5 10
ATOM 5265 H H . LYS C 1 10 ? -2.978 5.645 6.596 1.00 0.00 ? 54 LYS C H 5 10
ATOM 5266 H HA . LYS C 1 10 ? -0.489 5.742 8.115 1.00 0.00 ? 54 LYS C HA 5 10
ATOM 5267 H HB2 . LYS C 1 10 ? -2.476 7.443 7.780 1.00 0.00 ? 54 LYS C HB2 5 10
ATOM 5268 H HB3 . LYS C 1 10 ? -3.159 6.614 9.118 1.00 0.00 ? 54 LYS C HB3 5 10
ATOM 5269 H HG2 . LYS C 1 10 ? -0.420 7.941 9.105 1.00 0.00 ? 54 LYS C HG2 5 10
ATOM 5270 H HG3 . LYS C 1 10 ? -1.887 8.761 9.568 1.00 0.00 ? 54 LYS C HG3 5 10
ATOM 5271 H HD2 . LYS C 1 10 ? -0.756 6.366 11.001 1.00 0.00 ? 54 LYS C HD2 5 10
ATOM 5272 H HD3 . LYS C 1 10 ? -0.531 8.027 11.473 1.00 0.00 ? 54 LYS C HD3 5 10
ATOM 5273 H HE2 . LYS C 1 10 ? -3.018 8.268 11.633 1.00 0.00 ? 54 LYS C HE2 5 10
ATOM 5274 H HE3 . LYS C 1 10 ? -3.118 6.574 11.388 1.00 0.00 ? 54 LYS C HE3 5 10
ATOM 5275 H HZ1 . LYS C 1 10 ? -1.791 6.287 13.344 1.00 0.00 ? 54 LYS C HZ1 5 10
ATOM 5276 H HZ2 . LYS C 1 10 ? -1.757 7.834 13.558 1.00 0.00 ? 54 LYS C HZ2 5 10
ATOM 5277 H HZ3 . LYS C 1 10 ? -3.103 7.062 13.662 1.00 0.00 ? 54 LYS C HZ3 5 10
ATOM 5278 N N . ALA C 1 11 ? -2.879 3.706 8.992 1.00 0.00 ? 55 ALA C N 5 11
ATOM 5279 C CA . ALA C 1 11 ? -3.038 2.378 9.538 1.00 0.00 ? 55 ALA C CA 5 11
ATOM 5280 C C . ALA C 1 11 ? -2.167 1.346 8.848 1.00 0.00 ? 55 ALA C C 5 11
ATOM 5281 O O . ALA C 1 11 ? -1.514 0.555 9.508 1.00 0.00 ? 55 ALA C O 5 11
ATOM 5282 C CB . ALA C 1 11 ? -4.499 1.997 9.470 1.00 0.00 ? 55 ALA C CB 5 11
ATOM 5283 H H . ALA C 1 11 ? -3.592 4.062 8.385 1.00 0.00 ? 55 ALA C H 5 11
ATOM 5284 H HA . ALA C 1 11 ? -2.759 2.352 10.581 1.00 0.00 ? 55 ALA C HA 5 11
ATOM 5285 H HB1 . ALA C 1 11 ? -4.835 1.966 8.452 1.00 0.00 ? 55 ALA C HB1 5 11
ATOM 5286 H HB2 . ALA C 1 11 ? -4.662 1.042 9.924 1.00 0.00 ? 55 ALA C HB2 5 11
ATOM 5287 H HB3 . ALA C 1 11 ? -5.074 2.734 9.990 1.00 0.00 ? 55 ALA C HB3 5 11
ATOM 5288 N N . ILE C 1 12 ? -2.102 1.361 7.522 1.00 0.00 ? 56 ILE C N 5 12
ATOM 5289 C CA . ILE C 1 12 ? -1.478 0.309 6.752 1.00 0.00 ? 56 ILE C CA 5 12
ATOM 5290 C C . ILE C 1 12 ? 0.019 0.358 6.987 1.00 0.00 ? 56 ILE C C 5 12
ATOM 5291 O O . ILE C 1 12 ? 0.610 -0.696 7.161 1.00 0.00 ? 56 ILE C O 5 12
ATOM 5292 C CB . ILE C 1 12 ? -1.903 0.353 5.301 1.00 0.00 ? 56 ILE C CB 5 12
ATOM 5293 C CG1 . ILE C 1 12 ? -3.319 -0.122 5.126 1.00 0.00 ? 56 ILE C CG1 5 12
ATOM 5294 C CG2 . ILE C 1 12 ? -0.974 -0.388 4.363 1.00 0.00 ? 56 ILE C CG2 5 12
ATOM 5295 C CD1 . ILE C 1 12 ? -3.595 -1.587 5.253 1.00 0.00 ? 56 ILE C CD1 5 12
ATOM 5296 H H . ILE C 1 12 ? -2.587 2.089 7.027 1.00 0.00 ? 56 ILE C H 5 12
ATOM 5297 H HA . ILE C 1 12 ? -1.756 -0.642 7.195 1.00 0.00 ? 56 ILE C HA 5 12
ATOM 5298 H HB . ILE C 1 12 ? -1.903 1.396 5.035 1.00 0.00 ? 56 ILE C HB 5 12
ATOM 5299 H HG12 . ILE C 1 12 ? -3.935 0.395 5.862 1.00 0.00 ? 56 ILE C HG12 5 12
ATOM 5300 H HG13 . ILE C 1 12 ? -3.649 0.202 4.170 1.00 0.00 ? 56 ILE C HG13 5 12
ATOM 5301 H HG21 . ILE C 1 12 ? -0.024 0.096 4.282 1.00 0.00 ? 56 ILE C HG21 5 12
ATOM 5302 H HG22 . ILE C 1 12 ? -0.800 -1.388 4.713 1.00 0.00 ? 56 ILE C HG22 5 12
ATOM 5303 H HG23 . ILE C 1 12 ? -1.394 -0.466 3.380 1.00 0.00 ? 56 ILE C HG23 5 12
ATOM 5304 H HD11 . ILE C 1 12 ? -4.355 -1.875 5.172 1.00 0.00 ? 56 ILE C HD11 5 12
ATOM 5305 H HD12 . ILE C 1 12 ? -3.423 -1.915 5.912 1.00 0.00 ? 56 ILE C HD12 5 12
ATOM 5306 H HD13 . ILE C 1 12 ? -3.259 -2.039 4.728 1.00 0.00 ? 56 ILE C HD13 5 12
ATOM 5307 N N . ALA C 1 13 ? 0.661 1.516 7.104 1.00 0.00 ? 57 ALA C N 5 13
ATOM 5308 C CA . ALA C 1 13 ? 2.070 1.571 7.404 1.00 0.00 ? 57 ALA C CA 5 13
ATOM 5309 C C . ALA C 1 13 ? 2.473 1.038 8.766 1.00 0.00 ? 57 ALA C C 5 13
ATOM 5310 O O . ALA C 1 13 ? 3.621 0.710 9.006 1.00 0.00 ? 57 ALA C O 5 13
ATOM 5311 C CB . ALA C 1 13 ? 2.522 3.003 7.187 1.00 0.00 ? 57 ALA C CB 5 13
ATOM 5312 H H . ALA C 1 13 ? 0.084 2.326 6.989 1.00 0.00 ? 57 ALA C H 5 13
ATOM 5313 H HA . ALA C 1 13 ? 2.599 0.963 6.678 1.00 0.00 ? 57 ALA C HA 5 13
ATOM 5314 H HB1 . ALA C 1 13 ? 3.596 3.039 7.252 1.00 0.00 ? 57 ALA C HB1 5 13
ATOM 5315 H HB2 . ALA C 1 13 ? 2.189 3.294 6.206 1.00 0.00 ? 57 ALA C HB2 5 13
ATOM 5316 H HB3 . ALA C 1 13 ? 2.084 3.641 7.939 1.00 0.00 ? 57 ALA C HB3 5 13
ATOM 5317 N N . ALA C 1 14 ? 1.518 0.895 9.671 1.00 0.00 ? 58 ALA C N 5 14
ATOM 5318 C CA . ALA C 1 14 ? 1.681 0.312 10.981 1.00 0.00 ? 58 ALA C CA 5 14
ATOM 5319 C C . ALA C 1 14 ? 1.378 -1.175 10.958 1.00 0.00 ? 58 ALA C C 5 14
ATOM 5320 O O . ALA C 1 14 ? 2.056 -1.992 11.558 1.00 0.00 ? 58 ALA C O 5 14
ATOM 5321 C CB . ALA C 1 14 ? 0.833 1.069 11.979 1.00 0.00 ? 58 ALA C CB 5 14
ATOM 5322 H H . ALA C 1 14 ? 0.588 1.071 9.350 1.00 0.00 ? 58 ALA C H 5 14
ATOM 5323 H HA . ALA C 1 14 ? 2.716 0.409 11.285 1.00 0.00 ? 58 ALA C HA 5 14
ATOM 5324 H HB1 . ALA C 1 14 ? 1.020 1.323 12.474 1.00 0.00 ? 58 ALA C HB1 5 14
ATOM 5325 H HB2 . ALA C 1 14 ? 0.466 1.582 11.921 1.00 0.00 ? 58 ALA C HB2 5 14
ATOM 5326 H HB3 . ALA C 1 14 ? 0.415 0.878 12.297 1.00 0.00 ? 58 ALA C HB3 5 14
ATOM 5327 N N . ILE C 1 15 ? 0.341 -1.582 10.234 1.00 0.00 ? 59 ILE C N 5 15
ATOM 5328 C CA . ILE C 1 15 ? -0.027 -2.927 9.868 1.00 0.00 ? 59 ILE C CA 5 15
ATOM 5329 C C . ILE C 1 15 ? 1.119 -3.559 9.104 1.00 0.00 ? 59 ILE C C 5 15
ATOM 5330 O O . ILE C 1 15 ? 1.385 -4.733 9.303 1.00 0.00 ? 59 ILE C O 5 15
ATOM 5331 C CB . ILE C 1 15 ? -1.339 -2.905 9.107 1.00 0.00 ? 59 ILE C CB 5 15
ATOM 5332 C CG1 . ILE C 1 15 ? -2.474 -2.634 10.072 1.00 0.00 ? 59 ILE C CG1 5 15
ATOM 5333 C CG2 . ILE C 1 15 ? -1.613 -4.164 8.302 1.00 0.00 ? 59 ILE C CG2 5 15
ATOM 5334 C CD1 . ILE C 1 15 ? -3.711 -2.050 9.411 1.00 0.00 ? 59 ILE C CD1 5 15
ATOM 5335 H H . ILE C 1 15 ? -0.157 -0.830 9.805 1.00 0.00 ? 59 ILE C H 5 15
ATOM 5336 H HA . ILE C 1 15 ? -0.109 -3.533 10.759 1.00 0.00 ? 59 ILE C HA 5 15
ATOM 5337 H HB . ILE C 1 15 ? -1.271 -2.105 8.379 1.00 0.00 ? 59 ILE C HB 5 15
ATOM 5338 H HG12 . ILE C 1 15 ? -2.734 -3.562 10.582 1.00 0.00 ? 59 ILE C HG12 5 15
ATOM 5339 H HG13 . ILE C 1 15 ? -2.190 -1.913 10.822 1.00 0.00 ? 59 ILE C HG13 5 15
ATOM 5340 H HG21 . ILE C 1 15 ? -0.824 -4.303 7.595 1.00 0.00 ? 59 ILE C HG21 5 15
ATOM 5341 H HG22 . ILE C 1 15 ? -1.642 -4.995 8.971 1.00 0.00 ? 59 ILE C HG22 5 15
ATOM 5342 H HG23 . ILE C 1 15 ? -2.535 -4.076 7.760 1.00 0.00 ? 59 ILE C HG23 5 15
ATOM 5343 H HD11 . ILE C 1 15 ? -4.127 -2.697 8.668 1.00 0.00 ? 59 ILE C HD11 5 15
ATOM 5344 H HD12 . ILE C 1 15 ? -4.470 -1.859 10.133 1.00 0.00 ? 59 ILE C HD12 5 15
ATOM 5345 H HD13 . ILE C 1 15 ? -3.480 -1.116 8.954 1.00 0.00 ? 59 ILE C HD13 5 15
ATOM 5346 N N . ILE C 1 16 ? 1.875 -2.818 8.302 1.00 0.00 ? 60 ILE C N 5 16
ATOM 5347 C CA . ILE C 1 16 ? 3.057 -3.286 7.613 1.00 0.00 ? 60 ILE C CA 5 16
ATOM 5348 C C . ILE C 1 16 ? 4.142 -3.701 8.589 1.00 0.00 ? 60 ILE C C 5 16
ATOM 5349 O O . ILE C 1 16 ? 4.698 -4.786 8.516 1.00 0.00 ? 60 ILE C O 5 16
ATOM 5350 C CB . ILE C 1 16 ? 3.554 -2.232 6.635 1.00 0.00 ? 60 ILE C CB 5 16
ATOM 5351 C CG1 . ILE C 1 16 ? 2.721 -2.429 5.380 1.00 0.00 ? 60 ILE C CG1 5 16
ATOM 5352 C CG2 . ILE C 1 16 ? 5.038 -2.318 6.342 1.00 0.00 ? 60 ILE C CG2 5 16
ATOM 5353 C CD1 . ILE C 1 16 ? 3.088 -1.706 4.099 1.00 0.00 ? 60 ILE C CD1 5 16
ATOM 5354 H H . ILE C 1 16 ? 1.496 -1.926 8.045 1.00 0.00 ? 60 ILE C H 5 16
ATOM 5355 H HA . ILE C 1 16 ? 2.772 -4.182 7.067 1.00 0.00 ? 60 ILE C HA 5 16
ATOM 5356 H HB . ILE C 1 16 ? 3.344 -1.252 7.050 1.00 0.00 ? 60 ILE C HB 5 16
ATOM 5357 H HG12 . ILE C 1 16 ? 2.709 -3.496 5.161 1.00 0.00 ? 60 ILE C HG12 5 16
ATOM 5358 H HG13 . ILE C 1 16 ? 1.715 -2.136 5.615 1.00 0.00 ? 60 ILE C HG13 5 16
ATOM 5359 H HG21 . ILE C 1 16 ? 5.321 -1.627 5.559 1.00 0.00 ? 60 ILE C HG21 5 16
ATOM 5360 H HG22 . ILE C 1 16 ? 5.633 -2.042 7.195 1.00 0.00 ? 60 ILE C HG22 5 16
ATOM 5361 H HG23 . ILE C 1 16 ? 5.327 -3.312 6.041 1.00 0.00 ? 60 ILE C HG23 5 16
ATOM 5362 H HD11 . ILE C 1 16 ? 2.330 -1.893 3.383 1.00 0.00 ? 60 ILE C HD11 5 16
ATOM 5363 H HD12 . ILE C 1 16 ? 3.109 -0.656 4.296 1.00 0.00 ? 60 ILE C HD12 5 16
ATOM 5364 H HD13 . ILE C 1 16 ? 4.036 -2.068 3.758 1.00 0.00 ? 60 ILE C HD13 5 16
ATOM 5365 N N . LYS C 1 17 ? 4.447 -2.818 9.522 1.00 0.00 ? 61 LYS C N 5 17
ATOM 5366 C CA . LYS C 1 17 ? 5.410 -2.979 10.588 1.00 0.00 ? 61 LYS C CA 5 17
ATOM 5367 C C . LYS C 1 17 ? 5.084 -4.156 11.482 1.00 0.00 ? 61 LYS C C 5 17
ATOM 5368 O O . LYS C 1 17 ? 5.942 -4.922 11.858 1.00 0.00 ? 61 LYS C O 5 17
ATOM 5369 C CB . LYS C 1 17 ? 5.552 -1.693 11.376 1.00 0.00 ? 61 LYS C CB 5 17
ATOM 5370 C CG . LYS C 1 17 ? 6.716 -1.698 12.337 1.00 0.00 ? 61 LYS C CG 5 17
ATOM 5371 C CD . LYS C 1 17 ? 7.021 -0.341 12.924 1.00 0.00 ? 61 LYS C CD 5 17
ATOM 5372 C CE . LYS C 1 17 ? 6.033 0.226 13.822 1.00 0.00 ? 61 LYS C CE 5 17
ATOM 5373 N NZ . LYS C 1 17 ? 6.021 -0.370 15.066 1.00 0.00 ? 61 LYS C NZ 5 17
ATOM 5374 H H . LYS C 1 17 ? 3.916 -1.974 9.493 1.00 0.00 ? 61 LYS C H 5 17
ATOM 5375 H HA . LYS C 1 17 ? 6.369 -3.205 10.129 1.00 0.00 ? 61 LYS C HA 5 17
ATOM 5376 H HB2 . LYS C 1 17 ? 5.660 -0.856 10.685 1.00 0.00 ? 61 LYS C HB2 5 17
ATOM 5377 H HB3 . LYS C 1 17 ? 4.652 -1.546 11.926 1.00 0.00 ? 61 LYS C HB3 5 17
ATOM 5378 H HG2 . LYS C 1 17 ? 6.515 -2.405 13.142 1.00 0.00 ? 61 LYS C HG2 5 17
ATOM 5379 H HG3 . LYS C 1 17 ? 7.583 -2.028 11.820 1.00 0.00 ? 61 LYS C HG3 5 17
ATOM 5380 H HD2 . LYS C 1 17 ? 7.983 -0.379 13.435 1.00 0.00 ? 61 LYS C HD2 5 17
ATOM 5381 H HD3 . LYS C 1 17 ? 7.085 0.288 12.106 1.00 0.00 ? 61 LYS C HD3 5 17
ATOM 5382 H HE2 . LYS C 1 17 ? 6.236 1.289 13.947 1.00 0.00 ? 61 LYS C HE2 5 17
ATOM 5383 H HE3 . LYS C 1 17 ? 5.110 0.159 13.366 1.00 0.00 ? 61 LYS C HE3 5 17
ATOM 5384 H HZ1 . LYS C 1 17 ? 5.765 -1.272 14.975 1.00 0.00 ? 61 LYS C HZ1 5 17
ATOM 5385 H HZ2 . LYS C 1 17 ? 6.838 -0.304 15.504 1.00 0.00 ? 61 LYS C HZ2 5 17
ATOM 5386 H HZ3 . LYS C 1 17 ? 5.436 0.080 15.665 1.00 0.00 ? 61 LYS C HZ3 5 17
ATOM 5387 N N . ALA C 1 18 ? 3.803 -4.361 11.749 1.00 0.00 ? 62 ALA C N 5 18
ATOM 5388 C CA . ALA C 1 18 ? 3.258 -5.488 12.458 1.00 0.00 ? 62 ALA C CA 5 18
ATOM 5389 C C . ALA C 1 18 ? 3.296 -6.776 11.662 1.00 0.00 ? 62 ALA C C 5 18
ATOM 5390 O O . ALA C 1 18 ? 3.550 -7.841 12.191 1.00 0.00 ? 62 ALA C O 5 18
ATOM 5391 C CB . ALA C 1 18 ? 1.868 -5.137 12.927 1.00 0.00 ? 62 ALA C CB 5 18
ATOM 5392 H H . ALA C 1 18 ? 3.171 -3.701 11.357 1.00 0.00 ? 62 ALA C H 5 18
ATOM 5393 H HA . ALA C 1 18 ? 3.854 -5.616 13.343 1.00 0.00 ? 62 ALA C HA 5 18
ATOM 5394 H HB1 . ALA C 1 18 ? 1.550 -5.871 13.631 1.00 0.00 ? 62 ALA C HB1 5 18
ATOM 5395 H HB2 . ALA C 1 18 ? 1.867 -4.177 13.395 1.00 0.00 ? 62 ALA C HB2 5 18
ATOM 5396 H HB3 . ALA C 1 18 ? 1.179 -5.142 12.118 1.00 0.00 ? 62 ALA C HB3 5 18
ATOM 5397 N N . GLY C 1 19 ? 3.067 -6.696 10.360 1.00 0.00 ? 63 GLY C N 5 19
ATOM 5398 C CA . GLY C 1 19 ? 2.959 -7.763 9.402 1.00 0.00 ? 63 GLY C CA 5 19
ATOM 5399 C C . GLY C 1 19 ? 4.241 -8.520 9.141 1.00 0.00 ? 63 GLY C C 5 19
ATOM 5400 O O . GLY C 1 19 ? 4.198 -9.655 8.738 1.00 0.00 ? 63 GLY C O 5 19
ATOM 5401 H H . GLY C 1 19 ? 2.860 -5.782 10.027 1.00 0.00 ? 63 GLY C H 5 19
ATOM 5402 H HA2 . GLY C 1 19 ? 2.227 -8.454 9.743 1.00 0.00 ? 63 GLY C HA2 5 19
ATOM 5403 H HA3 . GLY C 1 19 ? 2.602 -7.374 8.464 1.00 0.00 ? 63 GLY C HA3 5 19
ATOM 5404 N N . GLY C 1 20 ? 5.385 -7.899 9.364 1.00 0.00 ? 64 GLY C N 5 20
ATOM 5405 C CA . GLY C 1 20 ? 6.688 -8.440 9.109 1.00 0.00 ? 64 GLY C CA 5 20
ATOM 5406 C C . GLY C 1 20 ? 7.178 -8.385 7.678 1.00 0.00 ? 64 GLY C C 5 20
ATOM 5407 O O . GLY C 1 20 ? 8.055 -9.134 7.297 1.00 0.00 ? 64 GLY C O 5 20
ATOM 5408 H H . GLY C 1 20 ? 5.310 -6.952 9.626 1.00 0.00 ? 64 GLY C H 5 20
ATOM 5409 H HA2 . GLY C 1 20 ? 7.369 -7.880 9.725 1.00 0.00 ? 64 GLY C HA2 5 20
ATOM 5410 H HA3 . GLY C 1 20 ? 6.736 -9.466 9.448 1.00 0.00 ? 64 GLY C HA3 5 20
ATOM 5411 N N . TYR C 1 21 ? 6.573 -7.537 6.849 1.00 0.00 ? 65 TYR C N 5 21
ATOM 5412 C CA . TYR C 1 21 ? 6.893 -7.274 5.470 1.00 0.00 ? 65 TYR C CA 5 21
ATOM 5413 C C . TYR C 1 21 ? 8.338 -6.938 5.178 1.00 0.00 ? 65 TYR C C 5 21
ATOM 5414 O O . TYR C 1 21 ? 8.792 -7.177 4.116 1.00 0.00 ? 65 TYR C O 5 21
ATOM 5415 C CB . TYR C 1 21 ? 5.987 -6.122 5.080 1.00 0.00 ? 65 TYR C CB 5 21
ATOM 5416 C CG . TYR C 1 21 ? 4.661 -6.459 4.462 1.00 0.00 ? 65 TYR C CG 5 21
ATOM 5417 C CD1 . TYR C 1 21 ? 4.514 -7.105 3.248 1.00 0.00 ? 65 TYR C CD1 5 21
ATOM 5418 C CD2 . TYR C 1 21 ? 3.528 -5.981 5.122 1.00 0.00 ? 65 TYR C CD2 5 21
ATOM 5419 C CE1 . TYR C 1 21 ? 3.270 -7.211 2.628 1.00 0.00 ? 65 TYR C CE1 5 21
ATOM 5420 C CE2 . TYR C 1 21 ? 2.286 -6.003 4.497 1.00 0.00 ? 65 TYR C CE2 5 21
ATOM 5421 C CZ . TYR C 1 21 ? 2.168 -6.612 3.241 1.00 0.00 ? 65 TYR C CZ 5 21
ATOM 5422 O OH . TYR C 1 21 ? 0.931 -6.700 2.689 1.00 0.00 ? 65 TYR C OH 5 21
ATOM 5423 H H . TYR C 1 21 ? 5.870 -6.962 7.253 1.00 0.00 ? 65 TYR C H 5 21
ATOM 5424 H HA . TYR C 1 21 ? 6.674 -8.138 4.871 1.00 0.00 ? 65 TYR C HA 5 21
ATOM 5425 H HB2 . TYR C 1 21 ? 5.801 -5.537 5.981 1.00 0.00 ? 65 TYR C HB2 5 21
ATOM 5426 H HB3 . TYR C 1 21 ? 6.461 -5.451 4.374 1.00 0.00 ? 65 TYR C HB3 5 21
ATOM 5427 H HD1 . TYR C 1 21 ? 5.396 -7.453 2.763 1.00 0.00 ? 65 TYR C HD1 5 21
ATOM 5428 H HD2 . TYR C 1 21 ? 3.644 -5.569 6.096 1.00 0.00 ? 65 TYR C HD2 5 21
ATOM 5429 H HE1 . TYR C 1 21 ? 3.163 -7.695 1.686 1.00 0.00 ? 65 TYR C HE1 5 21
ATOM 5430 H HE2 . TYR C 1 21 ? 1.436 -5.577 4.987 1.00 0.00 ? 65 TYR C HE2 5 21
ATOM 5431 H HH . TYR C 1 21 ? 0.374 -7.119 3.303 1.00 0.00 ? 65 TYR C HH 5 21
HETATM 5432 N N . NH2 C 1 22 ? 9.096 -6.432 6.056 1.00 0.00 ? 66 NH2 C N 5 22
HETATM 5433 H HN1 . NH2 C 1 22 ? 10.015 -6.191 5.782 1.00 0.00 ? 66 NH2 C HN1 5 22
HETATM 5434 H HN2 . NH2 C 1 22 ? 8.704 -6.229 6.877 1.00 0.00 ? 66 NH2 C HN2 5 22
HETATM 5435 C C . ACE D 1 1 ? 4.677 -11.742 4.628 1.00 0.00 ? 67 ACE D C 5 1
HETATM 5436 O O . ACE D 1 1 ? 4.174 -10.986 3.855 1.00 0.00 ? 67 ACE D O 5 1
HETATM 5437 C CH3 . ACE D 1 1 ? 5.669 -11.220 5.609 1.00 0.00 ? 67 ACE D CH3 5 1
HETATM 5438 H H1 . ACE D 1 1 ? 5.924 -11.489 6.085 1.00 0.00 ? 67 ACE D H1 5 1
HETATM 5439 H H2 . ACE D 1 1 ? 6.210 -10.996 5.492 1.00 0.00 ? 67 ACE D H2 5 1
HETATM 5440 H H3 . ACE D 1 1 ? 5.580 -10.774 5.886 1.00 0.00 ? 67 ACE D H3 5 1
ATOM 5441 N N . ALA D 1 2 ? 4.389 -13.017 4.610 1.00 0.00 ? 68 ALA D N 5 2
ATOM 5442 C CA . ALA D 1 2 ? 3.523 -13.630 3.658 1.00 0.00 ? 68 ALA D CA 5 2
ATOM 5443 C C . ALA D 1 2 ? 2.050 -13.559 3.964 1.00 0.00 ? 68 ALA D C 5 2
ATOM 5444 O O . ALA D 1 2 ? 1.229 -13.500 3.079 1.00 0.00 ? 68 ALA D O 5 2
ATOM 5445 C CB . ALA D 1 2 ? 3.937 -15.045 3.562 1.00 0.00 ? 68 ALA D CB 5 2
ATOM 5446 H H . ALA D 1 2 ? 4.856 -13.600 5.248 1.00 0.00 ? 68 ALA D H 5 2
ATOM 5447 H HA . ALA D 1 2 ? 3.655 -13.160 2.723 1.00 0.00 ? 68 ALA D HA 5 2
ATOM 5448 H HB1 . ALA D 1 2 ? 3.720 -15.522 4.458 1.00 0.00 ? 68 ALA D HB1 5 2
ATOM 5449 H HB2 . ALA D 1 2 ? 3.401 -15.496 2.769 1.00 0.00 ? 68 ALA D HB2 5 2
ATOM 5450 H HB3 . ALA D 1 2 ? 4.973 -15.081 3.395 1.00 0.00 ? 68 ALA D HB3 5 2
ATOM 5451 N N . LYS D 1 3 ? 1.695 -13.532 5.234 1.00 0.00 ? 69 LYS D N 5 3
ATOM 5452 C CA . LYS D 1 3 ? 0.347 -13.389 5.728 1.00 0.00 ? 69 LYS D CA 5 3
ATOM 5453 C C . LYS D 1 3 ? -0.166 -11.968 5.700 1.00 0.00 ? 69 LYS D C 5 3
ATOM 5454 O O . LYS D 1 3 ? -1.252 -11.703 5.212 1.00 0.00 ? 69 LYS D O 5 3
ATOM 5455 C CB . LYS D 1 3 ? 0.274 -13.862 7.161 1.00 0.00 ? 69 LYS D CB 5 3
ATOM 5456 C CG . LYS D 1 3 ? 0.420 -15.343 7.315 1.00 0.00 ? 69 LYS D CG 5 3
ATOM 5457 C CD . LYS D 1 3 ? 0.233 -15.822 8.694 1.00 0.00 ? 69 LYS D CD 5 3
ATOM 5458 C CE . LYS D 1 3 ? 0.338 -17.274 8.795 1.00 0.00 ? 69 LYS D CE 5 3
ATOM 5459 N NZ . LYS D 1 3 ? 0.190 -17.799 10.086 1.00 0.00 ? 69 LYS D NZ 5 3
ATOM 5460 H H . LYS D 1 3 ? 2.439 -13.537 5.904 1.00 0.00 ? 69 LYS D H 5 3
ATOM 5461 H HA . LYS D 1 3 ? -0.341 -13.941 5.105 1.00 0.00 ? 69 LYS D HA 5 3
ATOM 5462 H HB2 . LYS D 1 3 ? 1.031 -13.357 7.761 1.00 0.00 ? 69 LYS D HB2 5 3
ATOM 5463 H HB3 . LYS D 1 3 ? -0.695 -13.570 7.499 1.00 0.00 ? 69 LYS D HB3 5 3
ATOM 5464 H HG2 . LYS D 1 3 ? -0.316 -15.832 6.676 1.00 0.00 ? 69 LYS D HG2 5 3
ATOM 5465 H HG3 . LYS D 1 3 ? 1.363 -15.642 6.955 1.00 0.00 ? 69 LYS D HG3 5 3
ATOM 5466 H HD2 . LYS D 1 3 ? 0.965 -15.353 9.351 1.00 0.00 ? 69 LYS D HD2 5 3
ATOM 5467 H HD3 . LYS D 1 3 ? -0.691 -15.540 9.000 1.00 0.00 ? 69 LYS D HD3 5 3
ATOM 5468 H HE2 . LYS D 1 3 ? -0.423 -17.722 8.157 1.00 0.00 ? 69 LYS D HE2 5 3
ATOM 5469 H HE3 . LYS D 1 3 ? 1.201 -17.531 8.420 1.00 0.00 ? 69 LYS D HE3 5 3
ATOM 5470 H HZ1 . LYS D 1 3 ? 0.445 -17.488 10.574 1.00 0.00 ? 69 LYS D HZ1 5 3
ATOM 5471 H HZ2 . LYS D 1 3 ? -0.414 -17.885 10.311 1.00 0.00 ? 69 LYS D HZ2 5 3
ATOM 5472 H HZ3 . LYS D 1 3 ? 0.406 -18.435 10.324 1.00 0.00 ? 69 LYS D HZ3 5 3
ATOM 5473 N N . ALA D 1 4 ? 0.710 -11.048 6.094 1.00 0.00 ? 70 ALA D N 5 4
ATOM 5474 C CA . ALA D 1 4 ? 0.647 -9.629 5.857 1.00 0.00 ? 70 ALA D CA 5 4
ATOM 5475 C C . ALA D 1 4 ? 0.266 -9.327 4.421 1.00 0.00 ? 70 ALA D C 5 4
ATOM 5476 O O . ALA D 1 4 ? -0.514 -8.433 4.124 1.00 0.00 ? 70 ALA D O 5 4
ATOM 5477 C CB . ALA D 1 4 ? 2.031 -9.080 6.141 1.00 0.00 ? 70 ALA D CB 5 4
ATOM 5478 H H . ALA D 1 4 ? 1.528 -11.404 6.527 1.00 0.00 ? 70 ALA D H 5 4
ATOM 5479 H HA . ALA D 1 4 ? -0.067 -9.168 6.522 1.00 0.00 ? 70 ALA D HA 5 4
ATOM 5480 H HB1 . ALA D 1 4 ? 2.419 -8.980 6.170 1.00 0.00 ? 70 ALA D HB1 5 4
ATOM 5481 H HB2 . ALA D 1 4 ? 2.403 -8.928 6.211 1.00 0.00 ? 70 ALA D HB2 5 4
ATOM 5482 H HB3 . ALA D 1 4 ? 2.377 -8.960 6.215 1.00 0.00 ? 70 ALA D HB3 5 4
ATOM 5483 N N . ALA D 1 5 ? 0.772 -10.145 3.506 1.00 0.00 ? 71 ALA D N 5 5
ATOM 5484 C CA . ALA D 1 5 ? 0.644 -10.010 2.072 1.00 0.00 ? 71 ALA D CA 5 5
ATOM 5485 C C . ALA D 1 5 ? -0.673 -10.529 1.525 1.00 0.00 ? 71 ALA D C 5 5
ATOM 5486 O O . ALA D 1 5 ? -0.910 -10.457 0.333 1.00 0.00 ? 71 ALA D O 5 5
ATOM 5487 C CB . ALA D 1 5 ? 1.836 -10.610 1.356 1.00 0.00 ? 71 ALA D CB 5 5
ATOM 5488 H H . ALA D 1 5 ? 1.283 -10.912 3.899 1.00 0.00 ? 71 ALA D H 5 5
ATOM 5489 H HA . ALA D 1 5 ? 0.601 -8.955 1.848 1.00 0.00 ? 71 ALA D HA 5 5
ATOM 5490 H HB1 . ALA D 1 5 ? 2.748 -10.217 1.734 1.00 0.00 ? 71 ALA D HB1 5 5
ATOM 5491 H HB2 . ALA D 1 5 ? 1.848 -11.665 1.475 1.00 0.00 ? 71 ALA D HB2 5 5
ATOM 5492 H HB3 . ALA D 1 5 ? 1.772 -10.345 0.323 1.00 0.00 ? 71 ALA D HB3 5 5
ATOM 5493 N N . ALA D 1 6 ? -1.621 -10.945 2.352 1.00 0.00 ? 72 ALA D N 5 6
ATOM 5494 C CA . ALA D 1 6 ? -3.038 -10.830 2.116 1.00 0.00 ? 72 ALA D CA 5 6
ATOM 5495 C C . ALA D 1 6 ? -3.698 -9.815 3.019 1.00 0.00 ? 72 ALA D C 5 6
ATOM 5496 O O . ALA D 1 6 ? -4.311 -8.871 2.545 1.00 0.00 ? 72 ALA D O 5 6
ATOM 5497 C CB . ALA D 1 6 ? -3.693 -12.192 2.218 1.00 0.00 ? 72 ALA D CB 5 6
ATOM 5498 H H . ALA D 1 6 ? -1.342 -11.029 3.300 1.00 0.00 ? 72 ALA D H 5 6
ATOM 5499 H HA . ALA D 1 6 ? -3.209 -10.438 1.118 1.00 0.00 ? 72 ALA D HA 5 6
ATOM 5500 H HB1 . ALA D 1 6 ? -3.484 -12.582 3.194 1.00 0.00 ? 72 ALA D HB1 5 6
ATOM 5501 H HB2 . ALA D 1 6 ? -4.749 -12.160 2.083 1.00 0.00 ? 72 ALA D HB2 5 6
ATOM 5502 H HB3 . ALA D 1 6 ? -3.286 -12.822 1.450 1.00 0.00 ? 72 ALA D HB3 5 6
ATOM 5503 N N . ALA D 1 7 ? -3.521 -9.897 4.332 1.00 0.00 ? 73 ALA D N 5 7
ATOM 5504 C CA . ALA D 1 7 ? -4.189 -9.142 5.363 1.00 0.00 ? 73 ALA D CA 5 7
ATOM 5505 C C . ALA D 1 7 ? -4.151 -7.644 5.185 1.00 0.00 ? 73 ALA D C 5 7
ATOM 5506 O O . ALA D 1 7 ? -5.117 -7.004 5.487 1.00 0.00 ? 73 ALA D O 5 7
ATOM 5507 C CB . ALA D 1 7 ? -3.579 -9.580 6.677 1.00 0.00 ? 73 ALA D CB 5 7
ATOM 5508 H H . ALA D 1 7 ? -2.889 -10.621 4.614 1.00 0.00 ? 73 ALA D H 5 7
ATOM 5509 H HA . ALA D 1 7 ? -5.233 -9.422 5.375 1.00 0.00 ? 73 ALA D HA 5 7
ATOM 5510 H HB1 . ALA D 1 7 ? -4.094 -9.073 7.450 1.00 0.00 ? 73 ALA D HB1 5 7
ATOM 5511 H HB2 . ALA D 1 7 ? -3.660 -10.629 6.805 1.00 0.00 ? 73 ALA D HB2 5 7
ATOM 5512 H HB3 . ALA D 1 7 ? -2.551 -9.317 6.700 1.00 0.00 ? 73 ALA D HB3 5 7
ATOM 5513 N N . ALA D 1 8 ? -3.076 -7.073 4.687 1.00 0.00 ? 74 ALA D N 5 8
ATOM 5514 C CA . ALA D 1 8 ? -3.001 -5.645 4.492 1.00 0.00 ? 74 ALA D CA 5 8
ATOM 5515 C C . ALA D 1 8 ? -3.530 -5.240 3.139 1.00 0.00 ? 74 ALA D C 5 8
ATOM 5516 O O . ALA D 1 8 ? -4.313 -4.329 2.982 1.00 0.00 ? 74 ALA D O 5 8
ATOM 5517 C CB . ALA D 1 8 ? -1.581 -5.148 4.651 1.00 0.00 ? 74 ALA D CB 5 8
ATOM 5518 H H . ALA D 1 8 ? -2.375 -7.689 4.353 1.00 0.00 ? 74 ALA D H 5 8
ATOM 5519 H HA . ALA D 1 8 ? -3.603 -5.169 5.250 1.00 0.00 ? 74 ALA D HA 5 8
ATOM 5520 H HB1 . ALA D 1 8 ? -1.384 -4.603 4.801 1.00 0.00 ? 74 ALA D HB1 5 8
ATOM 5521 H HB2 . ALA D 1 8 ? -1.187 -5.308 5.066 1.00 0.00 ? 74 ALA D HB2 5 8
ATOM 5522 H HB3 . ALA D 1 8 ? -1.126 -5.162 4.247 1.00 0.00 ? 74 ALA D HB3 5 8
ATOM 5523 N N . ILE D 1 9 ? -3.112 -5.986 2.122 1.00 0.00 ? 75 ILE D N 5 9
ATOM 5524 C CA . ILE D 1 9 ? -3.538 -5.831 0.755 1.00 0.00 ? 75 ILE D CA 5 9
ATOM 5525 C C . ILE D 1 9 ? -5.042 -5.899 0.569 1.00 0.00 ? 75 ILE D C 5 9
ATOM 5526 O O . ILE D 1 9 ? -5.645 -5.094 -0.129 1.00 0.00 ? 75 ILE D O 5 9
ATOM 5527 C CB . ILE D 1 9 ? -2.917 -6.887 -0.143 1.00 0.00 ? 75 ILE D CB 5 9
ATOM 5528 C CG1 . ILE D 1 9 ? -1.405 -7.018 -0.055 1.00 0.00 ? 75 ILE D CG1 5 9
ATOM 5529 C CG2 . ILE D 1 9 ? -3.350 -6.692 -1.579 1.00 0.00 ? 75 ILE D CG2 5 9
ATOM 5530 C CD1 . ILE D 1 9 ? -0.636 -5.739 -0.309 1.00 0.00 ? 75 ILE D CD1 5 9
ATOM 5531 H H . ILE D 1 9 ? -2.566 -6.784 2.357 1.00 0.00 ? 75 ILE D H 5 9
ATOM 5532 H HA . ILE D 1 9 ? -3.200 -4.861 0.420 1.00 0.00 ? 75 ILE D HA 5 9
ATOM 5533 H HB . ILE D 1 9 ? -3.371 -7.829 0.138 1.00 0.00 ? 75 ILE D HB 5 9
ATOM 5534 H HG12 . ILE D 1 9 ? -1.152 -7.370 0.945 1.00 0.00 ? 75 ILE D HG12 5 9
ATOM 5535 H HG13 . ILE D 1 9 ? -1.079 -7.791 -0.723 1.00 0.00 ? 75 ILE D HG13 5 9
ATOM 5536 H HG21 . ILE D 1 9 ? -2.977 -6.187 -1.950 1.00 0.00 ? 75 ILE D HG21 5 9
ATOM 5537 H HG22 . ILE D 1 9 ? -4.064 -6.485 -1.732 1.00 0.00 ? 75 ILE D HG22 5 9
ATOM 5538 H HG23 . ILE D 1 9 ? -3.345 -7.277 -2.078 1.00 0.00 ? 75 ILE D HG23 5 9
ATOM 5539 H HD11 . ILE D 1 9 ? -0.906 -5.007 0.401 1.00 0.00 ? 75 ILE D HD11 5 9
ATOM 5540 H HD12 . ILE D 1 9 ? 0.415 -5.920 -0.224 1.00 0.00 ? 75 ILE D HD12 5 9
ATOM 5541 H HD13 . ILE D 1 9 ? -0.828 -5.350 -1.292 1.00 0.00 ? 75 ILE D HD13 5 9
ATOM 5542 N N . LYS D 1 10 ? -5.667 -6.880 1.214 1.00 0.00 ? 76 LYS D N 5 10
ATOM 5543 C CA . LYS D 1 10 ? -7.078 -7.172 1.132 1.00 0.00 ? 76 LYS D CA 5 10
ATOM 5544 C C . LYS D 1 10 ? -7.967 -6.056 1.644 1.00 0.00 ? 76 LYS D C 5 10
ATOM 5545 O O . LYS D 1 10 ? -9.001 -5.791 1.048 1.00 0.00 ? 76 LYS D O 5 10
ATOM 5546 C CB . LYS D 1 10 ? -7.325 -8.460 1.899 1.00 0.00 ? 76 LYS D CB 5 10
ATOM 5547 C CG . LYS D 1 10 ? -7.078 -9.753 1.167 1.00 0.00 ? 76 LYS D CG 5 10
ATOM 5548 C CD . LYS D 1 10 ? -8.145 -10.076 0.166 1.00 0.00 ? 76 LYS D CD 5 10
ATOM 5549 C CE . LYS D 1 10 ? -7.897 -11.437 -0.387 1.00 0.00 ? 76 LYS D CE 5 10
ATOM 5550 N NZ . LYS D 1 10 ? -8.857 -11.806 -1.364 1.00 0.00 ? 76 LYS D NZ 5 10
ATOM 5551 H H . LYS D 1 10 ? -5.071 -7.494 1.737 1.00 0.00 ? 76 LYS D H 5 10
ATOM 5552 H HA . LYS D 1 10 ? -7.307 -7.246 0.075 1.00 0.00 ? 76 LYS D HA 5 10
ATOM 5553 H HB2 . LYS D 1 10 ? -6.676 -8.451 2.774 1.00 0.00 ? 76 LYS D HB2 5 10
ATOM 5554 H HB3 . LYS D 1 10 ? -8.329 -8.453 2.290 1.00 0.00 ? 76 LYS D HB3 5 10
ATOM 5555 H HG2 . LYS D 1 10 ? -6.107 -9.715 0.672 1.00 0.00 ? 76 LYS D HG2 5 10
ATOM 5556 H HG3 . LYS D 1 10 ? -7.064 -10.536 1.879 1.00 0.00 ? 76 LYS D HG3 5 10
ATOM 5557 H HD2 . LYS D 1 10 ? -9.131 -10.028 0.629 1.00 0.00 ? 76 LYS D HD2 5 10
ATOM 5558 H HD3 . LYS D 1 10 ? -8.119 -9.359 -0.603 1.00 0.00 ? 76 LYS D HD3 5 10
ATOM 5559 H HE2 . LYS D 1 10 ? -6.899 -11.482 -0.822 1.00 0.00 ? 76 LYS D HE2 5 10
ATOM 5560 H HE3 . LYS D 1 10 ? -7.931 -12.098 0.388 1.00 0.00 ? 76 LYS D HE3 5 10
ATOM 5561 H HZ1 . LYS D 1 10 ? -8.730 -11.305 -2.180 1.00 0.00 ? 76 LYS D HZ1 5 10
ATOM 5562 H HZ2 . LYS D 1 10 ? -8.769 -12.752 -1.598 1.00 0.00 ? 76 LYS D HZ2 5 10
ATOM 5563 H HZ3 . LYS D 1 10 ? -9.760 -11.677 -1.062 1.00 0.00 ? 76 LYS D HZ3 5 10
ATOM 5564 N N . ALA D 1 11 ? -7.536 -5.389 2.709 1.00 0.00 ? 77 ALA D N 5 11
ATOM 5565 C CA . ALA D 1 11 ? -8.071 -4.107 3.101 1.00 0.00 ? 77 ALA D CA 5 11
ATOM 5566 C C . ALA D 1 11 ? -7.800 -3.076 2.022 1.00 0.00 ? 77 ALA D C 5 11
ATOM 5567 O O . ALA D 1 11 ? -8.723 -2.469 1.508 1.00 0.00 ? 77 ALA D O 5 11
ATOM 5568 C CB . ALA D 1 11 ? -7.491 -3.707 4.441 1.00 0.00 ? 77 ALA D CB 5 11
ATOM 5569 H H . ALA D 1 11 ? -6.716 -5.748 3.150 1.00 0.00 ? 77 ALA D H 5 11
ATOM 5570 H HA . ALA D 1 11 ? -9.147 -4.176 3.179 1.00 0.00 ? 77 ALA D HA 5 11
ATOM 5571 H HB1 . ALA D 1 11 ? -7.560 -4.511 5.133 1.00 0.00 ? 77 ALA D HB1 5 11
ATOM 5572 H HB2 . ALA D 1 11 ? -6.464 -3.460 4.354 1.00 0.00 ? 77 ALA D HB2 5 11
ATOM 5573 H HB3 . ALA D 1 11 ? -8.007 -2.873 4.845 1.00 0.00 ? 77 ALA D HB3 5 11
ATOM 5574 N N . ILE D 1 12 ? -6.555 -2.866 1.603 1.00 0.00 ? 78 ILE D N 5 12
ATOM 5575 C CA . ILE D 1 12 ? -6.144 -1.746 0.783 1.00 0.00 ? 78 ILE D CA 5 12
ATOM 5576 C C . ILE D 1 12 ? -6.745 -1.788 -0.612 1.00 0.00 ? 78 ILE D C 5 12
ATOM 5577 O O . ILE D 1 12 ? -7.284 -0.769 -1.026 1.00 0.00 ? 78 ILE D O 5 12
ATOM 5578 C CB . ILE D 1 12 ? -4.636 -1.542 0.839 1.00 0.00 ? 78 ILE D CB 5 12
ATOM 5579 C CG1 . ILE D 1 12 ? -4.272 -0.167 1.347 1.00 0.00 ? 78 ILE D CG1 5 12
ATOM 5580 C CG2 . ILE D 1 12 ? -3.871 -1.904 -0.417 1.00 0.00 ? 78 ILE D CG2 5 12
ATOM 5581 C CD1 . ILE D 1 12 ? -4.574 0.998 0.452 1.00 0.00 ? 78 ILE D CD1 5 12
ATOM 5582 H H . ILE D 1 12 ? -5.884 -3.578 1.819 1.00 0.00 ? 78 ILE D H 5 12
ATOM 5583 H HA . ILE D 1 12 ? -6.616 -0.860 1.191 1.00 0.00 ? 78 ILE D HA 5 12
ATOM 5584 H HB . ILE D 1 12 ? -4.255 -2.203 1.604 1.00 0.00 ? 78 ILE D HB 5 12
ATOM 5585 H HG12 . ILE D 1 12 ? -4.807 -0.010 2.284 1.00 0.00 ? 78 ILE D HG12 5 12
ATOM 5586 H HG13 . ILE D 1 12 ? -3.233 -0.151 1.599 1.00 0.00 ? 78 ILE D HG13 5 12
ATOM 5587 H HG21 . ILE D 1 12 ? -4.087 -1.262 -1.231 1.00 0.00 ? 78 ILE D HG21 5 12
ATOM 5588 H HG22 . ILE D 1 12 ? -2.825 -1.821 -0.209 1.00 0.00 ? 78 ILE D HG22 5 12
ATOM 5589 H HG23 . ILE D 1 12 ? -4.094 -2.901 -0.695 1.00 0.00 ? 78 ILE D HG23 5 12
ATOM 5590 H HD11 . ILE D 1 12 ? -4.222 1.892 0.910 1.00 0.00 ? 78 ILE D HD11 5 12
ATOM 5591 H HD12 . ILE D 1 12 ? -4.129 0.908 -0.496 1.00 0.00 ? 78 ILE D HD12 5 12
ATOM 5592 H HD13 . ILE D 1 12 ? -5.622 1.091 0.320 1.00 0.00 ? 78 ILE D HD13 5 12
ATOM 5593 N N . ALA D 1 13 ? -6.797 -2.929 -1.294 1.00 0.00 ? 79 ALA D N 5 13
ATOM 5594 C CA . ALA D 1 13 ? -7.396 -2.969 -2.607 1.00 0.00 ? 79 ALA D CA 5 13
ATOM 5595 C C . ALA D 1 13 ? -8.898 -2.754 -2.645 1.00 0.00 ? 79 ALA D C 5 13
ATOM 5596 O O . ALA D 1 13 ? -9.436 -2.425 -3.686 1.00 0.00 ? 79 ALA D O 5 13
ATOM 5597 C CB . ALA D 1 13 ? -7.034 -4.302 -3.243 1.00 0.00 ? 79 ALA D CB 5 13
ATOM 5598 H H . ALA D 1 13 ? -6.420 -3.732 -0.822 1.00 0.00 ? 79 ALA D H 5 13
ATOM 5599 H HA . ALA D 1 13 ? -6.978 -2.176 -3.213 1.00 0.00 ? 79 ALA D HA 5 13
ATOM 5600 H HB1 . ALA D 1 13 ? -5.988 -4.478 -3.168 1.00 0.00 ? 79 ALA D HB1 5 13
ATOM 5601 H HB2 . ALA D 1 13 ? -7.533 -5.069 -2.706 1.00 0.00 ? 79 ALA D HB2 5 13
ATOM 5602 H HB3 . ALA D 1 13 ? -7.327 -4.314 -4.263 1.00 0.00 ? 79 ALA D HB3 5 13
ATOM 5603 N N . ALA D 1 14 ? -9.573 -2.835 -1.501 1.00 0.00 ? 80 ALA D N 5 14
ATOM 5604 C CA . ALA D 1 14 ? -10.965 -2.499 -1.322 1.00 0.00 ? 80 ALA D CA 5 14
ATOM 5605 C C . ALA D 1 14 ? -11.154 -1.063 -0.883 1.00 0.00 ? 80 ALA D C 5 14
ATOM 5606 O O . ALA D 1 14 ? -12.047 -0.381 -1.352 1.00 0.00 ? 80 ALA D O 5 14
ATOM 5607 C CB . ALA D 1 14 ? -11.553 -3.462 -0.318 1.00 0.00 ? 80 ALA D CB 5 14
ATOM 5608 H H . ALA D 1 14 ? -9.013 -3.023 -0.689 1.00 0.00 ? 80 ALA D H 5 14
ATOM 5609 H HA . ALA D 1 14 ? -11.497 -2.640 -2.254 1.00 0.00 ? 80 ALA D HA 5 14
ATOM 5610 H HB1 . ALA D 1 14 ? -11.382 -4.307 -0.474 1.00 0.00 ? 80 ALA D HB1 5 14
ATOM 5611 H HB2 . ALA D 1 14 ? -11.340 -3.308 0.526 1.00 0.00 ? 80 ALA D HB2 5 14
ATOM 5612 H HB3 . ALA D 1 14 ? -12.440 -3.470 -0.286 1.00 0.00 ? 80 ALA D HB3 5 14
ATOM 5613 N N . ILE D 1 15 ? -10.270 -0.584 -0.016 1.00 0.00 ? 81 ILE D N 5 15
ATOM 5614 C CA . ILE D 1 15 ? -10.187 0.778 0.461 1.00 0.00 ? 81 ILE D CA 5 15
ATOM 5615 C C . ILE D 1 15 ? -9.756 1.694 -0.670 1.00 0.00 ? 81 ILE D C 5 15
ATOM 5616 O O . ILE D 1 15 ? -10.235 2.817 -0.735 1.00 0.00 ? 81 ILE D O 5 15
ATOM 5617 C CB . ILE D 1 15 ? -9.275 0.854 1.678 1.00 0.00 ? 81 ILE D CB 5 15
ATOM 5618 C CG1 . ILE D 1 15 ? -9.867 0.193 2.913 1.00 0.00 ? 81 ILE D CG1 5 15
ATOM 5619 C CG2 . ILE D 1 15 ? -8.926 2.300 1.971 1.00 0.00 ? 81 ILE D CG2 5 15
ATOM 5620 C CD1 . ILE D 1 15 ? -8.846 -0.130 3.993 1.00 0.00 ? 81 ILE D CD1 5 15
ATOM 5621 H H . ILE D 1 15 ? -9.593 -1.272 0.263 1.00 0.00 ? 81 ILE D H 5 15
ATOM 5622 H HA . ILE D 1 15 ? -11.175 1.093 0.772 1.00 0.00 ? 81 ILE D HA 5 15
ATOM 5623 H HB . ILE D 1 15 ? -8.351 0.351 1.436 1.00 0.00 ? 81 ILE D HB 5 15
ATOM 5624 H HG12 . ILE D 1 15 ? -10.643 0.837 3.327 1.00 0.00 ? 81 ILE D HG12 5 15
ATOM 5625 H HG13 . ILE D 1 15 ? -10.322 -0.746 2.630 1.00 0.00 ? 81 ILE D HG13 5 15
ATOM 5626 H HG21 . ILE D 1 15 ? -8.473 2.348 2.948 1.00 0.00 ? 81 ILE D HG21 5 15
ATOM 5627 H HG22 . ILE D 1 15 ? -8.221 2.666 1.255 1.00 0.00 ? 81 ILE D HG22 5 15
ATOM 5628 H HG23 . ILE D 1 15 ? -9.793 2.930 1.987 1.00 0.00 ? 81 ILE D HG23 5 15
ATOM 5629 H HD11 . ILE D 1 15 ? -9.365 -0.559 4.829 1.00 0.00 ? 81 ILE D HD11 5 15
ATOM 5630 H HD12 . ILE D 1 15 ? -8.135 -0.825 3.625 1.00 0.00 ? 81 ILE D HD12 5 15
ATOM 5631 H HD13 . ILE D 1 15 ? -8.323 0.736 4.330 1.00 0.00 ? 81 ILE D HD13 5 15
ATOM 5632 N N . ILE D 1 16 ? -8.933 1.254 -1.621 1.00 0.00 ? 82 ILE D N 5 16
ATOM 5633 C CA . ILE D 1 16 ? -8.590 1.993 -2.812 1.00 0.00 ? 82 ILE D CA 5 16
ATOM 5634 C C . ILE D 1 16 ? -9.812 2.356 -3.621 1.00 0.00 ? 82 ILE D C 5 16
ATOM 5635 O O . ILE D 1 16 ? -10.001 3.489 -4.009 1.00 0.00 ? 82 ILE D O 5 16
ATOM 5636 C CB . ILE D 1 16 ? -7.571 1.237 -3.654 1.00 0.00 ? 82 ILE D CB 5 16
ATOM 5637 C CG1 . ILE D 1 16 ? -6.223 1.378 -2.981 1.00 0.00 ? 82 ILE D CG1 5 16
ATOM 5638 C CG2 . ILE D 1 16 ? -7.478 1.746 -5.081 1.00 0.00 ? 82 ILE D CG2 5 16
ATOM 5639 C CD1 . ILE D 1 16 ? -5.067 0.643 -3.609 1.00 0.00 ? 82 ILE D CD1 5 16
ATOM 5640 H H . ILE D 1 16 ? -8.503 0.370 -1.456 1.00 0.00 ? 82 ILE D H 5 16
ATOM 5641 H HA . ILE D 1 16 ? -8.169 2.948 -2.521 1.00 0.00 ? 82 ILE D HA 5 16
ATOM 5642 H HB . ILE D 1 16 ? -7.906 0.209 -3.657 1.00 0.00 ? 82 ILE D HB 5 16
ATOM 5643 H HG12 . ILE D 1 16 ? -5.974 2.438 -2.958 1.00 0.00 ? 82 ILE D HG12 5 16
ATOM 5644 H HG13 . ILE D 1 16 ? -6.292 1.067 -1.964 1.00 0.00 ? 82 ILE D HG13 5 16
ATOM 5645 H HG21 . ILE D 1 16 ? -8.391 1.543 -5.615 1.00 0.00 ? 82 ILE D HG21 5 16
ATOM 5646 H HG22 . ILE D 1 16 ? -7.253 2.794 -5.103 1.00 0.00 ? 82 ILE D HG22 5 16
ATOM 5647 H HG23 . ILE D 1 16 ? -6.712 1.241 -5.632 1.00 0.00 ? 82 ILE D HG23 5 16
ATOM 5648 H HD11 . ILE D 1 16 ? -4.219 0.798 -3.010 1.00 0.00 ? 82 ILE D HD11 5 16
ATOM 5649 H HD12 . ILE D 1 16 ? -5.266 -0.382 -3.626 1.00 0.00 ? 82 ILE D HD12 5 16
ATOM 5650 H HD13 . ILE D 1 16 ? -4.888 0.998 -4.575 1.00 0.00 ? 82 ILE D HD13 5 16
ATOM 5651 N N . LYS D 1 17 ? -10.644 1.362 -3.878 1.00 0.00 ? 83 LYS D N 5 17
ATOM 5652 C CA . LYS D 1 17 ? -11.862 1.421 -4.643 1.00 0.00 ? 83 LYS D CA 5 17
ATOM 5653 C C . LYS D 1 17 ? -12.961 2.237 -4.009 1.00 0.00 ? 83 LYS D C 5 17
ATOM 5654 O O . LYS D 1 17 ? -13.678 2.915 -4.711 1.00 0.00 ? 83 LYS D O 5 17
ATOM 5655 C CB . LYS D 1 17 ? -12.322 -0.006 -4.876 1.00 0.00 ? 83 LYS D CB 5 17
ATOM 5656 C CG . LYS D 1 17 ? -11.522 -0.745 -5.909 1.00 0.00 ? 83 LYS D CG 5 17
ATOM 5657 C CD . LYS D 1 17 ? -11.998 -2.129 -6.085 1.00 0.00 ? 83 LYS D CD 5 17
ATOM 5658 C CE . LYS D 1 17 ? -11.141 -3.028 -6.910 1.00 0.00 ? 83 LYS D CE 5 17
ATOM 5659 N NZ . LYS D 1 17 ? -10.065 -3.456 -6.263 1.00 0.00 ? 83 LYS D NZ 5 17
ATOM 5660 H H . LYS D 1 17 ? -10.356 0.497 -3.479 1.00 0.00 ? 83 LYS D H 5 17
ATOM 5661 H HA . LYS D 1 17 ? -11.649 1.911 -5.581 1.00 0.00 ? 83 LYS D HA 5 17
ATOM 5662 H HB2 . LYS D 1 17 ? -12.279 -0.552 -3.934 1.00 0.00 ? 83 LYS D HB2 5 17
ATOM 5663 H HB3 . LYS D 1 17 ? -13.339 0.004 -5.191 1.00 0.00 ? 83 LYS D HB3 5 17
ATOM 5664 H HG2 . LYS D 1 17 ? -11.586 -0.217 -6.861 1.00 0.00 ? 83 LYS D HG2 5 17
ATOM 5665 H HG3 . LYS D 1 17 ? -10.521 -0.753 -5.641 1.00 0.00 ? 83 LYS D HG3 5 17
ATOM 5666 H HD2 . LYS D 1 17 ? -12.098 -2.579 -5.097 1.00 0.00 ? 83 LYS D HD2 5 17
ATOM 5667 H HD3 . LYS D 1 17 ? -12.946 -2.085 -6.475 1.00 0.00 ? 83 LYS D HD3 5 17
ATOM 5668 H HE2 . LYS D 1 17 ? -11.730 -3.884 -7.238 1.00 0.00 ? 83 LYS D HE2 5 17
ATOM 5669 H HE3 . LYS D 1 17 ? -10.841 -2.546 -7.725 1.00 0.00 ? 83 LYS D HE3 5 17
ATOM 5670 H HZ1 . LYS D 1 17 ? -9.591 -2.942 -5.893 1.00 0.00 ? 83 LYS D HZ1 5 17
ATOM 5671 H HZ2 . LYS D 1 17 ? -10.210 -3.901 -5.768 1.00 0.00 ? 83 LYS D HZ2 5 17
ATOM 5672 H HZ3 . LYS D 1 17 ? -9.618 -3.875 -6.663 1.00 0.00 ? 83 LYS D HZ3 5 17
ATOM 5673 N N . ALA D 1 18 ? -13.065 2.229 -2.691 1.00 0.00 ? 84 ALA D N 5 18
ATOM 5674 C CA . ALA D 1 18 ? -13.956 3.047 -1.908 1.00 0.00 ? 84 ALA D CA 5 18
ATOM 5675 C C . ALA D 1 18 ? -13.463 4.461 -1.703 1.00 0.00 ? 84 ALA D C 5 18
ATOM 5676 O O . ALA D 1 18 ? -14.192 5.398 -1.837 1.00 0.00 ? 84 ALA D O 5 18
ATOM 5677 C CB . ALA D 1 18 ? -14.244 2.334 -0.604 1.00 0.00 ? 84 ALA D CB 5 18
ATOM 5678 H H . ALA D 1 18 ? -12.425 1.614 -2.222 1.00 0.00 ? 84 ALA D H 5 18
ATOM 5679 H HA . ALA D 1 18 ? -14.900 3.116 -2.431 1.00 0.00 ? 84 ALA D HA 5 18
ATOM 5680 H HB1 . ALA D 1 18 ? -14.603 1.351 -0.827 1.00 0.00 ? 84 ALA D HB1 5 18
ATOM 5681 H HB2 . ALA D 1 18 ? -13.354 2.322 -0.011 1.00 0.00 ? 84 ALA D HB2 5 18
ATOM 5682 H HB3 . ALA D 1 18 ? -14.984 2.879 -0.055 1.00 0.00 ? 84 ALA D HB3 5 18
ATOM 5683 N N . GLY D 1 19 ? -12.179 4.641 -1.439 1.00 0.00 ? 85 GLY D N 5 19
ATOM 5684 C CA . GLY D 1 19 ? -11.487 5.893 -1.309 1.00 0.00 ? 85 GLY D CA 5 19
ATOM 5685 C C . GLY D 1 19 ? -11.419 6.692 -2.589 1.00 0.00 ? 85 GLY D C 5 19
ATOM 5686 O O . GLY D 1 19 ? -11.467 7.900 -2.530 1.00 0.00 ? 85 GLY D O 5 19
ATOM 5687 H H . GLY D 1 19 ? -11.670 3.798 -1.370 1.00 0.00 ? 85 GLY D H 5 19
ATOM 5688 H HA2 . GLY D 1 19 ? -11.940 6.475 -0.540 1.00 0.00 ? 85 GLY D HA2 5 19
ATOM 5689 H HA3 . GLY D 1 19 ? -10.488 5.694 -0.965 1.00 0.00 ? 85 GLY D HA3 5 19
ATOM 5690 N N . GLY D 1 20 ? -11.316 6.031 -3.734 1.00 0.00 ? 86 GLY D N 5 20
ATOM 5691 C CA . GLY D 1 20 ? -11.303 6.588 -5.058 1.00 0.00 ? 86 GLY D CA 5 20
ATOM 5692 C C . GLY D 1 20 ? -10.000 7.261 -5.402 1.00 0.00 ? 86 GLY D C 5 20
ATOM 5693 O O . GLY D 1 20 ? -10.040 8.291 -6.023 1.00 0.00 ? 86 GLY D O 5 20
ATOM 5694 H H . GLY D 1 20 ? -11.233 5.054 -3.658 1.00 0.00 ? 86 GLY D H 5 20
ATOM 5695 H HA2 . GLY D 1 20 ? -11.459 5.807 -5.746 1.00 0.00 ? 86 GLY D HA2 5 20
ATOM 5696 H HA3 . GLY D 1 20 ? -12.077 7.317 -5.161 1.00 0.00 ? 86 GLY D HA3 5 20
ATOM 5697 N N . TYR D 1 21 ? -8.865 6.697 -5.009 1.00 0.00 ? 87 TYR D N 5 21
ATOM 5698 C CA . TYR D 1 21 ? -7.525 7.203 -5.136 1.00 0.00 ? 87 TYR D CA 5 21
ATOM 5699 C C . TYR D 1 21 ? -7.153 7.737 -6.494 1.00 0.00 ? 87 TYR D C 5 21
ATOM 5700 O O . TYR D 1 21 ? -6.410 8.662 -6.616 1.00 0.00 ? 87 TYR D O 5 21
ATOM 5701 C CB . TYR D 1 21 ? -6.554 6.123 -4.698 1.00 0.00 ? 87 TYR D CB 5 21
ATOM 5702 C CG . TYR D 1 21 ? -6.101 6.111 -3.266 1.00 0.00 ? 87 TYR D CG 5 21
ATOM 5703 C CD1 . TYR D 1 21 ? -5.304 7.083 -2.689 1.00 0.00 ? 87 TYR D CD1 5 21
ATOM 5704 C CD2 . TYR D 1 21 ? -6.356 4.966 -2.555 1.00 0.00 ? 87 TYR D CD2 5 21
ATOM 5705 C CE1 . TYR D 1 21 ? -4.798 6.891 -1.403 1.00 0.00 ? 87 TYR D CE1 5 21
ATOM 5706 C CE2 . TYR D 1 21 ? -5.893 4.766 -1.254 1.00 0.00 ? 87 TYR D CE2 5 21
ATOM 5707 C CZ . TYR D 1 21 ? -5.100 5.744 -0.669 1.00 0.00 ? 87 TYR D CZ 5 21
ATOM 5708 O OH . TYR D 1 21 ? -4.684 5.582 0.613 1.00 0.00 ? 87 TYR D OH 5 21
ATOM 5709 H H . TYR D 1 21 ? -8.957 5.829 -4.575 1.00 0.00 ? 87 TYR D H 5 21
ATOM 5710 H HA . TYR D 1 21 ? -7.436 8.029 -4.456 1.00 0.00 ? 87 TYR D HA 5 21
ATOM 5711 H HB2 . TYR D 1 21 ? -7.041 5.167 -4.887 1.00 0.00 ? 87 TYR D HB2 5 21
ATOM 5712 H HB3 . TYR D 1 21 ? -5.673 6.115 -5.323 1.00 0.00 ? 87 TYR D HB3 5 21
ATOM 5713 H HD1 . TYR D 1 21 ? -5.076 7.969 -3.241 1.00 0.00 ? 87 TYR D HD1 5 21
ATOM 5714 H HD2 . TYR D 1 21 ? -6.943 4.248 -3.054 1.00 0.00 ? 87 TYR D HD2 5 21
ATOM 5715 H HE1 . TYR D 1 21 ? -4.219 7.648 -0.942 1.00 0.00 ? 87 TYR D HE1 5 21
ATOM 5716 H HE2 . TYR D 1 21 ? -6.076 3.854 -0.729 1.00 0.00 ? 87 TYR D HE2 5 21
ATOM 5717 H HH . TYR D 1 21 ? -5.381 5.887 1.183 1.00 0.00 ? 87 TYR D HH 5 21
HETATM 5718 N N . NH2 D 1 22 ? -7.613 7.200 -7.556 1.00 0.00 ? 88 NH2 D N 5 22
HETATM 5719 H HN1 . NH2 D 1 22 ? -7.322 7.544 -8.435 1.00 0.00 ? 88 NH2 D HN1 5 22
HETATM 5720 H HN2 . NH2 D 1 22 ? -8.209 6.440 -7.477 1.00 0.00 ? 88 NH2 D HN2 5 22
HETATM 5721 C C . ACE A 1 1 ? -1.145 16.270 0.008 1.00 0.00 ? 1 ACE A C 6 1
HETATM 5722 O O . ACE A 1 1 ? -1.883 16.150 -0.938 1.00 0.00 ? 1 ACE A O 6 1
HETATM 5723 C CH3 . ACE A 1 1 ? -0.711 17.644 0.439 1.00 0.00 ? 1 ACE A CH3 6 1
HETATM 5724 H H1 . ACE A 1 1 ? -0.826 17.925 0.655 1.00 0.00 ? 1 ACE A H1 6 1
HETATM 5725 H H2 . ACE A 1 1 ? -0.406 17.878 0.652 1.00 0.00 ? 1 ACE A H2 6 1
HETATM 5726 H H3 . ACE A 1 1 ? -0.601 18.079 0.291 1.00 0.00 ? 1 ACE A H3 6 1
ATOM 5727 N N . ALA A 1 2 ? -0.676 15.239 0.659 1.00 0.00 ? 2 ALA A N 6 2
ATOM 5728 C CA . ALA A 1 2 ? -0.801 13.856 0.298 1.00 0.00 ? 2 ALA A CA 6 2
ATOM 5729 C C . ALA A 1 2 ? -0.323 13.539 -1.089 1.00 0.00 ? 2 ALA A C 6 2
ATOM 5730 O O . ALA A 1 2 ? -0.757 12.569 -1.678 1.00 0.00 ? 2 ALA A O 6 2
ATOM 5731 C CB . ALA A 1 2 ? -2.173 13.339 0.644 1.00 0.00 ? 2 ALA A CB 6 2
ATOM 5732 H H . ALA A 1 2 ? -0.180 15.503 1.474 1.00 0.00 ? 2 ALA A H 6 2
ATOM 5733 H HA . ALA A 1 2 ? -0.124 13.315 0.938 1.00 0.00 ? 2 ALA A HA 6 2
ATOM 5734 H HB1 . ALA A 1 2 ? -2.190 12.282 0.500 1.00 0.00 ? 2 ALA A HB1 6 2
ATOM 5735 H HB2 . ALA A 1 2 ? -2.411 13.542 1.633 1.00 0.00 ? 2 ALA A HB2 6 2
ATOM 5736 H HB3 . ALA A 1 2 ? -2.928 13.797 0.075 1.00 0.00 ? 2 ALA A HB3 6 2
ATOM 5737 N N . LYS A 1 3 ? 0.576 14.313 -1.667 1.00 0.00 ? 3 LYS A N 6 3
ATOM 5738 C CA . LYS A 1 3 ? 1.162 14.081 -2.962 1.00 0.00 ? 3 LYS A CA 6 3
ATOM 5739 C C . LYS A 1 3 ? 1.873 12.759 -3.138 1.00 0.00 ? 3 LYS A C 6 3
ATOM 5740 O O . LYS A 1 3 ? 1.901 12.223 -4.218 1.00 0.00 ? 3 LYS A O 6 3
ATOM 5741 C CB . LYS A 1 3 ? 2.153 15.199 -3.217 1.00 0.00 ? 3 LYS A CB 6 3
ATOM 5742 C CG . LYS A 1 3 ? 1.582 16.584 -3.331 1.00 0.00 ? 3 LYS A CG 6 3
ATOM 5743 C CD . LYS A 1 3 ? 2.596 17.571 -3.762 1.00 0.00 ? 3 LYS A CD 6 3
ATOM 5744 C CE . LYS A 1 3 ? 2.034 18.886 -4.026 1.00 0.00 ? 3 LYS A CE 6 3
ATOM 5745 N NZ . LYS A 1 3 ? 2.987 19.766 -4.352 1.00 0.00 ? 3 LYS A NZ 6 3
ATOM 5746 H H . LYS A 1 3 ? 0.898 15.080 -1.121 1.00 0.00 ? 3 LYS A H 6 3
ATOM 5747 H HA . LYS A 1 3 ? 0.398 14.110 -3.725 1.00 0.00 ? 3 LYS A HA 6 3
ATOM 5748 H HB2 . LYS A 1 3 ? 2.904 15.199 -2.426 1.00 0.00 ? 3 LYS A HB2 6 3
ATOM 5749 H HB3 . LYS A 1 3 ? 2.634 14.918 -4.141 1.00 0.00 ? 3 LYS A HB3 6 3
ATOM 5750 H HG2 . LYS A 1 3 ? 0.749 16.585 -4.033 1.00 0.00 ? 3 LYS A HG2 6 3
ATOM 5751 H HG3 . LYS A 1 3 ? 1.219 16.839 -2.406 1.00 0.00 ? 3 LYS A HG3 6 3
ATOM 5752 H HD2 . LYS A 1 3 ? 3.380 17.645 -3.008 1.00 0.00 ? 3 LYS A HD2 6 3
ATOM 5753 H HD3 . LYS A 1 3 ? 3.005 17.268 -4.624 1.00 0.00 ? 3 LYS A HD3 6 3
ATOM 5754 H HE2 . LYS A 1 3 ? 1.295 18.821 -4.825 1.00 0.00 ? 3 LYS A HE2 6 3
ATOM 5755 H HE3 . LYS A 1 3 ? 1.575 19.221 -3.205 1.00 0.00 ? 3 LYS A HE3 6 3
ATOM 5756 H HZ1 . LYS A 1 3 ? 3.553 19.929 -3.688 1.00 0.00 ? 3 LYS A HZ1 6 3
ATOM 5757 H HZ2 . LYS A 1 3 ? 3.521 19.470 -5.055 1.00 0.00 ? 3 LYS A HZ2 6 3
ATOM 5758 H HZ3 . LYS A 1 3 ? 2.562 20.581 -4.611 1.00 0.00 ? 3 LYS A HZ3 6 3
ATOM 5759 N N . ALA A 1 4 ? 2.476 12.229 -2.086 1.00 0.00 ? 4 ALA A N 6 4
ATOM 5760 C CA . ALA A 1 4 ? 3.056 10.911 -2.049 1.00 0.00 ? 4 ALA A CA 6 4
ATOM 5761 C C . ALA A 1 4 ? 2.083 9.812 -2.430 1.00 0.00 ? 4 ALA A C 6 4
ATOM 5762 O O . ALA A 1 4 ? 2.491 8.740 -2.848 1.00 0.00 ? 4 ALA A O 6 4
ATOM 5763 C CB . ALA A 1 4 ? 3.599 10.678 -0.655 1.00 0.00 ? 4 ALA A CB 6 4
ATOM 5764 H H . ALA A 1 4 ? 2.407 12.734 -1.230 1.00 0.00 ? 4 ALA A H 6 4
ATOM 5765 H HA . ALA A 1 4 ? 3.891 10.895 -2.740 1.00 0.00 ? 4 ALA A HA 6 4
ATOM 5766 H HB1 . ALA A 1 4 ? 4.263 11.481 -0.387 1.00 0.00 ? 4 ALA A HB1 6 4
ATOM 5767 H HB2 . ALA A 1 4 ? 2.811 10.608 0.071 1.00 0.00 ? 4 ALA A HB2 6 4
ATOM 5768 H HB3 . ALA A 1 4 ? 4.177 9.768 -0.621 1.00 0.00 ? 4 ALA A HB3 6 4
ATOM 5769 N N . ALA A 1 5 ? 0.785 10.094 -2.384 1.00 0.00 ? 5 ALA A N 6 5
ATOM 5770 C CA . ALA A 1 5 ? -0.270 9.131 -2.565 1.00 0.00 ? 5 ALA A CA 6 5
ATOM 5771 C C . ALA A 1 5 ? -0.366 8.690 -4.013 1.00 0.00 ? 5 ALA A C 6 5
ATOM 5772 O O . ALA A 1 5 ? 0.180 7.673 -4.397 1.00 0.00 ? 5 ALA A O 6 5
ATOM 5773 C CB . ALA A 1 5 ? -1.553 9.634 -1.918 1.00 0.00 ? 5 ALA A CB 6 5
ATOM 5774 H H . ALA A 1 5 ? 0.573 11.048 -2.191 1.00 0.00 ? 5 ALA A H 6 5
ATOM 5775 H HA . ALA A 1 5 ? -0.025 8.216 -2.035 1.00 0.00 ? 5 ALA A HA 6 5
ATOM 5776 H HB1 . ALA A 1 5 ? -1.354 9.877 -0.889 1.00 0.00 ? 5 ALA A HB1 6 5
ATOM 5777 H HB2 . ALA A 1 5 ? -1.949 10.509 -2.408 1.00 0.00 ? 5 ALA A HB2 6 5
ATOM 5778 H HB3 . ALA A 1 5 ? -2.304 8.863 -1.983 1.00 0.00 ? 5 ALA A HB3 6 5
ATOM 5779 N N . ALA A 1 6 ? -1.082 9.419 -4.854 1.00 0.00 ? 6 ALA A N 6 6
ATOM 5780 C CA . ALA A 1 6 ? -1.354 9.051 -6.217 1.00 0.00 ? 6 ALA A CA 6 6
ATOM 5781 C C . ALA A 1 6 ? -0.158 9.083 -7.132 1.00 0.00 ? 6 ALA A C 6 6
ATOM 5782 O O . ALA A 1 6 ? -0.318 8.980 -8.332 1.00 0.00 ? 6 ALA A O 6 6
ATOM 5783 C CB . ALA A 1 6 ? -2.516 9.838 -6.777 1.00 0.00 ? 6 ALA A CB 6 6
ATOM 5784 H H . ALA A 1 6 ? -1.414 10.278 -4.482 1.00 0.00 ? 6 ALA A H 6 6
ATOM 5785 H HA . ALA A 1 6 ? -1.654 8.021 -6.142 1.00 0.00 ? 6 ALA A HA 6 6
ATOM 5786 H HB1 . ALA A 1 6 ? -2.284 10.856 -6.918 1.00 0.00 ? 6 ALA A HB1 6 6
ATOM 5787 H HB2 . ALA A 1 6 ? -2.850 9.442 -7.709 1.00 0.00 ? 6 ALA A HB2 6 6
ATOM 5788 H HB3 . ALA A 1 6 ? -3.311 9.810 -6.091 1.00 0.00 ? 6 ALA A HB3 6 6
ATOM 5789 N N . ALA A 1 7 ? 1.048 9.242 -6.627 1.00 0.00 ? 7 ALA A N 6 7
ATOM 5790 C CA . ALA A 1 7 ? 2.268 8.826 -7.269 1.00 0.00 ? 7 ALA A CA 6 7
ATOM 5791 C C . ALA A 1 7 ? 2.575 7.369 -7.021 1.00 0.00 ? 7 ALA A C 6 7
ATOM 5792 O O . ALA A 1 7 ? 2.639 6.598 -7.948 1.00 0.00 ? 7 ALA A O 6 7
ATOM 5793 C CB . ALA A 1 7 ? 3.394 9.702 -6.760 1.00 0.00 ? 7 ALA A CB 6 7
ATOM 5794 H H . ALA A 1 7 ? 1.038 9.418 -5.656 1.00 0.00 ? 7 ALA A H 6 7
ATOM 5795 H HA . ALA A 1 7 ? 2.201 8.952 -8.341 1.00 0.00 ? 7 ALA A HA 6 7
ATOM 5796 H HB1 . ALA A 1 7 ? 4.315 9.479 -7.233 1.00 0.00 ? 7 ALA A HB1 6 7
ATOM 5797 H HB2 . ALA A 1 7 ? 3.166 10.729 -6.972 1.00 0.00 ? 7 ALA A HB2 6 7
ATOM 5798 H HB3 . ALA A 1 7 ? 3.504 9.561 -5.721 1.00 0.00 ? 7 ALA A HB3 6 7
ATOM 5799 N N . ALA A 1 8 ? 2.707 6.914 -5.794 1.00 0.00 ? 8 ALA A N 6 8
ATOM 5800 C CA . ALA A 1 8 ? 3.228 5.616 -5.429 1.00 0.00 ? 8 ALA A CA 6 8
ATOM 5801 C C . ALA A 1 8 ? 2.127 4.572 -5.439 1.00 0.00 ? 8 ALA A C 6 8
ATOM 5802 O O . ALA A 1 8 ? 2.317 3.492 -5.969 1.00 0.00 ? 8 ALA A O 6 8
ATOM 5803 C CB . ALA A 1 8 ? 3.830 5.716 -4.034 1.00 0.00 ? 8 ALA A CB 6 8
ATOM 5804 H H . ALA A 1 8 ? 2.453 7.529 -5.054 1.00 0.00 ? 8 ALA A H 6 8
ATOM 5805 H HA . ALA A 1 8 ? 3.990 5.322 -6.140 1.00 0.00 ? 8 ALA A HA 6 8
ATOM 5806 H HB1 . ALA A 1 8 ? 4.492 6.556 -3.980 1.00 0.00 ? 8 ALA A HB1 6 8
ATOM 5807 H HB2 . ALA A 1 8 ? 3.047 5.859 -3.327 1.00 0.00 ? 8 ALA A HB2 6 8
ATOM 5808 H HB3 . ALA A 1 8 ? 4.363 4.816 -3.781 1.00 0.00 ? 8 ALA A HB3 6 8
ATOM 5809 N N . ILE A 1 9 ? 0.956 4.922 -4.928 1.00 0.00 ? 9 ILE A N 6 9
ATOM 5810 C CA . ILE A 1 9 ? -0.262 4.150 -5.020 1.00 0.00 ? 9 ILE A CA 6 9
ATOM 5811 C C . ILE A 1 9 ? -0.623 3.829 -6.459 1.00 0.00 ? 9 ILE A C 6 9
ATOM 5812 O O . ILE A 1 9 ? -1.032 2.718 -6.737 1.00 0.00 ? 9 ILE A O 6 9
ATOM 5813 C CB . ILE A 1 9 ? -1.417 4.903 -4.380 1.00 0.00 ? 9 ILE A CB 6 9
ATOM 5814 C CG1 . ILE A 1 9 ? -1.189 5.336 -2.941 1.00 0.00 ? 9 ILE A CG1 6 9
ATOM 5815 C CG2 . ILE A 1 9 ? -2.716 4.131 -4.483 1.00 0.00 ? 9 ILE A CG2 6 9
ATOM 5816 C CD1 . ILE A 1 9 ? -0.975 4.209 -1.971 1.00 0.00 ? 9 ILE A CD1 6 9
ATOM 5817 H H . ILE A 1 9 ? 0.878 5.837 -4.557 1.00 0.00 ? 9 ILE A H 6 9
ATOM 5818 H HA . ILE A 1 9 ? -0.133 3.215 -4.493 1.00 0.00 ? 9 ILE A HA 6 9
ATOM 5819 H HB . ILE A 1 9 ? -1.568 5.778 -5.002 1.00 0.00 ? 9 ILE A HB 6 9
ATOM 5820 H HG12 . ILE A 1 9 ? -0.314 5.985 -2.914 1.00 0.00 ? 9 ILE A HG12 6 9
ATOM 5821 H HG13 . ILE A 1 9 ? -2.009 5.928 -2.598 1.00 0.00 ? 9 ILE A HG13 6 9
ATOM 5822 H HG21 . ILE A 1 9 ? -2.540 3.126 -4.171 1.00 0.00 ? 9 ILE A HG21 6 9
ATOM 5823 H HG22 . ILE A 1 9 ? -3.407 4.583 -3.810 1.00 0.00 ? 9 ILE A HG22 6 9
ATOM 5824 H HG23 . ILE A 1 9 ? -3.123 4.201 -5.474 1.00 0.00 ? 9 ILE A HG23 6 9
ATOM 5825 H HD11 . ILE A 1 9 ? -0.741 3.855 -1.867 1.00 0.00 ? 9 ILE A HD11 6 9
ATOM 5826 H HD12 . ILE A 1 9 ? -0.863 4.070 -1.592 1.00 0.00 ? 9 ILE A HD12 6 9
ATOM 5827 H HD13 . ILE A 1 9 ? -1.109 3.907 -1.795 1.00 0.00 ? 9 ILE A HD13 6 9
ATOM 5828 N N . LYS A 1 10 ? -0.523 4.799 -7.364 1.00 0.00 ? 10 LYS A N 6 10
ATOM 5829 C CA . LYS A 1 10 ? -0.905 4.626 -8.743 1.00 0.00 ? 10 LYS A CA 6 10
ATOM 5830 C C . LYS A 1 10 ? -0.089 3.563 -9.446 1.00 0.00 ? 10 LYS A C 6 10
ATOM 5831 O O . LYS A 1 10 ? -0.645 2.782 -10.189 1.00 0.00 ? 10 LYS A O 6 10
ATOM 5832 C CB . LYS A 1 10 ? -0.834 5.954 -9.479 1.00 0.00 ? 10 LYS A CB 6 10
ATOM 5833 C CG . LYS A 1 10 ? -2.151 6.601 -9.675 1.00 0.00 ? 10 LYS A CG 6 10
ATOM 5834 C CD . LYS A 1 10 ? -2.166 7.705 -10.693 1.00 0.00 ? 10 LYS A CD 6 10
ATOM 5835 C CE . LYS A 1 10 ? -3.440 8.255 -11.008 1.00 0.00 ? 10 LYS A CE 6 10
ATOM 5836 N NZ . LYS A 1 10 ? -3.550 9.097 -12.013 1.00 0.00 ? 10 LYS A NZ 6 10
ATOM 5837 H H . LYS A 1 10 ? -0.201 5.675 -7.020 1.00 0.00 ? 10 LYS A H 6 10
ATOM 5838 H HA . LYS A 1 10 ? -1.927 4.271 -8.739 1.00 0.00 ? 10 LYS A HA 6 10
ATOM 5839 H HB2 . LYS A 1 10 ? -0.172 6.635 -8.945 1.00 0.00 ? 10 LYS A HB2 6 10
ATOM 5840 H HB3 . LYS A 1 10 ? -0.424 5.751 -10.403 1.00 0.00 ? 10 LYS A HB3 6 10
ATOM 5841 H HG2 . LYS A 1 10 ? -2.871 5.840 -9.976 1.00 0.00 ? 10 LYS A HG2 6 10
ATOM 5842 H HG3 . LYS A 1 10 ? -2.471 6.971 -8.779 1.00 0.00 ? 10 LYS A HG3 6 10
ATOM 5843 H HD2 . LYS A 1 10 ? -1.522 8.511 -10.342 1.00 0.00 ? 10 LYS A HD2 6 10
ATOM 5844 H HD3 . LYS A 1 10 ? -1.757 7.336 -11.527 1.00 0.00 ? 10 LYS A HD3 6 10
ATOM 5845 H HE2 . LYS A 1 10 ? -4.108 7.418 -11.207 1.00 0.00 ? 10 LYS A HE2 6 10
ATOM 5846 H HE3 . LYS A 1 10 ? -3.782 8.683 -10.346 1.00 0.00 ? 10 LYS A HE3 6 10
ATOM 5847 H HZ1 . LYS A 1 10 ? -4.103 9.479 -12.252 1.00 0.00 ? 10 LYS A HZ1 6 10
ATOM 5848 H HZ2 . LYS A 1 10 ? -3.258 9.582 -12.056 1.00 0.00 ? 10 LYS A HZ2 6 10
ATOM 5849 H HZ3 . LYS A 1 10 ? -3.413 8.877 -12.473 1.00 0.00 ? 10 LYS A HZ3 6 10
ATOM 5850 N N . ALA A 1 11 ? 1.212 3.523 -9.178 1.00 0.00 ? 11 ALA A N 6 11
ATOM 5851 C CA . ALA A 1 11 ? 2.057 2.409 -9.537 1.00 0.00 ? 11 ALA A CA 6 11
ATOM 5852 C C . ALA A 1 11 ? 1.642 1.137 -8.822 1.00 0.00 ? 11 ALA A C 6 11
ATOM 5853 O O . ALA A 1 11 ? 1.445 0.112 -9.447 1.00 0.00 ? 11 ALA A O 6 11
ATOM 5854 C CB . ALA A 1 11 ? 3.509 2.764 -9.293 1.00 0.00 ? 11 ALA A CB 6 11
ATOM 5855 H H . ALA A 1 11 ? 1.603 4.262 -8.643 1.00 0.00 ? 11 ALA A H 6 11
ATOM 5856 H HA . ALA A 1 11 ? 1.938 2.226 -10.596 1.00 0.00 ? 11 ALA A HA 6 11
ATOM 5857 H HB1 . ALA A 1 11 ? 4.095 1.975 -9.591 1.00 0.00 ? 11 ALA A HB1 6 11
ATOM 5858 H HB2 . ALA A 1 11 ? 3.744 3.610 -9.835 1.00 0.00 ? 11 ALA A HB2 6 11
ATOM 5859 H HB3 . ALA A 1 11 ? 3.694 2.949 -8.300 1.00 0.00 ? 11 ALA A HB3 6 11
ATOM 5860 N N . ILE A 1 12 ? 1.427 1.159 -7.510 1.00 0.00 ? 12 ILE A N 6 12
ATOM 5861 C CA . ILE A 1 12 ? 1.152 -0.026 -6.731 1.00 0.00 ? 12 ILE A CA 6 12
ATOM 5862 C C . ILE A 1 12 ? -0.159 -0.650 -7.170 1.00 0.00 ? 12 ILE A C 6 12
ATOM 5863 O O . ILE A 1 12 ? -0.234 -1.852 -7.377 1.00 0.00 ? 12 ILE A O 6 12
ATOM 5864 C CB . ILE A 1 12 ? 1.340 0.132 -5.229 1.00 0.00 ? 12 ILE A CB 6 12
ATOM 5865 C CG1 . ILE A 1 12 ? 2.203 -1.019 -4.768 1.00 0.00 ? 12 ILE A CG1 6 12
ATOM 5866 C CG2 . ILE A 1 12 ? 0.079 0.255 -4.405 1.00 0.00 ? 12 ILE A CG2 6 12
ATOM 5867 C CD1 . ILE A 1 12 ? 2.434 -1.229 -3.301 1.00 0.00 ? 12 ILE A CD1 6 12
ATOM 5868 H H . ILE A 1 12 ? 1.413 2.043 -7.040 1.00 0.00 ? 12 ILE A H 6 12
ATOM 5869 H HA . ILE A 1 12 ? 1.874 -0.758 -7.071 1.00 0.00 ? 12 ILE A HA 6 12
ATOM 5870 H HB . ILE A 1 12 ? 1.905 1.028 -5.035 1.00 0.00 ? 12 ILE A HB 6 12
ATOM 5871 H HG12 . ILE A 1 12 ? 1.772 -1.937 -5.168 1.00 0.00 ? 12 ILE A HG12 6 12
ATOM 5872 H HG13 . ILE A 1 12 ? 3.159 -0.887 -5.225 1.00 0.00 ? 12 ILE A HG13 6 12
ATOM 5873 H HG21 . ILE A 1 12 ? -0.429 -0.692 -4.379 1.00 0.00 ? 12 ILE A HG21 6 12
ATOM 5874 H HG22 . ILE A 1 12 ? 0.303 0.551 -3.401 1.00 0.00 ? 12 ILE A HG22 6 12
ATOM 5875 H HG23 . ILE A 1 12 ? -0.590 1.003 -4.789 1.00 0.00 ? 12 ILE A HG23 6 12
ATOM 5876 H HD11 . ILE A 1 12 ? 1.726 -1.202 -2.854 1.00 0.00 ? 12 ILE A HD11 6 12
ATOM 5877 H HD12 . ILE A 1 12 ? 2.801 -1.994 -3.084 1.00 0.00 ? 12 ILE A HD12 6 12
ATOM 5878 H HD13 . ILE A 1 12 ? 2.958 -0.668 -2.974 1.00 0.00 ? 12 ILE A HD13 6 12
ATOM 5879 N N . ALA A 1 13 ? -1.225 0.115 -7.390 1.00 0.00 ? 13 ALA A N 6 13
ATOM 5880 C CA . ALA A 1 13 ? -2.483 -0.466 -7.802 1.00 0.00 ? 13 ALA A CA 6 13
ATOM 5881 C C . ALA A 1 13 ? -2.436 -1.143 -9.159 1.00 0.00 ? 13 ALA A C 6 13
ATOM 5882 O O . ALA A 1 13 ? -3.272 -1.986 -9.457 1.00 0.00 ? 13 ALA A O 6 13
ATOM 5883 C CB . ALA A 1 13 ? -3.508 0.648 -7.740 1.00 0.00 ? 13 ALA A CB 6 13
ATOM 5884 H H . ALA A 1 13 ? -1.099 1.101 -7.238 1.00 0.00 ? 13 ALA A H 6 13
ATOM 5885 H HA . ALA A 1 13 ? -2.788 -1.221 -7.092 1.00 0.00 ? 13 ALA A HA 6 13
ATOM 5886 H HB1 . ALA A 1 13 ? -4.480 0.228 -7.921 1.00 0.00 ? 13 ALA A HB1 6 13
ATOM 5887 H HB2 . ALA A 1 13 ? -3.463 1.118 -6.772 1.00 0.00 ? 13 ALA A HB2 6 13
ATOM 5888 H HB3 . ALA A 1 13 ? -3.272 1.351 -8.512 1.00 0.00 ? 13 ALA A HB3 6 13
ATOM 5889 N N . ALA A 1 14 ? -1.461 -0.808 -9.991 1.00 0.00 ? 14 ALA A N 6 14
ATOM 5890 C CA . ALA A 1 14 ? -1.165 -1.493 -11.227 1.00 0.00 ? 14 ALA A CA 6 14
ATOM 5891 C C . ALA A 1 14 ? -0.278 -2.701 -11.035 1.00 0.00 ? 14 ALA A C 6 14
ATOM 5892 O O . ALA A 1 14 ? -0.532 -3.752 -11.592 1.00 0.00 ? 14 ALA A O 6 14
ATOM 5893 C CB . ALA A 1 14 ? -0.541 -0.525 -12.203 1.00 0.00 ? 14 ALA A CB 6 14
ATOM 5894 H H . ALA A 1 14 ? -0.784 -0.182 -9.597 1.00 0.00 ? 14 ALA A H 6 14
ATOM 5895 H HA . ALA A 1 14 ? -2.093 -1.846 -11.655 1.00 0.00 ? 14 ALA A HA 6 14
ATOM 5896 H HB1 . ALA A 1 14 ? -0.027 -0.639 -12.555 1.00 0.00 ? 14 ALA A HB1 6 14
ATOM 5897 H HB2 . ALA A 1 14 ? -0.867 -0.299 -12.694 1.00 0.00 ? 14 ALA A HB2 6 14
ATOM 5898 H HB3 . ALA A 1 14 ? -0.334 0.101 -12.065 1.00 0.00 ? 14 ALA A HB3 6 14
ATOM 5899 N N . ILE A 1 15 ? 0.724 -2.573 -10.169 1.00 0.00 ? 15 ILE A N 6 15
ATOM 5900 C CA . ILE A 1 15 ? 1.620 -3.632 -9.761 1.00 0.00 ? 15 ILE A CA 6 15
ATOM 5901 C C . ILE A 1 15 ? 0.903 -4.725 -8.995 1.00 0.00 ? 15 ILE A C 6 15
ATOM 5902 O O . ILE A 1 15 ? 1.243 -5.876 -9.186 1.00 0.00 ? 15 ILE A O 6 15
ATOM 5903 C CB . ILE A 1 15 ? 2.779 -3.066 -8.961 1.00 0.00 ? 15 ILE A CB 6 15
ATOM 5904 C CG1 . ILE A 1 15 ? 3.638 -2.161 -9.821 1.00 0.00 ? 15 ILE A CG1 6 15
ATOM 5905 C CG2 . ILE A 1 15 ? 3.662 -4.146 -8.375 1.00 0.00 ? 15 ILE A CG2 6 15
ATOM 5906 C CD1 . ILE A 1 15 ? 4.526 -1.186 -9.077 1.00 0.00 ? 15 ILE A CD1 6 15
ATOM 5907 H H . ILE A 1 15 ? 0.845 -1.669 -9.766 1.00 0.00 ? 15 ILE A H 6 15
ATOM 5908 H HA . ILE A 1 15 ? 2.010 -4.112 -10.651 1.00 0.00 ? 15 ILE A HA 6 15
ATOM 5909 H HB . ILE A 1 15 ? 2.367 -2.487 -8.146 1.00 0.00 ? 15 ILE A HB 6 15
ATOM 5910 H HG12 . ILE A 1 15 ? 4.267 -2.791 -10.449 1.00 0.00 ? 15 ILE A HG12 6 15
ATOM 5911 H HG13 . ILE A 1 15 ? 3.032 -1.566 -10.487 1.00 0.00 ? 15 ILE A HG13 6 15
ATOM 5912 H HG21 . ILE A 1 15 ? 4.558 -3.774 -7.933 1.00 0.00 ? 15 ILE A HG21 6 15
ATOM 5913 H HG22 . ILE A 1 15 ? 3.128 -4.629 -7.594 1.00 0.00 ? 15 ILE A HG22 6 15
ATOM 5914 H HG23 . ILE A 1 15 ? 3.938 -4.855 -9.106 1.00 0.00 ? 15 ILE A HG23 6 15
ATOM 5915 H HD11 . ILE A 1 15 ? 4.930 -1.396 -8.470 1.00 0.00 ? 15 ILE A HD11 6 15
ATOM 5916 H HD12 . ILE A 1 15 ? 5.085 -0.876 -9.455 1.00 0.00 ? 15 ILE A HD12 6 15
ATOM 5917 H HD13 . ILE A 1 15 ? 4.228 -0.555 -8.787 1.00 0.00 ? 15 ILE A HD13 6 15
ATOM 5918 N N . ILE A 1 16 ? -0.132 -4.422 -8.226 1.00 0.00 ? 16 ILE A N 6 16
ATOM 5919 C CA . ILE A 1 16 ? -1.008 -5.369 -7.579 1.00 0.00 ? 16 ILE A CA 6 16
ATOM 5920 C C . ILE A 1 16 ? -1.713 -6.264 -8.578 1.00 0.00 ? 16 ILE A C 6 16
ATOM 5921 O O . ILE A 1 16 ? -1.635 -7.480 -8.501 1.00 0.00 ? 16 ILE A O 6 16
ATOM 5922 C CB . ILE A 1 16 ? -1.979 -4.635 -6.670 1.00 0.00 ? 16 ILE A CB 6 16
ATOM 5923 C CG1 . ILE A 1 16 ? -1.177 -4.201 -5.464 1.00 0.00 ? 16 ILE A CG1 6 16
ATOM 5924 C CG2 . ILE A 1 16 ? -3.147 -5.482 -6.198 1.00 0.00 ? 16 ILE A CG2 6 16
ATOM 5925 C CD1 . ILE A 1 16 ? -1.897 -3.573 -4.291 1.00 0.00 ? 16 ILE A CD1 6 16
ATOM 5926 H H . ILE A 1 16 ? -0.286 -3.442 -8.088 1.00 0.00 ? 16 ILE A H 6 16
ATOM 5927 H HA . ILE A 1 16 ? -0.418 -6.053 -6.982 1.00 0.00 ? 16 ILE A HA 6 16
ATOM 5928 H HB . ILE A 1 16 ? -2.305 -3.771 -7.239 1.00 0.00 ? 16 ILE A HB 6 16
ATOM 5929 H HG12 . ILE A 1 16 ? -0.651 -5.081 -5.093 1.00 0.00 ? 16 ILE A HG12 6 16
ATOM 5930 H HG13 . ILE A 1 16 ? -0.415 -3.497 -5.773 1.00 0.00 ? 16 ILE A HG13 6 16
ATOM 5931 H HG21 . ILE A 1 16 ? -3.771 -5.795 -7.016 1.00 0.00 ? 16 ILE A HG21 6 16
ATOM 5932 H HG22 . ILE A 1 16 ? -2.810 -6.373 -5.710 1.00 0.00 ? 16 ILE A HG22 6 16
ATOM 5933 H HG23 . ILE A 1 16 ? -3.770 -4.925 -5.525 1.00 0.00 ? 16 ILE A HG23 6 16
ATOM 5934 H HD11 . ILE A 1 16 ? -2.566 -2.840 -4.660 1.00 0.00 ? 16 ILE A HD11 6 16
ATOM 5935 H HD12 . ILE A 1 16 ? -2.429 -4.327 -3.761 1.00 0.00 ? 16 ILE A HD12 6 16
ATOM 5936 H HD13 . ILE A 1 16 ? -1.146 -3.132 -3.663 1.00 0.00 ? 16 ILE A HD13 6 16
ATOM 5937 N N . LYS A 1 17 ? -2.397 -5.645 -9.536 1.00 0.00 ? 17 LYS A N 6 17
ATOM 5938 C CA . LYS A 1 17 ? -3.066 -6.248 -10.664 1.00 0.00 ? 17 LYS A CA 6 17
ATOM 5939 C C . LYS A 1 17 ? -2.158 -7.130 -11.496 1.00 0.00 ? 17 LYS A C 6 17
ATOM 5940 O O . LYS A 1 17 ? -2.564 -8.202 -11.887 1.00 0.00 ? 17 LYS A O 6 17
ATOM 5941 C CB . LYS A 1 17 ? -3.664 -5.110 -11.480 1.00 0.00 ? 17 LYS A CB 6 17
ATOM 5942 C CG . LYS A 1 17 ? -4.926 -4.531 -10.866 1.00 0.00 ? 17 LYS A CG 6 17
ATOM 5943 C CD . LYS A 1 17 ? -5.477 -3.401 -11.698 1.00 0.00 ? 17 LYS A CD 6 17
ATOM 5944 C CE . LYS A 1 17 ? -6.591 -2.688 -10.963 1.00 0.00 ? 17 LYS A CE 6 17
ATOM 5945 N NZ . LYS A 1 17 ? -6.102 -1.891 -9.877 1.00 0.00 ? 17 LYS A NZ 6 17
ATOM 5946 H H . LYS A 1 17 ? -2.379 -4.656 -9.511 1.00 0.00 ? 17 LYS A H 6 17
ATOM 5947 H HA . LYS A 1 17 ? -3.858 -6.885 -10.280 1.00 0.00 ? 17 LYS A HA 6 17
ATOM 5948 H HB2 . LYS A 1 17 ? -2.925 -4.318 -11.594 1.00 0.00 ? 17 LYS A HB2 6 17
ATOM 5949 H HB3 . LYS A 1 17 ? -3.885 -5.494 -12.469 1.00 0.00 ? 17 LYS A HB3 6 17
ATOM 5950 H HG2 . LYS A 1 17 ? -5.681 -5.311 -10.771 1.00 0.00 ? 17 LYS A HG2 6 17
ATOM 5951 H HG3 . LYS A 1 17 ? -4.691 -4.204 -9.875 1.00 0.00 ? 17 LYS A HG3 6 17
ATOM 5952 H HD2 . LYS A 1 17 ? -4.683 -2.695 -11.942 1.00 0.00 ? 17 LYS A HD2 6 17
ATOM 5953 H HD3 . LYS A 1 17 ? -5.840 -3.810 -12.622 1.00 0.00 ? 17 LYS A HD3 6 17
ATOM 5954 H HE2 . LYS A 1 17 ? -7.155 -2.064 -11.656 1.00 0.00 ? 17 LYS A HE2 6 17
ATOM 5955 H HE3 . LYS A 1 17 ? -7.234 -3.420 -10.573 1.00 0.00 ? 17 LYS A HE3 6 17
ATOM 5956 H HZ1 . LYS A 1 17 ? -6.768 -1.366 -9.449 1.00 0.00 ? 17 LYS A HZ1 6 17
ATOM 5957 H HZ2 . LYS A 1 17 ? -5.702 -2.389 -9.169 1.00 0.00 ? 17 LYS A HZ2 6 17
ATOM 5958 H HZ3 . LYS A 1 17 ? -5.429 -1.275 -10.177 1.00 0.00 ? 17 LYS A HZ3 6 17
ATOM 5959 N N . ALA A 1 18 ? -0.916 -6.718 -11.707 1.00 0.00 ? 18 ALA A N 6 18
ATOM 5960 C CA . ALA A 1 18 ? 0.087 -7.484 -12.409 1.00 0.00 ? 18 ALA A CA 6 18
ATOM 5961 C C . ALA A 1 18 ? 0.809 -8.512 -11.564 1.00 0.00 ? 18 ALA A C 6 18
ATOM 5962 O O . ALA A 1 18 ? 1.288 -9.484 -12.081 1.00 0.00 ? 18 ALA A O 6 18
ATOM 5963 C CB . ALA A 1 18 ? 1.051 -6.503 -13.034 1.00 0.00 ? 18 ALA A CB 6 18
ATOM 5964 H H . ALA A 1 18 ? -0.646 -5.806 -11.386 1.00 0.00 ? 18 ALA A H 6 18
ATOM 5965 H HA . ALA A 1 18 ? -0.367 -8.004 -13.237 1.00 0.00 ? 18 ALA A HA 6 18
ATOM 5966 H HB1 . ALA A 1 18 ? 0.516 -5.807 -13.627 1.00 0.00 ? 18 ALA A HB1 6 18
ATOM 5967 H HB2 . ALA A 1 18 ? 1.557 -5.963 -12.274 1.00 0.00 ? 18 ALA A HB2 6 18
ATOM 5968 H HB3 . ALA A 1 18 ? 1.767 -6.992 -13.642 1.00 0.00 ? 18 ALA A HB3 6 18
ATOM 5969 N N . GLY A 1 19 ? 0.876 -8.323 -10.263 1.00 0.00 ? 19 GLY A N 6 19
ATOM 5970 C CA . GLY A 1 19 ? 1.602 -9.072 -9.274 1.00 0.00 ? 19 GLY A CA 6 19
ATOM 5971 C C . GLY A 1 19 ? 0.945 -10.335 -8.777 1.00 0.00 ? 19 GLY A C 6 19
ATOM 5972 O O . GLY A 1 19 ? 1.612 -11.223 -8.332 1.00 0.00 ? 19 GLY A O 6 19
ATOM 5973 H H . GLY A 1 19 ? 0.479 -7.473 -9.958 1.00 0.00 ? 19 GLY A H 6 19
ATOM 5974 H HA2 . GLY A 1 19 ? 2.564 -9.358 -9.651 1.00 0.00 ? 19 GLY A HA2 6 19
ATOM 5975 H HA3 . GLY A 1 19 ? 1.775 -8.459 -8.413 1.00 0.00 ? 19 GLY A HA3 6 19
ATOM 5976 N N . GLY A 1 20 ? -0.364 -10.433 -8.839 1.00 0.00 ? 20 GLY A N 6 20
ATOM 5977 C CA . GLY A 1 20 ? -1.118 -11.575 -8.424 1.00 0.00 ? 20 GLY A CA 6 20
ATOM 5978 C C . GLY A 1 20 ? -1.266 -11.716 -6.926 1.00 0.00 ? 20 GLY A C 6 20
ATOM 5979 O O . GLY A 1 20 ? -1.329 -12.809 -6.410 1.00 0.00 ? 20 GLY A O 6 20
ATOM 5980 H H . GLY A 1 20 ? -0.836 -9.654 -9.197 1.00 0.00 ? 20 GLY A H 6 20
ATOM 5981 H HA2 . GLY A 1 20 ? -2.076 -11.543 -8.869 1.00 0.00 ? 20 GLY A HA2 6 20
ATOM 5982 H HA3 . GLY A 1 20 ? -0.628 -12.448 -8.798 1.00 0.00 ? 20 GLY A HA3 6 20
ATOM 5983 N N . TYR A 1 21 ? -1.318 -10.614 -6.195 1.00 0.00 ? 21 TYR A N 6 21
ATOM 5984 C CA . TYR A 1 21 ? -1.507 -10.573 -4.787 1.00 0.00 ? 21 TYR A CA 6 21
ATOM 5985 C C . TYR A 1 21 ? -2.699 -11.307 -4.292 1.00 0.00 ? 21 TYR A C 6 21
ATOM 5986 O O . TYR A 1 21 ? -2.619 -11.975 -3.321 1.00 0.00 ? 21 TYR A O 6 21
ATOM 5987 C CB . TYR A 1 21 ? -1.533 -9.123 -4.377 1.00 0.00 ? 21 TYR A CB 6 21
ATOM 5988 C CG . TYR A 1 21 ? -0.217 -8.495 -4.006 1.00 0.00 ? 21 TYR A CG 6 21
ATOM 5989 C CD1 . TYR A 1 21 ? 0.441 -8.738 -2.810 1.00 0.00 ? 21 TYR A CD1 6 21
ATOM 5990 C CD2 . TYR A 1 21 ? 0.271 -7.512 -4.854 1.00 0.00 ? 21 TYR A CD2 6 21
ATOM 5991 C CE1 . TYR A 1 21 ? 1.527 -7.940 -2.446 1.00 0.00 ? 21 TYR A CE1 6 21
ATOM 5992 C CE2 . TYR A 1 21 ? 1.365 -6.711 -4.519 1.00 0.00 ? 21 TYR A CE2 6 21
ATOM 5993 C CZ . TYR A 1 21 ? 1.990 -6.928 -3.293 1.00 0.00 ? 21 TYR A CZ 6 21
ATOM 5994 O OH . TYR A 1 21 ? 3.085 -6.194 -2.961 1.00 0.00 ? 21 TYR A OH 6 21
ATOM 5995 H H . TYR A 1 21 ? -1.226 -9.753 -6.671 1.00 0.00 ? 21 TYR A H 6 21
ATOM 5996 H HA . TYR A 1 21 ? -0.657 -11.000 -4.332 1.00 0.00 ? 21 TYR A HA 6 21
ATOM 5997 H HB2 . TYR A 1 21 ? -1.967 -8.549 -5.196 1.00 0.00 ? 21 TYR A HB2 6 21
ATOM 5998 H HB3 . TYR A 1 21 ? -2.183 -9.004 -3.532 1.00 0.00 ? 21 TYR A HB3 6 21
ATOM 5999 H HD1 . TYR A 1 21 ? 0.105 -9.499 -2.139 1.00 0.00 ? 21 TYR A HD1 6 21
ATOM 6000 H HD2 . TYR A 1 21 ? -0.227 -7.354 -5.774 1.00 0.00 ? 21 TYR A HD2 6 21
ATOM 6001 H HE1 . TYR A 1 21 ? 1.979 -8.033 -1.486 1.00 0.00 ? 21 TYR A HE1 6 21
ATOM 6002 H HE2 . TYR A 1 21 ? 1.680 -5.955 -5.201 1.00 0.00 ? 21 TYR A HE2 6 21
ATOM 6003 H HH . TYR A 1 21 ? 3.791 -6.459 -3.525 1.00 0.00 ? 21 TYR A HH 6 21
HETATM 6004 N N . NH2 A 1 22 ? -3.823 -11.221 -4.919 1.00 0.00 ? 22 NH2 A N 6 22
HETATM 6005 H HN1 . NH2 A 1 22 ? -4.642 -11.695 -4.656 1.00 0.00 ? 22 NH2 A HN1 6 22
HETATM 6006 H HN2 . NH2 A 1 22 ? -3.844 -10.687 -5.732 1.00 0.00 ? 22 NH2 A HN2 6 22
HETATM 6007 C C . ACE B 1 1 ? 1.032 -15.030 -4.018 1.00 0.00 ? 23 ACE B C 6 1
HETATM 6008 O O . ACE B 1 1 ? 1.868 -15.681 -3.466 1.00 0.00 ? 23 ACE B O 6 1
HETATM 6009 C CH3 . ACE B 1 1 ? 0.212 -15.677 -5.082 1.00 0.00 ? 23 ACE B CH3 6 1
HETATM 6010 H H1 . ACE B 1 1 ? 0.256 -15.824 -5.591 1.00 0.00 ? 23 ACE B H1 6 1
HETATM 6011 H H2 . ACE B 1 1 ? -0.049 -16.126 -5.151 1.00 0.00 ? 23 ACE B H2 6 1
HETATM 6012 H H3 . ACE B 1 1 ? -0.206 -15.547 -5.309 1.00 0.00 ? 23 ACE B H3 6 1
ATOM 6013 N N . ALA B 1 2 ? 0.749 -13.793 -3.701 1.00 0.00 ? 24 ALA B N 6 2
ATOM 6014 C CA . ALA B 1 2 ? 1.289 -12.976 -2.661 1.00 0.00 ? 24 ALA B CA 6 2
ATOM 6015 C C . ALA B 1 2 ? 2.781 -12.769 -2.605 1.00 0.00 ? 24 ALA B C 6 2
ATOM 6016 O O . ALA B 1 2 ? 3.217 -11.950 -1.809 1.00 0.00 ? 24 ALA B O 6 2
ATOM 6017 C CB . ALA B 1 2 ? 0.754 -13.450 -1.351 1.00 0.00 ? 24 ALA B CB 6 2
ATOM 6018 H H . ALA B 1 2 ? 0.078 -13.385 -4.281 1.00 0.00 ? 24 ALA B H 6 2
ATOM 6019 H HA . ALA B 1 2 ? 0.885 -12.009 -2.843 1.00 0.00 ? 24 ALA B HA 6 2
ATOM 6020 H HB1 . ALA B 1 2 ? 0.067 -13.902 -1.380 1.00 0.00 ? 24 ALA B HB1 6 2
ATOM 6021 H HB2 . ALA B 1 2 ? 1.253 -13.903 -0.904 1.00 0.00 ? 24 ALA B HB2 6 2
ATOM 6022 H HB3 . ALA B 1 2 ? 0.580 -12.873 -0.803 1.00 0.00 ? 24 ALA B HB3 6 2
ATOM 6023 N N . LYS B 1 3 ? 3.596 -13.393 -3.447 1.00 0.00 ? 25 LYS B N 6 3
ATOM 6024 C CA . LYS B 1 3 ? 5.015 -13.165 -3.566 1.00 0.00 ? 25 LYS B CA 6 3
ATOM 6025 C C . LYS B 1 3 ? 5.392 -11.834 -4.178 1.00 0.00 ? 25 LYS B C 6 3
ATOM 6026 O O . LYS B 1 3 ? 6.520 -11.389 -4.031 1.00 0.00 ? 25 LYS B O 6 3
ATOM 6027 C CB . LYS B 1 3 ? 5.686 -14.258 -4.369 1.00 0.00 ? 25 LYS B CB 6 3
ATOM 6028 C CG . LYS B 1 3 ? 5.645 -15.630 -3.787 1.00 0.00 ? 25 LYS B CG 6 3
ATOM 6029 C CD . LYS B 1 3 ? 6.365 -16.658 -4.611 1.00 0.00 ? 25 LYS B CD 6 3
ATOM 6030 C CE . LYS B 1 3 ? 7.015 -17.454 -3.964 1.00 0.00 ? 25 LYS B CE 6 3
ATOM 6031 N NZ . LYS B 1 3 ? 7.748 -18.410 -4.687 1.00 0.00 ? 25 LYS B NZ 6 3
ATOM 6032 H H . LYS B 1 3 ? 3.172 -14.050 -4.066 1.00 0.00 ? 25 LYS B H 6 3
ATOM 6033 H HA . LYS B 1 3 ? 5.430 -13.135 -2.570 1.00 0.00 ? 25 LYS B HA 6 3
ATOM 6034 H HB2 . LYS B 1 3 ? 5.227 -14.290 -5.358 1.00 0.00 ? 25 LYS B HB2 6 3
ATOM 6035 H HB3 . LYS B 1 3 ? 6.713 -13.999 -4.504 1.00 0.00 ? 25 LYS B HB3 6 3
ATOM 6036 H HG2 . LYS B 1 3 ? 6.058 -15.612 -2.778 1.00 0.00 ? 25 LYS B HG2 6 3
ATOM 6037 H HG3 . LYS B 1 3 ? 4.650 -15.914 -3.737 1.00 0.00 ? 25 LYS B HG3 6 3
ATOM 6038 H HD2 . LYS B 1 3 ? 5.620 -17.198 -5.196 1.00 0.00 ? 25 LYS B HD2 6 3
ATOM 6039 H HD3 . LYS B 1 3 ? 6.937 -16.388 -5.172 1.00 0.00 ? 25 LYS B HD3 6 3
ATOM 6040 H HE2 . LYS B 1 3 ? 7.744 -16.883 -3.388 1.00 0.00 ? 25 LYS B HE2 6 3
ATOM 6041 H HE3 . LYS B 1 3 ? 6.463 -17.743 -3.350 1.00 0.00 ? 25 LYS B HE3 6 3
ATOM 6042 H HZ1 . LYS B 1 3 ? 7.806 -18.633 -4.925 1.00 0.00 ? 25 LYS B HZ1 6 3
ATOM 6043 H HZ2 . LYS B 1 3 ? 8.096 -18.598 -4.936 1.00 0.00 ? 25 LYS B HZ2 6 3
ATOM 6044 H HZ3 . LYS B 1 3 ? 7.943 -18.750 -4.760 1.00 0.00 ? 25 LYS B HZ3 6 3
ATOM 6045 N N . ALA B 1 4 ? 4.429 -11.127 -4.761 1.00 0.00 ? 26 ALA B N 6 4
ATOM 6046 C CA . ALA B 1 4 ? 4.482 -9.755 -5.195 1.00 0.00 ? 26 ALA B CA 6 4
ATOM 6047 C C . ALA B 1 4 ? 4.802 -8.776 -4.082 1.00 0.00 ? 26 ALA B C 6 4
ATOM 6048 O O . ALA B 1 4 ? 4.956 -7.587 -4.319 1.00 0.00 ? 26 ALA B O 6 4
ATOM 6049 C CB . ALA B 1 4 ? 3.127 -9.442 -5.799 1.00 0.00 ? 26 ALA B CB 6 4
ATOM 6050 H H . ALA B 1 4 ? 3.593 -11.662 -4.871 1.00 0.00 ? 26 ALA B H 6 4
ATOM 6051 H HA . ALA B 1 4 ? 5.242 -9.676 -5.951 1.00 0.00 ? 26 ALA B HA 6 4
ATOM 6052 H HB1 . ALA B 1 4 ? 2.339 -9.654 -5.102 1.00 0.00 ? 26 ALA B HB1 6 4
ATOM 6053 H HB2 . ALA B 1 4 ? 3.059 -8.429 -6.153 1.00 0.00 ? 26 ALA B HB2 6 4
ATOM 6054 H HB3 . ALA B 1 4 ? 2.990 -10.063 -6.659 1.00 0.00 ? 26 ALA B HB3 6 4
ATOM 6055 N N . ALA B 1 5 ? 4.897 -9.239 -2.842 1.00 0.00 ? 27 ALA B N 6 5
ATOM 6056 C CA . ALA B 1 5 ? 5.036 -8.484 -1.626 1.00 0.00 ? 27 ALA B CA 6 5
ATOM 6057 C C . ALA B 1 5 ? 6.245 -7.571 -1.611 1.00 0.00 ? 27 ALA B C 6 5
ATOM 6058 O O . ALA B 1 5 ? 6.155 -6.399 -1.951 1.00 0.00 ? 27 ALA B O 6 5
ATOM 6059 C CB . ALA B 1 5 ? 4.899 -9.437 -0.449 1.00 0.00 ? 27 ALA B CB 6 5
ATOM 6060 H H . ALA B 1 5 ? 4.822 -10.232 -2.732 1.00 0.00 ? 27 ALA B H 6 5
ATOM 6061 H HA . ALA B 1 5 ? 4.202 -7.795 -1.546 1.00 0.00 ? 27 ALA B HA 6 5
ATOM 6062 H HB1 . ALA B 1 5 ? 5.086 -8.904 0.460 1.00 0.00 ? 27 ALA B HB1 6 5
ATOM 6063 H HB2 . ALA B 1 5 ? 3.884 -9.787 -0.402 1.00 0.00 ? 27 ALA B HB2 6 5
ATOM 6064 H HB3 . ALA B 1 5 ? 5.546 -10.277 -0.562 1.00 0.00 ? 27 ALA B HB3 6 5
ATOM 6065 N N . ALA B 1 6 ? 7.416 -8.088 -1.249 1.00 0.00 ? 28 ALA B N 6 6
ATOM 6066 C CA . ALA B 1 6 ? 8.594 -7.267 -1.098 1.00 0.00 ? 28 ALA B CA 6 6
ATOM 6067 C C . ALA B 1 6 ? 9.190 -6.877 -2.432 1.00 0.00 ? 28 ALA B C 6 6
ATOM 6068 O O . ALA B 1 6 ? 10.289 -6.367 -2.491 1.00 0.00 ? 28 ALA B O 6 6
ATOM 6069 C CB . ALA B 1 6 ? 9.602 -7.937 -0.189 1.00 0.00 ? 28 ALA B CB 6 6
ATOM 6070 H H . ALA B 1 6 ? 7.422 -9.028 -0.899 1.00 0.00 ? 28 ALA B H 6 6
ATOM 6071 H HA . ALA B 1 6 ? 8.239 -6.373 -0.617 1.00 0.00 ? 28 ALA B HA 6 6
ATOM 6072 H HB1 . ALA B 1 6 ? 9.116 -8.194 0.722 1.00 0.00 ? 28 ALA B HB1 6 6
ATOM 6073 H HB2 . ALA B 1 6 ? 9.980 -8.808 -0.656 1.00 0.00 ? 28 ALA B HB2 6 6
ATOM 6074 H HB3 . ALA B 1 6 ? 10.410 -7.265 0.037 1.00 0.00 ? 28 ALA B HB3 6 6
ATOM 6075 N N . ALA B 1 7 ? 8.495 -7.058 -3.546 1.00 0.00 ? 29 ALA B N 6 7
ATOM 6076 C CA . ALA B 1 7 ? 8.769 -6.472 -4.837 1.00 0.00 ? 29 ALA B CA 6 7
ATOM 6077 C C . ALA B 1 7 ? 7.895 -5.282 -5.170 1.00 0.00 ? 29 ALA B C 6 7
ATOM 6078 O O . ALA B 1 7 ? 8.103 -4.669 -6.193 1.00 0.00 ? 29 ALA B O 6 7
ATOM 6079 C CB . ALA B 1 7 ? 8.606 -7.554 -5.891 1.00 0.00 ? 29 ALA B CB 6 7
ATOM 6080 H H . ALA B 1 7 ? 7.651 -7.552 -3.421 1.00 0.00 ? 29 ALA B H 6 7
ATOM 6081 H HA . ALA B 1 7 ? 9.773 -6.074 -4.855 1.00 0.00 ? 29 ALA B HA 6 7
ATOM 6082 H HB1 . ALA B 1 7 ? 8.857 -7.151 -6.846 1.00 0.00 ? 29 ALA B HB1 6 7
ATOM 6083 H HB2 . ALA B 1 7 ? 9.244 -8.389 -5.690 1.00 0.00 ? 29 ALA B HB2 6 7
ATOM 6084 H HB3 . ALA B 1 7 ? 7.588 -7.831 -5.933 1.00 0.00 ? 29 ALA B HB3 6 7
ATOM 6085 N N . ALA B 1 8 ? 6.963 -4.907 -4.308 1.00 0.00 ? 30 ALA B N 6 8
ATOM 6086 C CA . ALA B 1 8 ? 6.303 -3.628 -4.347 1.00 0.00 ? 30 ALA B CA 6 8
ATOM 6087 C C . ALA B 1 8 ? 6.254 -2.910 -3.015 1.00 0.00 ? 30 ALA B C 6 8
ATOM 6088 O O . ALA B 1 8 ? 6.562 -1.735 -2.914 1.00 0.00 ? 30 ALA B O 6 8
ATOM 6089 C CB . ALA B 1 8 ? 4.891 -3.795 -4.873 1.00 0.00 ? 30 ALA B CB 6 8
ATOM 6090 H H . ALA B 1 8 ? 6.781 -5.533 -3.565 1.00 0.00 ? 30 ALA B H 6 8
ATOM 6091 H HA . ALA B 1 8 ? 6.853 -3.009 -5.036 1.00 0.00 ? 30 ALA B HA 6 8
ATOM 6092 H HB1 . ALA B 1 8 ? 4.869 -4.491 -5.697 1.00 0.00 ? 30 ALA B HB1 6 8
ATOM 6093 H HB2 . ALA B 1 8 ? 4.256 -4.154 -4.092 1.00 0.00 ? 30 ALA B HB2 6 8
ATOM 6094 H HB3 . ALA B 1 8 ? 4.507 -2.868 -5.249 1.00 0.00 ? 30 ALA B HB3 6 8
ATOM 6095 N N . ILE B 1 9 ? 5.953 -3.629 -1.936 1.00 0.00 ? 31 ILE B N 6 9
ATOM 6096 C CA . ILE B 1 9 ? 5.851 -3.094 -0.597 1.00 0.00 ? 31 ILE B CA 6 9
ATOM 6097 C C . ILE B 1 9 ? 7.189 -2.572 -0.106 1.00 0.00 ? 31 ILE B C 6 9
ATOM 6098 O O . ILE B 1 9 ? 7.208 -1.615 0.658 1.00 0.00 ? 31 ILE B O 6 9
ATOM 6099 C CB . ILE B 1 9 ? 5.331 -4.148 0.368 1.00 0.00 ? 31 ILE B CB 6 9
ATOM 6100 C CG1 . ILE B 1 9 ? 4.026 -4.821 -0.031 1.00 0.00 ? 31 ILE B CG1 6 9
ATOM 6101 C CG2 . ILE B 1 9 ? 5.137 -3.572 1.761 1.00 0.00 ? 31 ILE B CG2 6 9
ATOM 6102 C CD1 . ILE B 1 9 ? 2.956 -3.903 -0.473 1.00 0.00 ? 31 ILE B CD1 6 9
ATOM 6103 H H . ILE B 1 9 ? 5.783 -4.605 -2.072 1.00 0.00 ? 31 ILE B H 6 9
ATOM 6104 H HA . ILE B 1 9 ? 5.155 -2.265 -0.624 1.00 0.00 ? 31 ILE B HA 6 9
ATOM 6105 H HB . ILE B 1 9 ? 6.089 -4.913 0.491 1.00 0.00 ? 31 ILE B HB 6 9
ATOM 6106 H HG12 . ILE B 1 9 ? 4.232 -5.532 -0.832 1.00 0.00 ? 31 ILE B HG12 6 9
ATOM 6107 H HG13 . ILE B 1 9 ? 3.653 -5.372 0.788 1.00 0.00 ? 31 ILE B HG13 6 9
ATOM 6108 H HG21 . ILE B 1 9 ? 4.543 -2.688 1.699 1.00 0.00 ? 31 ILE B HG21 6 9
ATOM 6109 H HG22 . ILE B 1 9 ? 4.701 -4.302 2.416 1.00 0.00 ? 31 ILE B HG22 6 9
ATOM 6110 H HG23 . ILE B 1 9 ? 6.084 -3.338 2.179 1.00 0.00 ? 31 ILE B HG23 6 9
ATOM 6111 H HD11 . ILE B 1 9 ? 2.040 -4.375 -0.661 1.00 0.00 ? 31 ILE B HD11 6 9
ATOM 6112 H HD12 . ILE B 1 9 ? 2.807 -3.245 0.235 1.00 0.00 ? 31 ILE B HD12 6 9
ATOM 6113 H HD13 . ILE B 1 9 ? 3.255 -3.491 -1.315 1.00 0.00 ? 31 ILE B HD13 6 9
ATOM 6114 N N . LYS B 1 10 ? 8.315 -3.140 -0.523 1.00 0.00 ? 32 LYS B N 6 10
ATOM 6115 C CA . LYS B 1 10 ? 9.627 -2.775 -0.032 1.00 0.00 ? 32 LYS B CA 6 10
ATOM 6116 C C . LYS B 1 10 ? 10.054 -1.406 -0.528 1.00 0.00 ? 32 LYS B C 6 10
ATOM 6117 O O . LYS B 1 10 ? 10.542 -0.597 0.250 1.00 0.00 ? 32 LYS B O 6 10
ATOM 6118 C CB . LYS B 1 10 ? 10.591 -3.888 -0.418 1.00 0.00 ? 32 LYS B CB 6 10
ATOM 6119 C CG . LYS B 1 10 ? 11.700 -4.174 0.560 1.00 0.00 ? 32 LYS B CG 6 10
ATOM 6120 C CD . LYS B 1 10 ? 12.819 -3.201 0.515 1.00 0.00 ? 32 LYS B CD 6 10
ATOM 6121 C CE . LYS B 1 10 ? 13.771 -3.476 1.627 1.00 0.00 ? 32 LYS B CE 6 10
ATOM 6122 N NZ . LYS B 1 10 ? 14.878 -2.586 1.639 1.00 0.00 ? 32 LYS B NZ 6 10
ATOM 6123 H H . LYS B 1 10 ? 8.223 -3.843 -1.231 1.00 0.00 ? 32 LYS B H 6 10
ATOM 6124 H HA . LYS B 1 10 ? 9.549 -2.697 1.046 1.00 0.00 ? 32 LYS B HA 6 10
ATOM 6125 H HB2 . LYS B 1 10 ? 10.010 -4.803 -0.537 1.00 0.00 ? 32 LYS B HB2 6 10
ATOM 6126 H HB3 . LYS B 1 10 ? 11.009 -3.689 -1.394 1.00 0.00 ? 32 LYS B HB3 6 10
ATOM 6127 H HG2 . LYS B 1 10 ? 11.286 -4.197 1.568 1.00 0.00 ? 32 LYS B HG2 6 10
ATOM 6128 H HG3 . LYS B 1 10 ? 12.111 -5.140 0.357 1.00 0.00 ? 32 LYS B HG3 6 10
ATOM 6129 H HD2 . LYS B 1 10 ? 13.337 -3.267 -0.441 1.00 0.00 ? 32 LYS B HD2 6 10
ATOM 6130 H HD3 . LYS B 1 10 ? 12.418 -2.237 0.580 1.00 0.00 ? 32 LYS B HD3 6 10
ATOM 6131 H HE2 . LYS B 1 10 ? 13.243 -3.417 2.578 1.00 0.00 ? 32 LYS B HE2 6 10
ATOM 6132 H HE3 . LYS B 1 10 ? 14.154 -4.443 1.532 1.00 0.00 ? 32 LYS B HE3 6 10
ATOM 6133 H HZ1 . LYS B 1 10 ? 15.477 -2.722 2.163 1.00 0.00 ? 32 LYS B HZ1 6 10
ATOM 6134 H HZ2 . LYS B 1 10 ? 15.251 -2.553 0.970 1.00 0.00 ? 32 LYS B HZ2 6 10
ATOM 6135 H HZ3 . LYS B 1 10 ? 14.732 -1.829 1.802 1.00 0.00 ? 32 LYS B HZ3 6 10
ATOM 6136 N N . ALA B 1 11 ? 9.737 -1.087 -1.780 1.00 0.00 ? 33 ALA B N 6 11
ATOM 6137 C CA . ALA B 1 11 ? 9.798 0.265 -2.291 1.00 0.00 ? 33 ALA B CA 6 11
ATOM 6138 C C . ALA B 1 11 ? 8.792 1.171 -1.604 1.00 0.00 ? 33 ALA B C 6 11
ATOM 6139 O O . ALA B 1 11 ? 9.166 2.241 -1.148 1.00 0.00 ? 33 ALA B O 6 11
ATOM 6140 C CB . ALA B 1 11 ? 9.657 0.180 -3.801 1.00 0.00 ? 33 ALA B CB 6 11
ATOM 6141 H H . ALA B 1 11 ? 9.392 -1.826 -2.359 1.00 0.00 ? 33 ALA B H 6 11
ATOM 6142 H HA . ALA B 1 11 ? 10.762 0.700 -2.071 1.00 0.00 ? 33 ALA B HA 6 11
ATOM 6143 H HB1 . ALA B 1 11 ? 10.513 -0.297 -4.203 1.00 0.00 ? 33 ALA B HB1 6 11
ATOM 6144 H HB2 . ALA B 1 11 ? 8.779 -0.349 -4.061 1.00 0.00 ? 33 ALA B HB2 6 11
ATOM 6145 H HB3 . ALA B 1 11 ? 9.619 1.143 -4.227 1.00 0.00 ? 33 ALA B HB3 6 11
ATOM 6146 N N . ILE B 1 12 ? 7.546 0.728 -1.466 1.00 0.00 ? 34 ILE B N 6 12
ATOM 6147 C CA . ILE B 1 12 ? 6.481 1.568 -0.970 1.00 0.00 ? 34 ILE B CA 6 12
ATOM 6148 C C . ILE B 1 12 ? 6.710 1.938 0.485 1.00 0.00 ? 34 ILE B C 6 12
ATOM 6149 O O . ILE B 1 12 ? 6.697 3.128 0.779 1.00 0.00 ? 34 ILE B O 6 12
ATOM 6150 C CB . ILE B 1 12 ? 5.096 1.015 -1.257 1.00 0.00 ? 34 ILE B CB 6 12
ATOM 6151 C CG1 . ILE B 1 12 ? 4.252 1.994 -2.041 1.00 0.00 ? 34 ILE B CG1 6 12
ATOM 6152 C CG2 . ILE B 1 12 ? 4.352 0.440 -0.065 1.00 0.00 ? 34 ILE B CG2 6 12
ATOM 6153 C CD1 . ILE B 1 12 ? 3.747 3.198 -1.305 1.00 0.00 ? 34 ILE B CD1 6 12
ATOM 6154 H H . ILE B 1 12 ? 7.350 -0.239 -1.659 1.00 0.00 ? 34 ILE B H 6 12
ATOM 6155 H HA . ILE B 1 12 ? 6.557 2.529 -1.464 1.00 0.00 ? 34 ILE B HA 6 12
ATOM 6156 H HB . ILE B 1 12 ? 5.211 0.188 -1.946 1.00 0.00 ? 34 ILE B HB 6 12
ATOM 6157 H HG12 . ILE B 1 12 ? 4.849 2.338 -2.886 1.00 0.00 ? 34 ILE B HG12 6 12
ATOM 6158 H HG13 . ILE B 1 12 ? 3.395 1.542 -2.453 1.00 0.00 ? 34 ILE B HG13 6 12
ATOM 6159 H HG21 . ILE B 1 12 ? 4.114 1.215 0.646 1.00 0.00 ? 34 ILE B HG21 6 12
ATOM 6160 H HG22 . ILE B 1 12 ? 3.453 -0.027 -0.426 1.00 0.00 ? 34 ILE B HG22 6 12
ATOM 6161 H HG23 . ILE B 1 12 ? 4.970 -0.291 0.432 1.00 0.00 ? 34 ILE B HG23 6 12
ATOM 6162 H HD11 . ILE B 1 12 ? 3.760 3.269 -0.618 1.00 0.00 ? 34 ILE B HD11 6 12
ATOM 6163 H HD12 . ILE B 1 12 ? 3.099 3.381 -1.374 1.00 0.00 ? 34 ILE B HD12 6 12
ATOM 6164 H HD13 . ILE B 1 12 ? 3.984 3.842 -1.373 1.00 0.00 ? 34 ILE B HD13 6 12
ATOM 6165 N N . ALA B 1 13 ? 7.085 1.026 1.381 1.00 0.00 ? 35 ALA B N 6 13
ATOM 6166 C CA . ALA B 1 13 ? 7.311 1.310 2.776 1.00 0.00 ? 35 ALA B CA 6 13
ATOM 6167 C C . ALA B 1 13 ? 8.541 2.150 3.066 1.00 0.00 ? 35 ALA B C 6 13
ATOM 6168 O O . ALA B 1 13 ? 8.758 2.540 4.202 1.00 0.00 ? 35 ALA B O 6 13
ATOM 6169 C CB . ALA B 1 13 ? 7.163 0.039 3.595 1.00 0.00 ? 35 ALA B CB 6 13
ATOM 6170 H H . ALA B 1 13 ? 7.134 0.093 1.015 1.00 0.00 ? 35 ALA B H 6 13
ATOM 6171 H HA . ALA B 1 13 ? 6.495 1.941 3.095 1.00 0.00 ? 35 ALA B HA 6 13
ATOM 6172 H HB1 . ALA B 1 13 ? 7.925 -0.673 3.345 1.00 0.00 ? 35 ALA B HB1 6 13
ATOM 6173 H HB2 . ALA B 1 13 ? 7.159 0.281 4.642 1.00 0.00 ? 35 ALA B HB2 6 13
ATOM 6174 H HB3 . ALA B 1 13 ? 6.211 -0.408 3.387 1.00 0.00 ? 35 ALA B HB3 6 13
ATOM 6175 N N . ALA B 1 14 ? 9.304 2.512 2.044 1.00 0.00 ? 36 ALA B N 6 14
ATOM 6176 C CA . ALA B 1 14 ? 10.329 3.527 2.033 1.00 0.00 ? 36 ALA B CA 6 14
ATOM 6177 C C . ALA B 1 14 ? 9.854 4.828 1.421 1.00 0.00 ? 36 ALA B C 6 14
ATOM 6178 O O . ALA B 1 14 ? 10.115 5.893 1.952 1.00 0.00 ? 36 ALA B O 6 14
ATOM 6179 C CB . ALA B 1 14 ? 11.555 2.952 1.369 1.00 0.00 ? 36 ALA B CB 6 14
ATOM 6180 H H . ALA B 1 14 ? 8.874 2.231 1.184 1.00 0.00 ? 36 ALA B H 6 14
ATOM 6181 H HA . ALA B 1 14 ? 10.619 3.747 3.052 1.00 0.00 ? 36 ALA B HA 6 14
ATOM 6182 H HB1 . ALA B 1 14 ? 11.566 2.606 0.800 1.00 0.00 ? 36 ALA B HB1 6 14
ATOM 6183 H HB2 . ALA B 1 14 ? 12.036 3.343 1.186 1.00 0.00 ? 36 ALA B HB2 6 14
ATOM 6184 H HB3 . ALA B 1 14 ? 11.962 2.535 1.670 1.00 0.00 ? 36 ALA B HB3 6 14
ATOM 6185 N N . ILE B 1 15 ? 9.096 4.752 0.333 1.00 0.00 ? 37 ILE B N 6 15
ATOM 6186 C CA . ILE B 1 15 ? 8.394 5.840 -0.309 1.00 0.00 ? 37 ILE B CA 6 15
ATOM 6187 C C . ILE B 1 15 ? 7.326 6.439 0.588 1.00 0.00 ? 37 ILE B C 6 15
ATOM 6188 O O . ILE B 1 15 ? 7.073 7.631 0.514 1.00 0.00 ? 37 ILE B O 6 15
ATOM 6189 C CB . ILE B 1 15 ? 7.837 5.391 -1.647 1.00 0.00 ? 37 ILE B CB 6 15
ATOM 6190 C CG1 . ILE B 1 15 ? 8.918 5.038 -2.650 1.00 0.00 ? 37 ILE B CG1 6 15
ATOM 6191 C CG2 . ILE B 1 15 ? 6.917 6.412 -2.289 1.00 0.00 ? 37 ILE B CG2 6 15
ATOM 6192 C CD1 . ILE B 1 15 ? 8.455 4.080 -3.722 1.00 0.00 ? 37 ILE B CD1 6 15
ATOM 6193 H H . ILE B 1 15 ? 8.913 3.826 -0.013 1.00 0.00 ? 37 ILE B H 6 15
ATOM 6194 H HA . ILE B 1 15 ? 9.109 6.617 -0.527 1.00 0.00 ? 37 ILE B HA 6 15
ATOM 6195 H HB . ILE B 1 15 ? 7.257 4.507 -1.449 1.00 0.00 ? 37 ILE B HB 6 15
ATOM 6196 H HG12 . ILE B 1 15 ? 9.288 5.952 -3.113 1.00 0.00 ? 37 ILE B HG12 6 15
ATOM 6197 H HG13 . ILE B 1 15 ? 9.745 4.562 -2.155 1.00 0.00 ? 37 ILE B HG13 6 15
ATOM 6198 H HG21 . ILE B 1 15 ? 7.372 7.349 -2.353 1.00 0.00 ? 37 ILE B HG21 6 15
ATOM 6199 H HG22 . ILE B 1 15 ? 6.662 6.098 -3.257 1.00 0.00 ? 37 ILE B HG22 6 15
ATOM 6200 H HG23 . ILE B 1 15 ? 6.013 6.551 -1.778 1.00 0.00 ? 37 ILE B HG23 6 15
ATOM 6201 H HD11 . ILE B 1 15 ? 7.890 4.556 -4.420 1.00 0.00 ? 37 ILE B HD11 6 15
ATOM 6202 H HD12 . ILE B 1 15 ? 9.250 3.678 -4.209 1.00 0.00 ? 37 ILE B HD12 6 15
ATOM 6203 H HD13 . ILE B 1 15 ? 7.919 3.291 -3.373 1.00 0.00 ? 37 ILE B HD13 6 15
ATOM 6204 N N . ILE B 1 16 ? 6.784 5.670 1.522 1.00 0.00 ? 38 ILE B N 6 16
ATOM 6205 C CA . ILE B 1 16 ? 5.991 6.117 2.645 1.00 0.00 ? 38 ILE B CA 6 16
ATOM 6206 C C . ILE B 1 16 ? 6.741 7.182 3.420 1.00 0.00 ? 38 ILE B C 6 16
ATOM 6207 O O . ILE B 1 16 ? 6.312 8.321 3.534 1.00 0.00 ? 38 ILE B O 6 16
ATOM 6208 C CB . ILE B 1 16 ? 5.595 4.960 3.543 1.00 0.00 ? 38 ILE B CB 6 16
ATOM 6209 C CG1 . ILE B 1 16 ? 4.635 3.998 2.875 1.00 0.00 ? 38 ILE B CG1 6 16
ATOM 6210 C CG2 . ILE B 1 16 ? 4.924 5.455 4.817 1.00 0.00 ? 38 ILE B CG2 6 16
ATOM 6211 C CD1 . ILE B 1 16 ? 3.181 4.144 2.831 1.00 0.00 ? 38 ILE B CD1 6 16
ATOM 6212 H H . ILE B 1 16 ? 6.972 4.696 1.416 1.00 0.00 ? 38 ILE B H 6 16
ATOM 6213 H HA . ILE B 1 16 ? 5.070 6.547 2.268 1.00 0.00 ? 38 ILE B HA 6 16
ATOM 6214 H HB . ILE B 1 16 ? 6.499 4.403 3.767 1.00 0.00 ? 38 ILE B HB 6 16
ATOM 6215 H HG12 . ILE B 1 16 ? 4.964 3.929 1.838 1.00 0.00 ? 38 ILE B HG12 6 16
ATOM 6216 H HG13 . ILE B 1 16 ? 4.739 3.078 3.283 1.00 0.00 ? 38 ILE B HG13 6 16
ATOM 6217 H HG21 . ILE B 1 16 ? 4.170 6.199 4.581 1.00 0.00 ? 38 ILE B HG21 6 16
ATOM 6218 H HG22 . ILE B 1 16 ? 4.430 4.643 5.339 1.00 0.00 ? 38 ILE B HG22 6 16
ATOM 6219 H HG23 . ILE B 1 16 ? 5.649 5.873 5.498 1.00 0.00 ? 38 ILE B HG23 6 16
ATOM 6220 H HD11 . ILE B 1 16 ? 2.975 4.997 2.411 1.00 0.00 ? 38 ILE B HD11 6 16
ATOM 6221 H HD12 . ILE B 1 16 ? 2.735 3.376 2.329 1.00 0.00 ? 38 ILE B HD12 6 16
ATOM 6222 H HD13 . ILE B 1 16 ? 2.813 4.152 3.712 1.00 0.00 ? 38 ILE B HD13 6 16
ATOM 6223 N N . LYS B 1 17 ? 7.866 6.771 3.989 1.00 0.00 ? 39 LYS B N 6 17
ATOM 6224 C CA . LYS B 1 17 ? 8.745 7.546 4.830 1.00 0.00 ? 39 LYS B CA 6 17
ATOM 6225 C C . LYS B 1 17 ? 9.321 8.766 4.141 1.00 0.00 ? 39 LYS B C 6 17
ATOM 6226 O O . LYS B 1 17 ? 9.340 9.826 4.712 1.00 0.00 ? 39 LYS B O 6 17
ATOM 6227 C CB . LYS B 1 17 ? 9.845 6.652 5.371 1.00 0.00 ? 39 LYS B CB 6 17
ATOM 6228 C CG . LYS B 1 17 ? 9.356 5.577 6.316 1.00 0.00 ? 39 LYS B CG 6 17
ATOM 6229 C CD . LYS B 1 17 ? 10.428 4.673 6.807 1.00 0.00 ? 39 LYS B CD 6 17
ATOM 6230 C CE . LYS B 1 17 ? 9.972 3.530 7.674 1.00 0.00 ? 39 LYS B CE 6 17
ATOM 6231 N NZ . LYS B 1 17 ? 9.401 2.459 6.952 1.00 0.00 ? 39 LYS B NZ 6 17
ATOM 6232 H H . LYS B 1 17 ? 8.075 5.807 3.823 1.00 0.00 ? 39 LYS B H 6 17
ATOM 6233 H HA . LYS B 1 17 ? 8.173 7.949 5.659 1.00 0.00 ? 39 LYS B HA 6 17
ATOM 6234 H HB2 . LYS B 1 17 ? 10.370 6.185 4.537 1.00 0.00 ? 39 LYS B HB2 6 17
ATOM 6235 H HB3 . LYS B 1 17 ? 10.554 7.266 5.903 1.00 0.00 ? 39 LYS B HB3 6 17
ATOM 6236 H HG2 . LYS B 1 17 ? 8.865 6.049 7.167 1.00 0.00 ? 39 LYS B HG2 6 17
ATOM 6237 H HG3 . LYS B 1 17 ? 8.633 4.967 5.825 1.00 0.00 ? 39 LYS B HG3 6 17
ATOM 6238 H HD2 . LYS B 1 17 ? 10.967 4.267 5.951 1.00 0.00 ? 39 LYS B HD2 6 17
ATOM 6239 H HD3 . LYS B 1 17 ? 11.100 5.275 7.359 1.00 0.00 ? 39 LYS B HD3 6 17
ATOM 6240 H HE2 . LYS B 1 17 ? 10.823 3.159 8.245 1.00 0.00 ? 39 LYS B HE2 6 17
ATOM 6241 H HE3 . LYS B 1 17 ? 9.281 3.861 8.349 1.00 0.00 ? 39 LYS B HE3 6 17
ATOM 6242 H HZ1 . LYS B 1 17 ? 9.146 2.339 6.750 1.00 0.00 ? 39 LYS B HZ1 6 17
ATOM 6243 H HZ2 . LYS B 1 17 ? 9.389 2.160 6.682 1.00 0.00 ? 39 LYS B HZ2 6 17
ATOM 6244 H HZ3 . LYS B 1 17 ? 9.259 2.093 6.872 1.00 0.00 ? 39 LYS B HZ3 6 17
ATOM 6245 N N . ALA B 1 18 ? 9.743 8.655 2.894 1.00 0.00 ? 40 ALA B N 6 18
ATOM 6246 C CA . ALA B 1 18 ? 10.360 9.704 2.117 1.00 0.00 ? 40 ALA B CA 6 18
ATOM 6247 C C . ALA B 1 18 ? 9.354 10.628 1.463 1.00 0.00 ? 40 ALA B C 6 18
ATOM 6248 O O . ALA B 1 18 ? 9.601 11.813 1.344 1.00 0.00 ? 40 ALA B O 6 18
ATOM 6249 C CB . ALA B 1 18 ? 11.277 9.093 1.076 1.00 0.00 ? 40 ALA B CB 6 18
ATOM 6250 H H . ALA B 1 18 ? 9.727 7.748 2.487 1.00 0.00 ? 40 ALA B H 6 18
ATOM 6251 H HA . ALA B 1 18 ? 10.929 10.304 2.820 1.00 0.00 ? 40 ALA B HA 6 18
ATOM 6252 H HB1 . ALA B 1 18 ? 11.796 9.866 0.560 1.00 0.00 ? 40 ALA B HB1 6 18
ATOM 6253 H HB2 . ALA B 1 18 ? 11.975 8.444 1.567 1.00 0.00 ? 40 ALA B HB2 6 18
ATOM 6254 H HB3 . ALA B 1 18 ? 10.704 8.531 0.366 1.00 0.00 ? 40 ALA B HB3 6 18
ATOM 6255 N N . GLY B 1 19 ? 8.188 10.113 1.084 1.00 0.00 ? 41 GLY B N 6 19
ATOM 6256 C CA . GLY B 1 19 ? 7.056 10.820 0.531 1.00 0.00 ? 41 GLY B CA 6 19
ATOM 6257 C C . GLY B 1 19 ? 6.424 11.775 1.519 1.00 0.00 ? 41 GLY B C 6 19
ATOM 6258 O O . GLY B 1 19 ? 5.874 12.764 1.114 1.00 0.00 ? 41 GLY B O 6 19
ATOM 6259 H H . GLY B 1 19 ? 8.099 9.124 1.154 1.00 0.00 ? 41 GLY B H 6 19
ATOM 6260 H HA2 . GLY B 1 19 ? 7.317 11.371 -0.358 1.00 0.00 ? 41 GLY B HA2 6 19
ATOM 6261 H HA3 . GLY B 1 19 ? 6.302 10.096 0.274 1.00 0.00 ? 41 GLY B HA3 6 19
ATOM 6262 N N . GLY B 1 20 ? 6.471 11.501 2.808 1.00 0.00 ? 42 GLY B N 6 20
ATOM 6263 C CA . GLY B 1 20 ? 5.851 12.276 3.842 1.00 0.00 ? 42 GLY B CA 6 20
ATOM 6264 C C . GLY B 1 20 ? 4.349 12.109 3.859 1.00 0.00 ? 42 GLY B C 6 20
ATOM 6265 O O . GLY B 1 20 ? 3.622 13.066 3.849 1.00 0.00 ? 42 GLY B O 6 20
ATOM 6266 H H . GLY B 1 20 ? 6.913 10.664 3.082 1.00 0.00 ? 42 GLY B H 6 20
ATOM 6267 H HA2 . GLY B 1 20 ? 6.224 11.993 4.803 1.00 0.00 ? 42 GLY B HA2 6 20
ATOM 6268 H HA3 . GLY B 1 20 ? 6.055 13.310 3.679 1.00 0.00 ? 42 GLY B HA3 6 20
ATOM 6269 N N . TYR B 1 21 ? 3.873 10.882 3.804 1.00 0.00 ? 43 TYR B N 6 21
ATOM 6270 C CA . TYR B 1 21 ? 2.520 10.497 3.691 1.00 0.00 ? 43 TYR B CA 6 21
ATOM 6271 C C . TYR B 1 21 ? 1.593 11.048 4.683 1.00 0.00 ? 43 TYR B C 6 21
ATOM 6272 O O . TYR B 1 21 ? 0.531 11.342 4.360 1.00 0.00 ? 43 TYR B O 6 21
ATOM 6273 C CB . TYR B 1 21 ? 2.442 8.985 3.676 1.00 0.00 ? 43 TYR B CB 6 21
ATOM 6274 C CG . TYR B 1 21 ? 2.235 8.364 2.324 1.00 0.00 ? 43 TYR B CG 6 21
ATOM 6275 C CD1 . TYR B 1 21 ? 3.332 8.126 1.501 1.00 0.00 ? 43 TYR B CD1 6 21
ATOM 6276 C CD2 . TYR B 1 21 ? 0.954 8.004 1.915 1.00 0.00 ? 43 TYR B CD2 6 21
ATOM 6277 C CE1 . TYR B 1 21 ? 3.180 7.470 0.283 1.00 0.00 ? 43 TYR B CE1 6 21
ATOM 6278 C CE2 . TYR B 1 21 ? 0.775 7.383 0.681 1.00 0.00 ? 43 TYR B CE2 6 21
ATOM 6279 C CZ . TYR B 1 21 ? 1.886 7.115 -0.133 1.00 0.00 ? 43 TYR B CZ 6 21
ATOM 6280 O OH . TYR B 1 21 ? 1.718 6.627 -1.390 1.00 0.00 ? 43 TYR B OH 6 21
ATOM 6281 H H . TYR B 1 21 ? 4.537 10.152 3.777 1.00 0.00 ? 43 TYR B H 6 21
ATOM 6282 H HA . TYR B 1 21 ? 2.194 10.844 2.758 1.00 0.00 ? 43 TYR B HA 6 21
ATOM 6283 H HB2 . TYR B 1 21 ? 3.371 8.596 4.092 1.00 0.00 ? 43 TYR B HB2 6 21
ATOM 6284 H HB3 . TYR B 1 21 ? 1.653 8.636 4.331 1.00 0.00 ? 43 TYR B HB3 6 21
ATOM 6285 H HD1 . TYR B 1 21 ? 4.314 8.424 1.810 1.00 0.00 ? 43 TYR B HD1 6 21
ATOM 6286 H HD2 . TYR B 1 21 ? 0.118 8.244 2.537 1.00 0.00 ? 43 TYR B HD2 6 21
ATOM 6287 H HE1 . TYR B 1 21 ? 4.038 7.268 -0.325 1.00 0.00 ? 43 TYR B HE1 6 21
ATOM 6288 H HE2 . TYR B 1 21 ? -0.213 7.133 0.354 1.00 0.00 ? 43 TYR B HE2 6 21
ATOM 6289 H HH . TYR B 1 21 ? 2.040 7.262 -2.008 1.00 0.00 ? 43 TYR B HH 6 21
HETATM 6290 N N . NH2 B 1 22 ? 1.977 11.261 5.873 1.00 0.00 ? 44 NH2 B N 6 22
HETATM 6291 H HN1 . NH2 B 1 22 ? 1.371 11.607 6.519 1.00 0.00 ? 44 NH2 B HN1 6 22
HETATM 6292 H HN2 . NH2 B 1 22 ? 2.842 11.000 6.103 1.00 0.00 ? 44 NH2 B HN2 6 22
HETATM 6293 C C . ACE C 1 1 ? -7.875 11.093 -3.346 1.00 0.00 ? 45 ACE C C 6 1
HETATM 6294 O O . ACE C 1 1 ? -8.078 10.202 -2.542 1.00 0.00 ? 45 ACE C O 6 1
HETATM 6295 C CH3 . ACE C 1 1 ? -8.943 11.444 -4.337 1.00 0.00 ? 45 ACE C CH3 6 1
HETATM 6296 H H1 . ACE C 1 1 ? -9.435 11.138 -4.377 1.00 0.00 ? 45 ACE C H1 6 1
HETATM 6297 H H2 . ACE C 1 1 ? -9.228 11.989 -4.350 1.00 0.00 ? 45 ACE C H2 6 1
HETATM 6298 H H3 . ACE C 1 1 ? -8.891 11.444 -4.984 1.00 0.00 ? 45 ACE C H3 6 1
ATOM 6299 N N . ALA C 1 2 ? -6.741 11.779 -3.397 1.00 0.00 ? 46 ALA C N 6 2
ATOM 6300 C CA . ALA C 1 2 ? -5.551 11.543 -2.623 1.00 0.00 ? 46 ALA C CA 6 2
ATOM 6301 C C . ALA C 1 2 ? -5.754 11.519 -1.126 1.00 0.00 ? 46 ALA C C 6 2
ATOM 6302 O O . ALA C 1 2 ? -5.032 10.814 -0.451 1.00 0.00 ? 46 ALA C O 6 2
ATOM 6303 C CB . ALA C 1 2 ? -4.536 12.582 -3.003 1.00 0.00 ? 46 ALA C CB 6 2
ATOM 6304 H H . ALA C 1 2 ? -6.745 12.518 -4.071 1.00 0.00 ? 46 ALA C H 6 2
ATOM 6305 H HA . ALA C 1 2 ? -5.164 10.582 -2.902 1.00 0.00 ? 46 ALA C HA 6 2
ATOM 6306 H HB1 . ALA C 1 2 ? -3.658 12.356 -2.457 1.00 0.00 ? 46 ALA C HB1 6 2
ATOM 6307 H HB2 . ALA C 1 2 ? -4.338 12.526 -4.036 1.00 0.00 ? 46 ALA C HB2 6 2
ATOM 6308 H HB3 . ALA C 1 2 ? -4.892 13.562 -2.813 1.00 0.00 ? 46 ALA C HB3 6 2
ATOM 6309 N N . LYS C 1 3 ? -6.745 12.219 -0.592 1.00 0.00 ? 47 LYS C N 6 3
ATOM 6310 C CA . LYS C 1 3 ? -7.135 12.209 0.798 1.00 0.00 ? 47 LYS C CA 6 3
ATOM 6311 C C . LYS C 1 3 ? -7.548 10.853 1.335 1.00 0.00 ? 47 LYS C C 6 3
ATOM 6312 O O . LYS C 1 3 ? -7.567 10.698 2.544 1.00 0.00 ? 47 LYS C O 6 3
ATOM 6313 C CB . LYS C 1 3 ? -8.260 13.181 1.064 1.00 0.00 ? 47 LYS C CB 6 3
ATOM 6314 C CG . LYS C 1 3 ? -7.875 14.621 0.883 1.00 0.00 ? 47 LYS C CG 6 3
ATOM 6315 C CD . LYS C 1 3 ? -8.982 15.574 1.253 1.00 0.00 ? 47 LYS C CD 6 3
ATOM 6316 C CE . LYS C 1 3 ? -8.891 16.768 0.851 1.00 0.00 ? 47 LYS C CE 6 3
ATOM 6317 N NZ . LYS C 1 3 ? -9.843 17.728 1.221 1.00 0.00 ? 47 LYS C NZ 6 3
ATOM 6318 H H . LYS C 1 3 ? -7.253 12.741 -1.249 1.00 0.00 ? 47 LYS C H 6 3
ATOM 6319 H HA . LYS C 1 3 ? -6.283 12.549 1.375 1.00 0.00 ? 47 LYS C HA 6 3
ATOM 6320 H HB2 . LYS C 1 3 ? -9.109 12.948 0.422 1.00 0.00 ? 47 LYS C HB2 6 3
ATOM 6321 H HB3 . LYS C 1 3 ? -8.548 13.035 2.085 1.00 0.00 ? 47 LYS C HB3 6 3
ATOM 6322 H HG2 . LYS C 1 3 ? -6.994 14.844 1.486 1.00 0.00 ? 47 LYS C HG2 6 3
ATOM 6323 H HG3 . LYS C 1 3 ? -7.604 14.740 -0.134 1.00 0.00 ? 47 LYS C HG3 6 3
ATOM 6324 H HD2 . LYS C 1 3 ? -9.918 15.159 0.878 1.00 0.00 ? 47 LYS C HD2 6 3
ATOM 6325 H HD3 . LYS C 1 3 ? -9.057 15.643 2.104 1.00 0.00 ? 47 LYS C HD3 6 3
ATOM 6326 H HE2 . LYS C 1 3 ? -7.926 17.138 1.198 1.00 0.00 ? 47 LYS C HE2 6 3
ATOM 6327 H HE3 . LYS C 1 3 ? -8.838 16.752 0.050 1.00 0.00 ? 47 LYS C HE3 6 3
ATOM 6328 H HZ1 . LYS C 1 3 ? -10.250 17.740 1.132 1.00 0.00 ? 47 LYS C HZ1 6 3
ATOM 6329 H HZ2 . LYS C 1 3 ? -10.030 17.896 1.613 1.00 0.00 ? 47 LYS C HZ2 6 3
ATOM 6330 H HZ3 . LYS C 1 3 ? -9.946 18.241 1.171 1.00 0.00 ? 47 LYS C HZ3 6 3
ATOM 6331 N N . ALA C 1 4 ? -7.769 9.856 0.485 1.00 0.00 ? 48 ALA C N 6 4
ATOM 6332 C CA . ALA C 1 4 ? -7.814 8.454 0.825 1.00 0.00 ? 48 ALA C CA 6 4
ATOM 6333 C C . ALA C 1 4 ? -6.597 7.931 1.562 1.00 0.00 ? 48 ALA C C 6 4
ATOM 6334 O O . ALA C 1 4 ? -6.577 6.805 2.038 1.00 0.00 ? 48 ALA C O 6 4
ATOM 6335 C CB . ALA C 1 4 ? -7.975 7.709 -0.482 1.00 0.00 ? 48 ALA C CB 6 4
ATOM 6336 H H . ALA C 1 4 ? -7.757 10.081 -0.490 1.00 0.00 ? 48 ALA C H 6 4
ATOM 6337 H HA . ALA C 1 4 ? -8.682 8.305 1.448 1.00 0.00 ? 48 ALA C HA 6 4
ATOM 6338 H HB1 . ALA C 1 4 ? -8.888 8.037 -0.958 1.00 0.00 ? 48 ALA C HB1 6 4
ATOM 6339 H HB2 . ALA C 1 4 ? -7.172 7.904 -1.164 1.00 0.00 ? 48 ALA C HB2 6 4
ATOM 6340 H HB3 . ALA C 1 4 ? -8.022 6.651 -0.289 1.00 0.00 ? 48 ALA C HB3 6 4
ATOM 6341 N N . ALA C 1 5 ? -5.534 8.724 1.670 1.00 0.00 ? 49 ALA C N 6 5
ATOM 6342 C CA . ALA C 1 5 ? -4.228 8.436 2.207 1.00 0.00 ? 49 ALA C CA 6 5
ATOM 6343 C C . ALA C 1 5 ? -4.289 7.902 3.624 1.00 0.00 ? 49 ALA C C 6 5
ATOM 6344 O O . ALA C 1 5 ? -4.377 6.695 3.810 1.00 0.00 ? 49 ALA C O 6 5
ATOM 6345 C CB . ALA C 1 5 ? -3.338 9.637 1.949 1.00 0.00 ? 49 ALA C CB 6 5
ATOM 6346 H H . ALA C 1 5 ? -5.694 9.675 1.410 1.00 0.00 ? 49 ALA C H 6 5
ATOM 6347 H HA . ALA C 1 5 ? -3.774 7.640 1.633 1.00 0.00 ? 49 ALA C HA 6 5
ATOM 6348 H HB1 . ALA C 1 5 ? -3.237 9.764 0.890 1.00 0.00 ? 49 ALA C HB1 6 5
ATOM 6349 H HB2 . ALA C 1 5 ? -3.813 10.529 2.300 1.00 0.00 ? 49 ALA C HB2 6 5
ATOM 6350 H HB3 . ALA C 1 5 ? -2.390 9.523 2.411 1.00 0.00 ? 49 ALA C HB3 6 5
ATOM 6351 N N . ALA C 1 6 ? -4.299 8.758 4.644 1.00 0.00 ? 50 ALA C N 6 6
ATOM 6352 C CA . ALA C 1 6 ? -4.198 8.263 5.997 1.00 0.00 ? 50 ALA C CA 6 6
ATOM 6353 C C . ALA C 1 6 ? -5.310 7.310 6.397 1.00 0.00 ? 50 ALA C C 6 6
ATOM 6354 O O . ALA C 1 6 ? -5.112 6.368 7.148 1.00 0.00 ? 50 ALA C O 6 6
ATOM 6355 C CB . ALA C 1 6 ? -4.086 9.444 6.945 1.00 0.00 ? 50 ALA C CB 6 6
ATOM 6356 H H . ALA C 1 6 ? -4.132 9.728 4.460 1.00 0.00 ? 50 ALA C H 6 6
ATOM 6357 H HA . ALA C 1 6 ? -3.276 7.695 6.006 1.00 0.00 ? 50 ALA C HA 6 6
ATOM 6358 H HB1 . ALA C 1 6 ? -3.199 10.010 6.710 1.00 0.00 ? 50 ALA C HB1 6 6
ATOM 6359 H HB2 . ALA C 1 6 ? -4.946 10.083 6.893 1.00 0.00 ? 50 ALA C HB2 6 6
ATOM 6360 H HB3 . ALA C 1 6 ? -4.002 9.058 7.949 1.00 0.00 ? 50 ALA C HB3 6 6
ATOM 6361 N N . ALA C 1 7 ? -6.486 7.488 5.818 1.00 0.00 ? 51 ALA C N 6 7
ATOM 6362 C CA . ALA C 1 7 ? -7.621 6.611 5.986 1.00 0.00 ? 51 ALA C CA 6 7
ATOM 6363 C C . ALA C 1 7 ? -7.411 5.189 5.523 1.00 0.00 ? 51 ALA C C 6 7
ATOM 6364 O O . ALA C 1 7 ? -8.175 4.342 5.861 1.00 0.00 ? 51 ALA C O 6 7
ATOM 6365 C CB . ALA C 1 7 ? -8.824 7.248 5.326 1.00 0.00 ? 51 ALA C CB 6 7
ATOM 6366 H H . ALA C 1 7 ? -6.531 8.302 5.233 1.00 0.00 ? 51 ALA C H 6 7
ATOM 6367 H HA . ALA C 1 7 ? -7.795 6.528 7.052 1.00 0.00 ? 51 ALA C HA 6 7
ATOM 6368 H HB1 . ALA C 1 7 ? -9.011 8.162 5.734 1.00 0.00 ? 51 ALA C HB1 6 7
ATOM 6369 H HB2 . ALA C 1 7 ? -8.661 7.377 4.324 1.00 0.00 ? 51 ALA C HB2 6 7
ATOM 6370 H HB3 . ALA C 1 7 ? -9.662 6.655 5.458 1.00 0.00 ? 51 ALA C HB3 6 7
ATOM 6371 N N . ALA C 1 8 ? -6.374 4.876 4.781 1.00 0.00 ? 52 ALA C N 6 8
ATOM 6372 C CA . ALA C 1 8 ? -5.794 3.564 4.640 1.00 0.00 ? 52 ALA C CA 6 8
ATOM 6373 C C . ALA C 1 8 ? -4.445 3.501 5.329 1.00 0.00 ? 52 ALA C C 6 8
ATOM 6374 O O . ALA C 1 8 ? -4.207 2.714 6.226 1.00 0.00 ? 52 ALA C O 6 8
ATOM 6375 C CB . ALA C 1 8 ? -5.665 3.216 3.175 1.00 0.00 ? 52 ALA C CB 6 8
ATOM 6376 H H . ALA C 1 8 ? -5.840 5.604 4.395 1.00 0.00 ? 52 ALA C H 6 8
ATOM 6377 H HA . ALA C 1 8 ? -6.422 2.834 5.129 1.00 0.00 ? 52 ALA C HA 6 8
ATOM 6378 H HB1 . ALA C 1 8 ? -5.338 2.797 2.904 1.00 0.00 ? 52 ALA C HB1 6 8
ATOM 6379 H HB2 . ALA C 1 8 ? -6.082 3.079 2.826 1.00 0.00 ? 52 ALA C HB2 6 8
ATOM 6380 H HB3 . ALA C 1 8 ? -5.483 3.555 2.689 1.00 0.00 ? 52 ALA C HB3 6 8
ATOM 6381 N N . ILE C 1 9 ? -3.513 4.331 4.866 1.00 0.00 ? 53 ILE C N 6 9
ATOM 6382 C CA . ILE C 1 9 ? -2.090 4.263 5.103 1.00 0.00 ? 53 ILE C CA 6 9
ATOM 6383 C C . ILE C 1 9 ? -1.697 4.375 6.565 1.00 0.00 ? 53 ILE C C 6 9
ATOM 6384 O O . ILE C 1 9 ? -0.683 3.812 6.957 1.00 0.00 ? 53 ILE C O 6 9
ATOM 6385 C CB . ILE C 1 9 ? -1.343 5.311 4.295 1.00 0.00 ? 53 ILE C CB 6 9
ATOM 6386 C CG1 . ILE C 1 9 ? -1.647 5.304 2.808 1.00 0.00 ? 53 ILE C CG1 6 9
ATOM 6387 C CG2 . ILE C 1 9 ? 0.157 5.252 4.461 1.00 0.00 ? 53 ILE C CG2 6 9
ATOM 6388 C CD1 . ILE C 1 9 ? -1.473 3.989 2.113 1.00 0.00 ? 53 ILE C CD1 6 9
ATOM 6389 H H . ILE C 1 9 ? -3.883 4.959 4.179 1.00 0.00 ? 53 ILE C H 6 9
ATOM 6390 H HA . ILE C 1 9 ? -1.748 3.297 4.757 1.00 0.00 ? 53 ILE C HA 6 9
ATOM 6391 H HB . ILE C 1 9 ? -1.633 6.268 4.695 1.00 0.00 ? 53 ILE C HB 6 9
ATOM 6392 H HG12 . ILE C 1 9 ? -2.676 5.635 2.669 1.00 0.00 ? 53 ILE C HG12 6 9
ATOM 6393 H HG13 . ILE C 1 9 ? -1.027 6.007 2.303 1.00 0.00 ? 53 ILE C HG13 6 9
ATOM 6394 H HG21 . ILE C 1 9 ? 0.454 5.618 5.426 1.00 0.00 ? 53 ILE C HG21 6 9
ATOM 6395 H HG22 . ILE C 1 9 ? 0.475 4.235 4.337 1.00 0.00 ? 53 ILE C HG22 6 9
ATOM 6396 H HG23 . ILE C 1 9 ? 0.632 5.918 3.750 1.00 0.00 ? 53 ILE C HG23 6 9
ATOM 6397 H HD11 . ILE C 1 9 ? -2.046 3.275 2.571 1.00 0.00 ? 53 ILE C HD11 6 9
ATOM 6398 H HD12 . ILE C 1 9 ? -1.749 4.051 1.090 1.00 0.00 ? 53 ILE C HD12 6 9
ATOM 6399 H HD13 . ILE C 1 9 ? -0.497 3.728 2.115 1.00 0.00 ? 53 ILE C HD13 6 9
ATOM 6400 N N . LYS C 1 10 ? -2.498 5.049 7.388 1.00 0.00 ? 54 LYS C N 6 10
ATOM 6401 C CA . LYS C 1 10 ? -2.189 5.230 8.788 1.00 0.00 ? 54 LYS C CA 6 10
ATOM 6402 C C . LYS C 1 10 ? -2.413 3.952 9.573 1.00 0.00 ? 54 LYS C C 6 10
ATOM 6403 O O . LYS C 1 10 ? -1.532 3.572 10.316 1.00 0.00 ? 54 LYS C O 6 10
ATOM 6404 C CB . LYS C 1 10 ? -3.033 6.380 9.309 1.00 0.00 ? 54 LYS C CB 6 10
ATOM 6405 C CG . LYS C 1 10 ? -2.384 7.209 10.390 1.00 0.00 ? 54 LYS C CG 6 10
ATOM 6406 C CD . LYS C 1 10 ? -2.326 6.669 11.764 1.00 0.00 ? 54 LYS C CD 6 10
ATOM 6407 C CE . LYS C 1 10 ? -3.631 6.483 12.347 1.00 0.00 ? 54 LYS C CE 6 10
ATOM 6408 N NZ . LYS C 1 10 ? -3.533 6.156 13.672 1.00 0.00 ? 54 LYS C NZ 6 10
ATOM 6409 H H . LYS C 1 10 ? -3.330 5.426 6.980 1.00 0.00 ? 54 LYS C H 6 10
ATOM 6410 H HA . LYS C 1 10 ? -1.131 5.446 8.878 1.00 0.00 ? 54 LYS C HA 6 10
ATOM 6411 H HB2 . LYS C 1 10 ? -3.249 7.042 8.471 1.00 0.00 ? 54 LYS C HB2 6 10
ATOM 6412 H HB3 . LYS C 1 10 ? -3.996 6.010 9.619 1.00 0.00 ? 54 LYS C HB3 6 10
ATOM 6413 H HG2 . LYS C 1 10 ? -1.361 7.419 10.076 1.00 0.00 ? 54 LYS C HG2 6 10
ATOM 6414 H HG3 . LYS C 1 10 ? -2.890 8.135 10.429 1.00 0.00 ? 54 LYS C HG3 6 10
ATOM 6415 H HD2 . LYS C 1 10 ? -1.786 5.722 11.759 1.00 0.00 ? 54 LYS C HD2 6 10
ATOM 6416 H HD3 . LYS C 1 10 ? -1.798 7.348 12.397 1.00 0.00 ? 54 LYS C HD3 6 10
ATOM 6417 H HE2 . LYS C 1 10 ? -4.204 7.405 12.247 1.00 0.00 ? 54 LYS C HE2 6 10
ATOM 6418 H HE3 . LYS C 1 10 ? -4.171 5.756 11.828 1.00 0.00 ? 54 LYS C HE3 6 10
ATOM 6419 H HZ1 . LYS C 1 10 ? -4.149 5.880 14.084 1.00 0.00 ? 54 LYS C HZ1 6 10
ATOM 6420 H HZ2 . LYS C 1 10 ? -3.074 5.617 13.768 1.00 0.00 ? 54 LYS C HZ2 6 10
ATOM 6421 H HZ3 . LYS C 1 10 ? -3.290 6.682 14.171 1.00 0.00 ? 54 LYS C HZ3 6 10
ATOM 6422 N N . ALA C 1 11 ? -3.485 3.213 9.300 1.00 0.00 ? 55 ALA C N 6 11
ATOM 6423 C CA . ALA C 1 11 ? -3.631 1.831 9.692 1.00 0.00 ? 55 ALA C CA 6 11
ATOM 6424 C C . ALA C 1 11 ? -2.574 0.946 9.057 1.00 0.00 ? 55 ALA C C 6 11
ATOM 6425 O O . ALA C 1 11 ? -1.981 0.135 9.755 1.00 0.00 ? 55 ALA C O 6 11
ATOM 6426 C CB . ALA C 1 11 ? -5.032 1.332 9.391 1.00 0.00 ? 55 ALA C CB 6 11
ATOM 6427 H H . ALA C 1 11 ? -4.130 3.534 8.620 1.00 0.00 ? 55 ALA C H 6 11
ATOM 6428 H HA . ALA C 1 11 ? -3.487 1.762 10.767 1.00 0.00 ? 55 ALA C HA 6 11
ATOM 6429 H HB1 . ALA C 1 11 ? -5.248 1.386 8.342 1.00 0.00 ? 55 ALA C HB1 6 11
ATOM 6430 H HB2 . ALA C 1 11 ? -5.137 0.305 9.709 1.00 0.00 ? 55 ALA C HB2 6 11
ATOM 6431 H HB3 . ALA C 1 11 ? -5.776 1.906 9.915 1.00 0.00 ? 55 ALA C HB3 6 11
ATOM 6432 N N . ILE C 1 12 ? -2.300 1.092 7.763 1.00 0.00 ? 56 ILE C N 6 12
ATOM 6433 C CA . ILE C 1 12 ? -1.570 0.110 6.998 1.00 0.00 ? 56 ILE C CA 6 12
ATOM 6434 C C . ILE C 1 12 ? -0.085 0.214 7.286 1.00 0.00 ? 56 ILE C C 6 12
ATOM 6435 O O . ILE C 1 12 ? 0.528 -0.825 7.499 1.00 0.00 ? 56 ILE C O 6 12
ATOM 6436 C CB . ILE C 1 12 ? -1.893 0.218 5.522 1.00 0.00 ? 56 ILE C CB 6 12
ATOM 6437 C CG1 . ILE C 1 12 ? -3.293 -0.257 5.213 1.00 0.00 ? 56 ILE C CG1 6 12
ATOM 6438 C CG2 . ILE C 1 12 ? -0.907 -0.476 4.618 1.00 0.00 ? 56 ILE C CG2 6 12
ATOM 6439 C CD1 . ILE C 1 12 ? -3.553 -1.734 5.285 1.00 0.00 ? 56 ILE C CD1 6 12
ATOM 6440 H H . ILE C 1 12 ? -2.693 1.880 7.296 1.00 0.00 ? 56 ILE C H 6 12
ATOM 6441 H HA . ILE C 1 12 ? -1.833 -0.894 7.315 1.00 0.00 ? 56 ILE C HA 6 12
ATOM 6442 H HB . ILE C 1 12 ? -1.845 1.268 5.296 1.00 0.00 ? 56 ILE C HB 6 12
ATOM 6443 H HG12 . ILE C 1 12 ? -3.976 0.242 5.900 1.00 0.00 ? 56 ILE C HG12 6 12
ATOM 6444 H HG13 . ILE C 1 12 ? -3.558 0.055 4.221 1.00 0.00 ? 56 ILE C HG13 6 12
ATOM 6445 H HG21 . ILE C 1 12 ? 0.048 0.007 4.667 1.00 0.00 ? 56 ILE C HG21 6 12
ATOM 6446 H HG22 . ILE C 1 12 ? -0.799 -1.503 4.914 1.00 0.00 ? 56 ILE C HG22 6 12
ATOM 6447 H HG23 . ILE C 1 12 ? -1.246 -0.423 3.597 1.00 0.00 ? 56 ILE C HG23 6 12
ATOM 6448 H HD11 . ILE C 1 12 ? -2.994 -2.221 4.533 1.00 0.00 ? 56 ILE C HD11 6 12
ATOM 6449 H HD12 . ILE C 1 12 ? -3.282 -2.089 6.236 1.00 0.00 ? 56 ILE C HD12 6 12
ATOM 6450 H HD13 . ILE C 1 12 ? -4.594 -1.902 5.137 1.00 0.00 ? 56 ILE C HD13 6 12
ATOM 6451 N N . ALA C 1 13 ? 0.498 1.396 7.481 1.00 0.00 ? 57 ALA C N 6 13
ATOM 6452 C CA . ALA C 1 13 ? 1.900 1.443 7.826 1.00 0.00 ? 57 ALA C CA 6 13
ATOM 6453 C C . ALA C 1 13 ? 2.205 0.795 9.165 1.00 0.00 ? 57 ALA C C 6 13
ATOM 6454 O O . ALA C 1 13 ? 3.285 0.300 9.395 1.00 0.00 ? 57 ALA C O 6 13
ATOM 6455 C CB . ALA C 1 13 ? 2.323 2.896 7.789 1.00 0.00 ? 57 ALA C CB 6 13
ATOM 6456 H H . ALA C 1 13 ? -0.064 2.225 7.383 1.00 0.00 ? 57 ALA C H 6 13
ATOM 6457 H HA . ALA C 1 13 ? 2.461 0.904 7.068 1.00 0.00 ? 57 ALA C HA 6 13
ATOM 6458 H HB1 . ALA C 1 13 ? 3.364 2.975 7.997 1.00 0.00 ? 57 ALA C HB1 6 13
ATOM 6459 H HB2 . ALA C 1 13 ? 2.120 3.297 6.823 1.00 0.00 ? 57 ALA C HB2 6 13
ATOM 6460 H HB3 . ALA C 1 13 ? 1.771 3.443 8.502 1.00 0.00 ? 57 ALA C HB3 6 13
ATOM 6461 N N . ALA C 1 14 ? 1.215 0.680 10.044 1.00 0.00 ? 58 ALA C N 6 14
ATOM 6462 C CA . ALA C 1 14 ? 1.281 0.014 11.325 1.00 0.00 ? 58 ALA C CA 6 14
ATOM 6463 C C . ALA C 1 14 ? 1.044 -1.482 11.218 1.00 0.00 ? 58 ALA C C 6 14
ATOM 6464 O O . ALA C 1 14 ? 1.770 -2.276 11.792 1.00 0.00 ? 58 ALA C O 6 14
ATOM 6465 C CB . ALA C 1 14 ? 0.324 0.711 12.278 1.00 0.00 ? 58 ALA C CB 6 14
ATOM 6466 H H . ALA C 1 14 ? 0.333 0.955 9.666 1.00 0.00 ? 58 ALA C H 6 14
ATOM 6467 H HA . ALA C 1 14 ? 2.286 0.178 11.694 1.00 0.00 ? 58 ALA C HA 6 14
ATOM 6468 H HB1 . ALA C 1 14 ? 0.459 0.282 13.248 1.00 0.00 ? 58 ALA C HB1 6 14
ATOM 6469 H HB2 . ALA C 1 14 ? 0.512 1.767 12.309 1.00 0.00 ? 58 ALA C HB2 6 14
ATOM 6470 H HB3 . ALA C 1 14 ? -0.691 0.574 11.961 1.00 0.00 ? 58 ALA C HB3 6 14
ATOM 6471 N N . ILE C 1 15 ? 0.089 -1.850 10.368 1.00 0.00 ? 59 ILE C N 6 15
ATOM 6472 C CA . ILE C 1 15 ? -0.200 -3.210 9.975 1.00 0.00 ? 59 ILE C CA 6 15
ATOM 6473 C C . ILE C 1 15 ? 0.962 -3.847 9.236 1.00 0.00 ? 59 ILE C C 6 15
ATOM 6474 O O . ILE C 1 15 ? 1.192 -5.034 9.421 1.00 0.00 ? 59 ILE C O 6 15
ATOM 6475 C CB . ILE C 1 15 ? -1.496 -3.262 9.181 1.00 0.00 ? 59 ILE C CB 6 15
ATOM 6476 C CG1 . ILE C 1 15 ? -2.703 -3.021 10.069 1.00 0.00 ? 59 ILE C CG1 6 15
ATOM 6477 C CG2 . ILE C 1 15 ? -1.668 -4.521 8.353 1.00 0.00 ? 59 ILE C CG2 6 15
ATOM 6478 C CD1 . ILE C 1 15 ? -3.926 -2.549 9.303 1.00 0.00 ? 59 ILE C CD1 6 15
ATOM 6479 H H . ILE C 1 15 ? -0.377 -1.100 9.902 1.00 0.00 ? 59 ILE C H 6 15
ATOM 6480 H HA . ILE C 1 15 ? -0.367 -3.772 10.882 1.00 0.00 ? 59 ILE C HA 6 15
ATOM 6481 H HB . ILE C 1 15 ? -1.461 -2.450 8.468 1.00 0.00 ? 59 ILE C HB 6 15
ATOM 6482 H HG12 . ILE C 1 15 ? -2.941 -3.936 10.611 1.00 0.00 ? 59 ILE C HG12 6 15
ATOM 6483 H HG13 . ILE C 1 15 ? -2.464 -2.261 10.788 1.00 0.00 ? 59 ILE C HG13 6 15
ATOM 6484 H HG21 . ILE C 1 15 ? -1.709 -5.381 8.954 1.00 0.00 ? 59 ILE C HG21 6 15
ATOM 6485 H HG22 . ILE C 1 15 ? -2.538 -4.457 7.764 1.00 0.00 ? 59 ILE C HG22 6 15
ATOM 6486 H HG23 . ILE C 1 15 ? -0.886 -4.616 7.638 1.00 0.00 ? 59 ILE C HG23 6 15
ATOM 6487 H HD11 . ILE C 1 15 ? -4.316 -3.314 8.673 1.00 0.00 ? 59 ILE C HD11 6 15
ATOM 6488 H HD12 . ILE C 1 15 ? -4.684 -2.294 10.008 1.00 0.00 ? 59 ILE C HD12 6 15
ATOM 6489 H HD13 . ILE C 1 15 ? -3.713 -1.675 8.733 1.00 0.00 ? 59 ILE C HD13 6 15
ATOM 6490 N N . ILE C 1 16 ? 1.740 -3.077 8.481 1.00 0.00 ? 60 ILE C N 6 16
ATOM 6491 C CA . ILE C 1 16 ? 2.936 -3.520 7.804 1.00 0.00 ? 60 ILE C CA 6 16
ATOM 6492 C C . ILE C 1 16 ? 4.009 -3.927 8.796 1.00 0.00 ? 60 ILE C C 6 16
ATOM 6493 O O . ILE C 1 16 ? 4.546 -5.022 8.737 1.00 0.00 ? 60 ILE C O 6 16
ATOM 6494 C CB . ILE C 1 16 ? 3.413 -2.427 6.857 1.00 0.00 ? 60 ILE C CB 6 16
ATOM 6495 C CG1 . ILE C 1 16 ? 2.502 -2.506 5.642 1.00 0.00 ? 60 ILE C CG1 6 16
ATOM 6496 C CG2 . ILE C 1 16 ? 4.857 -2.552 6.406 1.00 0.00 ? 60 ILE C CG2 6 16
ATOM 6497 C CD1 . ILE C 1 16 ? 2.878 -1.646 4.448 1.00 0.00 ? 60 ILE C CD1 6 16
ATOM 6498 H H . ILE C 1 16 ? 1.413 -2.149 8.286 1.00 0.00 ? 60 ILE C H 6 16
ATOM 6499 H HA . ILE C 1 16 ? 2.678 -4.409 7.245 1.00 0.00 ? 60 ILE C HA 6 16
ATOM 6500 H HB . ILE C 1 16 ? 3.322 -1.491 7.392 1.00 0.00 ? 60 ILE C HB 6 16
ATOM 6501 H HG12 . ILE C 1 16 ? 2.491 -3.543 5.309 1.00 0.00 ? 60 ILE C HG12 6 16
ATOM 6502 H HG13 . ILE C 1 16 ? 1.484 -2.291 5.934 1.00 0.00 ? 60 ILE C HG13 6 16
ATOM 6503 H HG21 . ILE C 1 16 ? 5.125 -1.689 5.814 1.00 0.00 ? 60 ILE C HG21 6 16
ATOM 6504 H HG22 . ILE C 1 16 ? 5.532 -2.564 7.238 1.00 0.00 ? 60 ILE C HG22 6 16
ATOM 6505 H HG23 . ILE C 1 16 ? 4.993 -3.447 5.830 1.00 0.00 ? 60 ILE C HG23 6 16
ATOM 6506 H HD11 . ILE C 1 16 ? 3.087 -0.647 4.783 1.00 0.00 ? 60 ILE C HD11 6 16
ATOM 6507 H HD12 . ILE C 1 16 ? 3.734 -2.078 3.964 1.00 0.00 ? 60 ILE C HD12 6 16
ATOM 6508 H HD13 . ILE C 1 16 ? 2.067 -1.681 3.747 1.00 0.00 ? 60 ILE C HD13 6 16
ATOM 6509 N N . LYS C 1 17 ? 4.287 -3.044 9.751 1.00 0.00 ? 61 LYS C N 6 17
ATOM 6510 C CA . LYS C 1 17 ? 5.185 -3.257 10.855 1.00 0.00 ? 61 LYS C CA 6 17
ATOM 6511 C C . LYS C 1 17 ? 4.814 -4.478 11.669 1.00 0.00 ? 61 LYS C C 6 17
ATOM 6512 O O . LYS C 1 17 ? 5.655 -5.271 12.003 1.00 0.00 ? 61 LYS C O 6 17
ATOM 6513 C CB . LYS C 1 17 ? 5.234 -1.999 11.689 1.00 0.00 ? 61 LYS C CB 6 17
ATOM 6514 C CG . LYS C 1 17 ? 6.141 -1.122 11.446 1.00 0.00 ? 61 LYS C CG 6 17
ATOM 6515 C CD . LYS C 1 17 ? 6.088 0.181 12.115 1.00 0.00 ? 61 LYS C CD 6 17
ATOM 6516 C CE . LYS C 1 17 ? 6.269 0.253 13.498 1.00 0.00 ? 61 LYS C CE 6 17
ATOM 6517 N NZ . LYS C 1 17 ? 6.396 1.521 14.049 1.00 0.00 ? 61 LYS C NZ 6 17
ATOM 6518 H H . LYS C 1 17 ? 3.827 -2.177 9.632 1.00 0.00 ? 61 LYS C H 6 17
ATOM 6519 H HA . LYS C 1 17 ? 6.174 -3.460 10.489 1.00 0.00 ? 61 LYS C HA 6 17
ATOM 6520 H HB2 . LYS C 1 17 ? 4.272 -1.503 11.561 1.00 0.00 ? 61 LYS C HB2 6 17
ATOM 6521 H HB3 . LYS C 1 17 ? 5.293 -2.152 12.587 1.00 0.00 ? 61 LYS C HB3 6 17
ATOM 6522 H HG2 . LYS C 1 17 ? 7.103 -1.564 11.707 1.00 0.00 ? 61 LYS C HG2 6 17
ATOM 6523 H HG3 . LYS C 1 17 ? 6.125 -1.099 10.537 1.00 0.00 ? 61 LYS C HG3 6 17
ATOM 6524 H HD2 . LYS C 1 17 ? 6.840 0.821 11.655 1.00 0.00 ? 61 LYS C HD2 6 17
ATOM 6525 H HD3 . LYS C 1 17 ? 5.247 0.545 11.908 1.00 0.00 ? 61 LYS C HD3 6 17
ATOM 6526 H HE2 . LYS C 1 17 ? 5.430 -0.252 13.978 1.00 0.00 ? 61 LYS C HE2 6 17
ATOM 6527 H HE3 . LYS C 1 17 ? 7.035 -0.194 13.735 1.00 0.00 ? 61 LYS C HE3 6 17
ATOM 6528 H HZ1 . LYS C 1 17 ? 7.064 1.941 13.759 1.00 0.00 ? 61 LYS C HZ1 6 17
ATOM 6529 H HZ2 . LYS C 1 17 ? 6.486 1.570 14.941 1.00 0.00 ? 61 LYS C HZ2 6 17
ATOM 6530 H HZ3 . LYS C 1 17 ? 5.718 1.972 13.876 1.00 0.00 ? 61 LYS C HZ3 6 17
ATOM 6531 N N . ALA C 1 18 ? 3.528 -4.688 11.904 1.00 0.00 ? 62 ALA C N 6 18
ATOM 6532 C CA . ALA C 1 18 ? 2.996 -5.855 12.571 1.00 0.00 ? 62 ALA C CA 6 18
ATOM 6533 C C . ALA C 1 18 ? 3.038 -7.095 11.703 1.00 0.00 ? 62 ALA C C 6 18
ATOM 6534 O O . ALA C 1 18 ? 3.131 -8.197 12.195 1.00 0.00 ? 62 ALA C O 6 18
ATOM 6535 C CB . ALA C 1 18 ? 1.591 -5.535 13.049 1.00 0.00 ? 62 ALA C CB 6 18
ATOM 6536 H H . ALA C 1 18 ? 2.900 -3.998 11.568 1.00 0.00 ? 62 ALA C H 6 18
ATOM 6537 H HA . ALA C 1 18 ? 3.579 -6.048 13.459 1.00 0.00 ? 62 ALA C HA 6 18
ATOM 6538 H HB1 . ALA C 1 18 ? 1.217 -6.391 13.524 1.00 0.00 ? 62 ALA C HB1 6 18
ATOM 6539 H HB2 . ALA C 1 18 ? 1.591 -4.738 13.745 1.00 0.00 ? 62 ALA C HB2 6 18
ATOM 6540 H HB3 . ALA C 1 18 ? 0.969 -5.250 12.236 1.00 0.00 ? 62 ALA C HB3 6 18
ATOM 6541 N N . GLY C 1 19 ? 2.932 -6.930 10.391 1.00 0.00 ? 63 GLY C N 6 19
ATOM 6542 C CA . GLY C 1 19 ? 2.853 -7.925 9.359 1.00 0.00 ? 63 GLY C CA 6 19
ATOM 6543 C C . GLY C 1 19 ? 4.115 -8.645 9.032 1.00 0.00 ? 63 GLY C C 6 19
ATOM 6544 O O . GLY C 1 19 ? 4.033 -9.684 8.501 1.00 0.00 ? 63 GLY C O 6 19
ATOM 6545 H H . GLY C 1 19 ? 2.871 -6.008 10.109 1.00 0.00 ? 63 GLY C H 6 19
ATOM 6546 H HA2 . GLY C 1 19 ? 2.151 -8.649 9.651 1.00 0.00 ? 63 GLY C HA2 6 19
ATOM 6547 H HA3 . GLY C 1 19 ? 2.485 -7.468 8.483 1.00 0.00 ? 63 GLY C HA3 6 19
ATOM 6548 N N . GLY C 1 20 ? 5.282 -8.114 9.255 1.00 0.00 ? 64 GLY C N 6 20
ATOM 6549 C CA . GLY C 1 20 ? 6.544 -8.732 8.929 1.00 0.00 ? 64 GLY C CA 6 20
ATOM 6550 C C . GLY C 1 20 ? 6.959 -8.682 7.468 1.00 0.00 ? 64 GLY C C 6 20
ATOM 6551 O O . GLY C 1 20 ? 7.749 -9.502 7.032 1.00 0.00 ? 64 GLY C O 6 20
ATOM 6552 H H . GLY C 1 20 ? 5.241 -7.246 9.666 1.00 0.00 ? 64 GLY C H 6 20
ATOM 6553 H HA2 . GLY C 1 20 ? 7.315 -8.223 9.496 1.00 0.00 ? 64 GLY C HA2 6 20
ATOM 6554 H HA3 . GLY C 1 20 ? 6.521 -9.759 9.265 1.00 0.00 ? 64 GLY C HA3 6 20
ATOM 6555 N N . TYR C 1 21 ? 6.421 -7.731 6.721 1.00 0.00 ? 65 TYR C N 6 21
ATOM 6556 C CA . TYR C 1 21 ? 6.697 -7.422 5.342 1.00 0.00 ? 65 TYR C CA 6 21
ATOM 6557 C C . TYR C 1 21 ? 8.148 -7.198 5.002 1.00 0.00 ? 65 TYR C C 6 21
ATOM 6558 O O . TYR C 1 21 ? 8.548 -7.481 3.905 1.00 0.00 ? 65 TYR C O 6 21
ATOM 6559 C CB . TYR C 1 21 ? 5.817 -6.233 4.994 1.00 0.00 ? 65 TYR C CB 6 21
ATOM 6560 C CG . TYR C 1 21 ? 4.477 -6.549 4.382 1.00 0.00 ? 65 TYR C CG 6 21
ATOM 6561 C CD1 . TYR C 1 21 ? 4.325 -7.143 3.134 1.00 0.00 ? 65 TYR C CD1 6 21
ATOM 6562 C CD2 . TYR C 1 21 ? 3.360 -6.066 5.064 1.00 0.00 ? 65 TYR C CD2 6 21
ATOM 6563 C CE1 . TYR C 1 21 ? 3.054 -7.255 2.589 1.00 0.00 ? 65 TYR C CE1 6 21
ATOM 6564 C CE2 . TYR C 1 21 ? 2.095 -6.115 4.480 1.00 0.00 ? 65 TYR C CE2 6 21
ATOM 6565 C CZ . TYR C 1 21 ? 1.931 -6.727 3.244 1.00 0.00 ? 65 TYR C CZ 6 21
ATOM 6566 O OH . TYR C 1 21 ? 0.694 -6.872 2.711 1.00 0.00 ? 65 TYR C OH 6 21
ATOM 6567 H H . TYR C 1 21 ? 5.825 -7.073 7.177 1.00 0.00 ? 65 TYR C H 6 21
ATOM 6568 H HA . TYR C 1 21 ? 6.382 -8.258 4.740 1.00 0.00 ? 65 TYR C HA 6 21
ATOM 6569 H HB2 . TYR C 1 21 ? 5.646 -5.670 5.911 1.00 0.00 ? 65 TYR C HB2 6 21
ATOM 6570 H HB3 . TYR C 1 21 ? 6.320 -5.552 4.320 1.00 0.00 ? 65 TYR C HB3 6 21
ATOM 6571 H HD1 . TYR C 1 21 ? 5.157 -7.485 2.563 1.00 0.00 ? 65 TYR C HD1 6 21
ATOM 6572 H HD2 . TYR C 1 21 ? 3.501 -5.639 6.035 1.00 0.00 ? 65 TYR C HD2 6 21
ATOM 6573 H HE1 . TYR C 1 21 ? 2.906 -7.702 1.633 1.00 0.00 ? 65 TYR C HE1 6 21
ATOM 6574 H HE2 . TYR C 1 21 ? 1.270 -5.706 5.030 1.00 0.00 ? 65 TYR C HE2 6 21
ATOM 6575 H HH . TYR C 1 21 ? 0.136 -7.286 3.350 1.00 0.00 ? 65 TYR C HH 6 21
HETATM 6576 N N . NH2 C 1 22 ? 8.978 -6.684 5.879 1.00 0.00 ? 66 NH2 C N 6 22
HETATM 6577 H HN1 . NH2 C 1 22 ? 9.921 -6.540 5.618 1.00 0.00 ? 66 NH2 C HN1 6 22
HETATM 6578 H HN2 . NH2 C 1 22 ? 8.661 -6.440 6.779 1.00 0.00 ? 66 NH2 C HN2 6 22
HETATM 6579 C C . ACE D 1 1 ? 7.152 -13.012 5.337 1.00 0.00 ? 67 ACE D C 6 1
HETATM 6580 O O . ACE D 1 1 ? 6.803 -13.951 4.673 1.00 0.00 ? 67 ACE D O 6 1
HETATM 6581 C CH3 . ACE D 1 1 ? 8.103 -13.220 6.466 1.00 0.00 ? 67 ACE D CH3 6 1
HETATM 6582 H H1 . ACE D 1 1 ? 8.583 -13.162 6.606 1.00 0.00 ? 67 ACE D H1 6 1
HETATM 6583 H H2 . ACE D 1 1 ? 8.132 -13.092 6.890 1.00 0.00 ? 67 ACE D H2 6 1
HETATM 6584 H H3 . ACE D 1 1 ? 8.230 -13.597 6.691 1.00 0.00 ? 67 ACE D H3 6 1
ATOM 6585 N N . ALA D 1 2 ? 6.725 -11.783 5.151 1.00 0.00 ? 68 ALA D N 6 2
ATOM 6586 C CA . ALA D 1 2 ? 5.750 -11.294 4.221 1.00 0.00 ? 68 ALA D CA 6 2
ATOM 6587 C C . ALA D 1 2 ? 4.464 -12.078 4.142 1.00 0.00 ? 68 ALA D C 6 2
ATOM 6588 O O . ALA D 1 2 ? 3.804 -12.115 3.141 1.00 0.00 ? 68 ALA D O 6 2
ATOM 6589 C CB . ALA D 1 2 ? 6.405 -11.127 2.877 1.00 0.00 ? 68 ALA D CB 6 2
ATOM 6590 H H . ALA D 1 2 ? 7.122 -11.139 5.763 1.00 0.00 ? 68 ALA D H 6 2
ATOM 6591 H HA . ALA D 1 2 ? 5.468 -10.321 4.554 1.00 0.00 ? 68 ALA D HA 6 2
ATOM 6592 H HB1 . ALA D 1 2 ? 5.739 -10.684 2.165 1.00 0.00 ? 68 ALA D HB1 6 2
ATOM 6593 H HB2 . ALA D 1 2 ? 7.266 -10.523 2.980 1.00 0.00 ? 68 ALA D HB2 6 2
ATOM 6594 H HB3 . ALA D 1 2 ? 6.668 -12.091 2.492 1.00 0.00 ? 68 ALA D HB3 6 2
ATOM 6595 N N . LYS D 1 3 ? 4.039 -12.728 5.206 1.00 0.00 ? 69 LYS D N 6 3
ATOM 6596 C CA . LYS D 1 3 ? 2.777 -13.412 5.314 1.00 0.00 ? 69 LYS D CA 6 3
ATOM 6597 C C . LYS D 1 3 ? 1.607 -12.466 5.296 1.00 0.00 ? 69 LYS D C 6 3
ATOM 6598 O O . LYS D 1 3 ? 0.533 -12.847 4.887 1.00 0.00 ? 69 LYS D O 6 3
ATOM 6599 C CB . LYS D 1 3 ? 2.711 -14.225 6.581 1.00 0.00 ? 69 LYS D CB 6 3
ATOM 6600 C CG . LYS D 1 3 ? 3.707 -15.335 6.757 1.00 0.00 ? 69 LYS D CG 6 3
ATOM 6601 C CD . LYS D 1 3 ? 3.714 -16.407 5.731 1.00 0.00 ? 69 LYS D CD 6 3
ATOM 6602 C CE . LYS D 1 3 ? 2.457 -17.202 5.715 1.00 0.00 ? 69 LYS D CE 6 3
ATOM 6603 N NZ . LYS D 1 3 ? 2.513 -18.284 4.798 1.00 0.00 ? 69 LYS D NZ 6 3
ATOM 6604 H H . LYS D 1 3 ? 4.641 -12.679 5.986 1.00 0.00 ? 69 LYS D H 6 3
ATOM 6605 H HA . LYS D 1 3 ? 2.622 -14.062 4.473 1.00 0.00 ? 69 LYS D HA 6 3
ATOM 6606 H HB2 . LYS D 1 3 ? 2.812 -13.547 7.429 1.00 0.00 ? 69 LYS D HB2 6 3
ATOM 6607 H HB3 . LYS D 1 3 ? 1.724 -14.629 6.608 1.00 0.00 ? 69 LYS D HB3 6 3
ATOM 6608 H HG2 . LYS D 1 3 ? 4.701 -14.890 6.790 1.00 0.00 ? 69 LYS D HG2 6 3
ATOM 6609 H HG3 . LYS D 1 3 ? 3.552 -15.806 7.690 1.00 0.00 ? 69 LYS D HG3 6 3
ATOM 6610 H HD2 . LYS D 1 3 ? 3.900 -15.980 4.746 1.00 0.00 ? 69 LYS D HD2 6 3
ATOM 6611 H HD3 . LYS D 1 3 ? 4.500 -17.080 5.976 1.00 0.00 ? 69 LYS D HD3 6 3
ATOM 6612 H HE2 . LYS D 1 3 ? 2.244 -17.582 6.714 1.00 0.00 ? 69 LYS D HE2 6 3
ATOM 6613 H HE3 . LYS D 1 3 ? 1.693 -16.544 5.451 1.00 0.00 ? 69 LYS D HE3 6 3
ATOM 6614 H HZ1 . LYS D 1 3 ? 2.708 -17.977 3.904 1.00 0.00 ? 69 LYS D HZ1 6 3
ATOM 6615 H HZ2 . LYS D 1 3 ? 3.153 -18.922 5.088 1.00 0.00 ? 69 LYS D HZ2 6 3
ATOM 6616 H HZ3 . LYS D 1 3 ? 1.687 -18.789 4.787 1.00 0.00 ? 69 LYS D HZ3 6 3
ATOM 6617 N N . ALA D 1 4 ? 1.828 -11.214 5.670 1.00 0.00 ? 70 ALA D N 6 4
ATOM 6618 C CA . ALA D 1 4 ? 0.902 -10.110 5.649 1.00 0.00 ? 70 ALA D CA 6 4
ATOM 6619 C C . ALA D 1 4 ? 0.258 -9.748 4.325 1.00 0.00 ? 70 ALA D C 6 4
ATOM 6620 O O . ALA D 1 4 ? -0.550 -8.842 4.212 1.00 0.00 ? 70 ALA D O 6 4
ATOM 6621 C CB . ALA D 1 4 ? 1.617 -8.897 6.212 1.00 0.00 ? 70 ALA D CB 6 4
ATOM 6622 H H . ALA D 1 4 ? 2.750 -11.051 6.016 1.00 0.00 ? 70 ALA D H 6 4
ATOM 6623 H HA . ALA D 1 4 ? 0.085 -10.369 6.304 1.00 0.00 ? 70 ALA D HA 6 4
ATOM 6624 H HB1 . ALA D 1 4 ? 1.936 -9.181 7.199 1.00 0.00 ? 70 ALA D HB1 6 4
ATOM 6625 H HB2 . ALA D 1 4 ? 2.468 -8.654 5.617 1.00 0.00 ? 70 ALA D HB2 6 4
ATOM 6626 H HB3 . ALA D 1 4 ? 0.966 -8.048 6.282 1.00 0.00 ? 70 ALA D HB3 6 4
ATOM 6627 N N . ALA D 1 5 ? 0.676 -10.446 3.279 1.00 0.00 ? 71 ALA D N 6 5
ATOM 6628 C CA . ALA D 1 5 ? 0.483 -10.096 1.890 1.00 0.00 ? 71 ALA D CA 6 5
ATOM 6629 C C . ALA D 1 5 ? -0.830 -10.500 1.256 1.00 0.00 ? 71 ALA D C 6 5
ATOM 6630 O O . ALA D 1 5 ? -0.999 -10.329 0.058 1.00 0.00 ? 71 ALA D O 6 5
ATOM 6631 C CB . ALA D 1 5 ? 1.677 -10.657 1.137 1.00 0.00 ? 71 ALA D CB 6 5
ATOM 6632 H H . ALA D 1 5 ? 1.212 -11.252 3.527 1.00 0.00 ? 71 ALA D H 6 5
ATOM 6633 H HA . ALA D 1 5 ? 0.475 -9.013 1.817 1.00 0.00 ? 71 ALA D HA 6 5
ATOM 6634 H HB1 . ALA D 1 5 ? 1.673 -11.722 1.238 1.00 0.00 ? 71 ALA D HB1 6 5
ATOM 6635 H HB2 . ALA D 1 5 ? 1.594 -10.387 0.106 1.00 0.00 ? 71 ALA D HB2 6 5
ATOM 6636 H HB3 . ALA D 1 5 ? 2.594 -10.271 1.543 1.00 0.00 ? 71 ALA D HB3 6 5
ATOM 6637 N N . ALA D 1 6 ? -1.790 -10.961 2.048 1.00 0.00 ? 72 ALA D N 6 6
ATOM 6638 C CA . ALA D 1 6 ? -3.173 -10.946 1.666 1.00 0.00 ? 72 ALA D CA 6 6
ATOM 6639 C C . ALA D 1 6 ? -3.966 -9.997 2.526 1.00 0.00 ? 72 ALA D C 6 6
ATOM 6640 O O . ALA D 1 6 ? -4.593 -9.097 2.013 1.00 0.00 ? 72 ALA D O 6 6
ATOM 6641 C CB . ALA D 1 6 ? -3.695 -12.358 1.654 1.00 0.00 ? 72 ALA D CB 6 6
ATOM 6642 H H . ALA D 1 6 ? -1.582 -11.168 2.992 1.00 0.00 ? 72 ALA D H 6 6
ATOM 6643 H HA . ALA D 1 6 ? -3.248 -10.520 0.674 1.00 0.00 ? 72 ALA D HA 6 6
ATOM 6644 H HB1 . ALA D 1 6 ? -3.687 -12.785 2.615 1.00 0.00 ? 72 ALA D HB1 6 6
ATOM 6645 H HB2 . ALA D 1 6 ? -4.678 -12.400 1.262 1.00 0.00 ? 72 ALA D HB2 6 6
ATOM 6646 H HB3 . ALA D 1 6 ? -3.103 -12.967 1.035 1.00 0.00 ? 72 ALA D HB3 6 6
ATOM 6647 N N . ALA D 1 7 ? -3.871 -10.114 3.844 1.00 0.00 ? 73 ALA D N 6 7
ATOM 6648 C CA . ALA D 1 7 ? -4.696 -9.425 4.803 1.00 0.00 ? 73 ALA D CA 6 7
ATOM 6649 C C . ALA D 1 7 ? -4.586 -7.916 4.766 1.00 0.00 ? 73 ALA D C 6 7
ATOM 6650 O O . ALA D 1 7 ? -5.581 -7.235 4.919 1.00 0.00 ? 73 ALA D O 6 7
ATOM 6651 C CB . ALA D 1 7 ? -4.344 -9.956 6.173 1.00 0.00 ? 73 ALA D CB 6 7
ATOM 6652 H H . ALA D 1 7 ? -3.231 -10.817 4.162 1.00 0.00 ? 73 ALA D H 6 7
ATOM 6653 H HA . ALA D 1 7 ? -5.729 -9.656 4.596 1.00 0.00 ? 73 ALA D HA 6 7
ATOM 6654 H HB1 . ALA D 1 7 ? -4.958 -9.506 6.934 1.00 0.00 ? 73 ALA D HB1 6 7
ATOM 6655 H HB2 . ALA D 1 7 ? -4.525 -11.022 6.207 1.00 0.00 ? 73 ALA D HB2 6 7
ATOM 6656 H HB3 . ALA D 1 7 ? -3.319 -9.738 6.414 1.00 0.00 ? 73 ALA D HB3 6 7
ATOM 6657 N N . ALA D 1 8 ? -3.399 -7.373 4.591 1.00 0.00 ? 74 ALA D N 6 8
ATOM 6658 C CA . ALA D 1 8 ? -3.210 -5.945 4.482 1.00 0.00 ? 74 ALA D CA 6 8
ATOM 6659 C C . ALA D 1 8 ? -3.653 -5.450 3.123 1.00 0.00 ? 74 ALA D C 6 8
ATOM 6660 O O . ALA D 1 8 ? -4.299 -4.427 2.995 1.00 0.00 ? 74 ALA D O 6 8
ATOM 6661 C CB . ALA D 1 8 ? -1.769 -5.570 4.747 1.00 0.00 ? 74 ALA D CB 6 8
ATOM 6662 H H . ALA D 1 8 ? -2.637 -7.971 4.344 1.00 0.00 ? 74 ALA D H 6 8
ATOM 6663 H HA . ALA D 1 8 ? -3.840 -5.448 5.202 1.00 0.00 ? 74 ALA D HA 6 8
ATOM 6664 H HB1 . ALA D 1 8 ? -1.392 -6.039 5.598 1.00 0.00 ? 74 ALA D HB1 6 8
ATOM 6665 H HB2 . ALA D 1 8 ? -1.152 -5.800 3.943 1.00 0.00 ? 74 ALA D HB2 6 8
ATOM 6666 H HB3 . ALA D 1 8 ? -1.663 -4.569 4.883 1.00 0.00 ? 74 ALA D HB3 6 8
ATOM 6667 N N . ILE D 1 9 ? -3.330 -6.203 2.081 1.00 0.00 ? 75 ILE D N 6 9
ATOM 6668 C CA . ILE D 1 9 ? -3.659 -5.899 0.709 1.00 0.00 ? 75 ILE D CA 6 9
ATOM 6669 C C . ILE D 1 9 ? -5.158 -5.909 0.468 1.00 0.00 ? 75 ILE D C 6 9
ATOM 6670 O O . ILE D 1 9 ? -5.697 -5.064 -0.230 1.00 0.00 ? 75 ILE D O 6 9
ATOM 6671 C CB . ILE D 1 9 ? -3.000 -6.907 -0.219 1.00 0.00 ? 75 ILE D CB 6 9
ATOM 6672 C CG1 . ILE D 1 9 ? -1.504 -7.052 0.008 1.00 0.00 ? 75 ILE D CG1 6 9
ATOM 6673 C CG2 . ILE D 1 9 ? -3.323 -6.589 -1.665 1.00 0.00 ? 75 ILE D CG2 6 9
ATOM 6674 C CD1 . ILE D 1 9 ? -0.704 -5.780 -0.177 1.00 0.00 ? 75 ILE D CD1 6 9
ATOM 6675 H H . ILE D 1 9 ? -2.852 -7.066 2.223 1.00 0.00 ? 75 ILE D H 6 9
ATOM 6676 H HA . ILE D 1 9 ? -3.321 -4.901 0.456 1.00 0.00 ? 75 ILE D HA 6 9
ATOM 6677 H HB . ILE D 1 9 ? -3.510 -7.835 -0.007 1.00 0.00 ? 75 ILE D HB 6 9
ATOM 6678 H HG12 . ILE D 1 9 ? -1.325 -7.454 1.005 1.00 0.00 ? 75 ILE D HG12 6 9
ATOM 6679 H HG13 . ILE D 1 9 ? -1.139 -7.745 -0.726 1.00 0.00 ? 75 ILE D HG13 6 9
ATOM 6680 H HG21 . ILE D 1 9 ? -4.352 -6.770 -1.872 1.00 0.00 ? 75 ILE D HG21 6 9
ATOM 6681 H HG22 . ILE D 1 9 ? -3.090 -5.577 -1.880 1.00 0.00 ? 75 ILE D HG22 6 9
ATOM 6682 H HG23 . ILE D 1 9 ? -2.781 -7.226 -2.297 1.00 0.00 ? 75 ILE D HG23 6 9
ATOM 6683 H HD11 . ILE D 1 9 ? -1.044 -5.040 0.515 1.00 0.00 ? 75 ILE D HD11 6 9
ATOM 6684 H HD12 . ILE D 1 9 ? 0.335 -5.962 -0.029 1.00 0.00 ? 75 ILE D HD12 6 9
ATOM 6685 H HD13 . ILE D 1 9 ? -0.846 -5.377 -1.164 1.00 0.00 ? 75 ILE D HD13 6 9
ATOM 6686 N N . LYS D 1 10 ? -5.864 -6.862 1.072 1.00 0.00 ? 76 LYS D N 6 10
ATOM 6687 C CA . LYS D 1 10 ? -7.288 -7.079 0.955 1.00 0.00 ? 76 LYS D CA 6 10
ATOM 6688 C C . LYS D 1 10 ? -8.104 -5.915 1.485 1.00 0.00 ? 76 LYS D C 6 10
ATOM 6689 O O . LYS D 1 10 ? -9.086 -5.526 0.881 1.00 0.00 ? 76 LYS D O 6 10
ATOM 6690 C CB . LYS D 1 10 ? -7.634 -8.375 1.673 1.00 0.00 ? 76 LYS D CB 6 10
ATOM 6691 C CG . LYS D 1 10 ? -7.621 -9.634 0.830 1.00 0.00 ? 76 LYS D CG 6 10
ATOM 6692 C CD . LYS D 1 10 ? -8.837 -9.826 -0.026 1.00 0.00 ? 76 LYS D CD 6 10
ATOM 6693 C CE . LYS D 1 10 ? -8.805 -11.115 -0.776 1.00 0.00 ? 76 LYS D CE 6 10
ATOM 6694 N NZ . LYS D 1 10 ? -9.942 -11.364 -1.582 1.00 0.00 ? 76 LYS D NZ 6 10
ATOM 6695 H H . LYS D 1 10 ? -5.293 -7.516 1.571 1.00 0.00 ? 76 LYS D H 6 10
ATOM 6696 H HA . LYS D 1 10 ? -7.524 -7.120 -0.103 1.00 0.00 ? 76 LYS D HA 6 10
ATOM 6697 H HB2 . LYS D 1 10 ? -6.912 -8.507 2.480 1.00 0.00 ? 76 LYS D HB2 6 10
ATOM 6698 H HB3 . LYS D 1 10 ? -8.590 -8.300 2.158 1.00 0.00 ? 76 LYS D HB3 6 10
ATOM 6699 H HG2 . LYS D 1 10 ? -6.734 -9.629 0.196 1.00 0.00 ? 76 LYS D HG2 6 10
ATOM 6700 H HG3 . LYS D 1 10 ? -7.554 -10.479 1.486 1.00 0.00 ? 76 LYS D HG3 6 10
ATOM 6701 H HD2 . LYS D 1 10 ? -9.722 -9.813 0.609 1.00 0.00 ? 76 LYS D HD2 6 10
ATOM 6702 H HD3 . LYS D 1 10 ? -8.941 -9.001 -0.673 1.00 0.00 ? 76 LYS D HD3 6 10
ATOM 6703 H HE2 . LYS D 1 10 ? -7.911 -11.142 -1.399 1.00 0.00 ? 76 LYS D HE2 6 10
ATOM 6704 H HE3 . LYS D 1 10 ? -8.749 -11.880 -0.110 1.00 0.00 ? 76 LYS D HE3 6 10
ATOM 6705 H HZ1 . LYS D 1 10 ? -9.978 -10.784 -2.282 1.00 0.00 ? 76 LYS D HZ1 6 10
ATOM 6706 H HZ2 . LYS D 1 10 ? -9.995 -12.241 -1.969 1.00 0.00 ? 76 LYS D HZ2 6 10
ATOM 6707 H HZ3 . LYS D 1 10 ? -10.704 -11.230 -1.108 1.00 0.00 ? 76 LYS D HZ3 6 10
ATOM 6708 N N . ALA D 1 11 ? -7.663 -5.330 2.590 1.00 0.00 ? 77 ALA D N 6 11
ATOM 6709 C CA . ALA D 1 11 ? -8.098 -4.031 3.042 1.00 0.00 ? 77 ALA D CA 6 11
ATOM 6710 C C . ALA D 1 11 ? -7.791 -2.980 1.994 1.00 0.00 ? 77 ALA D C 6 11
ATOM 6711 O O . ALA D 1 11 ? -8.688 -2.298 1.517 1.00 0.00 ? 77 ALA D O 6 11
ATOM 6712 C CB . ALA D 1 11 ? -7.484 -3.720 4.395 1.00 0.00 ? 77 ALA D CB 6 11
ATOM 6713 H H . ALA D 1 11 ? -6.929 -5.769 3.106 1.00 0.00 ? 77 ALA D H 6 11
ATOM 6714 H HA . ALA D 1 11 ? -9.173 -4.065 3.174 1.00 0.00 ? 77 ALA D HA 6 11
ATOM 6715 H HB1 . ALA D 1 11 ? -7.770 -4.407 5.148 1.00 0.00 ? 77 ALA D HB1 6 11
ATOM 6716 H HB2 . ALA D 1 11 ? -6.434 -3.690 4.360 1.00 0.00 ? 77 ALA D HB2 6 11
ATOM 6717 H HB3 . ALA D 1 11 ? -7.813 -2.780 4.720 1.00 0.00 ? 77 ALA D HB3 6 11
ATOM 6718 N N . ILE D 1 12 ? -6.534 -2.832 1.583 1.00 0.00 ? 78 ILE D N 6 12
ATOM 6719 C CA . ILE D 1 12 ? -6.072 -1.709 0.799 1.00 0.00 ? 78 ILE D CA 6 12
ATOM 6720 C C . ILE D 1 12 ? -6.634 -1.707 -0.612 1.00 0.00 ? 78 ILE D C 6 12
ATOM 6721 O O . ILE D 1 12 ? -7.170 -0.683 -1.015 1.00 0.00 ? 78 ILE D O 6 12
ATOM 6722 C CB . ILE D 1 12 ? -4.562 -1.542 0.886 1.00 0.00 ? 78 ILE D CB 6 12
ATOM 6723 C CG1 . ILE D 1 12 ? -4.175 -0.174 1.417 1.00 0.00 ? 78 ILE D CG1 6 12
ATOM 6724 C CG2 . ILE D 1 12 ? -3.750 -1.950 -0.330 1.00 0.00 ? 78 ILE D CG2 6 12
ATOM 6725 C CD1 . ILE D 1 12 ? -4.428 0.992 0.493 1.00 0.00 ? 78 ILE D CD1 6 12
ATOM 6726 H H . ILE D 1 12 ? -5.905 -3.593 1.760 1.00 0.00 ? 78 ILE D H 6 12
ATOM 6727 H HA . ILE D 1 12 ? -6.531 -0.828 1.236 1.00 0.00 ? 78 ILE D HA 6 12
ATOM 6728 H HB . ILE D 1 12 ? -4.235 -2.187 1.692 1.00 0.00 ? 78 ILE D HB 6 12
ATOM 6729 H HG12 . ILE D 1 12 ? -4.725 0.002 2.342 1.00 0.00 ? 78 ILE D HG12 6 12
ATOM 6730 H HG13 . ILE D 1 12 ? -3.132 -0.206 1.683 1.00 0.00 ? 78 ILE D HG13 6 12
ATOM 6731 H HG21 . ILE D 1 12 ? -3.939 -2.979 -0.581 1.00 0.00 ? 78 ILE D HG21 6 12
ATOM 6732 H HG22 . ILE D 1 12 ? -4.031 -1.334 -1.162 1.00 0.00 ? 78 ILE D HG22 6 12
ATOM 6733 H HG23 . ILE D 1 12 ? -2.695 -1.818 -0.173 1.00 0.00 ? 78 ILE D HG23 6 12
ATOM 6734 H HD11 . ILE D 1 12 ? -3.932 0.816 -0.423 1.00 0.00 ? 78 ILE D HD11 6 12
ATOM 6735 H HD12 . ILE D 1 12 ? -5.458 1.162 0.333 1.00 0.00 ? 78 ILE D HD12 6 12
ATOM 6736 H HD13 . ILE D 1 12 ? -4.022 1.881 0.917 1.00 0.00 ? 78 ILE D HD13 6 12
ATOM 6737 N N . ALA D 1 13 ? -6.696 -2.821 -1.341 1.00 0.00 ? 79 ALA D N 6 13
ATOM 6738 C CA . ALA D 1 13 ? -7.222 -2.836 -2.685 1.00 0.00 ? 79 ALA D CA 6 13
ATOM 6739 C C . ALA D 1 13 ? -8.699 -2.483 -2.769 1.00 0.00 ? 79 ALA D C 6 13
ATOM 6740 O O . ALA D 1 13 ? -9.185 -1.927 -3.743 1.00 0.00 ? 79 ALA D O 6 13
ATOM 6741 C CB . ALA D 1 13 ? -6.954 -4.196 -3.300 1.00 0.00 ? 79 ALA D CB 6 13
ATOM 6742 H H . ALA D 1 13 ? -6.355 -3.638 -0.877 1.00 0.00 ? 79 ALA D H 6 13
ATOM 6743 H HA . ALA D 1 13 ? -6.722 -2.089 -3.290 1.00 0.00 ? 79 ALA D HA 6 13
ATOM 6744 H HB1 . ALA D 1 13 ? -7.544 -4.934 -2.796 1.00 0.00 ? 79 ALA D HB1 6 13
ATOM 6745 H HB2 . ALA D 1 13 ? -7.247 -4.176 -4.323 1.00 0.00 ? 79 ALA D HB2 6 13
ATOM 6746 H HB3 . ALA D 1 13 ? -5.923 -4.445 -3.196 1.00 0.00 ? 79 ALA D HB3 6 13
ATOM 6747 N N . ALA D 1 14 ? -9.436 -2.711 -1.690 1.00 0.00 ? 80 ALA D N 6 14
ATOM 6748 C CA . ALA D 1 14 ? -10.802 -2.271 -1.524 1.00 0.00 ? 80 ALA D CA 6 14
ATOM 6749 C C . ALA D 1 14 ? -10.900 -0.799 -1.164 1.00 0.00 ? 80 ALA D C 6 14
ATOM 6750 O O . ALA D 1 14 ? -11.685 -0.041 -1.716 1.00 0.00 ? 80 ALA D O 6 14
ATOM 6751 C CB . ALA D 1 14 ? -11.540 -3.193 -0.578 1.00 0.00 ? 80 ALA D CB 6 14
ATOM 6752 H H . ALA D 1 14 ? -8.938 -3.034 -0.882 1.00 0.00 ? 80 ALA D H 6 14
ATOM 6753 H HA . ALA D 1 14 ? -11.318 -2.397 -2.464 1.00 0.00 ? 80 ALA D HA 6 14
ATOM 6754 H HB1 . ALA D 1 14 ? -11.074 -3.158 0.377 1.00 0.00 ? 80 ALA D HB1 6 14
ATOM 6755 H HB2 . ALA D 1 14 ? -12.565 -2.923 -0.486 1.00 0.00 ? 80 ALA D HB2 6 14
ATOM 6756 H HB3 . ALA D 1 14 ? -11.494 -4.207 -0.921 1.00 0.00 ? 80 ALA D HB3 6 14
ATOM 6757 N N . ILE D 1 15 ? -10.035 -0.345 -0.267 1.00 0.00 ? 81 ILE D N 6 15
ATOM 6758 C CA . ILE D 1 15 ? -9.907 1.013 0.211 1.00 0.00 ? 81 ILE D CA 6 15
ATOM 6759 C C . ILE D 1 15 ? -9.422 1.937 -0.892 1.00 0.00 ? 81 ILE D C 6 15
ATOM 6760 O O . ILE D 1 15 ? -9.908 3.052 -1.007 1.00 0.00 ? 81 ILE D O 6 15
ATOM 6761 C CB . ILE D 1 15 ? -9.052 1.091 1.465 1.00 0.00 ? 81 ILE D CB 6 15
ATOM 6762 C CG1 . ILE D 1 15 ? -9.702 0.422 2.664 1.00 0.00 ? 81 ILE D CG1 6 15
ATOM 6763 C CG2 . ILE D 1 15 ? -8.697 2.517 1.820 1.00 0.00 ? 81 ILE D CG2 6 15
ATOM 6764 C CD1 . ILE D 1 15 ? -8.740 0.026 3.767 1.00 0.00 ? 81 ILE D CD1 6 15
ATOM 6765 H H . ILE D 1 15 ? -9.426 -1.055 0.093 1.00 0.00 ? 81 ILE D H 6 15
ATOM 6766 H HA . ILE D 1 15 ? -10.918 1.315 0.459 1.00 0.00 ? 81 ILE D HA 6 15
ATOM 6767 H HB . ILE D 1 15 ? -8.118 0.590 1.255 1.00 0.00 ? 81 ILE D HB 6 15
ATOM 6768 H HG12 . ILE D 1 15 ? -10.446 1.104 3.076 1.00 0.00 ? 81 ILE D HG12 6 15
ATOM 6769 H HG13 . ILE D 1 15 ? -10.235 -0.473 2.367 1.00 0.00 ? 81 ILE D HG13 6 15
ATOM 6770 H HG21 . ILE D 1 15 ? -9.570 3.101 1.816 1.00 0.00 ? 81 ILE D HG21 6 15
ATOM 6771 H HG22 . ILE D 1 15 ? -8.283 2.572 2.800 1.00 0.00 ? 81 ILE D HG22 6 15
ATOM 6772 H HG23 . ILE D 1 15 ? -8.023 2.876 1.085 1.00 0.00 ? 81 ILE D HG23 6 15
ATOM 6773 H HD11 . ILE D 1 15 ? -8.408 0.896 4.284 1.00 0.00 ? 81 ILE D HD11 6 15
ATOM 6774 H HD12 . ILE D 1 15 ? -9.194 -0.662 4.440 1.00 0.00 ? 81 ILE D HD12 6 15
ATOM 6775 H HD13 . ILE D 1 15 ? -7.887 -0.487 3.378 1.00 0.00 ? 81 ILE D HD13 6 15
ATOM 6776 N N . ILE D 1 16 ? -8.539 1.484 -1.774 1.00 0.00 ? 82 ILE D N 6 16
ATOM 6777 C CA . ILE D 1 16 ? -8.150 2.186 -2.975 1.00 0.00 ? 82 ILE D CA 6 16
ATOM 6778 C C . ILE D 1 16 ? -9.362 2.589 -3.797 1.00 0.00 ? 82 ILE D C 6 16
ATOM 6779 O O . ILE D 1 16 ? -9.484 3.732 -4.203 1.00 0.00 ? 82 ILE D O 6 16
ATOM 6780 C CB . ILE D 1 16 ? -7.158 1.360 -3.783 1.00 0.00 ? 82 ILE D CB 6 16
ATOM 6781 C CG1 . ILE D 1 16 ? -5.820 1.304 -3.068 1.00 0.00 ? 82 ILE D CG1 6 16
ATOM 6782 C CG2 . ILE D 1 16 ? -6.959 1.955 -5.170 1.00 0.00 ? 82 ILE D CG2 6 16
ATOM 6783 C CD1 . ILE D 1 16 ? -4.695 0.527 -3.707 1.00 0.00 ? 82 ILE D CD1 6 16
ATOM 6784 H H . ILE D 1 16 ? -8.174 0.564 -1.617 1.00 0.00 ? 82 ILE D H 6 16
ATOM 6785 H HA . ILE D 1 16 ? -7.660 3.117 -2.720 1.00 0.00 ? 82 ILE D HA 6 16
ATOM 6786 H HB . ILE D 1 16 ? -7.562 0.355 -3.828 1.00 0.00 ? 82 ILE D HB 6 16
ATOM 6787 H HG12 . ILE D 1 16 ? -5.481 2.329 -2.916 1.00 0.00 ? 82 ILE D HG12 6 16
ATOM 6788 H HG13 . ILE D 1 16 ? -5.964 0.862 -2.101 1.00 0.00 ? 82 ILE D HG13 6 16
ATOM 6789 H HG21 . ILE D 1 16 ? -7.835 1.854 -5.772 1.00 0.00 ? 82 ILE D HG21 6 16
ATOM 6790 H HG22 . ILE D 1 16 ? -6.713 2.996 -5.098 1.00 0.00 ? 82 ILE D HG22 6 16
ATOM 6791 H HG23 . ILE D 1 16 ? -6.211 1.433 -5.716 1.00 0.00 ? 82 ILE D HG23 6 16
ATOM 6792 H HD11 . ILE D 1 16 ? -4.000 0.380 -2.969 1.00 0.00 ? 82 ILE D HD11 6 16
ATOM 6793 H HD12 . ILE D 1 16 ? -4.987 -0.390 -4.097 1.00 0.00 ? 82 ILE D HD12 6 16
ATOM 6794 H HD13 . ILE D 1 16 ? -4.241 1.070 -4.469 1.00 0.00 ? 82 ILE D HD13 6 16
ATOM 6795 N N . LYS D 1 17 ? -10.241 1.625 -4.061 1.00 0.00 ? 83 LYS D N 6 17
ATOM 6796 C CA . LYS D 1 17 ? -11.448 1.769 -4.840 1.00 0.00 ? 83 LYS D CA 6 17
ATOM 6797 C C . LYS D 1 17 ? -12.519 2.591 -4.148 1.00 0.00 ? 83 LYS D C 6 17
ATOM 6798 O O . LYS D 1 17 ? -13.136 3.422 -4.793 1.00 0.00 ? 83 LYS D O 6 17
ATOM 6799 C CB . LYS D 1 17 ? -11.960 0.367 -5.137 1.00 0.00 ? 83 LYS D CB 6 17
ATOM 6800 C CG . LYS D 1 17 ? -11.236 -0.286 -6.262 1.00 0.00 ? 83 LYS D CG 6 17
ATOM 6801 C CD . LYS D 1 17 ? -11.765 -1.649 -6.645 1.00 0.00 ? 83 LYS D CD 6 17
ATOM 6802 C CE . LYS D 1 17 ? -11.610 -2.658 -5.624 1.00 0.00 ? 83 LYS D CE 6 17
ATOM 6803 N NZ . LYS D 1 17 ? -12.111 -3.946 -6.010 1.00 0.00 ? 83 LYS D NZ 6 17
ATOM 6804 H H . LYS D 1 17 ? -10.024 0.743 -3.660 1.00 0.00 ? 83 LYS D H 6 17
ATOM 6805 H HA . LYS D 1 17 ? -11.231 2.260 -5.783 1.00 0.00 ? 83 LYS D HA 6 17
ATOM 6806 H HB2 . LYS D 1 17 ? -11.885 -0.249 -4.241 1.00 0.00 ? 83 LYS D HB2 6 17
ATOM 6807 H HB3 . LYS D 1 17 ? -12.972 0.433 -5.410 1.00 0.00 ? 83 LYS D HB3 6 17
ATOM 6808 H HG2 . LYS D 1 17 ? -11.283 0.366 -7.134 1.00 0.00 ? 83 LYS D HG2 6 17
ATOM 6809 H HG3 . LYS D 1 17 ? -10.215 -0.373 -5.995 1.00 0.00 ? 83 LYS D HG3 6 17
ATOM 6810 H HD2 . LYS D 1 17 ? -12.817 -1.563 -6.917 1.00 0.00 ? 83 LYS D HD2 6 17
ATOM 6811 H HD3 . LYS D 1 17 ? -11.238 -1.997 -7.463 1.00 0.00 ? 83 LYS D HD3 6 17
ATOM 6812 H HE2 . LYS D 1 17 ? -10.558 -2.746 -5.355 1.00 0.00 ? 83 LYS D HE2 6 17
ATOM 6813 H HE3 . LYS D 1 17 ? -12.115 -2.336 -4.815 1.00 0.00 ? 83 LYS D HE3 6 17
ATOM 6814 H HZ1 . LYS D 1 17 ? -12.038 -4.577 -5.310 1.00 0.00 ? 83 LYS D HZ1 6 17
ATOM 6815 H HZ2 . LYS D 1 17 ? -13.021 -3.917 -6.219 1.00 0.00 ? 83 LYS D HZ2 6 17
ATOM 6816 H HZ3 . LYS D 1 17 ? -11.673 -4.308 -6.756 1.00 0.00 ? 83 LYS D HZ3 6 17
ATOM 6817 N N . ALA D 1 18 ? -12.705 2.402 -2.845 1.00 0.00 ? 84 ALA D N 6 18
ATOM 6818 C CA . ALA D 1 18 ? -13.651 3.113 -2.026 1.00 0.00 ? 84 ALA D CA 6 18
ATOM 6819 C C . ALA D 1 18 ? -13.217 4.538 -1.756 1.00 0.00 ? 84 ALA D C 6 18
ATOM 6820 O O . ALA D 1 18 ? -14.010 5.438 -1.907 1.00 0.00 ? 84 ALA D O 6 18
ATOM 6821 C CB . ALA D 1 18 ? -13.843 2.344 -0.733 1.00 0.00 ? 84 ALA D CB 6 18
ATOM 6822 H H . ALA D 1 18 ? -12.121 1.734 -2.372 1.00 0.00 ? 84 ALA D H 6 18
ATOM 6823 H HA . ALA D 1 18 ? -14.592 3.119 -2.559 1.00 0.00 ? 84 ALA D HA 6 18
ATOM 6824 H HB1 . ALA D 1 18 ? -12.938 2.261 -0.189 1.00 0.00 ? 84 ALA D HB1 6 18
ATOM 6825 H HB2 . ALA D 1 18 ? -14.561 2.831 -0.124 1.00 0.00 ? 84 ALA D HB2 6 18
ATOM 6826 H HB3 . ALA D 1 18 ? -14.195 1.369 -0.929 1.00 0.00 ? 84 ALA D HB3 6 18
ATOM 6827 N N . GLY D 1 19 ? -11.959 4.745 -1.423 1.00 0.00 ? 85 GLY D N 6 19
ATOM 6828 C CA . GLY D 1 19 ? -11.283 5.998 -1.206 1.00 0.00 ? 85 GLY D CA 6 19
ATOM 6829 C C . GLY D 1 19 ? -11.048 6.794 -2.473 1.00 0.00 ? 85 GLY D C 6 19
ATOM 6830 O O . GLY D 1 19 ? -11.118 8.000 -2.446 1.00 0.00 ? 85 GLY D O 6 19
ATOM 6831 H H . GLY D 1 19 ? -11.411 3.913 -1.357 1.00 0.00 ? 85 GLY D H 6 19
ATOM 6832 H HA2 . GLY D 1 19 ? -11.838 6.606 -0.511 1.00 0.00 ? 85 GLY D HA2 6 19
ATOM 6833 H HA3 . GLY D 1 19 ? -10.313 5.824 -0.761 1.00 0.00 ? 85 GLY D HA3 6 19
ATOM 6834 N N . GLY D 1 20 ? -10.796 6.137 -3.585 1.00 0.00 ? 86 GLY D N 6 20
ATOM 6835 C CA . GLY D 1 20 ? -10.723 6.724 -4.894 1.00 0.00 ? 86 GLY D CA 6 20
ATOM 6836 C C . GLY D 1 20 ? -9.415 7.411 -5.188 1.00 0.00 ? 86 GLY D C 6 20
ATOM 6837 O O . GLY D 1 20 ? -9.441 8.456 -5.763 1.00 0.00 ? 86 GLY D O 6 20
ATOM 6838 H H . GLY D 1 20 ? -10.703 5.154 -3.481 1.00 0.00 ? 86 GLY D H 6 20
ATOM 6839 H HA2 . GLY D 1 20 ? -10.835 5.931 -5.602 1.00 0.00 ? 86 GLY D HA2 6 20
ATOM 6840 H HA3 . GLY D 1 20 ? -11.531 7.413 -5.044 1.00 0.00 ? 86 GLY D HA3 6 20
ATOM 6841 N N . TYR D 1 21 ? -8.291 6.821 -4.835 1.00 0.00 ? 87 TYR D N 6 21
ATOM 6842 C CA . TYR D 1 21 ? -6.973 7.377 -4.949 1.00 0.00 ? 87 TYR D CA 6 21
ATOM 6843 C C . TYR D 1 21 ? -6.625 7.905 -6.301 1.00 0.00 ? 87 TYR D C 6 21
ATOM 6844 O O . TYR D 1 21 ? -5.910 8.839 -6.388 1.00 0.00 ? 87 TYR D O 6 21
ATOM 6845 C CB . TYR D 1 21 ? -5.940 6.341 -4.550 1.00 0.00 ? 87 TYR D CB 6 21
ATOM 6846 C CG . TYR D 1 21 ? -5.581 6.203 -3.097 1.00 0.00 ? 87 TYR D CG 6 21
ATOM 6847 C CD1 . TYR D 1 21 ? -4.899 7.165 -2.368 1.00 0.00 ? 87 TYR D CD1 6 21
ATOM 6848 C CD2 . TYR D 1 21 ? -5.779 4.951 -2.524 1.00 0.00 ? 87 TYR D CD2 6 21
ATOM 6849 C CE1 . TYR D 1 21 ? -4.491 6.877 -1.062 1.00 0.00 ? 87 TYR D CE1 6 21
ATOM 6850 C CE2 . TYR D 1 21 ? -5.399 4.652 -1.214 1.00 0.00 ? 87 TYR D CE2 6 21
ATOM 6851 C CZ . TYR D 1 21 ? -4.753 5.635 -0.465 1.00 0.00 ? 87 TYR D CZ 6 21
ATOM 6852 O OH . TYR D 1 21 ? -4.472 5.425 0.847 1.00 0.00 ? 87 TYR D OH 6 21
ATOM 6853 H H . TYR D 1 21 ? -8.328 5.921 -4.447 1.00 0.00 ? 87 TYR D H 6 21
ATOM 6854 H HA . TYR D 1 21 ? -6.876 8.199 -4.267 1.00 0.00 ? 87 TYR D HA 6 21
ATOM 6855 H HB2 . TYR D 1 21 ? -6.333 5.377 -4.872 1.00 0.00 ? 87 TYR D HB2 6 21
ATOM 6856 H HB3 . TYR D 1 21 ? -5.012 6.446 -5.095 1.00 0.00 ? 87 TYR D HB3 6 21
ATOM 6857 H HD1 . TYR D 1 21 ? -4.674 8.128 -2.764 1.00 0.00 ? 87 TYR D HD1 6 21
ATOM 6858 H HD2 . TYR D 1 21 ? -6.158 4.216 -3.194 1.00 0.00 ? 87 TYR D HD2 6 21
ATOM 6859 H HE1 . TYR D 1 21 ? -3.998 7.648 -0.519 1.00 0.00 ? 87 TYR D HE1 6 21
ATOM 6860 H HE2 . TYR D 1 21 ? -5.569 3.672 -0.824 1.00 0.00 ? 87 TYR D HE2 6 21
ATOM 6861 H HH . TYR D 1 21 ? -5.189 5.758 1.325 1.00 0.00 ? 87 TYR D HH 6 21
HETATM 6862 N N . NH2 D 1 22 ? -7.054 7.358 -7.366 1.00 0.00 ? 88 NH2 D N 6 22
HETATM 6863 H HN1 . NH2 D 1 22 ? -6.802 7.773 -8.210 1.00 0.00 ? 88 NH2 D HN1 6 22
HETATM 6864 H HN2 . NH2 D 1 22 ? -7.660 6.628 -7.328 1.00 0.00 ? 88 NH2 D HN2 6 22
HETATM 6865 C C . ACE A 1 1 ? 1.896 14.125 2.190 1.00 0.00 ? 1 ACE A C 7 1
HETATM 6866 O O . ACE A 1 1 ? 2.541 13.453 1.414 1.00 0.00 ? 1 ACE A O 7 1
HETATM 6867 C CH3 . ACE A 1 1 ? 2.541 15.258 2.929 1.00 0.00 ? 1 ACE A CH3 7 1
HETATM 6868 H H1 . ACE A 1 1 ? 2.808 15.771 2.579 1.00 0.00 ? 1 ACE A H1 7 1
HETATM 6869 H H2 . ACE A 1 1 ? 2.205 15.591 3.377 1.00 0.00 ? 1 ACE A H2 7 1
HETATM 6870 H H3 . ACE A 1 1 ? 3.135 15.194 3.340 1.00 0.00 ? 1 ACE A H3 7 1
ATOM 6871 N N . ALA A 1 2 ? 0.605 13.927 2.403 1.00 0.00 ? 2 ALA A N 7 2
ATOM 6872 C CA . ALA A 1 2 ? -0.191 12.928 1.748 1.00 0.00 ? 2 ALA A CA 7 2
ATOM 6873 C C . ALA A 1 2 ? -0.175 12.927 0.238 1.00 0.00 ? 2 ALA A C 7 2
ATOM 6874 O O . ALA A 1 2 ? -0.500 11.900 -0.339 1.00 0.00 ? 2 ALA A O 7 2
ATOM 6875 C CB . ALA A 1 2 ? -1.596 13.048 2.240 1.00 0.00 ? 2 ALA A CB 7 2
ATOM 6876 H H . ALA A 1 2 ? 0.140 14.492 3.071 1.00 0.00 ? 2 ALA A H 7 2
ATOM 6877 H HA . ALA A 1 2 ? 0.177 11.979 2.061 1.00 0.00 ? 2 ALA A HA 7 2
ATOM 6878 H HB1 . ALA A 1 2 ? -1.622 13.009 3.297 1.00 0.00 ? 2 ALA A HB1 7 2
ATOM 6879 H HB2 . ALA A 1 2 ? -2.039 13.944 1.914 1.00 0.00 ? 2 ALA A HB2 7 2
ATOM 6880 H HB3 . ALA A 1 2 ? -2.148 12.250 1.829 1.00 0.00 ? 2 ALA A HB3 7 2
ATOM 6881 N N . LYS A 1 3 ? 0.269 13.980 -0.445 1.00 0.00 ? 3 LYS A N 7 3
ATOM 6882 C CA . LYS A 1 3 ? 0.511 14.069 -1.866 1.00 0.00 ? 3 LYS A CA 7 3
ATOM 6883 C C . LYS A 1 3 ? 1.554 13.117 -2.413 1.00 0.00 ? 3 LYS A C 7 3
ATOM 6884 O O . LYS A 1 3 ? 1.628 12.927 -3.618 1.00 0.00 ? 3 LYS A O 7 3
ATOM 6885 C CB . LYS A 1 3 ? 0.952 15.483 -2.184 1.00 0.00 ? 3 LYS A CB 7 3
ATOM 6886 C CG . LYS A 1 3 ? -0.112 16.522 -1.914 1.00 0.00 ? 3 LYS A CG 7 3
ATOM 6887 C CD . LYS A 1 3 ? 0.265 17.849 -2.414 1.00 0.00 ? 3 LYS A CD 7 3
ATOM 6888 C CE . LYS A 1 3 ? -0.721 18.913 -2.071 1.00 0.00 ? 3 LYS A CE 7 3
ATOM 6889 N NZ . LYS A 1 3 ? -0.431 20.122 -2.587 1.00 0.00 ? 3 LYS A NZ 7 3
ATOM 6890 H H . LYS A 1 3 ? 0.531 14.756 0.127 1.00 0.00 ? 3 LYS A H 7 3
ATOM 6891 H HA . LYS A 1 3 ? -0.421 13.882 -2.377 1.00 0.00 ? 3 LYS A HA 7 3
ATOM 6892 H HB2 . LYS A 1 3 ? 1.857 15.725 -1.626 1.00 0.00 ? 3 LYS A HB2 7 3
ATOM 6893 H HB3 . LYS A 1 3 ? 1.163 15.511 -3.233 1.00 0.00 ? 3 LYS A HB3 7 3
ATOM 6894 H HG2 . LYS A 1 3 ? -1.053 16.205 -2.364 1.00 0.00 ? 3 LYS A HG2 7 3
ATOM 6895 H HG3 . LYS A 1 3 ? -0.260 16.639 -0.892 1.00 0.00 ? 3 LYS A HG3 7 3
ATOM 6896 H HD2 . LYS A 1 3 ? 1.231 18.122 -1.989 1.00 0.00 ? 3 LYS A HD2 7 3
ATOM 6897 H HD3 . LYS A 1 3 ? 0.412 17.793 -3.431 1.00 0.00 ? 3 LYS A HD3 7 3
ATOM 6898 H HE2 . LYS A 1 3 ? -1.706 18.604 -2.423 1.00 0.00 ? 3 LYS A HE2 7 3
ATOM 6899 H HE3 . LYS A 1 3 ? -0.787 19.017 -1.106 1.00 0.00 ? 3 LYS A HE3 7 3
ATOM 6900 H HZ1 . LYS A 1 3 ? -0.401 20.062 -3.466 1.00 0.00 ? 3 LYS A HZ1 7 3
ATOM 6901 H HZ2 . LYS A 1 3 ? -1.061 20.801 -2.308 1.00 0.00 ? 3 LYS A HZ2 7 3
ATOM 6902 H HZ3 . LYS A 1 3 ? 0.385 20.357 -2.322 1.00 0.00 ? 3 LYS A HZ3 7 3
ATOM 6903 N N . ALA A 1 4 ? 2.285 12.398 -1.574 1.00 0.00 ? 4 ALA A N 7 4
ATOM 6904 C CA . ALA A 1 4 ? 2.990 11.192 -1.926 1.00 0.00 ? 4 ALA A CA 7 4
ATOM 6905 C C . ALA A 1 4 ? 2.119 10.102 -2.515 1.00 0.00 ? 4 ALA A C 7 4
ATOM 6906 O O . ALA A 1 4 ? 2.657 9.069 -2.893 1.00 0.00 ? 4 ALA A O 7 4
ATOM 6907 C CB . ALA A 1 4 ? 3.694 10.719 -0.664 1.00 0.00 ? 4 ALA A CB 7 4
ATOM 6908 H H . ALA A 1 4 ? 2.204 12.675 -0.620 1.00 0.00 ? 4 ALA A H 7 4
ATOM 6909 H HA . ALA A 1 4 ? 3.752 11.462 -2.648 1.00 0.00 ? 4 ALA A HA 7 4
ATOM 6910 H HB1 . ALA A 1 4 ? 4.227 9.805 -0.844 1.00 0.00 ? 4 ALA A HB1 7 4
ATOM 6911 H HB2 . ALA A 1 4 ? 4.396 11.468 -0.339 1.00 0.00 ? 4 ALA A HB2 7 4
ATOM 6912 H HB3 . ALA A 1 4 ? 2.991 10.529 0.124 1.00 0.00 ? 4 ALA A HB3 7 4
ATOM 6913 N N . ALA A 1 5 ? 0.800 10.288 -2.562 1.00 0.00 ? 5 ALA A N 7 5
ATOM 6914 C CA . ALA A 1 5 ? -0.202 9.327 -2.954 1.00 0.00 ? 5 ALA A CA 7 5
ATOM 6915 C C . ALA A 1 5 ? 0.025 8.787 -4.353 1.00 0.00 ? 5 ALA A C 7 5
ATOM 6916 O O . ALA A 1 5 ? 0.659 7.748 -4.472 1.00 0.00 ? 5 ALA A O 7 5
ATOM 6917 C CB . ALA A 1 5 ? -1.578 9.909 -2.687 1.00 0.00 ? 5 ALA A CB 7 5
ATOM 6918 H H . ALA A 1 5 ? 0.463 11.197 -2.301 1.00 0.00 ? 5 ALA A H 7 5
ATOM 6919 H HA . ALA A 1 5 ? -0.111 8.440 -2.339 1.00 0.00 ? 5 ALA A HA 7 5
ATOM 6920 H HB1 . ALA A 1 5 ? -2.368 9.281 -3.062 1.00 0.00 ? 5 ALA A HB1 7 5
ATOM 6921 H HB2 . ALA A 1 5 ? -1.657 10.058 -1.622 1.00 0.00 ? 5 ALA A HB2 7 5
ATOM 6922 H HB3 . ALA A 1 5 ? -1.644 10.874 -3.166 1.00 0.00 ? 5 ALA A HB3 7 5
ATOM 6923 N N . ALA A 1 6 ? -0.427 9.473 -5.402 1.00 0.00 ? 6 ALA A N 7 6
ATOM 6924 C CA . ALA A 1 6 ? -0.443 8.893 -6.726 1.00 0.00 ? 6 ALA A CA 7 6
ATOM 6925 C C . ALA A 1 6 ? 0.935 8.565 -7.266 1.00 0.00 ? 6 ALA A C 7 6
ATOM 6926 O O . ALA A 1 6 ? 1.100 7.580 -7.964 1.00 0.00 ? 6 ALA A O 7 6
ATOM 6927 C CB . ALA A 1 6 ? -1.229 9.802 -7.657 1.00 0.00 ? 6 ALA A CB 7 6
ATOM 6928 H H . ALA A 1 6 ? -0.915 10.322 -5.209 1.00 0.00 ? 6 ALA A H 7 6
ATOM 6929 H HA . ALA A 1 6 ? -0.939 7.938 -6.600 1.00 0.00 ? 6 ALA A HA 7 6
ATOM 6930 H HB1 . ALA A 1 6 ? -2.210 9.897 -7.326 1.00 0.00 ? 6 ALA A HB1 7 6
ATOM 6931 H HB2 . ALA A 1 6 ? -0.824 10.759 -7.694 1.00 0.00 ? 6 ALA A HB2 7 6
ATOM 6932 H HB3 . ALA A 1 6 ? -1.235 9.411 -8.608 1.00 0.00 ? 6 ALA A HB3 7 6
ATOM 6933 N N . ALA A 1 7 ? 1.977 9.258 -6.825 1.00 0.00 ? 7 ALA A N 7 7
ATOM 6934 C CA . ALA A 1 7 ? 3.336 8.920 -7.185 1.00 0.00 ? 7 ALA A CA 7 7
ATOM 6935 C C . ALA A 1 7 ? 3.781 7.543 -6.738 1.00 0.00 ? 7 ALA A C 7 7
ATOM 6936 O O . ALA A 1 7 ? 4.670 6.997 -7.361 1.00 0.00 ? 7 ALA A O 7 7
ATOM 6937 C CB . ALA A 1 7 ? 4.289 9.972 -6.656 1.00 0.00 ? 7 ALA A CB 7 7
ATOM 6938 H H . ALA A 1 7 ? 1.740 9.958 -6.155 1.00 0.00 ? 7 ALA A H 7 7
ATOM 6939 H HA . ALA A 1 7 ? 3.390 8.888 -8.261 1.00 0.00 ? 7 ALA A HA 7 7
ATOM 6940 H HB1 . ALA A 1 7 ? 4.265 9.981 -5.598 1.00 0.00 ? 7 ALA A HB1 7 7
ATOM 6941 H HB2 . ALA A 1 7 ? 5.298 9.749 -6.961 1.00 0.00 ? 7 ALA A HB2 7 7
ATOM 6942 H HB3 . ALA A 1 7 ? 4.028 10.933 -7.038 1.00 0.00 ? 7 ALA A HB3 7 7
ATOM 6943 N N . ALA A 1 8 ? 3.152 6.975 -5.719 1.00 0.00 ? 8 ALA A N 7 8
ATOM 6944 C CA . ALA A 1 8 ? 3.263 5.575 -5.387 1.00 0.00 ? 8 ALA A CA 7 8
ATOM 6945 C C . ALA A 1 8 ? 2.040 4.785 -5.818 1.00 0.00 ? 8 ALA A C 7 8
ATOM 6946 O O . ALA A 1 8 ? 2.117 3.876 -6.620 1.00 0.00 ? 8 ALA A O 7 8
ATOM 6947 C CB . ALA A 1 8 ? 3.469 5.480 -3.888 1.00 0.00 ? 8 ALA A CB 7 8
ATOM 6948 H H . ALA A 1 8 ? 2.398 7.445 -5.260 1.00 0.00 ? 8 ALA A H 7 8
ATOM 6949 H HA . ALA A 1 8 ? 4.126 5.154 -5.897 1.00 0.00 ? 8 ALA A HA 7 8
ATOM 6950 H HB1 . ALA A 1 8 ? 3.669 4.457 -3.627 1.00 0.00 ? 8 ALA A HB1 7 8
ATOM 6951 H HB2 . ALA A 1 8 ? 4.297 6.110 -3.618 1.00 0.00 ? 8 ALA A HB2 7 8
ATOM 6952 H HB3 . ALA A 1 8 ? 2.588 5.784 -3.349 1.00 0.00 ? 8 ALA A HB3 7 8
ATOM 6953 N N . ILE A 1 9 ? 0.878 5.095 -5.254 1.00 0.00 ? 9 ILE A N 7 9
ATOM 6954 C CA . ILE A 1 9 ? -0.371 4.372 -5.335 1.00 0.00 ? 9 ILE A CA 7 9
ATOM 6955 C C . ILE A 1 9 ? -0.881 4.190 -6.752 1.00 0.00 ? 9 ILE A C 7 9
ATOM 6956 O O . ILE A 1 9 ? -1.447 3.146 -7.051 1.00 0.00 ? 9 ILE A O 7 9
ATOM 6957 C CB . ILE A 1 9 ? -1.455 5.013 -4.483 1.00 0.00 ? 9 ILE A CB 7 9
ATOM 6958 C CG1 . ILE A 1 9 ? -1.028 5.326 -3.065 1.00 0.00 ? 9 ILE A CG1 7 9
ATOM 6959 C CG2 . ILE A 1 9 ? -2.672 4.113 -4.418 1.00 0.00 ? 9 ILE A CG2 7 9
ATOM 6960 C CD1 . ILE A 1 9 ? -0.412 4.211 -2.282 1.00 0.00 ? 9 ILE A CD1 7 9
ATOM 6961 H H . ILE A 1 9 ? 0.869 5.903 -4.664 1.00 0.00 ? 9 ILE A H 7 9
ATOM 6962 H HA . ILE A 1 9 ? -0.179 3.378 -4.949 1.00 0.00 ? 9 ILE A HA 7 9
ATOM 6963 H HB . ILE A 1 9 ? -1.758 5.911 -4.988 1.00 0.00 ? 9 ILE A HB 7 9
ATOM 6964 H HG12 . ILE A 1 9 ? -0.307 6.142 -3.110 1.00 0.00 ? 9 ILE A HG12 7 9
ATOM 6965 H HG13 . ILE A 1 9 ? -1.850 5.691 -2.511 1.00 0.00 ? 9 ILE A HG13 7 9
ATOM 6966 H HG21 . ILE A 1 9 ? -3.311 4.428 -3.615 1.00 0.00 ? 9 ILE A HG21 7 9
ATOM 6967 H HG22 . ILE A 1 9 ? -3.240 4.167 -5.324 1.00 0.00 ? 9 ILE A HG22 7 9
ATOM 6968 H HG23 . ILE A 1 9 ? -2.359 3.096 -4.247 1.00 0.00 ? 9 ILE A HG23 7 9
ATOM 6969 H HD11 . ILE A 1 9 ? 0.428 3.930 -2.692 1.00 0.00 ? 9 ILE A HD11 7 9
ATOM 6970 H HD12 . ILE A 1 9 ? -0.152 4.456 -1.326 1.00 0.00 ? 9 ILE A HD12 7 9
ATOM 6971 H HD13 . ILE A 1 9 ? -1.020 3.449 -2.279 1.00 0.00 ? 9 ILE A HD13 7 9
ATOM 6972 N N . LYS A 1 10 ? -0.592 5.119 -7.658 1.00 0.00 ? 10 LYS A N 7 10
ATOM 6973 C CA . LYS A 1 10 ? -1.063 5.021 -9.018 1.00 0.00 ? 10 LYS A CA 7 10
ATOM 6974 C C . LYS A 1 10 ? -0.318 4.004 -9.860 1.00 0.00 ? 10 LYS A C 7 10
ATOM 6975 O O . LYS A 1 10 ? -0.955 3.226 -10.560 1.00 0.00 ? 10 LYS A O 7 10
ATOM 6976 C CB . LYS A 1 10 ? -1.017 6.426 -9.602 1.00 0.00 ? 10 LYS A CB 7 10
ATOM 6977 C CG . LYS A 1 10 ? -2.047 6.793 -10.642 1.00 0.00 ? 10 LYS A CG 7 10
ATOM 6978 C CD . LYS A 1 10 ? -1.990 6.111 -11.968 1.00 0.00 ? 10 LYS A CD 7 10
ATOM 6979 C CE . LYS A 1 10 ? -2.471 6.541 -12.805 1.00 0.00 ? 10 LYS A CE 7 10
ATOM 6980 N NZ . LYS A 1 10 ? -2.491 5.919 -14.085 1.00 0.00 ? 10 LYS A NZ 7 10
ATOM 6981 H H . LYS A 1 10 ? 0.019 5.871 -7.388 1.00 0.00 ? 10 LYS A H 7 10
ATOM 6982 H HA . LYS A 1 10 ? -2.091 4.675 -8.997 1.00 0.00 ? 10 LYS A HA 7 10
ATOM 6983 H HB2 . LYS A 1 10 ? -1.125 7.131 -8.778 1.00 0.00 ? 10 LYS A HB2 7 10
ATOM 6984 H HB3 . LYS A 1 10 ? -0.020 6.568 -9.983 1.00 0.00 ? 10 LYS A HB3 7 10
ATOM 6985 H HG2 . LYS A 1 10 ? -3.038 6.623 -10.220 1.00 0.00 ? 10 LYS A HG2 7 10
ATOM 6986 H HG3 . LYS A 1 10 ? -1.918 7.839 -10.774 1.00 0.00 ? 10 LYS A HG3 7 10
ATOM 6987 H HD2 . LYS A 1 10 ? -0.933 6.031 -12.220 1.00 0.00 ? 10 LYS A HD2 7 10
ATOM 6988 H HD3 . LYS A 1 10 ? -2.241 5.397 -12.038 1.00 0.00 ? 10 LYS A HD3 7 10
ATOM 6989 H HE2 . LYS A 1 10 ? -3.519 6.669 -12.531 1.00 0.00 ? 10 LYS A HE2 7 10
ATOM 6990 H HE3 . LYS A 1 10 ? -2.191 7.185 -12.708 1.00 0.00 ? 10 LYS A HE3 7 10
ATOM 6991 H HZ1 . LYS A 1 10 ? -1.944 5.778 -14.393 1.00 0.00 ? 10 LYS A HZ1 7 10
ATOM 6992 H HZ2 . LYS A 1 10 ? -2.718 5.356 -14.219 1.00 0.00 ? 10 LYS A HZ2 7 10
ATOM 6993 H HZ3 . LYS A 1 10 ? -2.774 6.171 -14.605 1.00 0.00 ? 10 LYS A HZ3 7 10
ATOM 6994 N N . ALA A 1 11 ? 0.992 3.897 -9.658 1.00 0.00 ? 11 ALA A N 7 11
ATOM 6995 C CA . ALA A 1 11 ? 1.752 2.734 -10.054 1.00 0.00 ? 11 ALA A CA 7 11
ATOM 6996 C C . ALA A 1 11 ? 1.351 1.479 -9.305 1.00 0.00 ? 11 ALA A C 7 11
ATOM 6997 O O . ALA A 1 11 ? 1.130 0.435 -9.902 1.00 0.00 ? 11 ALA A O 7 11
ATOM 6998 C CB . ALA A 1 11 ? 3.236 3.019 -9.968 1.00 0.00 ? 11 ALA A CB 7 11
ATOM 6999 H H . ALA A 1 11 ? 1.441 4.570 -9.064 1.00 0.00 ? 11 ALA A H 7 11
ATOM 7000 H HA . ALA A 1 11 ? 1.496 2.541 -11.088 1.00 0.00 ? 11 ALA A HA 7 11
ATOM 7001 H HB1 . ALA A 1 11 ? 3.848 2.266 -10.387 1.00 0.00 ? 11 ALA A HB1 7 11
ATOM 7002 H HB2 . ALA A 1 11 ? 3.430 3.908 -10.500 1.00 0.00 ? 11 ALA A HB2 7 11
ATOM 7003 H HB3 . ALA A 1 11 ? 3.522 3.194 -8.968 1.00 0.00 ? 11 ALA A HB3 7 11
ATOM 7004 N N . ILE A 1 12 ? 1.216 1.549 -7.983 1.00 0.00 ? 12 ILE A N 7 12
ATOM 7005 C CA . ILE A 1 12 ? 1.097 0.399 -7.119 1.00 0.00 ? 12 ILE A CA 7 12
ATOM 7006 C C . ILE A 1 12 ? -0.237 -0.290 -7.291 1.00 0.00 ? 12 ILE A C 7 12
ATOM 7007 O O . ILE A 1 12 ? -0.255 -1.500 -7.432 1.00 0.00 ? 12 ILE A O 7 12
ATOM 7008 C CB . ILE A 1 12 ? 1.419 0.729 -5.670 1.00 0.00 ? 12 ILE A CB 7 12
ATOM 7009 C CG1 . ILE A 1 12 ? 2.914 0.886 -5.475 1.00 0.00 ? 12 ILE A CG1 7 12
ATOM 7010 C CG2 . ILE A 1 12 ? 0.825 -0.210 -4.641 1.00 0.00 ? 12 ILE A CG2 7 12
ATOM 7011 C CD1 . ILE A 1 12 ? 3.738 -0.380 -5.439 1.00 0.00 ? 12 ILE A CD1 7 12
ATOM 7012 H H . ILE A 1 12 ? 1.198 2.478 -7.597 1.00 0.00 ? 12 ILE A H 7 12
ATOM 7013 H HA . ILE A 1 12 ? 1.812 -0.347 -7.452 1.00 0.00 ? 12 ILE A HA 7 12
ATOM 7014 H HB . ILE A 1 12 ? 0.970 1.691 -5.476 1.00 0.00 ? 12 ILE A HB 7 12
ATOM 7015 H HG12 . ILE A 1 12 ? 3.298 1.524 -6.271 1.00 0.00 ? 12 ILE A HG12 7 12
ATOM 7016 H HG13 . ILE A 1 12 ? 3.076 1.397 -4.540 1.00 0.00 ? 12 ILE A HG13 7 12
ATOM 7017 H HG21 . ILE A 1 12 ? -0.238 -0.131 -4.581 1.00 0.00 ? 12 ILE A HG21 7 12
ATOM 7018 H HG22 . ILE A 1 12 ? 1.113 -1.219 -4.832 1.00 0.00 ? 12 ILE A HG22 7 12
ATOM 7019 H HG23 . ILE A 1 12 ? 1.141 0.046 -3.653 1.00 0.00 ? 12 ILE A HG23 7 12
ATOM 7020 H HD11 . ILE A 1 12 ? 4.286 -0.413 -4.877 1.00 0.00 ? 12 ILE A HD11 7 12
ATOM 7021 H HD12 . ILE A 1 12 ? 3.389 -1.056 -5.336 1.00 0.00 ? 12 ILE A HD12 7 12
ATOM 7022 H HD13 . ILE A 1 12 ? 4.138 -0.513 -6.091 1.00 0.00 ? 12 ILE A HD13 7 12
ATOM 7023 N N . ALA A 1 13 ? -1.336 0.433 -7.497 1.00 0.00 ? 13 ALA A N 7 13
ATOM 7024 C CA . ALA A 1 13 ? -2.600 -0.179 -7.827 1.00 0.00 ? 13 ALA A CA 7 13
ATOM 7025 C C . ALA A 1 13 ? -2.655 -0.889 -9.166 1.00 0.00 ? 13 ALA A C 7 13
ATOM 7026 O O . ALA A 1 13 ? -3.478 -1.754 -9.364 1.00 0.00 ? 13 ALA A O 7 13
ATOM 7027 C CB . ALA A 1 13 ? -3.661 0.897 -7.716 1.00 0.00 ? 13 ALA A CB 7 13
ATOM 7028 H H . ALA A 1 13 ? -1.233 1.432 -7.470 1.00 0.00 ? 13 ALA A H 7 13
ATOM 7029 H HA . ALA A 1 13 ? -2.815 -0.897 -7.047 1.00 0.00 ? 13 ALA A HA 7 13
ATOM 7030 H HB1 . ALA A 1 13 ? -3.627 1.390 -6.769 1.00 0.00 ? 13 ALA A HB1 7 13
ATOM 7031 H HB2 . ALA A 1 13 ? -3.519 1.623 -8.490 1.00 0.00 ? 13 ALA A HB2 7 13
ATOM 7032 H HB3 . ALA A 1 13 ? -4.616 0.417 -7.847 1.00 0.00 ? 13 ALA A HB3 7 13
ATOM 7033 N N . ALA A 1 14 ? -1.696 -0.630 -10.049 1.00 0.00 ? 14 ALA A N 7 14
ATOM 7034 C CA . ALA A 1 14 ? -1.527 -1.304 -11.317 1.00 0.00 ? 14 ALA A CA 7 14
ATOM 7035 C C . ALA A 1 14 ? -0.476 -2.396 -11.239 1.00 0.00 ? 14 ALA A C 7 14
ATOM 7036 O O . ALA A 1 14 ? -0.632 -3.423 -11.874 1.00 0.00 ? 14 ALA A O 7 14
ATOM 7037 C CB . ALA A 1 14 ? -1.220 -0.275 -12.387 1.00 0.00 ? 14 ALA A CB 7 14
ATOM 7038 H H . ALA A 1 14 ? -0.986 0.020 -9.760 1.00 0.00 ? 14 ALA A H 7 14
ATOM 7039 H HA . ALA A 1 14 ? -2.450 -1.794 -11.591 1.00 0.00 ? 14 ALA A HA 7 14
ATOM 7040 H HB1 . ALA A 1 14 ? -1.981 0.465 -12.404 1.00 0.00 ? 14 ALA A HB1 7 14
ATOM 7041 H HB2 . ALA A 1 14 ? -0.282 0.191 -12.229 1.00 0.00 ? 14 ALA A HB2 7 14
ATOM 7042 H HB3 . ALA A 1 14 ? -1.163 -0.760 -13.326 1.00 0.00 ? 14 ALA A HB3 7 14
ATOM 7043 N N . ILE A 1 15 ? 0.535 -2.252 -10.395 1.00 0.00 ? 15 ILE A N 7 15
ATOM 7044 C CA . ILE A 1 15 ? 1.513 -3.238 -9.996 1.00 0.00 ? 15 ILE A CA 7 15
ATOM 7045 C C . ILE A 1 15 ? 0.824 -4.335 -9.207 1.00 0.00 ? 15 ILE A C 7 15
ATOM 7046 O O . ILE A 1 15 ? 1.147 -5.487 -9.413 1.00 0.00 ? 15 ILE A O 7 15
ATOM 7047 C CB . ILE A 1 15 ? 2.637 -2.595 -9.200 1.00 0.00 ? 15 ILE A CB 7 15
ATOM 7048 C CG1 . ILE A 1 15 ? 3.539 -1.783 -10.115 1.00 0.00 ? 15 ILE A CG1 7 15
ATOM 7049 C CG2 . ILE A 1 15 ? 3.437 -3.574 -8.363 1.00 0.00 ? 15 ILE A CG2 7 15
ATOM 7050 C CD1 . ILE A 1 15 ? 4.394 -0.753 -9.423 1.00 0.00 ? 15 ILE A CD1 7 15
ATOM 7051 H H . ILE A 1 15 ? 0.565 -1.366 -9.924 1.00 0.00 ? 15 ILE A H 7 15
ATOM 7052 H HA . ILE A 1 15 ? 1.942 -3.689 -10.886 1.00 0.00 ? 15 ILE A HA 7 15
ATOM 7053 H HB . ILE A 1 15 ? 2.169 -1.937 -8.477 1.00 0.00 ? 15 ILE A HB 7 15
ATOM 7054 H HG12 . ILE A 1 15 ? 4.182 -2.468 -10.668 1.00 0.00 ? 15 ILE A HG12 7 15
ATOM 7055 H HG13 . ILE A 1 15 ? 2.948 -1.237 -10.831 1.00 0.00 ? 15 ILE A HG13 7 15
ATOM 7056 H HG21 . ILE A 1 15 ? 4.254 -3.072 -7.889 1.00 0.00 ? 15 ILE A HG21 7 15
ATOM 7057 H HG22 . ILE A 1 15 ? 2.844 -4.013 -7.591 1.00 0.00 ? 15 ILE A HG22 7 15
ATOM 7058 H HG23 . ILE A 1 15 ? 3.816 -4.360 -8.965 1.00 0.00 ? 15 ILE A HG23 7 15
ATOM 7059 H HD11 . ILE A 1 15 ? 5.000 -0.240 -10.120 1.00 0.00 ? 15 ILE A HD11 7 15
ATOM 7060 H HD12 . ILE A 1 15 ? 3.799 -0.013 -8.958 1.00 0.00 ? 15 ILE A HD12 7 15
ATOM 7061 H HD13 . ILE A 1 15 ? 5.038 -1.203 -8.702 1.00 0.00 ? 15 ILE A HD13 7 15
ATOM 7062 N N . ILE A 1 16 ? -0.170 -4.034 -8.377 1.00 0.00 ? 16 ILE A N 7 16
ATOM 7063 C CA . ILE A 1 16 ? -0.976 -5.024 -7.705 1.00 0.00 ? 16 ILE A CA 7 16
ATOM 7064 C C . ILE A 1 16 ? -1.607 -5.994 -8.679 1.00 0.00 ? 16 ILE A C 7 16
ATOM 7065 O O . ILE A 1 16 ? -1.413 -7.187 -8.560 1.00 0.00 ? 16 ILE A O 7 16
ATOM 7066 C CB . ILE A 1 16 ? -2.000 -4.343 -6.814 1.00 0.00 ? 16 ILE A CB 7 16
ATOM 7067 C CG1 . ILE A 1 16 ? -1.224 -3.897 -5.594 1.00 0.00 ? 16 ILE A CG1 7 16
ATOM 7068 C CG2 . ILE A 1 16 ? -3.138 -5.251 -6.393 1.00 0.00 ? 16 ILE A CG2 7 16
ATOM 7069 C CD1 . ILE A 1 16 ? -1.988 -3.388 -4.406 1.00 0.00 ? 16 ILE A CD1 7 16
ATOM 7070 H H . ILE A 1 16 ? -0.342 -3.072 -8.162 1.00 0.00 ? 16 ILE A H 7 16
ATOM 7071 H HA . ILE A 1 16 ? -0.327 -5.605 -7.065 1.00 0.00 ? 16 ILE A HA 7 16
ATOM 7072 H HB . ILE A 1 16 ? -2.392 -3.498 -7.368 1.00 0.00 ? 16 ILE A HB 7 16
ATOM 7073 H HG12 . ILE A 1 16 ? -0.622 -4.745 -5.265 1.00 0.00 ? 16 ILE A HG12 7 16
ATOM 7074 H HG13 . ILE A 1 16 ? -0.535 -3.117 -5.855 1.00 0.00 ? 16 ILE A HG13 7 16
ATOM 7075 H HG21 . ILE A 1 16 ? -3.733 -5.574 -7.214 1.00 0.00 ? 16 ILE A HG21 7 16
ATOM 7076 H HG22 . ILE A 1 16 ? -2.758 -6.087 -5.846 1.00 0.00 ? 16 ILE A HG22 7 16
ATOM 7077 H HG23 . ILE A 1 16 ? -3.830 -4.729 -5.774 1.00 0.00 ? 16 ILE A HG23 7 16
ATOM 7078 H HD11 . ILE A 1 16 ? -2.368 -4.237 -3.878 1.00 0.00 ? 16 ILE A HD11 7 16
ATOM 7079 H HD12 . ILE A 1 16 ? -1.318 -2.853 -3.771 1.00 0.00 ? 16 ILE A HD12 7 16
ATOM 7080 H HD13 . ILE A 1 16 ? -2.754 -2.733 -4.762 1.00 0.00 ? 16 ILE A HD13 7 16
ATOM 7081 N N . LYS A 1 17 ? -2.313 -5.445 -9.661 1.00 0.00 ? 17 LYS A N 7 17
ATOM 7082 C CA . LYS A 1 17 ? -2.974 -6.119 -10.752 1.00 0.00 ? 17 LYS A CA 7 17
ATOM 7083 C C . LYS A 1 17 ? -2.044 -6.936 -11.615 1.00 0.00 ? 17 LYS A C 7 17
ATOM 7084 O O . LYS A 1 17 ? -2.412 -7.978 -12.030 1.00 0.00 ? 17 LYS A O 7 17
ATOM 7085 C CB . LYS A 1 17 ? -3.691 -5.062 -11.566 1.00 0.00 ? 17 LYS A CB 7 17
ATOM 7086 C CG . LYS A 1 17 ? -4.954 -4.578 -10.877 1.00 0.00 ? 17 LYS A CG 7 17
ATOM 7087 C CD . LYS A 1 17 ? -5.609 -3.492 -11.690 1.00 0.00 ? 17 LYS A CD 7 17
ATOM 7088 C CE . LYS A 1 17 ? -6.766 -2.858 -10.956 1.00 0.00 ? 17 LYS A CE 7 17
ATOM 7089 N NZ . LYS A 1 17 ? -6.342 -2.079 -9.823 1.00 0.00 ? 17 LYS A NZ 7 17
ATOM 7090 H H . LYS A 1 17 ? -2.425 -4.452 -9.608 1.00 0.00 ? 17 LYS A H 7 17
ATOM 7091 H HA . LYS A 1 17 ? -3.673 -6.814 -10.322 1.00 0.00 ? 17 LYS A HA 7 17
ATOM 7092 H HB2 . LYS A 1 17 ? -3.023 -4.213 -11.711 1.00 0.00 ? 17 LYS A HB2 7 17
ATOM 7093 H HB3 . LYS A 1 17 ? -3.902 -5.437 -12.559 1.00 0.00 ? 17 LYS A HB3 7 17
ATOM 7094 H HG2 . LYS A 1 17 ? -5.647 -5.408 -10.739 1.00 0.00 ? 17 LYS A HG2 7 17
ATOM 7095 H HG3 . LYS A 1 17 ? -4.701 -4.213 -9.908 1.00 0.00 ? 17 LYS A HG3 7 17
ATOM 7096 H HD2 . LYS A 1 17 ? -4.874 -2.734 -11.961 1.00 0.00 ? 17 LYS A HD2 7 17
ATOM 7097 H HD3 . LYS A 1 17 ? -6.008 -3.925 -12.588 1.00 0.00 ? 17 LYS A HD3 7 17
ATOM 7098 H HE2 . LYS A 1 17 ? -7.320 -2.218 -11.643 1.00 0.00 ? 17 LYS A HE2 7 17
ATOM 7099 H HE3 . LYS A 1 17 ? -7.432 -3.617 -10.641 1.00 0.00 ? 17 LYS A HE3 7 17
ATOM 7100 H HZ1 . LYS A 1 17 ? -5.647 -1.449 -10.098 1.00 0.00 ? 17 LYS A HZ1 7 17
ATOM 7101 H HZ2 . LYS A 1 17 ? -7.046 -1.542 -9.385 1.00 0.00 ? 17 LYS A HZ2 7 17
ATOM 7102 H HZ3 . LYS A 1 17 ? -5.974 -2.653 -9.116 1.00 0.00 ? 17 LYS A HZ3 7 17
ATOM 7103 N N . ALA A 1 18 ? -0.829 -6.509 -11.851 1.00 0.00 ? 18 ALA A N 7 18
ATOM 7104 C CA . ALA A 1 18 ? 0.199 -7.242 -12.549 1.00 0.00 ? 18 ALA A CA 7 18
ATOM 7105 C C . ALA A 1 18 ? 0.900 -8.297 -11.726 1.00 0.00 ? 18 ALA A C 7 18
ATOM 7106 O O . ALA A 1 18 ? 1.254 -9.360 -12.173 1.00 0.00 ? 18 ALA A O 7 18
ATOM 7107 C CB . ALA A 1 18 ? 1.193 -6.278 -13.138 1.00 0.00 ? 18 ALA A CB 7 18
ATOM 7108 H H . ALA A 1 18 ? -0.614 -5.605 -11.506 1.00 0.00 ? 18 ALA A H 7 18
ATOM 7109 H HA . ALA A 1 18 ? -0.296 -7.756 -13.350 1.00 0.00 ? 18 ALA A HA 7 18
ATOM 7110 H HB1 . ALA A 1 18 ? 1.904 -6.818 -13.705 1.00 0.00 ? 18 ALA A HB1 7 18
ATOM 7111 H HB2 . ALA A 1 18 ? 0.685 -5.595 -13.765 1.00 0.00 ? 18 ALA A HB2 7 18
ATOM 7112 H HB3 . ALA A 1 18 ? 1.698 -5.761 -12.362 1.00 0.00 ? 18 ALA A HB3 7 18
ATOM 7113 N N . GLY A 1 19 ? 1.113 -7.991 -10.458 1.00 0.00 ? 19 GLY A N 7 19
ATOM 7114 C CA . GLY A 1 19 ? 1.825 -8.749 -9.461 1.00 0.00 ? 19 GLY A CA 7 19
ATOM 7115 C C . GLY A 1 19 ? 1.133 -10.036 -9.106 1.00 0.00 ? 19 GLY A C 7 19
ATOM 7116 O O . GLY A 1 19 ? 1.794 -10.959 -8.775 1.00 0.00 ? 19 GLY A O 7 19
ATOM 7117 H H . GLY A 1 19 ? 0.753 -7.116 -10.174 1.00 0.00 ? 19 GLY A H 7 19
ATOM 7118 H HA2 . GLY A 1 19 ? 2.804 -8.990 -9.803 1.00 0.00 ? 19 GLY A HA2 7 19
ATOM 7119 H HA3 . GLY A 1 19 ? 1.965 -8.154 -8.573 1.00 0.00 ? 19 GLY A HA3 7 19
ATOM 7120 N N . GLY A 1 20 ? -0.157 -10.113 -9.184 1.00 0.00 ? 20 GLY A N 7 20
ATOM 7121 C CA . GLY A 1 20 ? -0.913 -11.287 -8.866 1.00 0.00 ? 20 GLY A CA 7 20
ATOM 7122 C C . GLY A 1 20 ? -1.302 -11.490 -7.432 1.00 0.00 ? 20 GLY A C 7 20
ATOM 7123 O O . GLY A 1 20 ? -1.437 -12.599 -7.005 1.00 0.00 ? 20 GLY A O 7 20
ATOM 7124 H H . GLY A 1 20 ? -0.611 -9.303 -9.474 1.00 0.00 ? 20 GLY A H 7 20
ATOM 7125 H HA2 . GLY A 1 20 ? -1.788 -11.269 -9.455 1.00 0.00 ? 20 GLY A HA2 7 20
ATOM 7126 H HA3 . GLY A 1 20 ? -0.371 -12.144 -9.169 1.00 0.00 ? 20 GLY A HA3 7 20
ATOM 7127 N N . TYR A 1 21 ? -1.405 -10.421 -6.683 1.00 0.00 ? 21 TYR A N 7 21
ATOM 7128 C CA . TYR A 1 21 ? -1.729 -10.369 -5.306 1.00 0.00 ? 21 TYR A CA 7 21
ATOM 7129 C C . TYR A 1 21 ? -3.029 -10.944 -4.951 1.00 0.00 ? 21 TYR A C 7 21
ATOM 7130 O O . TYR A 1 21 ? -3.231 -11.296 -3.858 1.00 0.00 ? 21 TYR A O 7 21
ATOM 7131 C CB . TYR A 1 21 ? -1.663 -8.916 -4.897 1.00 0.00 ? 21 TYR A CB 7 21
ATOM 7132 C CG . TYR A 1 21 ? -0.339 -8.401 -4.400 1.00 0.00 ? 21 TYR A CG 7 21
ATOM 7133 C CD1 . TYR A 1 21 ? 0.276 -8.814 -3.239 1.00 0.00 ? 21 TYR A CD1 7 21
ATOM 7134 C CD2 . TYR A 1 21 ? 0.179 -7.322 -5.070 1.00 0.00 ? 21 TYR A CD2 7 21
ATOM 7135 C CE1 . TYR A 1 21 ? 1.384 -8.128 -2.738 1.00 0.00 ? 21 TYR A CE1 7 21
ATOM 7136 C CE2 . TYR A 1 21 ? 1.252 -6.587 -4.558 1.00 0.00 ? 21 TYR A CE2 7 21
ATOM 7137 C CZ . TYR A 1 21 ? 1.854 -6.993 -3.376 1.00 0.00 ? 21 TYR A CZ 7 21
ATOM 7138 O OH . TYR A 1 21 ? 2.886 -6.254 -2.896 1.00 0.00 ? 21 TYR A OH 7 21
ATOM 7139 H H . TYR A 1 21 ? -1.258 -9.532 -7.092 1.00 0.00 ? 21 TYR A H 7 21
ATOM 7140 H HA . TYR A 1 21 ? -0.994 -10.913 -4.786 1.00 0.00 ? 21 TYR A HA 7 21
ATOM 7141 H HB2 . TYR A 1 21 ? -1.951 -8.319 -5.762 1.00 0.00 ? 21 TYR A HB2 7 21
ATOM 7142 H HB3 . TYR A 1 21 ? -2.385 -8.702 -4.137 1.00 0.00 ? 21 TYR A HB3 7 21
ATOM 7143 H HD1 . TYR A 1 21 ? -0.096 -9.613 -2.663 1.00 0.00 ? 21 TYR A HD1 7 21
ATOM 7144 H HD2 . TYR A 1 21 ? -0.326 -7.055 -5.957 1.00 0.00 ? 21 TYR A HD2 7 21
ATOM 7145 H HE1 . TYR A 1 21 ? 1.850 -8.440 -1.844 1.00 0.00 ? 21 TYR A HE1 7 21
ATOM 7146 H HE2 . TYR A 1 21 ? 1.613 -5.727 -5.050 1.00 0.00 ? 21 TYR A HE2 7 21
ATOM 7147 H HH . TYR A 1 21 ? 3.597 -6.380 -3.516 1.00 0.00 ? 21 TYR A HH 7 21
HETATM 7148 N N . NH2 A 1 22 ? -3.912 -11.061 -5.822 1.00 0.00 ? 22 NH2 A N 7 22
HETATM 7149 H HN1 . NH2 A 1 22 ? -4.780 -11.418 -5.614 1.00 0.00 ? 22 NH2 A HN1 7 22
HETATM 7150 H HN2 . NH2 A 1 22 ? -3.725 -10.741 -6.696 1.00 0.00 ? 22 NH2 A HN2 7 22
HETATM 7151 C C . ACE B 1 1 ? 1.717 -14.596 -1.372 1.00 0.00 ? 23 ACE B C 7 1
HETATM 7152 O O . ACE B 1 1 ? 1.270 -14.551 -0.268 1.00 0.00 ? 23 ACE B O 7 1
HETATM 7153 C CH3 . ACE B 1 1 ? 2.489 -15.727 -1.784 1.00 0.00 ? 23 ACE B CH3 7 1
HETATM 7154 H H1 . ACE B 1 1 ? 2.877 -15.943 -1.563 1.00 0.00 ? 23 ACE B H1 7 1
HETATM 7155 H H2 . ACE B 1 1 ? 2.383 -16.168 -1.816 1.00 0.00 ? 23 ACE B H2 7 1
HETATM 7156 H H3 . ACE B 1 1 ? 2.780 -15.833 -2.179 1.00 0.00 ? 23 ACE B H3 7 1
ATOM 7157 N N . ALA B 1 2 ? 1.557 -13.664 -2.188 1.00 0.00 ? 24 ALA B N 7 2
ATOM 7158 C CA . ALA B 1 2 ? 2.073 -13.539 -3.510 1.00 0.00 ? 24 ALA B CA 7 2
ATOM 7159 C C . ALA B 1 2 ? 3.475 -12.994 -3.538 1.00 0.00 ? 24 ALA B C 7 2
ATOM 7160 O O . ALA B 1 2 ? 3.859 -12.245 -2.683 1.00 0.00 ? 24 ALA B O 7 2
ATOM 7161 C CB . ALA B 1 2 ? 1.144 -12.631 -4.252 1.00 0.00 ? 24 ALA B CB 7 2
ATOM 7162 H H . ALA B 1 2 ? 1.070 -12.976 -1.782 1.00 0.00 ? 24 ALA B H 7 2
ATOM 7163 H HA . ALA B 1 2 ? 2.036 -14.494 -3.973 1.00 0.00 ? 24 ALA B HA 7 2
ATOM 7164 H HB1 . ALA B 1 2 ? 0.169 -13.072 -4.271 1.00 0.00 ? 24 ALA B HB1 7 2
ATOM 7165 H HB2 . ALA B 1 2 ? 1.080 -11.690 -3.764 1.00 0.00 ? 24 ALA B HB2 7 2
ATOM 7166 H HB3 . ALA B 1 2 ? 1.466 -12.510 -5.257 1.00 0.00 ? 24 ALA B HB3 7 2
ATOM 7167 N N . LYS B 1 3 ? 4.260 -13.322 -4.551 1.00 0.00 ? 25 LYS B N 7 3
ATOM 7168 C CA . LYS B 1 3 ? 5.600 -12.861 -4.740 1.00 0.00 ? 25 LYS B CA 7 3
ATOM 7169 C C . LYS B 1 3 ? 5.700 -11.383 -4.985 1.00 0.00 ? 25 LYS B C 7 3
ATOM 7170 O O . LYS B 1 3 ? 6.744 -10.806 -4.781 1.00 0.00 ? 25 LYS B O 7 3
ATOM 7171 C CB . LYS B 1 3 ? 6.244 -13.539 -5.918 1.00 0.00 ? 25 LYS B CB 7 3
ATOM 7172 C CG . LYS B 1 3 ? 6.377 -15.031 -5.772 1.00 0.00 ? 25 LYS B CG 7 3
ATOM 7173 C CD . LYS B 1 3 ? 7.233 -15.628 -6.855 1.00 0.00 ? 25 LYS B CD 7 3
ATOM 7174 C CE . LYS B 1 3 ? 6.619 -15.578 -8.225 1.00 0.00 ? 25 LYS B CE 7 3
ATOM 7175 N NZ . LYS B 1 3 ? 7.411 -16.181 -9.250 1.00 0.00 ? 25 LYS B NZ 7 3
ATOM 7176 H H . LYS B 1 3 ? 3.837 -13.844 -5.267 1.00 0.00 ? 25 LYS B H 7 3
ATOM 7177 H HA . LYS B 1 3 ? 6.190 -13.052 -3.866 1.00 0.00 ? 25 LYS B HA 7 3
ATOM 7178 H HB2 . LYS B 1 3 ? 5.677 -13.317 -6.822 1.00 0.00 ? 25 LYS B HB2 7 3
ATOM 7179 H HB3 . LYS B 1 3 ? 7.206 -13.103 -6.013 1.00 0.00 ? 25 LYS B HB3 7 3
ATOM 7180 H HG2 . LYS B 1 3 ? 6.818 -15.260 -4.802 1.00 0.00 ? 25 LYS B HG2 7 3
ATOM 7181 H HG3 . LYS B 1 3 ? 5.409 -15.474 -5.773 1.00 0.00 ? 25 LYS B HG3 7 3
ATOM 7182 H HD2 . LYS B 1 3 ? 8.194 -15.116 -6.877 1.00 0.00 ? 25 LYS B HD2 7 3
ATOM 7183 H HD3 . LYS B 1 3 ? 7.410 -16.646 -6.592 1.00 0.00 ? 25 LYS B HD3 7 3
ATOM 7184 H HE2 . LYS B 1 3 ? 5.651 -16.078 -8.194 1.00 0.00 ? 25 LYS B HE2 7 3
ATOM 7185 H HE3 . LYS B 1 3 ? 6.436 -14.581 -8.480 1.00 0.00 ? 25 LYS B HE3 7 3
ATOM 7186 H HZ1 . LYS B 1 3 ? 7.029 -16.144 -10.130 1.00 0.00 ? 25 LYS B HZ1 7 3
ATOM 7187 H HZ2 . LYS B 1 3 ? 8.252 -15.793 -9.308 1.00 0.00 ? 25 LYS B HZ2 7 3
ATOM 7188 H HZ3 . LYS B 1 3 ? 7.557 -17.084 -9.096 1.00 0.00 ? 25 LYS B HZ3 7 3
ATOM 7189 N N . ALA B 1 4 ? 4.619 -10.764 -5.440 1.00 0.00 ? 26 ALA B N 7 4
ATOM 7190 C CA . ALA B 1 4 ? 4.498 -9.355 -5.634 1.00 0.00 ? 26 ALA B CA 7 4
ATOM 7191 C C . ALA B 1 4 ? 4.745 -8.545 -4.378 1.00 0.00 ? 26 ALA B C 7 4
ATOM 7192 O O . ALA B 1 4 ? 4.829 -7.329 -4.424 1.00 0.00 ? 26 ALA B O 7 4
ATOM 7193 C CB . ALA B 1 4 ? 3.102 -9.121 -6.144 1.00 0.00 ? 26 ALA B CB 7 4
ATOM 7194 H H . ALA B 1 4 ? 3.853 -11.360 -5.641 1.00 0.00 ? 26 ALA B H 7 4
ATOM 7195 H HA . ALA B 1 4 ? 5.190 -9.042 -6.388 1.00 0.00 ? 26 ALA B HA 7 4
ATOM 7196 H HB1 . ALA B 1 4 ? 2.959 -9.691 -7.042 1.00 0.00 ? 26 ALA B HB1 7 4
ATOM 7197 H HB2 . ALA B 1 4 ? 2.403 -9.462 -5.410 1.00 0.00 ? 26 ALA B HB2 7 4
ATOM 7198 H HB3 . ALA B 1 4 ? 2.925 -8.083 -6.359 1.00 0.00 ? 26 ALA B HB3 7 4
ATOM 7199 N N . ALA B 1 5 ? 4.863 -9.205 -3.241 1.00 0.00 ? 27 ALA B N 7 5
ATOM 7200 C CA . ALA B 1 5 ? 4.955 -8.634 -1.919 1.00 0.00 ? 27 ALA B CA 7 5
ATOM 7201 C C . ALA B 1 5 ? 6.200 -7.781 -1.768 1.00 0.00 ? 27 ALA B C 7 5
ATOM 7202 O O . ALA B 1 5 ? 6.145 -6.577 -1.969 1.00 0.00 ? 27 ALA B O 7 5
ATOM 7203 C CB . ALA B 1 5 ? 4.722 -9.712 -0.878 1.00 0.00 ? 27 ALA B CB 7 5
ATOM 7204 H H . ALA B 1 5 ? 4.966 -10.186 -3.327 1.00 0.00 ? 27 ALA B H 7 5
ATOM 7205 H HA . ALA B 1 5 ? 4.151 -7.924 -1.790 1.00 0.00 ? 27 ALA B HA 7 5
ATOM 7206 H HB1 . ALA B 1 5 ? 3.741 -10.085 -0.995 1.00 0.00 ? 27 ALA B HB1 7 5
ATOM 7207 H HB2 . ALA B 1 5 ? 5.380 -10.545 -0.942 1.00 0.00 ? 27 ALA B HB2 7 5
ATOM 7208 H HB3 . ALA B 1 5 ? 4.776 -9.311 0.099 1.00 0.00 ? 27 ALA B HB3 7 5
ATOM 7209 N N . ALA B 1 6 ? 7.352 -8.357 -1.437 1.00 0.00 ? 28 ALA B N 7 6
ATOM 7210 C CA . ALA B 1 6 ? 8.517 -7.602 -1.060 1.00 0.00 ? 28 ALA B CA 7 6
ATOM 7211 C C . ALA B 1 6 ? 9.222 -6.908 -2.205 1.00 0.00 ? 28 ALA B C 7 6
ATOM 7212 O O . ALA B 1 6 ? 10.307 -6.386 -2.055 1.00 0.00 ? 28 ALA B O 7 6
ATOM 7213 C CB . ALA B 1 6 ? 9.431 -8.511 -0.258 1.00 0.00 ? 28 ALA B CB 7 6
ATOM 7214 H H . ALA B 1 6 ? 7.339 -9.349 -1.328 1.00 0.00 ? 28 ALA B H 7 6
ATOM 7215 H HA . ALA B 1 6 ? 8.154 -6.810 -0.415 1.00 0.00 ? 28 ALA B HA 7 6
ATOM 7216 H HB1 . ALA B 1 6 ? 9.855 -9.247 -0.914 1.00 0.00 ? 28 ALA B HB1 7 6
ATOM 7217 H HB2 . ALA B 1 6 ? 10.199 -7.948 0.233 1.00 0.00 ? 28 ALA B HB2 7 6
ATOM 7218 H HB3 . ALA B 1 6 ? 8.859 -8.983 0.512 1.00 0.00 ? 28 ALA B HB3 7 6
ATOM 7219 N N . ALA B 1 7 ? 8.602 -6.868 -3.375 1.00 0.00 ? 29 ALA B N 7 7
ATOM 7220 C CA . ALA B 1 7 ? 8.881 -5.999 -4.482 1.00 0.00 ? 29 ALA B CA 7 7
ATOM 7221 C C . ALA B 1 7 ? 8.126 -4.696 -4.343 1.00 0.00 ? 29 ALA B C 7 7
ATOM 7222 O O . ALA B 1 7 ? 8.725 -3.654 -4.267 1.00 0.00 ? 29 ALA B O 7 7
ATOM 7223 C CB . ALA B 1 7 ? 8.550 -6.725 -5.760 1.00 0.00 ? 29 ALA B CB 7 7
ATOM 7224 H H . ALA B 1 7 ? 7.710 -7.291 -3.354 1.00 0.00 ? 29 ALA B H 7 7
ATOM 7225 H HA . ALA B 1 7 ? 9.926 -5.755 -4.509 1.00 0.00 ? 29 ALA B HA 7 7
ATOM 7226 H HB1 . ALA B 1 7 ? 8.760 -6.106 -6.611 1.00 0.00 ? 29 ALA B HB1 7 7
ATOM 7227 H HB2 . ALA B 1 7 ? 9.110 -7.621 -5.844 1.00 0.00 ? 29 ALA B HB2 7 7
ATOM 7228 H HB3 . ALA B 1 7 ? 7.528 -6.991 -5.786 1.00 0.00 ? 29 ALA B HB3 7 7
ATOM 7229 N N . ALA B 1 8 ? 6.805 -4.718 -4.278 1.00 0.00 ? 30 ALA B N 7 8
ATOM 7230 C CA . ALA B 1 8 ? 5.958 -3.547 -4.337 1.00 0.00 ? 30 ALA B CA 7 8
ATOM 7231 C C . ALA B 1 8 ? 5.825 -2.898 -2.976 1.00 0.00 ? 30 ALA B C 7 8
ATOM 7232 O O . ALA B 1 8 ? 5.778 -1.684 -2.864 1.00 0.00 ? 30 ALA B O 7 8
ATOM 7233 C CB . ALA B 1 8 ? 4.609 -3.999 -4.852 1.00 0.00 ? 30 ALA B CB 7 8
ATOM 7234 H H . ALA B 1 8 ? 6.336 -5.598 -4.202 1.00 0.00 ? 30 ALA B H 7 8
ATOM 7235 H HA . ALA B 1 8 ? 6.381 -2.850 -5.049 1.00 0.00 ? 30 ALA B HA 7 8
ATOM 7236 H HB1 . ALA B 1 8 ? 4.098 -3.311 -5.050 1.00 0.00 ? 30 ALA B HB1 7 8
ATOM 7237 H HB2 . ALA B 1 8 ? 4.623 -4.495 -5.611 1.00 0.00 ? 30 ALA B HB2 7 8
ATOM 7238 H HB3 . ALA B 1 8 ? 4.130 -4.477 -4.259 1.00 0.00 ? 30 ALA B HB3 7 8
ATOM 7239 N N . ILE B 1 9 ? 5.799 -3.708 -1.928 1.00 0.00 ? 31 ILE B N 7 9
ATOM 7240 C CA . ILE B 1 9 ? 5.811 -3.265 -0.555 1.00 0.00 ? 31 ILE B CA 7 9
ATOM 7241 C C . ILE B 1 9 ? 7.096 -2.528 -0.238 1.00 0.00 ? 31 ILE B C 7 9
ATOM 7242 O O . ILE B 1 9 ? 7.074 -1.544 0.489 1.00 0.00 ? 31 ILE B O 7 9
ATOM 7243 C CB . ILE B 1 9 ? 5.634 -4.466 0.364 1.00 0.00 ? 31 ILE B CB 7 9
ATOM 7244 C CG1 . ILE B 1 9 ? 4.334 -5.222 0.159 1.00 0.00 ? 31 ILE B CG1 7 9
ATOM 7245 C CG2 . ILE B 1 9 ? 5.836 -4.110 1.829 1.00 0.00 ? 31 ILE B CG2 7 9
ATOM 7246 C CD1 . ILE B 1 9 ? 3.093 -4.388 0.368 1.00 0.00 ? 31 ILE B CD1 7 9
ATOM 7247 H H . ILE B 1 9 ? 5.804 -4.688 -2.108 1.00 0.00 ? 31 ILE B H 7 9
ATOM 7248 H HA . ILE B 1 9 ? 4.988 -2.577 -0.393 1.00 0.00 ? 31 ILE B HA 7 9
ATOM 7249 H HB . ILE B 1 9 ? 6.503 -5.079 0.151 1.00 0.00 ? 31 ILE B HB 7 9
ATOM 7250 H HG12 . ILE B 1 9 ? 4.318 -5.599 -0.864 1.00 0.00 ? 31 ILE B HG12 7 9
ATOM 7251 H HG13 . ILE B 1 9 ? 4.323 -6.096 0.774 1.00 0.00 ? 31 ILE B HG13 7 9
ATOM 7252 H HG21 . ILE B 1 9 ? 5.160 -3.347 2.146 1.00 0.00 ? 31 ILE B HG21 7 9
ATOM 7253 H HG22 . ILE B 1 9 ? 5.728 -5.002 2.388 1.00 0.00 ? 31 ILE B HG22 7 9
ATOM 7254 H HG23 . ILE B 1 9 ? 6.833 -3.758 1.943 1.00 0.00 ? 31 ILE B HG23 7 9
ATOM 7255 H HD11 . ILE B 1 9 ? 2.353 -4.904 0.279 1.00 0.00 ? 31 ILE B HD11 7 9
ATOM 7256 H HD12 . ILE B 1 9 ? 3.039 -4.038 1.164 1.00 0.00 ? 31 ILE B HD12 7 9
ATOM 7257 H HD13 . ILE B 1 9 ? 2.960 -3.718 -0.243 1.00 0.00 ? 31 ILE B HD13 7 9
ATOM 7258 N N . LYS B 1 10 ? 8.239 -2.976 -0.747 1.00 0.00 ? 32 LYS B N 7 10
ATOM 7259 C CA . LYS B 1 10 ? 9.470 -2.233 -0.622 1.00 0.00 ? 32 LYS B CA 7 10
ATOM 7260 C C . LYS B 1 10 ? 9.384 -0.873 -1.285 1.00 0.00 ? 32 LYS B C 7 10
ATOM 7261 O O . LYS B 1 10 ? 9.664 0.131 -0.652 1.00 0.00 ? 32 LYS B O 7 10
ATOM 7262 C CB . LYS B 1 10 ? 10.578 -3.123 -1.153 1.00 0.00 ? 32 LYS B CB 7 10
ATOM 7263 C CG . LYS B 1 10 ? 11.099 -4.082 -0.113 1.00 0.00 ? 32 LYS B CG 7 10
ATOM 7264 C CD . LYS B 1 10 ? 11.779 -3.458 1.014 1.00 0.00 ? 32 LYS B CD 7 10
ATOM 7265 C CE . LYS B 1 10 ? 12.493 -4.475 1.825 1.00 0.00 ? 32 LYS B CE 7 10
ATOM 7266 N NZ . LYS B 1 10 ? 13.147 -3.896 2.869 1.00 0.00 ? 32 LYS B NZ 7 10
ATOM 7267 H H . LYS B 1 10 ? 8.208 -3.783 -1.324 1.00 0.00 ? 32 LYS B H 7 10
ATOM 7268 H HA . LYS B 1 10 ? 9.636 -2.025 0.428 1.00 0.00 ? 32 LYS B HA 7 10
ATOM 7269 H HB2 . LYS B 1 10 ? 10.200 -3.690 -2.004 1.00 0.00 ? 32 LYS B HB2 7 10
ATOM 7270 H HB3 . LYS B 1 10 ? 11.394 -2.540 -1.518 1.00 0.00 ? 32 LYS B HB3 7 10
ATOM 7271 H HG2 . LYS B 1 10 ? 10.273 -4.688 0.259 1.00 0.00 ? 32 LYS B HG2 7 10
ATOM 7272 H HG3 . LYS B 1 10 ? 11.799 -4.728 -0.582 1.00 0.00 ? 32 LYS B HG3 7 10
ATOM 7273 H HD2 . LYS B 1 10 ? 12.498 -2.727 0.645 1.00 0.00 ? 32 LYS B HD2 7 10
ATOM 7274 H HD3 . LYS B 1 10 ? 11.096 -2.922 1.576 1.00 0.00 ? 32 LYS B HD3 7 10
ATOM 7275 H HE2 . LYS B 1 10 ? 11.781 -5.210 2.200 1.00 0.00 ? 32 LYS B HE2 7 10
ATOM 7276 H HE3 . LYS B 1 10 ? 13.166 -4.984 1.239 1.00 0.00 ? 32 LYS B HE3 7 10
ATOM 7277 H HZ1 . LYS B 1 10 ? 13.702 -4.489 3.360 1.00 0.00 ? 32 LYS B HZ1 7 10
ATOM 7278 H HZ2 . LYS B 1 10 ? 13.706 -3.220 2.592 1.00 0.00 ? 32 LYS B HZ2 7 10
ATOM 7279 H HZ3 . LYS B 1 10 ? 12.536 -3.523 3.438 1.00 0.00 ? 32 LYS B HZ3 7 10
ATOM 7280 N N . ALA B 1 11 ? 8.843 -0.821 -2.496 1.00 0.00 ? 33 ALA B N 7 11
ATOM 7281 C CA . ALA B 1 11 ? 8.425 0.363 -3.209 1.00 0.00 ? 33 ALA B CA 7 11
ATOM 7282 C C . ALA B 1 11 ? 7.222 1.097 -2.643 1.00 0.00 ? 33 ALA B C 7 11
ATOM 7283 O O . ALA B 1 11 ? 6.669 1.982 -3.283 1.00 0.00 ? 33 ALA B O 7 11
ATOM 7284 C CB . ALA B 1 11 ? 8.233 -0.040 -4.658 1.00 0.00 ? 33 ALA B CB 7 11
ATOM 7285 H H . ALA B 1 11 ? 8.697 -1.692 -2.956 1.00 0.00 ? 33 ALA B H 7 11
ATOM 7286 H HA . ALA B 1 11 ? 9.247 1.065 -3.163 1.00 0.00 ? 33 ALA B HA 7 11
ATOM 7287 H HB1 . ALA B 1 11 ? 8.137 0.820 -5.282 1.00 0.00 ? 33 ALA B HB1 7 11
ATOM 7288 H HB2 . ALA B 1 11 ? 9.095 -0.572 -5.008 1.00 0.00 ? 33 ALA B HB2 7 11
ATOM 7289 H HB3 . ALA B 1 11 ? 7.382 -0.664 -4.793 1.00 0.00 ? 33 ALA B HB3 7 11
ATOM 7290 N N . ILE B 1 12 ? 6.818 0.777 -1.420 1.00 0.00 ? 34 ILE B N 7 12
ATOM 7291 C CA . ILE B 1 12 ? 5.850 1.443 -0.578 1.00 0.00 ? 34 ILE B CA 7 12
ATOM 7292 C C . ILE B 1 12 ? 6.519 1.839 0.726 1.00 0.00 ? 34 ILE B C 7 12
ATOM 7293 O O . ILE B 1 12 ? 6.619 3.017 1.006 1.00 0.00 ? 34 ILE B O 7 12
ATOM 7294 C CB . ILE B 1 12 ? 4.550 0.658 -0.490 1.00 0.00 ? 34 ILE B CB 7 12
ATOM 7295 C CG1 . ILE B 1 12 ? 3.627 1.021 -1.606 1.00 0.00 ? 34 ILE B CG1 7 12
ATOM 7296 C CG2 . ILE B 1 12 ? 3.821 0.699 0.807 1.00 0.00 ? 34 ILE B CG2 7 12
ATOM 7297 C CD1 . ILE B 1 12 ? 2.861 2.247 -1.444 1.00 0.00 ? 34 ILE B CD1 7 12
ATOM 7298 H H . ILE B 1 12 ? 7.322 0.019 -1.006 1.00 0.00 ? 34 ILE B H 7 12
ATOM 7299 H HA . ILE B 1 12 ? 5.665 2.433 -0.977 1.00 0.00 ? 34 ILE B HA 7 12
ATOM 7300 H HB . ILE B 1 12 ? 4.767 -0.365 -0.661 1.00 0.00 ? 34 ILE B HB 7 12
ATOM 7301 H HG12 . ILE B 1 12 ? 4.220 1.103 -2.517 1.00 0.00 ? 34 ILE B HG12 7 12
ATOM 7302 H HG13 . ILE B 1 12 ? 2.915 0.256 -1.772 1.00 0.00 ? 34 ILE B HG13 7 12
ATOM 7303 H HG21 . ILE B 1 12 ? 3.650 1.681 1.106 1.00 0.00 ? 34 ILE B HG21 7 12
ATOM 7304 H HG22 . ILE B 1 12 ? 2.904 0.150 0.686 1.00 0.00 ? 34 ILE B HG22 7 12
ATOM 7305 H HG23 . ILE B 1 12 ? 4.412 0.272 1.553 1.00 0.00 ? 34 ILE B HG23 7 12
ATOM 7306 H HD11 . ILE B 1 12 ? 2.189 2.128 -0.671 1.00 0.00 ? 34 ILE B HD11 7 12
ATOM 7307 H HD12 . ILE B 1 12 ? 3.501 3.032 -1.324 1.00 0.00 ? 34 ILE B HD12 7 12
ATOM 7308 H HD13 . ILE B 1 12 ? 2.301 2.434 -2.300 1.00 0.00 ? 34 ILE B HD13 7 12
ATOM 7309 N N . ALA B 1 13 ? 7.060 0.949 1.547 1.00 0.00 ? 35 ALA B N 7 13
ATOM 7310 C CA . ALA B 1 13 ? 7.594 1.316 2.836 1.00 0.00 ? 35 ALA B CA 7 13
ATOM 7311 C C . ALA B 1 13 ? 8.782 2.260 2.797 1.00 0.00 ? 35 ALA B C 7 13
ATOM 7312 O O . ALA B 1 13 ? 8.999 3.039 3.706 1.00 0.00 ? 35 ALA B O 7 13
ATOM 7313 C CB . ALA B 1 13 ? 7.939 0.060 3.615 1.00 0.00 ? 35 ALA B CB 7 13
ATOM 7314 H H . ALA B 1 13 ? 7.040 -0.018 1.275 1.00 0.00 ? 35 ALA B H 7 13
ATOM 7315 H HA . ALA B 1 13 ? 6.798 1.845 3.335 1.00 0.00 ? 35 ALA B HA 7 13
ATOM 7316 H HB1 . ALA B 1 13 ? 8.200 0.320 4.626 1.00 0.00 ? 35 ALA B HB1 7 13
ATOM 7317 H HB2 . ALA B 1 13 ? 7.065 -0.562 3.648 1.00 0.00 ? 35 ALA B HB2 7 13
ATOM 7318 H HB3 . ALA B 1 13 ? 8.744 -0.496 3.167 1.00 0.00 ? 35 ALA B HB3 7 13
ATOM 7319 N N . ALA B 1 14 ? 9.505 2.263 1.684 1.00 0.00 ? 36 ALA B N 7 14
ATOM 7320 C CA . ALA B 1 14 ? 10.575 3.184 1.387 1.00 0.00 ? 36 ALA B CA 7 14
ATOM 7321 C C . ALA B 1 14 ? 10.104 4.484 0.764 1.00 0.00 ? 36 ALA B C 7 14
ATOM 7322 O O . ALA B 1 14 ? 10.563 5.560 1.106 1.00 0.00 ? 36 ALA B O 7 14
ATOM 7323 C CB . ALA B 1 14 ? 11.605 2.465 0.542 1.00 0.00 ? 36 ALA B CB 7 14
ATOM 7324 H H . ALA B 1 14 ? 9.137 1.681 0.962 1.00 0.00 ? 36 ALA B H 7 14
ATOM 7325 H HA . ALA B 1 14 ? 11.080 3.435 2.306 1.00 0.00 ? 36 ALA B HA 7 14
ATOM 7326 H HB1 . ALA B 1 14 ? 12.440 3.140 0.466 1.00 0.00 ? 36 ALA B HB1 7 14
ATOM 7327 H HB2 . ALA B 1 14 ? 11.920 1.555 1.013 1.00 0.00 ? 36 ALA B HB2 7 14
ATOM 7328 H HB3 . ALA B 1 14 ? 11.229 2.276 -0.447 1.00 0.00 ? 36 ALA B HB3 7 14
ATOM 7329 N N . ILE B 1 15 ? 9.086 4.391 -0.079 1.00 0.00 ? 37 ILE B N 7 15
ATOM 7330 C CA . ILE B 1 15 ? 8.319 5.476 -0.650 1.00 0.00 ? 37 ILE B CA 7 15
ATOM 7331 C C . ILE B 1 15 ? 7.616 6.289 0.423 1.00 0.00 ? 37 ILE B C 7 15
ATOM 7332 O O . ILE B 1 15 ? 7.428 7.493 0.308 1.00 0.00 ? 37 ILE B O 7 15
ATOM 7333 C CB . ILE B 1 15 ? 7.383 4.862 -1.679 1.00 0.00 ? 37 ILE B CB 7 15
ATOM 7334 C CG1 . ILE B 1 15 ? 7.828 5.128 -3.111 1.00 0.00 ? 37 ILE B CG1 7 15
ATOM 7335 C CG2 . ILE B 1 15 ? 5.920 5.251 -1.542 1.00 0.00 ? 37 ILE B CG2 7 15
ATOM 7336 C CD1 . ILE B 1 15 ? 9.137 4.449 -3.491 1.00 0.00 ? 37 ILE B CD1 7 15
ATOM 7337 H H . ILE B 1 15 ? 8.704 3.476 -0.223 1.00 0.00 ? 37 ILE B H 7 15
ATOM 7338 H HA . ILE B 1 15 ? 9.002 6.167 -1.136 1.00 0.00 ? 37 ILE B HA 7 15
ATOM 7339 H HB . ILE B 1 15 ? 7.413 3.784 -1.563 1.00 0.00 ? 37 ILE B HB 7 15
ATOM 7340 H HG12 . ILE B 1 15 ? 7.046 4.799 -3.796 1.00 0.00 ? 37 ILE B HG12 7 15
ATOM 7341 H HG13 . ILE B 1 15 ? 7.932 6.200 -3.222 1.00 0.00 ? 37 ILE B HG13 7 15
ATOM 7342 H HG21 . ILE B 1 15 ? 5.545 4.976 -0.572 1.00 0.00 ? 37 ILE B HG21 7 15
ATOM 7343 H HG22 . ILE B 1 15 ? 5.767 6.304 -1.701 1.00 0.00 ? 37 ILE B HG22 7 15
ATOM 7344 H HG23 . ILE B 1 15 ? 5.358 4.680 -2.257 1.00 0.00 ? 37 ILE B HG23 7 15
ATOM 7345 H HD11 . ILE B 1 15 ? 9.340 4.696 -4.508 1.00 0.00 ? 37 ILE B HD11 7 15
ATOM 7346 H HD12 . ILE B 1 15 ? 9.966 4.757 -2.903 1.00 0.00 ? 37 ILE B HD12 7 15
ATOM 7347 H HD13 . ILE B 1 15 ? 9.017 3.395 -3.432 1.00 0.00 ? 37 ILE B HD13 7 15
ATOM 7348 N N . ILE B 1 16 ? 7.146 5.632 1.479 1.00 0.00 ? 38 ILE B N 7 16
ATOM 7349 C CA . ILE B 1 16 ? 6.547 6.274 2.626 1.00 0.00 ? 38 ILE B CA 7 16
ATOM 7350 C C . ILE B 1 16 ? 7.581 7.078 3.393 1.00 0.00 ? 38 ILE B C 7 16
ATOM 7351 O O . ILE B 1 16 ? 7.382 8.261 3.618 1.00 0.00 ? 38 ILE B O 7 16
ATOM 7352 C CB . ILE B 1 16 ? 5.800 5.242 3.459 1.00 0.00 ? 38 ILE B CB 7 16
ATOM 7353 C CG1 . ILE B 1 16 ? 4.581 4.822 2.662 1.00 0.00 ? 38 ILE B CG1 7 16
ATOM 7354 C CG2 . ILE B 1 16 ? 5.365 5.844 4.787 1.00 0.00 ? 38 ILE B CG2 7 16
ATOM 7355 C CD1 . ILE B 1 16 ? 3.657 3.784 3.266 1.00 0.00 ? 38 ILE B CD1 7 16
ATOM 7356 H H . ILE B 1 16 ? 7.071 4.636 1.397 1.00 0.00 ? 38 ILE B H 7 16
ATOM 7357 H HA . ILE B 1 16 ? 5.813 6.991 2.276 1.00 0.00 ? 38 ILE B HA 7 16
ATOM 7358 H HB . ILE B 1 16 ? 6.461 4.397 3.633 1.00 0.00 ? 38 ILE B HB 7 16
ATOM 7359 H HG12 . ILE B 1 16 ? 3.993 5.717 2.461 1.00 0.00 ? 38 ILE B HG12 7 16
ATOM 7360 H HG13 . ILE B 1 16 ? 4.905 4.438 1.706 1.00 0.00 ? 38 ILE B HG13 7 16
ATOM 7361 H HG21 . ILE B 1 16 ? 4.860 5.080 5.355 1.00 0.00 ? 38 ILE B HG21 7 16
ATOM 7362 H HG22 . ILE B 1 16 ? 6.189 6.190 5.386 1.00 0.00 ? 38 ILE B HG22 7 16
ATOM 7363 H HG23 . ILE B 1 16 ? 4.671 6.657 4.630 1.00 0.00 ? 38 ILE B HG23 7 16
ATOM 7364 H HD11 . ILE B 1 16 ? 2.978 3.469 2.550 1.00 0.00 ? 38 ILE B HD11 7 16
ATOM 7365 H HD12 . ILE B 1 16 ? 4.201 2.994 3.605 1.00 0.00 ? 38 ILE B HD12 7 16
ATOM 7366 H HD13 . ILE B 1 16 ? 3.069 4.204 4.014 1.00 0.00 ? 38 ILE B HD13 7 16
ATOM 7367 N N . LYS B 1 17 ? 8.735 6.499 3.703 1.00 0.00 ? 39 LYS B N 7 17
ATOM 7368 C CA . LYS B 1 17 ? 9.836 7.180 4.339 1.00 0.00 ? 39 LYS B CA 7 17
ATOM 7369 C C . LYS B 1 17 ? 10.238 8.438 3.592 1.00 0.00 ? 39 LYS B C 7 17
ATOM 7370 O O . LYS B 1 17 ? 10.445 9.454 4.216 1.00 0.00 ? 39 LYS B O 7 17
ATOM 7371 C CB . LYS B 1 17 ? 10.985 6.205 4.513 1.00 0.00 ? 39 LYS B CB 7 17
ATOM 7372 C CG . LYS B 1 17 ? 12.176 6.707 5.300 1.00 0.00 ? 39 LYS B CG 7 17
ATOM 7373 C CD . LYS B 1 17 ? 12.003 6.886 6.777 1.00 0.00 ? 39 LYS B CD 7 17
ATOM 7374 C CE . LYS B 1 17 ? 11.947 5.568 7.427 1.00 0.00 ? 39 LYS B CE 7 17
ATOM 7375 N NZ . LYS B 1 17 ? 11.940 5.696 8.826 1.00 0.00 ? 39 LYS B NZ 7 17
ATOM 7376 H H . LYS B 1 17 ? 8.799 5.521 3.493 1.00 0.00 ? 39 LYS B H 7 17
ATOM 7377 H HA . LYS B 1 17 ? 9.501 7.479 5.320 1.00 0.00 ? 39 LYS B HA 7 17
ATOM 7378 H HB2 . LYS B 1 17 ? 10.606 5.305 4.997 1.00 0.00 ? 39 LYS B HB2 7 17
ATOM 7379 H HB3 . LYS B 1 17 ? 11.329 5.927 3.532 1.00 0.00 ? 39 LYS B HB3 7 17
ATOM 7380 H HG2 . LYS B 1 17 ? 12.992 6.000 5.150 1.00 0.00 ? 39 LYS B HG2 7 17
ATOM 7381 H HG3 . LYS B 1 17 ? 12.504 7.625 4.864 1.00 0.00 ? 39 LYS B HG3 7 17
ATOM 7382 H HD2 . LYS B 1 17 ? 12.844 7.453 7.178 1.00 0.00 ? 39 LYS B HD2 7 17
ATOM 7383 H HD3 . LYS B 1 17 ? 11.156 7.460 6.982 1.00 0.00 ? 39 LYS B HD3 7 17
ATOM 7384 H HE2 . LYS B 1 17 ? 11.055 5.032 7.103 1.00 0.00 ? 39 LYS B HE2 7 17
ATOM 7385 H HE3 . LYS B 1 17 ? 12.753 5.025 7.121 1.00 0.00 ? 39 LYS B HE3 7 17
ATOM 7386 H HZ1 . LYS B 1 17 ? 11.675 6.093 9.252 1.00 0.00 ? 39 LYS B HZ1 7 17
ATOM 7387 H HZ2 . LYS B 1 17 ? 11.752 5.305 9.176 1.00 0.00 ? 39 LYS B HZ2 7 17
ATOM 7388 H HZ3 . LYS B 1 17 ? 12.417 5.734 9.109 1.00 0.00 ? 39 LYS B HZ3 7 17
ATOM 7389 N N . ALA B 1 18 ? 10.333 8.363 2.278 1.00 0.00 ? 40 ALA B N 7 18
ATOM 7390 C CA . ALA B 1 18 ? 10.734 9.442 1.413 1.00 0.00 ? 40 ALA B CA 7 18
ATOM 7391 C C . ALA B 1 18 ? 9.633 10.408 1.058 1.00 0.00 ? 40 ALA B C 7 18
ATOM 7392 O O . ALA B 1 18 ? 9.905 11.559 0.852 1.00 0.00 ? 40 ALA B O 7 18
ATOM 7393 C CB . ALA B 1 18 ? 11.362 8.838 0.197 1.00 0.00 ? 40 ALA B CB 7 18
ATOM 7394 H H . ALA B 1 18 ? 10.102 7.466 1.892 1.00 0.00 ? 40 ALA B H 7 18
ATOM 7395 H HA . ALA B 1 18 ? 11.510 9.984 1.926 1.00 0.00 ? 40 ALA B HA 7 18
ATOM 7396 H HB1 . ALA B 1 18 ? 11.521 8.247 0.048 1.00 0.00 ? 40 ALA B HB1 7 18
ATOM 7397 H HB2 . ALA B 1 18 ? 11.146 8.882 -0.322 1.00 0.00 ? 40 ALA B HB2 7 18
ATOM 7398 H HB3 . ALA B 1 18 ? 11.839 8.995 0.027 1.00 0.00 ? 40 ALA B HB3 7 18
ATOM 7399 N N . GLY B 1 19 ? 8.394 9.961 0.979 1.00 0.00 ? 41 GLY B N 7 19
ATOM 7400 C CA . GLY B 1 19 ? 7.212 10.682 0.612 1.00 0.00 ? 41 GLY B CA 7 19
ATOM 7401 C C . GLY B 1 19 ? 6.738 11.645 1.665 1.00 0.00 ? 41 GLY B C 7 19
ATOM 7402 O O . GLY B 1 19 ? 6.226 12.694 1.333 1.00 0.00 ? 41 GLY B O 7 19
ATOM 7403 H H . GLY B 1 19 ? 8.262 8.994 1.123 1.00 0.00 ? 41 GLY B H 7 19
ATOM 7404 H HA2 . GLY B 1 19 ? 7.373 11.218 -0.292 1.00 0.00 ? 41 GLY B HA2 7 19
ATOM 7405 H HA3 . GLY B 1 19 ? 6.424 9.981 0.438 1.00 0.00 ? 41 GLY B HA3 7 19
ATOM 7406 N N . GLY B 1 20 ? 6.891 11.287 2.926 1.00 0.00 ? 42 GLY B N 7 20
ATOM 7407 C CA . GLY B 1 20 ? 6.433 12.073 4.039 1.00 0.00 ? 42 GLY B CA 7 20
ATOM 7408 C C . GLY B 1 20 ? 4.925 12.069 4.178 1.00 0.00 ? 42 GLY B C 7 20
ATOM 7409 O O . GLY B 1 20 ? 4.343 13.107 4.424 1.00 0.00 ? 42 GLY B O 7 20
ATOM 7410 H H . GLY B 1 20 ? 7.367 10.437 3.115 1.00 0.00 ? 42 GLY B H 7 20
ATOM 7411 H HA2 . GLY B 1 20 ? 6.847 11.688 4.954 1.00 0.00 ? 42 GLY B HA2 7 20
ATOM 7412 H HA3 . GLY B 1 20 ? 6.760 13.085 3.906 1.00 0.00 ? 42 GLY B HA3 7 20
ATOM 7413 N N . TYR B 1 21 ? 4.296 10.919 3.982 1.00 0.00 ? 43 TYR B N 7 21
ATOM 7414 C CA . TYR B 1 21 ? 2.878 10.709 3.930 1.00 0.00 ? 43 TYR B CA 7 21
ATOM 7415 C C . TYR B 1 21 ? 2.107 11.142 5.151 1.00 0.00 ? 43 TYR B C 7 21
ATOM 7416 O O . TYR B 1 21 ? 0.991 11.492 5.058 1.00 0.00 ? 43 TYR B O 7 21
ATOM 7417 C CB . TYR B 1 21 ? 2.642 9.234 3.654 1.00 0.00 ? 43 TYR B CB 7 21
ATOM 7418 C CG . TYR B 1 21 ? 2.361 8.815 2.235 1.00 0.00 ? 43 TYR B CG 7 21
ATOM 7419 C CD1 . TYR B 1 21 ? 1.136 9.007 1.603 1.00 0.00 ? 43 TYR B CD1 7 21
ATOM 7420 C CD2 . TYR B 1 21 ? 3.333 8.070 1.578 1.00 0.00 ? 43 TYR B CD2 7 21
ATOM 7421 C CE1 . TYR B 1 21 ? 0.885 8.397 0.370 1.00 0.00 ? 43 TYR B CE1 7 21
ATOM 7422 C CE2 . TYR B 1 21 ? 3.091 7.408 0.374 1.00 0.00 ? 43 TYR B CE2 7 21
ATOM 7423 C CZ . TYR B 1 21 ? 1.857 7.597 -0.246 1.00 0.00 ? 43 TYR B CZ 7 21
ATOM 7424 O OH . TYR B 1 21 ? 1.609 6.999 -1.437 1.00 0.00 ? 43 TYR B OH 7 21
ATOM 7425 H H . TYR B 1 21 ? 4.901 10.138 3.841 1.00 0.00 ? 43 TYR B H 7 21
ATOM 7426 H HA . TYR B 1 21 ? 2.521 11.246 3.066 1.00 0.00 ? 43 TYR B HA 7 21
ATOM 7427 H HB2 . TYR B 1 21 ? 3.523 8.690 3.995 1.00 0.00 ? 43 TYR B HB2 7 21
ATOM 7428 H HB3 . TYR B 1 21 ? 1.814 8.886 4.250 1.00 0.00 ? 43 TYR B HB3 7 21
ATOM 7429 H HD1 . TYR B 1 21 ? 0.357 9.593 2.036 1.00 0.00 ? 43 TYR B HD1 7 21
ATOM 7430 H HD2 . TYR B 1 21 ? 4.268 7.945 2.083 1.00 0.00 ? 43 TYR B HD2 7 21
ATOM 7431 H HE1 . TYR B 1 21 ? -0.082 8.519 -0.071 1.00 0.00 ? 43 TYR B HE1 7 21
ATOM 7432 H HE2 . TYR B 1 21 ? 3.852 6.749 0.002 1.00 0.00 ? 43 TYR B HE2 7 21
ATOM 7433 H HH . TYR B 1 21 ? 2.043 7.508 -2.103 1.00 0.00 ? 43 TYR B HH 7 21
HETATM 7434 N N . NH2 B 1 22 ? 2.648 11.167 6.295 1.00 0.00 ? 44 NH2 B N 7 22
HETATM 7435 H HN1 . NH2 B 1 22 ? 2.160 11.506 7.086 1.00 0.00 ? 44 NH2 B HN1 7 22
HETATM 7436 H HN2 . NH2 B 1 22 ? 3.530 10.855 6.350 1.00 0.00 ? 44 NH2 B HN2 7 22
HETATM 7437 C C . ACE C 1 1 ? -4.640 13.883 -1.110 1.00 0.00 ? 45 ACE C C 7 1
HETATM 7438 O O . ACE C 1 1 ? -4.470 14.844 -0.454 1.00 0.00 ? 45 ACE C O 7 1
HETATM 7439 C CH3 . ACE C 1 1 ? -3.485 13.025 -1.525 1.00 0.00 ? 45 ACE C CH3 7 1
HETATM 7440 H H1 . ACE C 1 1 ? -3.056 13.258 -1.943 1.00 0.00 ? 45 ACE C H1 7 1
HETATM 7441 H H2 . ACE C 1 1 ? -3.050 12.813 -1.089 1.00 0.00 ? 45 ACE C H2 7 1
HETATM 7442 H H3 . ACE C 1 1 ? -3.570 12.429 -1.811 1.00 0.00 ? 45 ACE C H3 7 1
ATOM 7443 N N . ALA C 1 2 ? -5.814 13.542 -1.484 1.00 0.00 ? 46 ALA C N 7 2
ATOM 7444 C CA . ALA C 1 2 ? -7.031 14.237 -1.185 1.00 0.00 ? 46 ALA C CA 7 2
ATOM 7445 C C . ALA C 1 2 ? -7.831 13.627 -0.062 1.00 0.00 ? 46 ALA C C 7 2
ATOM 7446 O O . ALA C 1 2 ? -8.378 14.323 0.770 1.00 0.00 ? 46 ALA C O 7 2
ATOM 7447 C CB . ALA C 1 2 ? -7.844 14.324 -2.450 1.00 0.00 ? 46 ALA C CB 7 2
ATOM 7448 H H . ALA C 1 2 ? -5.866 12.695 -1.986 1.00 0.00 ? 46 ALA C H 7 2
ATOM 7449 H HA . ALA C 1 2 ? -6.821 15.249 -0.902 1.00 0.00 ? 46 ALA C HA 7 2
ATOM 7450 H HB1 . ALA C 1 2 ? -7.302 14.766 -3.255 1.00 0.00 ? 46 ALA C HB1 7 2
ATOM 7451 H HB2 . ALA C 1 2 ? -8.156 13.337 -2.719 1.00 0.00 ? 46 ALA C HB2 7 2
ATOM 7452 H HB3 . ALA C 1 2 ? -8.709 14.911 -2.278 1.00 0.00 ? 46 ALA C HB3 7 2
ATOM 7453 N N . LYS C 1 3 ? -7.983 12.314 -0.052 1.00 0.00 ? 47 LYS C N 7 3
ATOM 7454 C CA . LYS C 1 3 ? -8.894 11.624 0.815 1.00 0.00 ? 47 LYS C CA 7 3
ATOM 7455 C C . LYS C 1 3 ? -8.485 10.224 1.237 1.00 0.00 ? 47 LYS C C 7 3
ATOM 7456 O O . LYS C 1 3 ? -8.419 9.902 2.414 1.00 0.00 ? 47 LYS C O 7 3
ATOM 7457 C CB . LYS C 1 3 ? -10.232 11.647 0.112 1.00 0.00 ? 47 LYS C CB 7 3
ATOM 7458 C CG . LYS C 1 3 ? -11.391 11.171 0.939 1.00 0.00 ? 47 LYS C CG 7 3
ATOM 7459 C CD . LYS C 1 3 ? -11.752 12.038 2.075 1.00 0.00 ? 47 LYS C CD 7 3
ATOM 7460 C CE . LYS C 1 3 ? -12.250 13.313 1.638 1.00 0.00 ? 47 LYS C CE 7 3
ATOM 7461 N NZ . LYS C 1 3 ? -12.658 14.087 2.719 1.00 0.00 ? 47 LYS C NZ 7 3
ATOM 7462 H H . LYS C 1 3 ? -7.548 11.802 -0.790 1.00 0.00 ? 47 LYS C H 7 3
ATOM 7463 H HA . LYS C 1 3 ? -8.991 12.174 1.738 1.00 0.00 ? 47 LYS C HA 7 3
ATOM 7464 H HB2 . LYS C 1 3 ? -10.436 12.654 -0.253 1.00 0.00 ? 47 LYS C HB2 7 3
ATOM 7465 H HB3 . LYS C 1 3 ? -10.137 10.976 -0.727 1.00 0.00 ? 47 LYS C HB3 7 3
ATOM 7466 H HG2 . LYS C 1 3 ? -12.257 11.079 0.285 1.00 0.00 ? 47 LYS C HG2 7 3
ATOM 7467 H HG3 . LYS C 1 3 ? -11.216 10.216 1.327 1.00 0.00 ? 47 LYS C HG3 7 3
ATOM 7468 H HD2 . LYS C 1 3 ? -12.491 11.544 2.705 1.00 0.00 ? 47 LYS C HD2 7 3
ATOM 7469 H HD3 . LYS C 1 3 ? -10.896 12.192 2.628 1.00 0.00 ? 47 LYS C HD3 7 3
ATOM 7470 H HE2 . LYS C 1 3 ? -11.489 13.836 1.060 1.00 0.00 ? 47 LYS C HE2 7 3
ATOM 7471 H HE3 . LYS C 1 3 ? -13.057 13.169 1.054 1.00 0.00 ? 47 LYS C HE3 7 3
ATOM 7472 H HZ1 . LYS C 1 3 ? -11.989 14.227 3.299 1.00 0.00 ? 47 LYS C HZ1 7 3
ATOM 7473 H HZ2 . LYS C 1 3 ? -12.968 14.906 2.486 1.00 0.00 ? 47 LYS C HZ2 7 3
ATOM 7474 H HZ3 . LYS C 1 3 ? -13.371 13.709 3.229 1.00 0.00 ? 47 LYS C HZ3 7 3
ATOM 7475 N N . ALA C 1 4 ? -8.327 9.365 0.234 1.00 0.00 ? 48 ALA C N 7 4
ATOM 7476 C CA . ALA C 1 4 ? -8.031 7.967 0.383 1.00 0.00 ? 48 ALA C CA 7 4
ATOM 7477 C C . ALA C 1 4 ? -6.655 7.772 0.996 1.00 0.00 ? 48 ALA C C 7 4
ATOM 7478 O O . ALA C 1 4 ? -6.366 6.735 1.575 1.00 0.00 ? 48 ALA C O 7 4
ATOM 7479 C CB . ALA C 1 4 ? -8.098 7.317 -0.982 1.00 0.00 ? 48 ALA C CB 7 4
ATOM 7480 H H . ALA C 1 4 ? -8.442 9.720 -0.679 1.00 0.00 ? 48 ALA C H 7 4
ATOM 7481 H HA . ALA C 1 4 ? -8.753 7.524 1.044 1.00 0.00 ? 48 ALA C HA 7 4
ATOM 7482 H HB1 . ALA C 1 4 ? -8.032 6.257 -0.901 1.00 0.00 ? 48 ALA C HB1 7 4
ATOM 7483 H HB2 . ALA C 1 4 ? -8.985 7.607 -1.502 1.00 0.00 ? 48 ALA C HB2 7 4
ATOM 7484 H HB3 . ALA C 1 4 ? -7.298 7.641 -1.608 1.00 0.00 ? 48 ALA C HB3 7 4
ATOM 7485 N N . ALA C 1 5 ? -5.823 8.803 0.914 1.00 0.00 ? 49 ALA C N 7 5
ATOM 7486 C CA . ALA C 1 5 ? -4.432 8.785 1.304 1.00 0.00 ? 49 ALA C CA 7 5
ATOM 7487 C C . ALA C 1 5 ? -4.279 8.567 2.799 1.00 0.00 ? 49 ALA C C 7 5
ATOM 7488 O O . ALA C 1 5 ? -4.136 7.450 3.262 1.00 0.00 ? 49 ALA C O 7 5
ATOM 7489 C CB . ALA C 1 5 ? -3.737 10.005 0.717 1.00 0.00 ? 49 ALA C CB 7 5
ATOM 7490 H H . ALA C 1 5 ? -6.219 9.606 0.468 1.00 0.00 ? 49 ALA C H 7 5
ATOM 7491 H HA . ALA C 1 5 ? -3.945 7.921 0.868 1.00 0.00 ? 49 ALA C HA 7 5
ATOM 7492 H HB1 . ALA C 1 5 ? -4.145 10.915 1.087 1.00 0.00 ? 49 ALA C HB1 7 5
ATOM 7493 H HB2 . ALA C 1 5 ? -2.692 9.937 0.927 1.00 0.00 ? 49 ALA C HB2 7 5
ATOM 7494 H HB3 . ALA C 1 5 ? -3.850 9.972 -0.350 1.00 0.00 ? 49 ALA C HB3 7 5
ATOM 7495 N N . ALA C 1 6 ? -4.377 9.633 3.585 1.00 0.00 ? 50 ALA C N 7 6
ATOM 7496 C CA . ALA C 1 6 ? -4.128 9.582 5.007 1.00 0.00 ? 50 ALA C CA 7 6
ATOM 7497 C C . ALA C 1 6 ? -5.165 8.820 5.802 1.00 0.00 ? 50 ALA C C 7 6
ATOM 7498 O O . ALA C 1 6 ? -5.074 8.785 7.015 1.00 0.00 ? 50 ALA C O 7 6
ATOM 7499 C CB . ALA C 1 6 ? -3.876 10.996 5.488 1.00 0.00 ? 50 ALA C CB 7 6
ATOM 7500 H H . ALA C 1 6 ? -4.632 10.495 3.155 1.00 0.00 ? 50 ALA C H 7 6
ATOM 7501 H HA . ALA C 1 6 ? -3.210 9.010 5.085 1.00 0.00 ? 50 ALA C HA 7 6
ATOM 7502 H HB1 . ALA C 1 6 ? -3.187 11.397 5.078 1.00 0.00 ? 50 ALA C HB1 7 6
ATOM 7503 H HB2 . ALA C 1 6 ? -4.570 11.561 5.352 1.00 0.00 ? 50 ALA C HB2 7 6
ATOM 7504 H HB3 . ALA C 1 6 ? -3.694 11.049 6.384 1.00 0.00 ? 50 ALA C HB3 7 6
ATOM 7505 N N . ALA C 1 7 ? -6.135 8.150 5.191 1.00 0.00 ? 51 ALA C N 7 7
ATOM 7506 C CA . ALA C 1 7 ? -6.996 7.138 5.747 1.00 0.00 ? 51 ALA C CA 7 7
ATOM 7507 C C . ALA C 1 7 ? -6.378 5.766 5.586 1.00 0.00 ? 51 ALA C C 7 7
ATOM 7508 O O . ALA C 1 7 ? -6.214 5.070 6.550 1.00 0.00 ? 51 ALA C O 7 7
ATOM 7509 C CB . ALA C 1 7 ? -8.360 7.174 5.091 1.00 0.00 ? 51 ALA C CB 7 7
ATOM 7510 H H . ALA C 1 7 ? -6.135 8.249 4.203 1.00 0.00 ? 51 ALA C H 7 7
ATOM 7511 H HA . ALA C 1 7 ? -7.134 7.301 6.806 1.00 0.00 ? 51 ALA C HA 7 7
ATOM 7512 H HB1 . ALA C 1 7 ? -8.767 8.155 5.207 1.00 0.00 ? 51 ALA C HB1 7 7
ATOM 7513 H HB2 . ALA C 1 7 ? -8.308 6.957 4.054 1.00 0.00 ? 51 ALA C HB2 7 7
ATOM 7514 H HB3 . ALA C 1 7 ? -8.996 6.440 5.542 1.00 0.00 ? 51 ALA C HB3 7 7
ATOM 7515 N N . ALA C 1 8 ? -6.021 5.353 4.386 1.00 0.00 ? 52 ALA C N 7 8
ATOM 7516 C CA . ALA C 1 8 ? -5.583 4.003 4.114 1.00 0.00 ? 52 ALA C CA 7 8
ATOM 7517 C C . ALA C 1 8 ? -4.119 3.799 4.419 1.00 0.00 ? 52 ALA C C 7 8
ATOM 7518 O O . ALA C 1 8 ? -3.743 2.776 4.935 1.00 0.00 ? 52 ALA C O 7 8
ATOM 7519 C CB . ALA C 1 8 ? -5.859 3.682 2.658 1.00 0.00 ? 52 ALA C CB 7 8
ATOM 7520 H H . ALA C 1 8 ? -5.939 6.012 3.643 1.00 0.00 ? 52 ALA C H 7 8
ATOM 7521 H HA . ALA C 1 8 ? -6.162 3.329 4.737 1.00 0.00 ? 52 ALA C HA 7 8
ATOM 7522 H HB1 . ALA C 1 8 ? -5.772 2.631 2.513 1.00 0.00 ? 52 ALA C HB1 7 8
ATOM 7523 H HB2 . ALA C 1 8 ? -6.823 4.027 2.359 1.00 0.00 ? 52 ALA C HB2 7 8
ATOM 7524 H HB3 . ALA C 1 8 ? -5.092 4.122 2.055 1.00 0.00 ? 52 ALA C HB3 7 8
ATOM 7525 N N . ILE C 1 9 ? -3.314 4.821 4.162 1.00 0.00 ? 53 ILE C N 7 9
ATOM 7526 C CA . ILE C 1 9 ? -1.901 4.822 4.452 1.00 0.00 ? 53 ILE C CA 7 9
ATOM 7527 C C . ILE C 1 9 ? -1.614 4.755 5.938 1.00 0.00 ? 53 ILE C C 7 9
ATOM 7528 O O . ILE C 1 9 ? -0.698 4.068 6.376 1.00 0.00 ? 53 ILE C O 7 9
ATOM 7529 C CB . ILE C 1 9 ? -1.221 6.076 3.925 1.00 0.00 ? 53 ILE C CB 7 9
ATOM 7530 C CG1 . ILE C 1 9 ? -1.391 6.294 2.433 1.00 0.00 ? 53 ILE C CG1 7 9
ATOM 7531 C CG2 . ILE C 1 9 ? 0.260 6.085 4.260 1.00 0.00 ? 53 ILE C CG2 7 9
ATOM 7532 C CD1 . ILE C 1 9 ? -0.685 5.312 1.533 1.00 0.00 ? 53 ILE C CD1 7 9
ATOM 7533 H H . ILE C 1 9 ? -3.683 5.642 3.725 1.00 0.00 ? 53 ILE C H 7 9
ATOM 7534 H HA . ILE C 1 9 ? -1.448 3.941 4.004 1.00 0.00 ? 53 ILE C HA 7 9
ATOM 7535 H HB . ILE C 1 9 ? -1.630 6.900 4.499 1.00 0.00 ? 53 ILE C HB 7 9
ATOM 7536 H HG12 . ILE C 1 9 ? -2.456 6.255 2.201 1.00 0.00 ? 53 ILE C HG12 7 9
ATOM 7537 H HG13 . ILE C 1 9 ? -1.075 7.295 2.219 1.00 0.00 ? 53 ILE C HG13 7 9
ATOM 7538 H HG21 . ILE C 1 9 ? 0.398 6.277 5.313 1.00 0.00 ? 53 ILE C HG21 7 9
ATOM 7539 H HG22 . ILE C 1 9 ? 0.707 5.151 3.994 1.00 0.00 ? 53 ILE C HG22 7 9
ATOM 7540 H HG23 . ILE C 1 9 ? 0.721 6.876 3.703 1.00 0.00 ? 53 ILE C HG23 7 9
ATOM 7541 H HD11 . ILE C 1 9 ? 0.346 5.322 1.701 1.00 0.00 ? 53 ILE C HD11 7 9
ATOM 7542 H HD12 . ILE C 1 9 ? -1.057 4.355 1.730 1.00 0.00 ? 53 ILE C HD12 7 9
ATOM 7543 H HD13 . ILE C 1 9 ? -0.897 5.559 0.512 1.00 0.00 ? 53 ILE C HD13 7 9
ATOM 7544 N N . LYS C 1 10 ? -2.428 5.429 6.748 1.00 0.00 ? 54 LYS C N 7 10
ATOM 7545 C CA . LYS C 1 10 ? -2.364 5.430 8.189 1.00 0.00 ? 54 LYS C CA 7 10
ATOM 7546 C C . LYS C 1 10 ? -2.671 4.051 8.742 1.00 0.00 ? 54 LYS C C 7 10
ATOM 7547 O O . LYS C 1 10 ? -1.974 3.606 9.637 1.00 0.00 ? 54 LYS C O 7 10
ATOM 7548 C CB . LYS C 1 10 ? -3.336 6.478 8.712 1.00 0.00 ? 54 LYS C CB 7 10
ATOM 7549 C CG . LYS C 1 10 ? -2.692 7.839 8.915 1.00 0.00 ? 54 LYS C CG 7 10
ATOM 7550 C CD . LYS C 1 10 ? -2.065 8.041 10.061 1.00 0.00 ? 54 LYS C CD 7 10
ATOM 7551 C CE . LYS C 1 10 ? -1.608 9.448 10.284 1.00 0.00 ? 54 LYS C CE 7 10
ATOM 7552 N NZ . LYS C 1 10 ? -0.567 9.944 9.610 1.00 0.00 ? 54 LYS C NZ 7 10
ATOM 7553 H H . LYS C 1 10 ? -3.156 5.942 6.309 1.00 0.00 ? 54 LYS C H 7 10
ATOM 7554 H HA . LYS C 1 10 ? -1.340 5.610 8.476 1.00 0.00 ? 54 LYS C HA 7 10
ATOM 7555 H HB2 . LYS C 1 10 ? -4.171 6.572 8.018 1.00 0.00 ? 54 LYS C HB2 7 10
ATOM 7556 H HB3 . LYS C 1 10 ? -3.736 6.163 9.658 1.00 0.00 ? 54 LYS C HB3 7 10
ATOM 7557 H HG2 . LYS C 1 10 ? -1.983 7.998 8.102 1.00 0.00 ? 54 LYS C HG2 7 10
ATOM 7558 H HG3 . LYS C 1 10 ? -3.325 8.530 8.866 1.00 0.00 ? 54 LYS C HG3 7 10
ATOM 7559 H HD2 . LYS C 1 10 ? -2.731 7.763 10.878 1.00 0.00 ? 54 LYS C HD2 7 10
ATOM 7560 H HD3 . LYS C 1 10 ? -1.354 7.444 10.088 1.00 0.00 ? 54 LYS C HD3 7 10
ATOM 7561 H HE2 . LYS C 1 10 ? -2.459 10.096 10.073 1.00 0.00 ? 54 LYS C HE2 7 10
ATOM 7562 H HE3 . LYS C 1 10 ? -1.408 9.559 11.194 1.00 0.00 ? 54 LYS C HE3 7 10
ATOM 7563 H HZ1 . LYS C 1 10 ? -0.679 9.896 8.877 1.00 0.00 ? 54 LYS C HZ1 7 10
ATOM 7564 H HZ2 . LYS C 1 10 ? -0.298 10.764 9.769 1.00 0.00 ? 54 LYS C HZ2 7 10
ATOM 7565 H HZ3 . LYS C 1 10 ? 0.036 9.555 9.715 1.00 0.00 ? 54 LYS C HZ3 7 10
ATOM 7566 N N . ALA C 1 11 ? -3.616 3.345 8.133 1.00 0.00 ? 55 ALA C N 7 11
ATOM 7567 C CA . ALA C 1 11 ? -3.817 1.932 8.337 1.00 0.00 ? 55 ALA C CA 7 11
ATOM 7568 C C . ALA C 1 11 ? -2.600 1.134 7.902 1.00 0.00 ? 55 ALA C C 7 11
ATOM 7569 O O . ALA C 1 11 ? -2.075 0.344 8.678 1.00 0.00 ? 55 ALA C O 7 11
ATOM 7570 C CB . ALA C 1 11 ? -5.122 1.514 7.682 1.00 0.00 ? 55 ALA C CB 7 11
ATOM 7571 H H . ALA C 1 11 ? -4.208 3.821 7.478 1.00 0.00 ? 55 ALA C H 7 11
ATOM 7572 H HA . ALA C 1 11 ? -3.918 1.738 9.394 1.00 0.00 ? 55 ALA C HA 7 11
ATOM 7573 H HB1 . ALA C 1 11 ? -5.142 1.668 6.768 1.00 0.00 ? 55 ALA C HB1 7 11
ATOM 7574 H HB2 . ALA C 1 11 ? -5.309 0.598 7.812 1.00 0.00 ? 55 ALA C HB2 7 11
ATOM 7575 H HB3 . ALA C 1 11 ? -5.864 1.928 8.045 1.00 0.00 ? 55 ALA C HB3 7 11
ATOM 7576 N N . ILE C 1 12 ? -2.103 1.320 6.682 1.00 0.00 ? 56 ILE C N 7 12
ATOM 7577 C CA . ILE C 1 12 ? -1.072 0.502 6.086 1.00 0.00 ? 56 ILE C CA 7 12
ATOM 7578 C C . ILE C 1 12 ? 0.251 0.630 6.821 1.00 0.00 ? 56 ILE C C 7 12
ATOM 7579 O O . ILE C 1 12 ? 0.836 -0.388 7.162 1.00 0.00 ? 56 ILE C O 7 12
ATOM 7580 C CB . ILE C 1 12 ? -0.940 0.666 4.579 1.00 0.00 ? 56 ILE C CB 7 12
ATOM 7581 C CG1 . ILE C 1 12 ? -0.778 -0.724 3.995 1.00 0.00 ? 56 ILE C CG1 7 12
ATOM 7582 C CG2 . ILE C 1 12 ? 0.208 1.550 4.129 1.00 0.00 ? 56 ILE C CG2 7 12
ATOM 7583 C CD1 . ILE C 1 12 ? -0.519 -0.842 2.511 1.00 0.00 ? 56 ILE C CD1 7 12
ATOM 7584 H H . ILE C 1 12 ? -2.419 2.092 6.137 1.00 0.00 ? 56 ILE C H 7 12
ATOM 7585 H HA . ILE C 1 12 ? -1.339 -0.536 6.255 1.00 0.00 ? 56 ILE C HA 7 12
ATOM 7586 H HB . ILE C 1 12 ? -1.874 1.073 4.211 1.00 0.00 ? 56 ILE C HB 7 12
ATOM 7587 H HG12 . ILE C 1 12 ? 0.025 -1.235 4.527 1.00 0.00 ? 56 ILE C HG12 7 12
ATOM 7588 H HG13 . ILE C 1 12 ? -1.707 -1.230 4.198 1.00 0.00 ? 56 ILE C HG13 7 12
ATOM 7589 H HG21 . ILE C 1 12 ? 1.145 1.063 4.350 1.00 0.00 ? 56 ILE C HG21 7 12
ATOM 7590 H HG22 . ILE C 1 12 ? 0.176 1.774 3.068 1.00 0.00 ? 56 ILE C HG22 7 12
ATOM 7591 H HG23 . ILE C 1 12 ? 0.190 2.509 4.628 1.00 0.00 ? 56 ILE C HG23 7 12
ATOM 7592 H HD11 . ILE C 1 12 ? -1.237 -0.292 1.950 1.00 0.00 ? 56 ILE C HD11 7 12
ATOM 7593 H HD12 . ILE C 1 12 ? 0.478 -0.534 2.305 1.00 0.00 ? 56 ILE C HD12 7 12
ATOM 7594 H HD13 . ILE C 1 12 ? -0.613 -1.868 2.231 1.00 0.00 ? 56 ILE C HD13 7 12
ATOM 7595 N N . ALA C 1 13 ? 0.660 1.835 7.217 1.00 0.00 ? 57 ALA C N 7 13
ATOM 7596 C CA . ALA C 1 13 ? 1.935 1.966 7.884 1.00 0.00 ? 57 ALA C CA 7 13
ATOM 7597 C C . ALA C 1 13 ? 1.986 1.265 9.228 1.00 0.00 ? 57 ALA C C 7 13
ATOM 7598 O O . ALA C 1 13 ? 3.054 0.869 9.666 1.00 0.00 ? 57 ALA C O 7 13
ATOM 7599 C CB . ALA C 1 13 ? 2.320 3.436 7.884 1.00 0.00 ? 57 ALA C CB 7 13
ATOM 7600 H H . ALA C 1 13 ? 0.067 2.601 6.955 1.00 0.00 ? 57 ALA C H 7 13
ATOM 7601 H HA . ALA C 1 13 ? 2.652 1.443 7.265 1.00 0.00 ? 57 ALA C HA 7 13
ATOM 7602 H HB1 . ALA C 1 13 ? 2.193 3.822 6.916 1.00 0.00 ? 57 ALA C HB1 7 13
ATOM 7603 H HB2 . ALA C 1 13 ? 1.673 3.961 8.526 1.00 0.00 ? 57 ALA C HB2 7 13
ATOM 7604 H HB3 . ALA C 1 13 ? 3.316 3.561 8.189 1.00 0.00 ? 57 ALA C HB3 7 13
ATOM 7605 N N . ALA C 1 14 ? 0.842 1.082 9.877 1.00 0.00 ? 58 ALA C N 7 14
ATOM 7606 C CA . ALA C 1 14 ? 0.648 0.318 11.086 1.00 0.00 ? 58 ALA C CA 7 14
ATOM 7607 C C . ALA C 1 14 ? 0.503 -1.167 10.827 1.00 0.00 ? 58 ALA C C 7 14
ATOM 7608 O O . ALA C 1 14 ? 1.168 -1.976 11.451 1.00 0.00 ? 58 ALA C O 7 14
ATOM 7609 C CB . ALA C 1 14 ? -0.556 0.873 11.820 1.00 0.00 ? 58 ALA C CB 7 14
ATOM 7610 H H . ALA C 1 14 ? 0.058 1.365 9.321 1.00 0.00 ? 58 ALA C H 7 14
ATOM 7611 H HA . ALA C 1 14 ? 1.513 0.445 11.720 1.00 0.00 ? 58 ALA C HA 7 14
ATOM 7612 H HB1 . ALA C 1 14 ? -0.629 0.389 12.777 1.00 0.00 ? 58 ALA C HB1 7 14
ATOM 7613 H HB2 . ALA C 1 14 ? -0.452 1.933 11.999 1.00 0.00 ? 58 ALA C HB2 7 14
ATOM 7614 H HB3 . ALA C 1 14 ? -1.461 0.711 11.264 1.00 0.00 ? 58 ALA C HB3 7 14
ATOM 7615 N N . ILE C 1 15 ? -0.305 -1.533 9.834 1.00 0.00 ? 59 ILE C N 7 15
ATOM 7616 C CA . ILE C 1 15 ? -0.502 -2.880 9.356 1.00 0.00 ? 59 ILE C CA 7 15
ATOM 7617 C C . ILE C 1 15 ? 0.785 -3.496 8.838 1.00 0.00 ? 59 ILE C C 7 15
ATOM 7618 O O . ILE C 1 15 ? 0.999 -4.682 9.044 1.00 0.00 ? 59 ILE C O 7 15
ATOM 7619 C CB . ILE C 1 15 ? -1.619 -2.922 8.326 1.00 0.00 ? 59 ILE C CB 7 15
ATOM 7620 C CG1 . ILE C 1 15 ? -2.976 -2.705 8.970 1.00 0.00 ? 59 ILE C CG1 7 15
ATOM 7621 C CG2 . ILE C 1 15 ? -1.632 -4.215 7.536 1.00 0.00 ? 59 ILE C CG2 7 15
ATOM 7622 C CD1 . ILE C 1 15 ? -4.076 -2.307 8.003 1.00 0.00 ? 59 ILE C CD1 7 15
ATOM 7623 H H . ILE C 1 15 ? -0.716 -0.777 9.326 1.00 0.00 ? 59 ILE C H 7 15
ATOM 7624 H HA . ILE C 1 15 ? -0.799 -3.504 10.193 1.00 0.00 ? 59 ILE C HA 7 15
ATOM 7625 H HB . ILE C 1 15 ? -1.462 -2.111 7.629 1.00 0.00 ? 59 ILE C HB 7 15
ATOM 7626 H HG12 . ILE C 1 15 ? -3.269 -3.608 9.505 1.00 0.00 ? 59 ILE C HG12 7 15
ATOM 7627 H HG13 . ILE C 1 15 ? -2.891 -1.896 9.674 1.00 0.00 ? 59 ILE C HG13 7 15
ATOM 7628 H HG21 . ILE C 1 15 ? -1.623 -5.060 8.199 1.00 0.00 ? 59 ILE C HG21 7 15
ATOM 7629 H HG22 . ILE C 1 15 ? -2.509 -4.251 6.909 1.00 0.00 ? 59 ILE C HG22 7 15
ATOM 7630 H HG23 . ILE C 1 15 ? -0.779 -4.236 6.896 1.00 0.00 ? 59 ILE C HG23 7 15
ATOM 7631 H HD11 . ILE C 1 15 ? -3.804 -1.439 7.457 1.00 0.00 ? 59 ILE C HD11 7 15
ATOM 7632 H HD12 . ILE C 1 15 ? -4.360 -3.120 7.384 1.00 0.00 ? 59 ILE C HD12 7 15
ATOM 7633 H HD13 . ILE C 1 15 ? -4.912 -2.017 8.585 1.00 0.00 ? 59 ILE C HD13 7 15
ATOM 7634 N N . ILE C 1 16 ? 1.680 -2.718 8.230 1.00 0.00 ? 60 ILE C N 7 16
ATOM 7635 C CA . ILE C 1 16 ? 2.959 -3.177 7.733 1.00 0.00 ? 60 ILE C CA 7 16
ATOM 7636 C C . ILE C 1 16 ? 3.830 -3.702 8.857 1.00 0.00 ? 60 ILE C C 7 16
ATOM 7637 O O . ILE C 1 16 ? 4.310 -4.827 8.808 1.00 0.00 ? 60 ILE C O 7 16
ATOM 7638 C CB . ILE C 1 16 ? 3.592 -2.050 6.929 1.00 0.00 ? 60 ILE C CB 7 16
ATOM 7639 C CG1 . ILE C 1 16 ? 2.912 -2.013 5.574 1.00 0.00 ? 60 ILE C CG1 7 16
ATOM 7640 C CG2 . ILE C 1 16 ? 5.104 -2.148 6.817 1.00 0.00 ? 60 ILE C CG2 7 16
ATOM 7641 C CD1 . ILE C 1 16 ? 3.525 -1.065 4.563 1.00 0.00 ? 60 ILE C CD1 7 16
ATOM 7642 H H . ILE C 1 16 ? 1.410 -1.763 8.098 1.00 0.00 ? 60 ILE C H 7 16
ATOM 7643 H HA . ILE C 1 16 ? 2.795 -4.023 7.074 1.00 0.00 ? 60 ILE C HA 7 16
ATOM 7644 H HB . ILE C 1 16 ? 3.361 -1.137 7.467 1.00 0.00 ? 60 ILE C HB 7 16
ATOM 7645 H HG12 . ILE C 1 16 ? 2.921 -3.020 5.155 1.00 0.00 ? 60 ILE C HG12 7 16
ATOM 7646 H HG13 . ILE C 1 16 ? 1.880 -1.738 5.715 1.00 0.00 ? 60 ILE C HG13 7 16
ATOM 7647 H HG21 . ILE C 1 16 ? 5.580 -2.171 7.783 1.00 0.00 ? 60 ILE C HG21 7 16
ATOM 7648 H HG22 . ILE C 1 16 ? 5.418 -3.006 6.246 1.00 0.00 ? 60 ILE C HG22 7 16
ATOM 7649 H HG23 . ILE C 1 16 ? 5.510 -1.273 6.339 1.00 0.00 ? 60 ILE C HG23 7 16
ATOM 7650 H HD11 . ILE C 1 16 ? 3.576 -0.098 4.987 1.00 0.00 ? 60 ILE C HD11 7 16
ATOM 7651 H HD12 . ILE C 1 16 ? 4.498 -1.395 4.279 1.00 0.00 ? 60 ILE C HD12 7 16
ATOM 7652 H HD13 . ILE C 1 16 ? 2.917 -1.096 3.705 1.00 0.00 ? 60 ILE C HD13 7 16
ATOM 7653 N N . LYS C 1 17 ? 3.965 -2.886 9.897 1.00 0.00 ? 61 LYS C N 7 17
ATOM 7654 C CA . LYS C 1 17 ? 4.641 -3.186 11.135 1.00 0.00 ? 61 LYS C CA 7 17
ATOM 7655 C C . LYS C 1 17 ? 4.034 -4.350 11.898 1.00 0.00 ? 61 LYS C C 7 17
ATOM 7656 O O . LYS C 1 17 ? 4.752 -5.232 12.338 1.00 0.00 ? 61 LYS C O 7 17
ATOM 7657 C CB . LYS C 1 17 ? 4.638 -1.898 11.943 1.00 0.00 ? 61 LYS C CB 7 17
ATOM 7658 C CG . LYS C 1 17 ? 5.766 -0.989 11.565 1.00 0.00 ? 61 LYS C CG 7 17
ATOM 7659 C CD . LYS C 1 17 ? 6.006 0.121 12.543 1.00 0.00 ? 61 LYS C CD 7 17
ATOM 7660 C CE . LYS C 1 17 ? 4.919 1.125 12.624 1.00 0.00 ? 61 LYS C CE 7 17
ATOM 7661 N NZ . LYS C 1 17 ? 5.075 2.073 13.657 1.00 0.00 ? 61 LYS C NZ 7 17
ATOM 7662 H H . LYS C 1 17 ? 3.513 -2.010 9.782 1.00 0.00 ? 61 LYS C H 7 17
ATOM 7663 H HA . LYS C 1 17 ? 5.661 -3.507 10.959 1.00 0.00 ? 61 LYS C HA 7 17
ATOM 7664 H HB2 . LYS C 1 17 ? 3.686 -1.382 11.821 1.00 0.00 ? 61 LYS C HB2 7 17
ATOM 7665 H HB3 . LYS C 1 17 ? 4.758 -2.158 12.973 1.00 0.00 ? 61 LYS C HB3 7 17
ATOM 7666 H HG2 . LYS C 1 17 ? 6.677 -1.580 11.464 1.00 0.00 ? 61 LYS C HG2 7 17
ATOM 7667 H HG3 . LYS C 1 17 ? 5.577 -0.547 10.631 1.00 0.00 ? 61 LYS C HG3 7 17
ATOM 7668 H HD2 . LYS C 1 17 ? 6.161 -0.310 13.532 1.00 0.00 ? 61 LYS C HD2 7 17
ATOM 7669 H HD3 . LYS C 1 17 ? 6.902 0.621 12.273 1.00 0.00 ? 61 LYS C HD3 7 17
ATOM 7670 H HE2 . LYS C 1 17 ? 4.830 1.640 11.668 1.00 0.00 ? 61 LYS C HE2 7 17
ATOM 7671 H HE3 . LYS C 1 17 ? 4.021 0.614 12.816 1.00 0.00 ? 61 LYS C HE3 7 17
ATOM 7672 H HZ1 . LYS C 1 17 ? 5.134 1.638 14.503 1.00 0.00 ? 61 LYS C HZ1 7 17
ATOM 7673 H HZ2 . LYS C 1 17 ? 5.890 2.578 13.516 1.00 0.00 ? 61 LYS C HZ2 7 17
ATOM 7674 H HZ3 . LYS C 1 17 ? 4.321 2.699 13.744 1.00 0.00 ? 61 LYS C HZ3 7 17
ATOM 7675 N N . ALA C 1 18 ? 2.712 -4.392 12.021 1.00 0.00 ? 62 ALA C N 7 18
ATOM 7676 C CA . ALA C 1 18 ? 1.999 -5.490 12.632 1.00 0.00 ? 62 ALA C CA 7 18
ATOM 7677 C C . ALA C 1 18 ? 2.116 -6.777 11.842 1.00 0.00 ? 62 ALA C C 7 18
ATOM 7678 O O . ALA C 1 18 ? 2.232 -7.831 12.426 1.00 0.00 ? 62 ALA C O 7 18
ATOM 7679 C CB . ALA C 1 18 ? 0.550 -5.100 12.839 1.00 0.00 ? 62 ALA C CB 7 18
ATOM 7680 H H . ALA C 1 18 ? 2.183 -3.677 11.567 1.00 0.00 ? 62 ALA C H 7 18
ATOM 7681 H HA . ALA C 1 18 ? 2.440 -5.652 13.607 1.00 0.00 ? 62 ALA C HA 7 18
ATOM 7682 H HB1 . ALA C 1 18 ? 0.495 -4.218 13.450 1.00 0.00 ? 62 ALA C HB1 7 18
ATOM 7683 H HB2 . ALA C 1 18 ? 0.075 -4.942 11.897 1.00 0.00 ? 62 ALA C HB2 7 18
ATOM 7684 H HB3 . ALA C 1 18 ? 0.024 -5.891 13.341 1.00 0.00 ? 62 ALA C HB3 7 18
ATOM 7685 N N . GLY C 1 19 ? 2.171 -6.689 10.526 1.00 0.00 ? 63 GLY C N 7 19
ATOM 7686 C CA . GLY C 1 19 ? 2.303 -7.771 9.582 1.00 0.00 ? 63 GLY C CA 7 19
ATOM 7687 C C . GLY C 1 19 ? 3.695 -8.364 9.561 1.00 0.00 ? 63 GLY C C 7 19
ATOM 7688 O O . GLY C 1 19 ? 3.880 -9.529 9.316 1.00 0.00 ? 63 GLY C O 7 19
ATOM 7689 H H . GLY C 1 19 ? 2.051 -5.762 10.162 1.00 0.00 ? 63 GLY C H 7 19
ATOM 7690 H HA2 . GLY C 1 19 ? 1.593 -8.537 9.845 1.00 0.00 ? 63 GLY C HA2 7 19
ATOM 7691 H HA3 . GLY C 1 19 ? 2.109 -7.406 8.591 1.00 0.00 ? 63 GLY C HA3 7 19
ATOM 7692 N N . GLY C 1 20 ? 4.730 -7.578 9.791 1.00 0.00 ? 64 GLY C N 7 20
ATOM 7693 C CA . GLY C 1 20 ? 6.095 -8.052 9.826 1.00 0.00 ? 64 GLY C CA 7 20
ATOM 7694 C C . GLY C 1 20 ? 6.819 -8.016 8.504 1.00 0.00 ? 64 GLY C C 7 20
ATOM 7695 O O . GLY C 1 20 ? 7.753 -8.775 8.307 1.00 0.00 ? 64 GLY C O 7 20
ATOM 7696 H H . GLY C 1 20 ? 4.518 -6.621 9.956 1.00 0.00 ? 64 GLY C H 7 20
ATOM 7697 H HA2 . GLY C 1 20 ? 6.668 -7.451 10.495 1.00 0.00 ? 64 GLY C HA2 7 20
ATOM 7698 H HA3 . GLY C 1 20 ? 6.139 -9.046 10.202 1.00 0.00 ? 64 GLY C HA3 7 20
ATOM 7699 N N . TYR C 1 21 ? 6.422 -7.147 7.583 1.00 0.00 ? 65 TYR C N 7 21
ATOM 7700 C CA . TYR C 1 21 ? 7.005 -6.979 6.276 1.00 0.00 ? 65 TYR C CA 7 21
ATOM 7701 C C . TYR C 1 21 ? 8.456 -6.577 6.278 1.00 0.00 ? 65 TYR C C 7 21
ATOM 7702 O O . TYR C 1 21 ? 9.193 -6.945 5.441 1.00 0.00 ? 65 TYR C O 7 21
ATOM 7703 C CB . TYR C 1 21 ? 6.172 -5.927 5.565 1.00 0.00 ? 65 TYR C CB 7 21
ATOM 7704 C CG . TYR C 1 21 ? 4.952 -6.385 4.821 1.00 0.00 ? 65 TYR C CG 7 21
ATOM 7705 C CD1 . TYR C 1 21 ? 4.943 -7.423 3.889 1.00 0.00 ? 65 TYR C CD1 7 21
ATOM 7706 C CD2 . TYR C 1 21 ? 3.828 -5.582 5.007 1.00 0.00 ? 65 TYR C CD2 7 21
ATOM 7707 C CE1 . TYR C 1 21 ? 3.763 -7.641 3.175 1.00 0.00 ? 65 TYR C CE1 7 21
ATOM 7708 C CE2 . TYR C 1 21 ? 2.647 -5.786 4.289 1.00 0.00 ? 65 TYR C CE2 7 21
ATOM 7709 C CZ . TYR C 1 21 ? 2.637 -6.816 3.339 1.00 0.00 ? 65 TYR C CZ 7 21
ATOM 7710 O OH . TYR C 1 21 ? 1.508 -7.061 2.620 1.00 0.00 ? 65 TYR C OH 7 21
ATOM 7711 H H . TYR C 1 21 ? 5.710 -6.490 7.822 1.00 0.00 ? 65 TYR C H 7 21
ATOM 7712 H HA . TYR C 1 21 ? 6.888 -7.913 5.744 1.00 0.00 ? 65 TYR C HA 7 21
ATOM 7713 H HB2 . TYR C 1 21 ? 5.859 -5.201 6.315 1.00 0.00 ? 65 TYR C HB2 7 21
ATOM 7714 H HB3 . TYR C 1 21 ? 6.741 -5.382 4.828 1.00 0.00 ? 65 TYR C HB3 7 21
ATOM 7715 H HD1 . TYR C 1 21 ? 5.805 -8.022 3.668 1.00 0.00 ? 65 TYR C HD1 7 21
ATOM 7716 H HD2 . TYR C 1 21 ? 3.864 -4.761 5.688 1.00 0.00 ? 65 TYR C HD2 7 21
ATOM 7717 H HE1 . TYR C 1 21 ? 3.721 -8.436 2.462 1.00 0.00 ? 65 TYR C HE1 7 21
ATOM 7718 H HE2 . TYR C 1 21 ? 1.814 -5.132 4.427 1.00 0.00 ? 65 TYR C HE2 7 21
ATOM 7719 H HH . TYR C 1 21 ? 0.813 -7.357 3.178 1.00 0.00 ? 65 TYR C HH 7 21
HETATM 7720 N N . NH2 C 1 22 ? 8.910 -5.883 7.254 1.00 0.00 ? 66 NH2 C N 7 22
HETATM 7721 H HN1 . NH2 C 1 22 ? 9.868 -5.695 7.276 1.00 0.00 ? 66 NH2 C HN1 7 22
HETATM 7722 H HN2 . NH2 C 1 22 ? 8.299 -5.612 7.911 1.00 0.00 ? 66 NH2 C HN2 7 22
HETATM 7723 C C . ACE D 1 1 ? 4.984 -11.665 5.498 1.00 0.00 ? 67 ACE D C 7 1
HETATM 7724 O O . ACE D 1 1 ? 4.222 -11.396 4.593 1.00 0.00 ? 67 ACE D O 7 1
HETATM 7725 C CH3 . ACE D 1 1 ? 5.791 -10.600 6.195 1.00 0.00 ? 67 ACE D CH3 7 1
HETATM 7726 H H1 . ACE D 1 1 ? 6.177 -10.331 6.065 1.00 0.00 ? 67 ACE D H1 7 1
HETATM 7727 H H2 . ACE D 1 1 ? 5.695 -10.161 6.386 1.00 0.00 ? 67 ACE D H2 7 1
HETATM 7728 H H3 . ACE D 1 1 ? 6.066 -10.550 6.615 1.00 0.00 ? 67 ACE D H3 7 1
ATOM 7729 N N . ALA D 1 2 ? 5.109 -12.910 5.920 1.00 0.00 ? 68 ALA D N 7 2
ATOM 7730 C CA . ALA D 1 2 ? 4.510 -14.069 5.354 1.00 0.00 ? 68 ALA D CA 7 2
ATOM 7731 C C . ALA D 1 2 ? 3.011 -14.028 5.172 1.00 0.00 ? 68 ALA D C 7 2
ATOM 7732 O O . ALA D 1 2 ? 2.528 -14.393 4.155 1.00 0.00 ? 68 ALA D O 7 2
ATOM 7733 C CB . ALA D 1 2 ? 4.860 -15.217 6.256 1.00 0.00 ? 68 ALA D CB 7 2
ATOM 7734 H H . ALA D 1 2 ? 5.706 -13.051 6.684 1.00 0.00 ? 68 ALA D H 7 2
ATOM 7735 H HA . ALA D 1 2 ? 4.977 -14.248 4.404 1.00 0.00 ? 68 ALA D HA 7 2
ATOM 7736 H HB1 . ALA D 1 2 ? 4.493 -15.045 7.247 1.00 0.00 ? 68 ALA D HB1 7 2
ATOM 7737 H HB2 . ALA D 1 2 ? 4.386 -16.111 5.925 1.00 0.00 ? 68 ALA D HB2 7 2
ATOM 7738 H HB3 . ALA D 1 2 ? 5.919 -15.357 6.278 1.00 0.00 ? 68 ALA D HB3 7 2
ATOM 7739 N N . LYS D 1 3 ? 2.243 -13.520 6.098 1.00 0.00 ? 69 LYS D N 7 3
ATOM 7740 C CA . LYS D 1 3 ? 0.805 -13.427 6.086 1.00 0.00 ? 69 LYS D CA 7 3
ATOM 7741 C C . LYS D 1 3 ? 0.282 -12.027 5.891 1.00 0.00 ? 69 LYS D C 7 3
ATOM 7742 O O . LYS D 1 3 ? -0.774 -11.846 5.307 1.00 0.00 ? 69 LYS D O 7 3
ATOM 7743 C CB . LYS D 1 3 ? 0.258 -13.877 7.403 1.00 0.00 ? 69 LYS D CB 7 3
ATOM 7744 C CG . LYS D 1 3 ? 0.551 -15.285 7.748 1.00 0.00 ? 69 LYS D CG 7 3
ATOM 7745 C CD . LYS D 1 3 ? -0.284 -15.907 8.828 1.00 0.00 ? 69 LYS D CD 7 3
ATOM 7746 C CE . LYS D 1 3 ? -0.108 -15.281 10.107 1.00 0.00 ? 69 LYS D CE 7 3
ATOM 7747 N NZ . LYS D 1 3 ? -0.853 -15.930 11.120 1.00 0.00 ? 69 LYS D NZ 7 3
ATOM 7748 H H . LYS D 1 3 ? 2.743 -13.230 6.877 1.00 0.00 ? 69 LYS D H 7 3
ATOM 7749 H HA . LYS D 1 3 ? 0.375 -14.042 5.324 1.00 0.00 ? 69 LYS D HA 7 3
ATOM 7750 H HB2 . LYS D 1 3 ? 0.620 -13.223 8.196 1.00 0.00 ? 69 LYS D HB2 7 3
ATOM 7751 H HB3 . LYS D 1 3 ? -0.791 -13.794 7.327 1.00 0.00 ? 69 LYS D HB3 7 3
ATOM 7752 H HG2 . LYS D 1 3 ? 0.446 -15.887 6.845 1.00 0.00 ? 69 LYS D HG2 7 3
ATOM 7753 H HG3 . LYS D 1 3 ? 1.552 -15.339 8.043 1.00 0.00 ? 69 LYS D HG3 7 3
ATOM 7754 H HD2 . LYS D 1 3 ? -1.334 -15.853 8.540 1.00 0.00 ? 69 LYS D HD2 7 3
ATOM 7755 H HD3 . LYS D 1 3 ? -0.052 -16.909 8.944 1.00 0.00 ? 69 LYS D HD3 7 3
ATOM 7756 H HE2 . LYS D 1 3 ? 0.948 -15.298 10.376 1.00 0.00 ? 69 LYS D HE2 7 3
ATOM 7757 H HE3 . LYS D 1 3 ? -0.368 -14.300 10.033 1.00 0.00 ? 69 LYS D HE3 7 3
ATOM 7758 H HZ1 . LYS D 1 3 ? -0.595 -16.843 11.265 1.00 0.00 ? 69 LYS D HZ1 7 3
ATOM 7759 H HZ2 . LYS D 1 3 ? -0.726 -15.478 11.951 1.00 0.00 ? 69 LYS D HZ2 7 3
ATOM 7760 H HZ3 . LYS D 1 3 ? -1.800 -15.913 10.919 1.00 0.00 ? 69 LYS D HZ3 7 3
ATOM 7761 N N . ALA D 1 4 ? 1.087 -11.031 6.253 1.00 0.00 ? 70 ALA D N 7 4
ATOM 7762 C CA . ALA D 1 4 ? 0.950 -9.647 5.879 1.00 0.00 ? 70 ALA D CA 7 4
ATOM 7763 C C . ALA D 1 4 ? 0.589 -9.505 4.415 1.00 0.00 ? 70 ALA D C 7 4
ATOM 7764 O O . ALA D 1 4 ? -0.196 -8.644 4.039 1.00 0.00 ? 70 ALA D O 7 4
ATOM 7765 C CB . ALA D 1 4 ? 2.248 -8.932 6.199 1.00 0.00 ? 70 ALA D CB 7 4
ATOM 7766 H H . ALA D 1 4 ? 1.925 -11.304 6.704 1.00 0.00 ? 70 ALA D H 7 4
ATOM 7767 H HA . ALA D 1 4 ? 0.161 -9.208 6.478 1.00 0.00 ? 70 ALA D HA 7 4
ATOM 7768 H HB1 . ALA D 1 4 ? 2.641 -9.192 6.865 1.00 0.00 ? 70 ALA D HB1 7 4
ATOM 7769 H HB2 . ALA D 1 4 ? 2.832 -9.011 5.659 1.00 0.00 ? 70 ALA D HB2 7 4
ATOM 7770 H HB3 . ALA D 1 4 ? 2.278 -8.139 6.310 1.00 0.00 ? 70 ALA D HB3 7 4
ATOM 7771 N N . ALA D 1 5 ? 1.131 -10.409 3.604 1.00 0.00 ? 71 ALA D N 7 5
ATOM 7772 C CA . ALA D 1 5 ? 1.043 -10.425 2.162 1.00 0.00 ? 71 ALA D CA 7 5
ATOM 7773 C C . ALA D 1 5 ? -0.244 -10.976 1.576 1.00 0.00 ? 71 ALA D C 7 5
ATOM 7774 O O . ALA D 1 5 ? -0.434 -10.903 0.377 1.00 0.00 ? 71 ALA D O 7 5
ATOM 7775 C CB . ALA D 1 5 ? 2.270 -11.117 1.596 1.00 0.00 ? 71 ALA D CB 7 5
ATOM 7776 H H . ALA D 1 5 ? 1.603 -11.158 4.063 1.00 0.00 ? 71 ALA D H 7 5
ATOM 7777 H HA . ALA D 1 5 ? 1.011 -9.387 1.851 1.00 0.00 ? 71 ALA D HA 7 5
ATOM 7778 H HB1 . ALA D 1 5 ? 2.319 -11.059 0.530 1.00 0.00 ? 71 ALA D HB1 7 5
ATOM 7779 H HB2 . ALA D 1 5 ? 3.147 -10.673 2.022 1.00 0.00 ? 71 ALA D HB2 7 5
ATOM 7780 H HB3 . ALA D 1 5 ? 2.293 -12.157 1.862 1.00 0.00 ? 71 ALA D HB3 7 5
ATOM 7781 N N . ALA D 1 6 ? -1.199 -11.435 2.380 1.00 0.00 ? 72 ALA D N 7 6
ATOM 7782 C CA . ALA D 1 6 ? -2.604 -11.404 2.065 1.00 0.00 ? 72 ALA D CA 7 6
ATOM 7783 C C . ALA D 1 6 ? -3.353 -10.385 2.899 1.00 0.00 ? 72 ALA D C 7 6
ATOM 7784 O O . ALA D 1 6 ? -3.972 -9.471 2.372 1.00 0.00 ? 72 ALA D O 7 6
ATOM 7785 C CB . ALA D 1 6 ? -3.150 -12.806 2.176 1.00 0.00 ? 72 ALA D CB 7 6
ATOM 7786 H H . ALA D 1 6 ? -0.968 -11.574 3.341 1.00 0.00 ? 72 ALA D H 7 6
ATOM 7787 H HA . ALA D 1 6 ? -2.752 -11.043 1.053 1.00 0.00 ? 72 ALA D HA 7 6
ATOM 7788 H HB1 . ALA D 1 6 ? -4.191 -12.809 1.965 1.00 0.00 ? 72 ALA D HB1 7 6
ATOM 7789 H HB2 . ALA D 1 6 ? -2.655 -13.477 1.501 1.00 0.00 ? 72 ALA D HB2 7 6
ATOM 7790 H HB3 . ALA D 1 6 ? -2.980 -13.156 3.153 1.00 0.00 ? 72 ALA D HB3 7 6
ATOM 7791 N N . ALA D 1 7 ? -3.263 -10.475 4.223 1.00 0.00 ? 73 ALA D N 7 7
ATOM 7792 C CA . ALA D 1 7 ? -4.012 -9.744 5.219 1.00 0.00 ? 73 ALA D CA 7 7
ATOM 7793 C C . ALA D 1 7 ? -3.974 -8.233 5.060 1.00 0.00 ? 73 ALA D C 7 7
ATOM 7794 O O . ALA D 1 7 ? -5.004 -7.615 5.283 1.00 0.00 ? 73 ALA D O 7 7
ATOM 7795 C CB . ALA D 1 7 ? -3.578 -10.145 6.615 1.00 0.00 ? 73 ALA D CB 7 7
ATOM 7796 H H . ALA D 1 7 ? -2.639 -11.181 4.549 1.00 0.00 ? 73 ALA D H 7 7
ATOM 7797 H HA . ALA D 1 7 ? -5.051 -10.025 5.111 1.00 0.00 ? 73 ALA D HA 7 7
ATOM 7798 H HB1 . ALA D 1 7 ? -3.756 -11.183 6.773 1.00 0.00 ? 73 ALA D HB1 7 7
ATOM 7799 H HB2 . ALA D 1 7 ? -2.549 -9.934 6.782 1.00 0.00 ? 73 ALA D HB2 7 7
ATOM 7800 H HB3 . ALA D 1 7 ? -4.123 -9.578 7.326 1.00 0.00 ? 73 ALA D HB3 7 7
ATOM 7801 N N . ALA D 1 8 ? -2.846 -7.654 4.665 1.00 0.00 ? 74 ALA D N 7 8
ATOM 7802 C CA . ALA D 1 8 ? -2.773 -6.223 4.461 1.00 0.00 ? 74 ALA D CA 7 8
ATOM 7803 C C . ALA D 1 8 ? -3.363 -5.863 3.111 1.00 0.00 ? 74 ALA D C 7 8
ATOM 7804 O O . ALA D 1 8 ? -4.208 -4.988 2.980 1.00 0.00 ? 74 ALA D O 7 8
ATOM 7805 C CB . ALA D 1 8 ? -1.348 -5.703 4.552 1.00 0.00 ? 74 ALA D CB 7 8
ATOM 7806 H H . ALA D 1 8 ? -2.080 -8.232 4.373 1.00 0.00 ? 74 ALA D H 7 8
ATOM 7807 H HA . ALA D 1 8 ? -3.379 -5.734 5.212 1.00 0.00 ? 74 ALA D HA 7 8
ATOM 7808 H HB1 . ALA D 1 8 ? -0.898 -6.063 5.462 1.00 0.00 ? 74 ALA D HB1 7 8
ATOM 7809 H HB2 . ALA D 1 8 ? -0.799 -6.070 3.706 1.00 0.00 ? 74 ALA D HB2 7 8
ATOM 7810 H HB3 . ALA D 1 8 ? -1.343 -4.626 4.517 1.00 0.00 ? 74 ALA D HB3 7 8
ATOM 7811 N N . ILE D 1 9 ? -2.987 -6.613 2.079 1.00 0.00 ? 75 ILE D N 7 9
ATOM 7812 C CA . ILE D 1 9 ? -3.394 -6.427 0.705 1.00 0.00 ? 75 ILE D CA 7 9
ATOM 7813 C C . ILE D 1 9 ? -4.895 -6.571 0.523 1.00 0.00 ? 75 ILE D C 7 9
ATOM 7814 O O . ILE D 1 9 ? -5.501 -5.863 -0.266 1.00 0.00 ? 75 ILE D O 7 9
ATOM 7815 C CB . ILE D 1 9 ? -2.699 -7.471 -0.156 1.00 0.00 ? 75 ILE D CB 7 9
ATOM 7816 C CG1 . ILE D 1 9 ? -1.197 -7.542 0.055 1.00 0.00 ? 75 ILE D CG1 7 9
ATOM 7817 C CG2 . ILE D 1 9 ? -3.080 -7.321 -1.612 1.00 0.00 ? 75 ILE D CG2 7 9
ATOM 7818 C CD1 . ILE D 1 9 ? -0.498 -6.217 -0.181 1.00 0.00 ? 75 ILE D CD1 7 9
ATOM 7819 H H . ILE D 1 9 ? -2.405 -7.403 2.263 1.00 0.00 ? 75 ILE D H 7 9
ATOM 7820 H HA . ILE D 1 9 ? -3.119 -5.430 0.381 1.00 0.00 ? 75 ILE D HA 7 9
ATOM 7821 H HB . ILE D 1 9 ? -3.116 -8.416 0.163 1.00 0.00 ? 75 ILE D HB 7 9
ATOM 7822 H HG12 . ILE D 1 9 ? -0.984 -7.902 1.062 1.00 0.00 ? 75 ILE D HG12 7 9
ATOM 7823 H HG13 . ILE D 1 9 ? -0.783 -8.234 -0.660 1.00 0.00 ? 75 ILE D HG13 7 9
ATOM 7824 H HG21 . ILE D 1 9 ? -4.060 -7.602 -1.759 1.00 0.00 ? 75 ILE D HG21 7 9
ATOM 7825 H HG22 . ILE D 1 9 ? -2.909 -6.364 -1.962 1.00 0.00 ? 75 ILE D HG22 7 9
ATOM 7826 H HG23 . ILE D 1 9 ? -2.483 -7.984 -2.149 1.00 0.00 ? 75 ILE D HG23 7 9
ATOM 7827 H HD11 . ILE D 1 9 ? -0.793 -5.520 0.562 1.00 0.00 ? 75 ILE D HD11 7 9
ATOM 7828 H HD12 . ILE D 1 9 ? 0.550 -6.388 -0.161 1.00 0.00 ? 75 ILE D HD12 7 9
ATOM 7829 H HD13 . ILE D 1 9 ? -0.772 -5.816 -1.116 1.00 0.00 ? 75 ILE D HD13 7 9
ATOM 7830 N N . LYS D 1 10 ? -5.513 -7.517 1.218 1.00 0.00 ? 76 LYS D N 7 10
ATOM 7831 C CA . LYS D 1 10 ? -6.899 -7.902 1.099 1.00 0.00 ? 76 LYS D CA 7 10
ATOM 7832 C C . LYS D 1 10 ? -7.858 -6.863 1.647 1.00 0.00 ? 76 LYS D C 7 10
ATOM 7833 O O . LYS D 1 10 ? -8.885 -6.602 1.059 1.00 0.00 ? 76 LYS D O 7 10
ATOM 7834 C CB . LYS D 1 10 ? -7.080 -9.244 1.796 1.00 0.00 ? 76 LYS D CB 7 10
ATOM 7835 C CG . LYS D 1 10 ? -6.712 -10.444 0.941 1.00 0.00 ? 76 LYS D CG 7 10
ATOM 7836 C CD . LYS D 1 10 ? -7.810 -10.819 -0.028 1.00 0.00 ? 76 LYS D CD 7 10
ATOM 7837 C CE . LYS D 1 10 ? -7.469 -12.071 -0.755 1.00 0.00 ? 76 LYS D CE 7 10
ATOM 7838 N NZ . LYS D 1 10 ? -8.503 -12.454 -1.698 1.00 0.00 ? 76 LYS D NZ 7 10
ATOM 7839 H H . LYS D 1 10 ? -4.893 -8.055 1.785 1.00 0.00 ? 76 LYS D H 7 10
ATOM 7840 H HA . LYS D 1 10 ? -7.125 -7.976 0.044 1.00 0.00 ? 76 LYS D HA 7 10
ATOM 7841 H HB2 . LYS D 1 10 ? -6.448 -9.254 2.683 1.00 0.00 ? 76 LYS D HB2 7 10
ATOM 7842 H HB3 . LYS D 1 10 ? -8.088 -9.336 2.168 1.00 0.00 ? 76 LYS D HB3 7 10
ATOM 7843 H HG2 . LYS D 1 10 ? -5.787 -10.245 0.400 1.00 0.00 ? 76 LYS D HG2 7 10
ATOM 7844 H HG3 . LYS D 1 10 ? -6.559 -11.290 1.598 1.00 0.00 ? 76 LYS D HG3 7 10
ATOM 7845 H HD2 . LYS D 1 10 ? -8.750 -10.944 0.509 1.00 0.00 ? 76 LYS D HD2 7 10
ATOM 7846 H HD3 . LYS D 1 10 ? -7.950 -10.043 -0.742 1.00 0.00 ? 76 LYS D HD3 7 10
ATOM 7847 H HE2 . LYS D 1 10 ? -6.528 -11.940 -1.289 1.00 0.00 ? 76 LYS D HE2 7 10
ATOM 7848 H HE3 . LYS D 1 10 ? -7.315 -12.820 -0.040 1.00 0.00 ? 76 LYS D HE3 7 10
ATOM 7849 H HZ1 . LYS D 1 10 ? -8.648 -11.781 -2.385 1.00 0.00 ? 76 LYS D HZ1 7 10
ATOM 7850 H HZ2 . LYS D 1 10 ? -8.280 -13.260 -2.188 1.00 0.00 ? 76 LYS D HZ2 7 10
ATOM 7851 H HZ3 . LYS D 1 10 ? -9.335 -12.581 -1.269 1.00 0.00 ? 76 LYS D HZ3 7 10
ATOM 7852 N N . ALA D 1 11 ? -7.461 -6.205 2.731 1.00 0.00 ? 77 ALA D N 7 11
ATOM 7853 C CA . ALA D 1 11 ? -8.019 -4.944 3.161 1.00 0.00 ? 77 ALA D CA 7 11
ATOM 7854 C C . ALA D 1 11 ? -7.756 -3.849 2.149 1.00 0.00 ? 77 ALA D C 7 11
ATOM 7855 O O . ALA D 1 11 ? -8.668 -3.204 1.671 1.00 0.00 ? 77 ALA D O 7 11
ATOM 7856 C CB . ALA D 1 11 ? -7.461 -4.624 4.532 1.00 0.00 ? 77 ALA D CB 7 11
ATOM 7857 H H . ALA D 1 11 ? -6.595 -6.506 3.127 1.00 0.00 ? 77 ALA D H 7 11
ATOM 7858 H HA . ALA D 1 11 ? -9.089 -5.047 3.234 1.00 0.00 ? 77 ALA D HA 7 11
ATOM 7859 H HB1 . ALA D 1 11 ? -6.399 -4.522 4.526 1.00 0.00 ? 77 ALA D HB1 7 11
ATOM 7860 H HB2 . ALA D 1 11 ? -7.891 -3.688 4.855 1.00 0.00 ? 77 ALA D HB2 7 11
ATOM 7861 H HB3 . ALA D 1 11 ? -7.747 -5.394 5.231 1.00 0.00 ? 77 ALA D HB3 7 11
ATOM 7862 N N . ILE D 1 12 ? -6.499 -3.659 1.767 1.00 0.00 ? 78 ILE D N 7 12
ATOM 7863 C CA . ILE D 1 12 ? -6.068 -2.480 1.051 1.00 0.00 ? 78 ILE D CA 7 12
ATOM 7864 C C . ILE D 1 12 ? -6.584 -2.456 -0.374 1.00 0.00 ? 78 ILE D C 7 12
ATOM 7865 O O . ILE D 1 12 ? -7.129 -1.439 -0.785 1.00 0.00 ? 78 ILE D O 7 12
ATOM 7866 C CB . ILE D 1 12 ? -4.578 -2.247 1.230 1.00 0.00 ? 78 ILE D CB 7 12
ATOM 7867 C CG1 . ILE D 1 12 ? -4.214 -1.826 2.635 1.00 0.00 ? 78 ILE D CG1 7 12
ATOM 7868 C CG2 . ILE D 1 12 ? -4.019 -1.287 0.215 1.00 0.00 ? 78 ILE D CG2 7 12
ATOM 7869 C CD1 . ILE D 1 12 ? -4.538 -0.432 3.028 1.00 0.00 ? 78 ILE D CD1 7 12
ATOM 7870 H H . ILE D 1 12 ? -5.831 -4.387 1.925 1.00 0.00 ? 78 ILE D H 7 12
ATOM 7871 H HA . ILE D 1 12 ? -6.580 -1.623 1.478 1.00 0.00 ? 78 ILE D HA 7 12
ATOM 7872 H HB . ILE D 1 12 ? -4.102 -3.188 1.068 1.00 0.00 ? 78 ILE D HB 7 12
ATOM 7873 H HG12 . ILE D 1 12 ? -4.714 -2.500 3.331 1.00 0.00 ? 78 ILE D HG12 7 12
ATOM 7874 H HG13 . ILE D 1 12 ? -3.164 -1.958 2.769 1.00 0.00 ? 78 ILE D HG13 7 12
ATOM 7875 H HG21 . ILE D 1 12 ? -4.571 -0.375 0.207 1.00 0.00 ? 78 ILE D HG21 7 12
ATOM 7876 H HG22 . ILE D 1 12 ? -2.979 -1.094 0.432 1.00 0.00 ? 78 ILE D HG22 7 12
ATOM 7877 H HG23 . ILE D 1 12 ? -4.074 -1.734 -0.766 1.00 0.00 ? 78 ILE D HG23 7 12
ATOM 7878 H HD11 . ILE D 1 12 ? -4.008 0.263 2.463 1.00 0.00 ? 78 ILE D HD11 7 12
ATOM 7879 H HD12 . ILE D 1 12 ? -5.572 -0.260 2.944 1.00 0.00 ? 78 ILE D HD12 7 12
ATOM 7880 H HD13 . ILE D 1 12 ? -4.229 -0.302 4.028 1.00 0.00 ? 78 ILE D HD13 7 12
ATOM 7881 N N . ALA D 1 13 ? -6.599 -3.556 -1.116 1.00 0.00 ? 79 ALA D N 7 13
ATOM 7882 C CA . ALA D 1 13 ? -7.178 -3.545 -2.440 1.00 0.00 ? 79 ALA D CA 7 13
ATOM 7883 C C . ALA D 1 13 ? -8.662 -3.230 -2.473 1.00 0.00 ? 79 ALA D C 7 13
ATOM 7884 O O . ALA D 1 13 ? -9.143 -2.634 -3.416 1.00 0.00 ? 79 ALA D O 7 13
ATOM 7885 C CB . ALA D 1 13 ? -6.860 -4.873 -3.109 1.00 0.00 ? 79 ALA D CB 7 13
ATOM 7886 H H . ALA D 1 13 ? -6.210 -4.396 -0.725 1.00 0.00 ? 79 ALA D H 7 13
ATOM 7887 H HA . ALA D 1 13 ? -6.682 -2.761 -2.991 1.00 0.00 ? 79 ALA D HA 7 13
ATOM 7888 H HB1 . ALA D 1 13 ? -5.805 -4.986 -3.131 1.00 0.00 ? 79 ALA D HB1 7 13
ATOM 7889 H HB2 . ALA D 1 13 ? -7.277 -5.695 -2.578 1.00 0.00 ? 79 ALA D HB2 7 13
ATOM 7890 H HB3 . ALA D 1 13 ? -7.211 -4.873 -4.111 1.00 0.00 ? 79 ALA D HB3 7 13
ATOM 7891 N N . ALA D 1 14 ? -9.396 -3.528 -1.411 1.00 0.00 ? 80 ALA D N 7 14
ATOM 7892 C CA . ALA D 1 14 ? -10.774 -3.126 -1.246 1.00 0.00 ? 80 ALA D CA 7 14
ATOM 7893 C C . ALA D 1 14 ? -10.897 -1.669 -0.843 1.00 0.00 ? 80 ALA D C 7 14
ATOM 7894 O O . ALA D 1 14 ? -11.719 -0.940 -1.358 1.00 0.00 ? 80 ALA D O 7 14
ATOM 7895 C CB . ALA D 1 14 ? -11.416 -4.043 -0.223 1.00 0.00 ? 80 ALA D CB 7 14
ATOM 7896 H H . ALA D 1 14 ? -8.865 -3.843 -0.626 1.00 0.00 ? 80 ALA D H 7 14
ATOM 7897 H HA . ALA D 1 14 ? -11.321 -3.258 -2.171 1.00 0.00 ? 80 ALA D HA 7 14
ATOM 7898 H HB1 . ALA D 1 14 ? -10.974 -3.985 0.745 1.00 0.00 ? 80 ALA D HB1 7 14
ATOM 7899 H HB2 . ALA D 1 14 ? -12.448 -3.793 -0.087 1.00 0.00 ? 80 ALA D HB2 7 14
ATOM 7900 H HB3 . ALA D 1 14 ? -11.364 -5.049 -0.559 1.00 0.00 ? 80 ALA D HB3 7 14
ATOM 7901 N N . ILE D 1 15 ? -10.057 -1.218 0.078 1.00 0.00 ? 81 ILE D N 7 15
ATOM 7902 C CA . ILE D 1 15 ? -9.936 0.125 0.594 1.00 0.00 ? 81 ILE D CA 7 15
ATOM 7903 C C . ILE D 1 15 ? -9.508 1.089 -0.496 1.00 0.00 ? 81 ILE D C 7 15
ATOM 7904 O O . ILE D 1 15 ? -10.028 2.191 -0.508 1.00 0.00 ? 81 ILE D O 7 15
ATOM 7905 C CB . ILE D 1 15 ? -9.047 0.152 1.825 1.00 0.00 ? 81 ILE D CB 7 15
ATOM 7906 C CG1 . ILE D 1 15 ? -9.740 -0.452 3.036 1.00 0.00 ? 81 ILE D CG1 7 15
ATOM 7907 C CG2 . ILE D 1 15 ? -8.486 1.522 2.167 1.00 0.00 ? 81 ILE D CG2 7 15
ATOM 7908 C CD1 . ILE D 1 15 ? -8.790 -0.866 4.151 1.00 0.00 ? 81 ILE D CD1 7 15
ATOM 7909 H H . ILE D 1 15 ? -9.395 -1.888 0.403 1.00 0.00 ? 81 ILE D H 7 15
ATOM 7910 H HA . ILE D 1 15 ? -10.913 0.463 0.920 1.00 0.00 ? 81 ILE D HA 7 15
ATOM 7911 H HB . ILE D 1 15 ? -8.180 -0.454 1.601 1.00 0.00 ? 81 ILE D HB 7 15
ATOM 7912 H HG12 . ILE D 1 15 ? -10.444 0.281 3.430 1.00 0.00 ? 81 ILE D HG12 7 15
ATOM 7913 H HG13 . ILE D 1 15 ? -10.327 -1.313 2.760 1.00 0.00 ? 81 ILE D HG13 7 15
ATOM 7914 H HG21 . ILE D 1 15 ? -9.278 2.225 2.220 1.00 0.00 ? 81 ILE D HG21 7 15
ATOM 7915 H HG22 . ILE D 1 15 ? -7.896 1.498 3.059 1.00 0.00 ? 81 ILE D HG22 7 15
ATOM 7916 H HG23 . ILE D 1 15 ? -7.871 1.856 1.383 1.00 0.00 ? 81 ILE D HG23 7 15
ATOM 7917 H HD11 . ILE D 1 15 ? -9.108 -1.056 4.816 1.00 0.00 ? 81 ILE D HD11 7 15
ATOM 7918 H HD12 . ILE D 1 15 ? -8.385 -1.487 4.065 1.00 0.00 ? 81 ILE D HD12 7 15
ATOM 7919 H HD13 . ILE D 1 15 ? -8.262 -0.411 4.436 1.00 0.00 ? 81 ILE D HD13 7 15
ATOM 7920 N N . ILE D 1 16 ? -8.648 0.705 -1.432 1.00 0.00 ? 82 ILE D N 7 16
ATOM 7921 C CA . ILE D 1 16 ? -8.273 1.476 -2.595 1.00 0.00 ? 82 ILE D CA 7 16
ATOM 7922 C C . ILE D 1 16 ? -9.497 1.877 -3.399 1.00 0.00 ? 82 ILE D C 7 16
ATOM 7923 O O . ILE D 1 16 ? -9.702 3.051 -3.654 1.00 0.00 ? 82 ILE D O 7 16
ATOM 7924 C CB . ILE D 1 16 ? -7.285 0.683 -3.439 1.00 0.00 ? 82 ILE D CB 7 16
ATOM 7925 C CG1 . ILE D 1 16 ? -5.942 0.757 -2.730 1.00 0.00 ? 82 ILE D CG1 7 16
ATOM 7926 C CG2 . ILE D 1 16 ? -7.122 1.181 -4.867 1.00 0.00 ? 82 ILE D CG2 7 16
ATOM 7927 C CD1 . ILE D 1 16 ? -4.768 0.079 -3.406 1.00 0.00 ? 82 ILE D CD1 7 16
ATOM 7928 H H . ILE D 1 16 ? -8.248 -0.210 -1.338 1.00 0.00 ? 82 ILE D H 7 16
ATOM 7929 H HA . ILE D 1 16 ? -7.826 2.414 -2.281 1.00 0.00 ? 82 ILE D HA 7 16
ATOM 7930 H HB . ILE D 1 16 ? -7.636 -0.342 -3.442 1.00 0.00 ? 82 ILE D HB 7 16
ATOM 7931 H HG12 . ILE D 1 16 ? -5.693 1.809 -2.588 1.00 0.00 ? 82 ILE D HG12 7 16
ATOM 7932 H HG13 . ILE D 1 16 ? -6.036 0.318 -1.749 1.00 0.00 ? 82 ILE D HG13 7 16
ATOM 7933 H HG21 . ILE D 1 16 ? -6.687 2.136 -4.888 1.00 0.00 ? 82 ILE D HG21 7 16
ATOM 7934 H HG22 . ILE D 1 16 ? -6.484 0.556 -5.434 1.00 0.00 ? 82 ILE D HG22 7 16
ATOM 7935 H HG23 . ILE D 1 16 ? -8.065 1.217 -5.343 1.00 0.00 ? 82 ILE D HG23 7 16
ATOM 7936 H HD11 . ILE D 1 16 ? -3.932 0.079 -2.726 1.00 0.00 ? 82 ILE D HD11 7 16
ATOM 7937 H HD12 . ILE D 1 16 ? -5.045 -0.916 -3.671 1.00 0.00 ? 82 ILE D HD12 7 16
ATOM 7938 H HD13 . ILE D 1 16 ? -4.451 0.656 -4.257 1.00 0.00 ? 82 ILE D HD13 7 16
ATOM 7939 N N . LYS D 1 17 ? -10.318 0.900 -3.755 1.00 0.00 ? 83 LYS D N 7 17
ATOM 7940 C CA . LYS D 1 17 ? -11.528 1.021 -4.530 1.00 0.00 ? 83 LYS D CA 7 17
ATOM 7941 C C . LYS D 1 17 ? -12.563 1.888 -3.846 1.00 0.00 ? 83 LYS D C 7 17
ATOM 7942 O O . LYS D 1 17 ? -13.211 2.705 -4.469 1.00 0.00 ? 83 LYS D O 7 17
ATOM 7943 C CB . LYS D 1 17 ? -12.060 -0.368 -4.817 1.00 0.00 ? 83 LYS D CB 7 17
ATOM 7944 C CG . LYS D 1 17 ? -11.934 -0.771 -6.049 1.00 0.00 ? 83 LYS D CG 7 17
ATOM 7945 C CD . LYS D 1 17 ? -12.308 -2.196 -6.340 1.00 0.00 ? 83 LYS D CD 7 17
ATOM 7946 C CE . LYS D 1 17 ? -13.568 -2.581 -6.203 1.00 0.00 ? 83 LYS D CE 7 17
ATOM 7947 N NZ . LYS D 1 17 ? -14.039 -3.254 -6.947 1.00 0.00 ? 83 LYS D NZ 7 17
ATOM 7948 H H . LYS D 1 17 ? -10.038 0.003 -3.445 1.00 0.00 ? 83 LYS D H 7 17
ATOM 7949 H HA . LYS D 1 17 ? -11.268 1.501 -5.460 1.00 0.00 ? 83 LYS D HA 7 17
ATOM 7950 H HB2 . LYS D 1 17 ? -11.538 -1.070 -4.166 1.00 0.00 ? 83 LYS D HB2 7 17
ATOM 7951 H HB3 . LYS D 1 17 ? -12.955 -0.461 -4.627 1.00 0.00 ? 83 LYS D HB3 7 17
ATOM 7952 H HG2 . LYS D 1 17 ? -12.554 -0.137 -6.682 1.00 0.00 ? 83 LYS D HG2 7 17
ATOM 7953 H HG3 . LYS D 1 17 ? -11.060 -0.545 -6.244 1.00 0.00 ? 83 LYS D HG3 7 17
ATOM 7954 H HD2 . LYS D 1 17 ? -12.013 -2.406 -7.368 1.00 0.00 ? 83 LYS D HD2 7 17
ATOM 7955 H HD3 . LYS D 1 17 ? -11.824 -2.747 -5.812 1.00 0.00 ? 83 LYS D HD3 7 17
ATOM 7956 H HE2 . LYS D 1 17 ? -13.608 -3.111 -5.251 1.00 0.00 ? 83 LYS D HE2 7 17
ATOM 7957 H HE3 . LYS D 1 17 ? -14.120 -1.992 -6.105 1.00 0.00 ? 83 LYS D HE3 7 17
ATOM 7958 H HZ1 . LYS D 1 17 ? -14.644 -3.580 -6.578 1.00 0.00 ? 83 LYS D HZ1 7 17
ATOM 7959 H HZ2 . LYS D 1 17 ? -13.504 -3.815 -7.355 1.00 0.00 ? 83 LYS D HZ2 7 17
ATOM 7960 H HZ3 . LYS D 1 17 ? -14.362 -2.855 -7.408 1.00 0.00 ? 83 LYS D HZ3 7 17
ATOM 7961 N N . ALA D 1 18 ? -12.693 1.728 -2.538 1.00 0.00 ? 84 ALA D N 7 18
ATOM 7962 C CA . ALA D 1 18 ? -13.668 2.429 -1.741 1.00 0.00 ? 84 ALA D CA 7 18
ATOM 7963 C C . ALA D 1 18 ? -13.200 3.832 -1.411 1.00 0.00 ? 84 ALA D C 7 18
ATOM 7964 O O . ALA D 1 18 ? -13.976 4.754 -1.430 1.00 0.00 ? 84 ALA D O 7 18
ATOM 7965 C CB . ALA D 1 18 ? -13.923 1.647 -0.469 1.00 0.00 ? 84 ALA D CB 7 18
ATOM 7966 H H . ALA D 1 18 ? -12.134 1.013 -2.124 1.00 0.00 ? 84 ALA D H 7 18
ATOM 7967 H HA . ALA D 1 18 ? -14.595 2.515 -2.290 1.00 0.00 ? 84 ALA D HA 7 18
ATOM 7968 H HB1 . ALA D 1 18 ? -14.302 0.673 -0.671 1.00 0.00 ? 84 ALA D HB1 7 18
ATOM 7969 H HB2 . ALA D 1 18 ? -13.036 1.552 0.128 1.00 0.00 ? 84 ALA D HB2 7 18
ATOM 7970 H HB3 . ALA D 1 18 ? -14.689 2.135 0.105 1.00 0.00 ? 84 ALA D HB3 7 18
ATOM 7971 N N . GLY D 1 19 ? -11.920 4.045 -1.170 1.00 0.00 ? 85 GLY D N 7 19
ATOM 7972 C CA . GLY D 1 19 ? -11.249 5.308 -0.997 1.00 0.00 ? 85 GLY D CA 7 19
ATOM 7973 C C . GLY D 1 19 ? -11.313 6.222 -2.198 1.00 0.00 ? 85 GLY D C 7 19
ATOM 7974 O O . GLY D 1 19 ? -11.544 7.411 -2.092 1.00 0.00 ? 85 GLY D O 7 19
ATOM 7975 H H . GLY D 1 19 ? -11.380 3.214 -1.159 1.00 0.00 ? 85 GLY D H 7 19
ATOM 7976 H HA2 . GLY D 1 19 ? -11.638 5.832 -0.145 1.00 0.00 ? 85 GLY D HA2 7 19
ATOM 7977 H HA3 . GLY D 1 19 ? -10.226 5.086 -0.793 1.00 0.00 ? 85 GLY D HA3 7 19
ATOM 7978 N N . GLY D 1 20 ? -11.187 5.637 -3.382 1.00 0.00 ? 86 GLY D N 7 20
ATOM 7979 C CA . GLY D 1 20 ? -11.105 6.363 -4.620 1.00 0.00 ? 86 GLY D CA 7 20
ATOM 7980 C C . GLY D 1 20 ? -9.760 6.940 -4.938 1.00 0.00 ? 86 GLY D C 7 20
ATOM 7981 O O . GLY D 1 20 ? -9.694 8.078 -5.318 1.00 0.00 ? 86 GLY D O 7 20
ATOM 7982 H H . GLY D 1 20 ? -11.040 4.653 -3.413 1.00 0.00 ? 86 GLY D H 7 20
ATOM 7983 H HA2 . GLY D 1 20 ? -11.364 5.701 -5.411 1.00 0.00 ? 86 GLY D HA2 7 20
ATOM 7984 H HA3 . GLY D 1 20 ? -11.801 7.167 -4.594 1.00 0.00 ? 86 GLY D HA3 7 20
ATOM 7985 N N . TYR D 1 21 ? -8.689 6.185 -4.749 1.00 0.00 ? 87 TYR D N 7 21
ATOM 7986 C CA . TYR D 1 21 ? -7.372 6.530 -5.177 1.00 0.00 ? 87 TYR D CA 7 21
ATOM 7987 C C . TYR D 1 21 ? -7.342 6.796 -6.636 1.00 0.00 ? 87 TYR D C 7 21
ATOM 7988 O O . TYR D 1 21 ? -7.655 5.994 -7.438 1.00 0.00 ? 87 TYR D O 7 21
ATOM 7989 C CB . TYR D 1 21 ? -6.411 5.424 -4.805 1.00 0.00 ? 87 TYR D CB 7 21
ATOM 7990 C CG . TYR D 1 21 ? -5.833 5.546 -3.424 1.00 0.00 ? 87 TYR D CG 7 21
ATOM 7991 C CD1 . TYR D 1 21 ? -5.099 6.654 -3.003 1.00 0.00 ? 87 TYR D CD1 7 21
ATOM 7992 C CD2 . TYR D 1 21 ? -5.968 4.432 -2.604 1.00 0.00 ? 87 TYR D CD2 7 21
ATOM 7993 C CE1 . TYR D 1 21 ? -4.482 6.632 -1.751 1.00 0.00 ? 87 TYR D CE1 7 21
ATOM 7994 C CE2 . TYR D 1 21 ? -5.401 4.406 -1.330 1.00 0.00 ? 87 TYR D CE2 7 21
ATOM 7995 C CZ . TYR D 1 21 ? -4.641 5.513 -0.923 1.00 0.00 ? 87 TYR D CZ 7 21
ATOM 7996 O OH . TYR D 1 21 ? -4.201 5.564 0.361 1.00 0.00 ? 87 TYR D OH 7 21
ATOM 7997 H H . TYR D 1 21 ? -8.837 5.280 -4.385 1.00 0.00 ? 87 TYR D H 7 21
ATOM 7998 H HA . TYR D 1 21 ? -7.117 7.414 -4.643 1.00 0.00 ? 87 TYR D HA 7 21
ATOM 7999 H HB2 . TYR D 1 21 ? -6.948 4.478 -4.877 1.00 0.00 ? 87 TYR D HB2 7 21
ATOM 8000 H HB3 . TYR D 1 21 ? -5.568 5.329 -5.473 1.00 0.00 ? 87 TYR D HB3 7 21
ATOM 8001 H HD1 . TYR D 1 21 ? -4.998 7.533 -3.606 1.00 0.00 ? 87 TYR D HD1 7 21
ATOM 8002 H HD2 . TYR D 1 21 ? -6.491 3.587 -3.012 1.00 0.00 ? 87 TYR D HD2 7 21
ATOM 8003 H HE1 . TYR D 1 21 ? -3.935 7.475 -1.378 1.00 0.00 ? 87 TYR D HE1 7 21
ATOM 8004 H HE2 . TYR D 1 21 ? -5.530 3.531 -0.723 1.00 0.00 ? 87 TYR D HE2 7 21
ATOM 8005 H HH . TYR D 1 21 ? -4.933 5.868 0.869 1.00 0.00 ? 87 TYR D HH 7 21
HETATM 8006 N N . NH2 D 1 22 ? -6.963 7.951 -7.034 1.00 0.00 ? 88 NH2 D N 7 22
HETATM 8007 H HN1 . NH2 D 1 22 ? -6.906 8.199 -7.976 1.00 0.00 ? 88 NH2 D HN1 7 22
HETATM 8008 H HN2 . NH2 D 1 22 ? -6.690 8.537 -6.341 1.00 0.00 ? 88 NH2 D HN2 7 22
HETATM 8009 C C . ACE A 1 1 ? -0.114 13.355 2.056 1.00 0.00 ? 1 ACE A C 8 1
HETATM 8010 O O . ACE A 1 1 ? 0.744 12.623 1.631 1.00 0.00 ? 1 ACE A O 8 1
HETATM 8011 C CH3 . ACE A 1 1 ? 0.060 13.986 3.402 1.00 0.00 ? 1 ACE A CH3 8 1
HETATM 8012 H H1 . ACE A 1 1 ? -0.004 14.134 3.721 1.00 0.00 ? 1 ACE A H1 8 1
HETATM 8013 H H2 . ACE A 1 1 ? 0.154 14.027 3.777 1.00 0.00 ? 1 ACE A H2 8 1
HETATM 8014 H H3 . ACE A 1 1 ? 0.157 14.228 3.671 1.00 0.00 ? 1 ACE A H3 8 1
ATOM 8015 N N . ALA A 1 2 ? -1.198 13.631 1.376 1.00 0.00 ? 2 ALA A N 8 2
ATOM 8016 C CA . ALA A 1 2 ? -1.622 13.029 0.160 1.00 0.00 ? 2 ALA A CA 8 2
ATOM 8017 C C . ALA A 1 2 ? -0.783 13.327 -1.048 1.00 0.00 ? 2 ALA A C 8 2
ATOM 8018 O O . ALA A 1 2 ? -0.961 12.723 -2.043 1.00 0.00 ? 2 ALA A O 8 2
ATOM 8019 C CB . ALA A 1 2 ? -3.073 13.385 -0.060 1.00 0.00 ? 2 ALA A CB 8 2
ATOM 8020 H H . ALA A 1 2 ? -1.788 14.280 1.805 1.00 0.00 ? 2 ALA A H 8 2
ATOM 8021 H HA . ALA A 1 2 ? -1.541 11.971 0.336 1.00 0.00 ? 2 ALA A HA 8 2
ATOM 8022 H HB1 . ALA A 1 2 ? -3.664 13.057 0.751 1.00 0.00 ? 2 ALA A HB1 8 2
ATOM 8023 H HB2 . ALA A 1 2 ? -3.180 14.430 -0.165 1.00 0.00 ? 2 ALA A HB2 8 2
ATOM 8024 H HB3 . ALA A 1 2 ? -3.408 12.928 -0.951 1.00 0.00 ? 2 ALA A HB3 8 2
ATOM 8025 N N . LYS A 1 3 ? 0.191 14.197 -0.986 1.00 0.00 ? 3 LYS A N 8 3
ATOM 8026 C CA . LYS A 1 3 ? 1.235 14.346 -1.950 1.00 0.00 ? 3 LYS A CA 8 3
ATOM 8027 C C . LYS A 1 3 ? 1.936 13.061 -2.324 1.00 0.00 ? 3 LYS A C 8 3
ATOM 8028 O O . LYS A 1 3 ? 2.199 12.802 -3.486 1.00 0.00 ? 3 LYS A O 8 3
ATOM 8029 C CB . LYS A 1 3 ? 2.286 15.236 -1.394 1.00 0.00 ? 3 LYS A CB 8 3
ATOM 8030 C CG . LYS A 1 3 ? 1.808 16.616 -1.029 1.00 0.00 ? 3 LYS A CG 8 3
ATOM 8031 C CD . LYS A 1 3 ? 2.911 17.552 -0.638 1.00 0.00 ? 3 LYS A CD 8 3
ATOM 8032 C CE . LYS A 1 3 ? 3.548 17.187 0.665 1.00 0.00 ? 3 LYS A CE 8 3
ATOM 8033 N NZ . LYS A 1 3 ? 4.567 18.118 1.025 1.00 0.00 ? 3 LYS A NZ 8 3
ATOM 8034 H H . LYS A 1 3 ? 0.230 14.767 -0.190 1.00 0.00 ? 3 LYS A H 8 3
ATOM 8035 H HA . LYS A 1 3 ? 0.816 14.762 -2.829 1.00 0.00 ? 3 LYS A HA 8 3
ATOM 8036 H HB2 . LYS A 1 3 ? 2.701 14.767 -0.501 1.00 0.00 ? 3 LYS A HB2 8 3
ATOM 8037 H HB3 . LYS A 1 3 ? 3.077 15.303 -2.087 1.00 0.00 ? 3 LYS A HB3 8 3
ATOM 8038 H HG2 . LYS A 1 3 ? 1.296 17.035 -1.895 1.00 0.00 ? 3 LYS A HG2 8 3
ATOM 8039 H HG3 . LYS A 1 3 ? 1.067 16.587 -0.261 1.00 0.00 ? 3 LYS A HG3 8 3
ATOM 8040 H HD2 . LYS A 1 3 ? 3.665 17.575 -1.425 1.00 0.00 ? 3 LYS A HD2 8 3
ATOM 8041 H HD3 . LYS A 1 3 ? 2.519 18.536 -0.525 1.00 0.00 ? 3 LYS A HD3 8 3
ATOM 8042 H HE2 . LYS A 1 3 ? 2.789 17.155 1.446 1.00 0.00 ? 3 LYS A HE2 8 3
ATOM 8043 H HE3 . LYS A 1 3 ? 3.972 16.230 0.608 1.00 0.00 ? 3 LYS A HE3 8 3
ATOM 8044 H HZ1 . LYS A 1 3 ? 5.265 18.127 0.373 1.00 0.00 ? 3 LYS A HZ1 8 3
ATOM 8045 H HZ2 . LYS A 1 3 ? 4.220 19.026 1.095 1.00 0.00 ? 3 LYS A HZ2 8 3
ATOM 8046 H HZ3 . LYS A 1 3 ? 4.960 17.883 1.900 1.00 0.00 ? 3 LYS A HZ3 8 3
ATOM 8047 N N . ALA A 1 4 ? 2.193 12.216 -1.341 1.00 0.00 ? 4 ALA A N 8 4
ATOM 8048 C CA . ALA A 1 4 ? 2.754 10.888 -1.418 1.00 0.00 ? 4 ALA A CA 8 4
ATOM 8049 C C . ALA A 1 4 ? 1.916 9.896 -2.198 1.00 0.00 ? 4 ALA A C 8 4
ATOM 8050 O O . ALA A 1 4 ? 2.390 8.803 -2.470 1.00 0.00 ? 4 ALA A O 8 4
ATOM 8051 C CB . ALA A 1 4 ? 2.921 10.431 0.024 1.00 0.00 ? 4 ALA A CB 8 4
ATOM 8052 H H . ALA A 1 4 ? 1.954 12.548 -0.438 1.00 0.00 ? 4 ALA A H 8 4
ATOM 8053 H HA . ALA A 1 4 ? 3.739 10.920 -1.867 1.00 0.00 ? 4 ALA A HA 8 4
ATOM 8054 H HB1 . ALA A 1 4 ? 1.969 10.463 0.519 1.00 0.00 ? 4 ALA A HB1 8 4
ATOM 8055 H HB2 . ALA A 1 4 ? 3.333 9.444 0.105 1.00 0.00 ? 4 ALA A HB2 8 4
ATOM 8056 H HB3 . ALA A 1 4 ? 3.573 11.094 0.541 1.00 0.00 ? 4 ALA A HB3 8 4
ATOM 8057 N N . ALA A 1 5 ? 0.673 10.250 -2.496 1.00 0.00 ? 5 ALA A N 8 5
ATOM 8058 C CA . ALA A 1 5 ? -0.338 9.296 -2.878 1.00 0.00 ? 5 ALA A CA 8 5
ATOM 8059 C C . ALA A 1 5 ? -0.044 8.623 -4.205 1.00 0.00 ? 5 ALA A C 8 5
ATOM 8060 O O . ALA A 1 5 ? 0.492 7.526 -4.212 1.00 0.00 ? 5 ALA A O 8 5
ATOM 8061 C CB . ALA A 1 5 ? -1.737 9.826 -2.636 1.00 0.00 ? 5 ALA A CB 8 5
ATOM 8062 H H . ALA A 1 5 ? 0.420 11.199 -2.340 1.00 0.00 ? 5 ALA A H 8 5
ATOM 8063 H HA . ALA A 1 5 ? -0.286 8.459 -2.193 1.00 0.00 ? 5 ALA A HA 8 5
ATOM 8064 H HB1 . ALA A 1 5 ? -2.474 9.087 -2.891 1.00 0.00 ? 5 ALA A HB1 8 5
ATOM 8065 H HB2 . ALA A 1 5 ? -1.835 10.044 -1.599 1.00 0.00 ? 5 ALA A HB2 8 5
ATOM 8066 H HB3 . ALA A 1 5 ? -1.885 10.695 -3.241 1.00 0.00 ? 5 ALA A HB3 8 5
ATOM 8067 N N . ALA A 1 6 ? -0.389 9.238 -5.328 1.00 0.00 ? 6 ALA A N 8 6
ATOM 8068 C CA . ALA A 1 6 ? -0.209 8.610 -6.615 1.00 0.00 ? 6 ALA A CA 8 6
ATOM 8069 C C . ALA A 1 6 ? 1.215 8.175 -6.878 1.00 0.00 ? 6 ALA A C 8 6
ATOM 8070 O O . ALA A 1 6 ? 1.438 7.140 -7.490 1.00 0.00 ? 6 ALA A O 8 6
ATOM 8071 C CB . ALA A 1 6 ? -0.737 9.555 -7.670 1.00 0.00 ? 6 ALA A CB 8 6
ATOM 8072 H H . ALA A 1 6 ? -0.849 10.123 -5.276 1.00 0.00 ? 6 ALA A H 8 6
ATOM 8073 H HA . ALA A 1 6 ? -0.821 7.715 -6.556 1.00 0.00 ? 6 ALA A HA 8 6
ATOM 8074 H HB1 . ALA A 1 6 ? -0.643 9.156 -8.651 1.00 0.00 ? 6 ALA A HB1 8 6
ATOM 8075 H HB2 . ALA A 1 6 ? -1.778 9.664 -7.536 1.00 0.00 ? 6 ALA A HB2 8 6
ATOM 8076 H HB3 . ALA A 1 6 ? -0.261 10.515 -7.659 1.00 0.00 ? 6 ALA A HB3 8 6
ATOM 8077 N N . ALA A 1 7 ? 2.214 8.829 -6.291 1.00 0.00 ? 7 ALA A N 8 7
ATOM 8078 C CA . ALA A 1 7 ? 3.606 8.475 -6.399 1.00 0.00 ? 7 ALA A CA 8 7
ATOM 8079 C C . ALA A 1 7 ? 3.992 7.135 -5.816 1.00 0.00 ? 7 ALA A C 8 7
ATOM 8080 O O . ALA A 1 7 ? 4.965 6.551 -6.224 1.00 0.00 ? 7 ALA A O 8 7
ATOM 8081 C CB . ALA A 1 7 ? 4.469 9.575 -5.829 1.00 0.00 ? 7 ALA A CB 8 7
ATOM 8082 H H . ALA A 1 7 ? 1.932 9.625 -5.753 1.00 0.00 ? 7 ALA A H 8 7
ATOM 8083 H HA . ALA A 1 7 ? 3.798 8.357 -7.455 1.00 0.00 ? 7 ALA A HA 8 7
ATOM 8084 H HB1 . ALA A 1 7 ? 5.470 9.378 -6.075 1.00 0.00 ? 7 ALA A HB1 8 7
ATOM 8085 H HB2 . ALA A 1 7 ? 4.215 10.524 -6.205 1.00 0.00 ? 7 ALA A HB2 8 7
ATOM 8086 H HB3 . ALA A 1 7 ? 4.368 9.627 -4.794 1.00 0.00 ? 7 ALA A HB3 8 7
ATOM 8087 N N . ALA A 1 8 ? 3.163 6.551 -4.973 1.00 0.00 ? 8 ALA A N 8 8
ATOM 8088 C CA . ALA A 1 8 ? 3.105 5.127 -4.756 1.00 0.00 ? 8 ALA A CA 8 8
ATOM 8089 C C . ALA A 1 8 ? 1.878 4.525 -5.411 1.00 0.00 ? 8 ALA A C 8 8
ATOM 8090 O O . ALA A 1 8 ? 2.011 3.737 -6.334 1.00 0.00 ? 8 ALA A O 8 8
ATOM 8091 C CB . ALA A 1 8 ? 3.174 4.799 -3.280 1.00 0.00 ? 8 ALA A CB 8 8
ATOM 8092 H H . ALA A 1 8 ? 2.346 7.058 -4.710 1.00 0.00 ? 8 ALA A H 8 8
ATOM 8093 H HA . ALA A 1 8 ? 3.950 4.661 -5.244 1.00 0.00 ? 8 ALA A HA 8 8
ATOM 8094 H HB1 . ALA A 1 8 ? 2.449 4.768 -2.840 1.00 0.00 ? 8 ALA A HB1 8 8
ATOM 8095 H HB2 . ALA A 1 8 ? 3.513 4.012 -3.102 1.00 0.00 ? 8 ALA A HB2 8 8
ATOM 8096 H HB3 . ALA A 1 8 ? 3.634 5.317 -2.876 1.00 0.00 ? 8 ALA A HB3 8 8
ATOM 8097 N N . ILE A 1 9 ? 0.691 4.896 -4.942 1.00 0.00 ? 9 ILE A N 8 9
ATOM 8098 C CA . ILE A 1 9 ? -0.541 4.176 -5.172 1.00 0.00 ? 9 ILE A CA 8 9
ATOM 8099 C C . ILE A 1 9 ? -0.894 4.031 -6.638 1.00 0.00 ? 9 ILE A C 8 9
ATOM 8100 O O . ILE A 1 9 ? -1.423 2.993 -6.997 1.00 0.00 ? 9 ILE A O 8 9
ATOM 8101 C CB . ILE A 1 9 ? -1.685 4.830 -4.422 1.00 0.00 ? 9 ILE A CB 8 9
ATOM 8102 C CG1 . ILE A 1 9 ? -1.413 5.171 -2.974 1.00 0.00 ? 9 ILE A CG1 8 9
ATOM 8103 C CG2 . ILE A 1 9 ? -2.922 3.958 -4.468 1.00 0.00 ? 9 ILE A CG2 8 9
ATOM 8104 C CD1 . ILE A 1 9 ? -0.835 4.077 -2.118 1.00 0.00 ? 9 ILE A CD1 8 9
ATOM 8105 H H . ILE A 1 9 ? 0.718 5.636 -4.278 1.00 0.00 ? 9 ILE A H 8 9
ATOM 8106 H HA . ILE A 1 9 ? -0.417 3.178 -4.772 1.00 0.00 ? 9 ILE A HA 8 9
ATOM 8107 H HB . ILE A 1 9 ? -1.942 5.733 -4.956 1.00 0.00 ? 9 ILE A HB 8 9
ATOM 8108 H HG12 . ILE A 1 9 ? -0.715 6.008 -2.956 1.00 0.00 ? 9 ILE A HG12 8 9
ATOM 8109 H HG13 . ILE A 1 9 ? -2.320 5.539 -2.529 1.00 0.00 ? 9 ILE A HG13 8 9
ATOM 8110 H HG21 . ILE A 1 9 ? -3.516 4.318 -4.669 1.00 0.00 ? 9 ILE A HG21 8 9
ATOM 8111 H HG22 . ILE A 1 9 ? -3.172 3.633 -3.866 1.00 0.00 ? 9 ILE A HG22 8 9
ATOM 8112 H HG23 . ILE A 1 9 ? -2.977 3.358 -4.939 1.00 0.00 ? 9 ILE A HG23 8 9
ATOM 8113 H HD11 . ILE A 1 9 ? -1.505 3.244 -2.037 1.00 0.00 ? 9 ILE A HD11 8 9
ATOM 8114 H HD12 . ILE A 1 9 ? 0.069 3.716 -2.555 1.00 0.00 ? 9 ILE A HD12 8 9
ATOM 8115 H HD13 . ILE A 1 9 ? -0.602 4.450 -1.143 1.00 0.00 ? 9 ILE A HD13 8 9
ATOM 8116 N N . LYS A 1 10 ? -0.553 4.978 -7.507 1.00 0.00 ? 10 LYS A N 8 10
ATOM 8117 C CA . LYS A 1 10 ? -0.901 4.935 -8.906 1.00 0.00 ? 10 LYS A CA 8 10
ATOM 8118 C C . LYS A 1 10 ? -0.088 3.931 -9.699 1.00 0.00 ? 10 LYS A C 8 10
ATOM 8119 O O . LYS A 1 10 ? -0.647 3.234 -10.523 1.00 0.00 ? 10 LYS A O 8 10
ATOM 8120 C CB . LYS A 1 10 ? -0.762 6.361 -9.410 1.00 0.00 ? 10 LYS A CB 8 10
ATOM 8121 C CG . LYS A 1 10 ? -1.480 6.762 -10.677 1.00 0.00 ? 10 LYS A CG 8 10
ATOM 8122 C CD . LYS A 1 10 ? -2.953 6.482 -10.657 1.00 0.00 ? 10 LYS A CD 8 10
ATOM 8123 C CE . LYS A 1 10 ? -3.642 7.039 -11.871 1.00 0.00 ? 10 LYS A CE 8 10
ATOM 8124 N NZ . LYS A 1 10 ? -3.370 6.338 -13.068 1.00 0.00 ? 10 LYS A NZ 8 10
ATOM 8125 H H . LYS A 1 10 ? 0.003 5.715 -7.114 1.00 0.00 ? 10 LYS A H 8 10
ATOM 8126 H HA . LYS A 1 10 ? -1.926 4.581 -8.943 1.00 0.00 ? 10 LYS A HA 8 10
ATOM 8127 H HB2 . LYS A 1 10 ? -1.101 7.023 -8.613 1.00 0.00 ? 10 LYS A HB2 8 10
ATOM 8128 H HB3 . LYS A 1 10 ? 0.285 6.579 -9.575 1.00 0.00 ? 10 LYS A HB3 8 10
ATOM 8129 H HG2 . LYS A 1 10 ? -1.326 7.827 -10.852 1.00 0.00 ? 10 LYS A HG2 8 10
ATOM 8130 H HG3 . LYS A 1 10 ? -1.026 6.239 -11.493 1.00 0.00 ? 10 LYS A HG3 8 10
ATOM 8131 H HD2 . LYS A 1 10 ? -3.137 5.411 -10.570 1.00 0.00 ? 10 LYS A HD2 8 10
ATOM 8132 H HD3 . LYS A 1 10 ? -3.356 6.981 -9.820 1.00 0.00 ? 10 LYS A HD3 8 10
ATOM 8133 H HE2 . LYS A 1 10 ? -4.718 7.025 -11.698 1.00 0.00 ? 10 LYS A HE2 8 10
ATOM 8134 H HE3 . LYS A 1 10 ? -3.378 8.027 -11.991 1.00 0.00 ? 10 LYS A HE3 8 10
ATOM 8135 H HZ1 . LYS A 1 10 ? -3.601 6.452 -13.597 1.00 0.00 ? 10 LYS A HZ1 8 10
ATOM 8136 H HZ2 . LYS A 1 10 ? -2.855 6.351 -13.349 1.00 0.00 ? 10 LYS A HZ2 8 10
ATOM 8137 H HZ3 . LYS A 1 10 ? -3.398 5.739 -13.197 1.00 0.00 ? 10 LYS A HZ3 8 10
ATOM 8138 N N . ALA A 1 11 ? 1.189 3.789 -9.365 1.00 0.00 ? 11 ALA A N 8 11
ATOM 8139 C CA . ALA A 1 11 ? 2.002 2.673 -9.793 1.00 0.00 ? 11 ALA A CA 8 11
ATOM 8140 C C . ALA A 1 11 ? 1.585 1.394 -9.093 1.00 0.00 ? 11 ALA A C 8 11
ATOM 8141 O O . ALA A 1 11 ? 1.436 0.352 -9.716 1.00 0.00 ? 11 ALA A O 8 11
ATOM 8142 C CB . ALA A 1 11 ? 3.462 3.003 -9.575 1.00 0.00 ? 11 ALA A CB 8 11
ATOM 8143 H H . ALA A 1 11 ? 1.535 4.414 -8.668 1.00 0.00 ? 11 ALA A H 8 11
ATOM 8144 H HA . ALA A 1 11 ? 1.871 2.511 -10.850 1.00 0.00 ? 11 ALA A HA 8 11
ATOM 8145 H HB1 . ALA A 1 11 ? 4.105 2.221 -9.919 1.00 0.00 ? 11 ALA A HB1 8 11
ATOM 8146 H HB2 . ALA A 1 11 ? 3.712 3.876 -10.133 1.00 0.00 ? 11 ALA A HB2 8 11
ATOM 8147 H HB3 . ALA A 1 11 ? 3.618 3.212 -8.547 1.00 0.00 ? 11 ALA A HB3 8 11
ATOM 8148 N N . ILE A 1 12 ? 1.335 1.419 -7.785 1.00 0.00 ? 12 ILE A N 8 12
ATOM 8149 C CA . ILE A 1 12 ? 1.186 0.256 -6.941 1.00 0.00 ? 12 ILE A CA 8 12
ATOM 8150 C C . ILE A 1 12 ? -0.134 -0.441 -7.210 1.00 0.00 ? 12 ILE A C 8 12
ATOM 8151 O O . ILE A 1 12 ? -0.140 -1.658 -7.341 1.00 0.00 ? 12 ILE A O 8 12
ATOM 8152 C CB . ILE A 1 12 ? 1.459 0.567 -5.486 1.00 0.00 ? 12 ILE A CB 8 12
ATOM 8153 C CG1 . ILE A 1 12 ? 2.906 0.923 -5.213 1.00 0.00 ? 12 ILE A CG1 8 12
ATOM 8154 C CG2 . ILE A 1 12 ? 0.966 -0.494 -4.537 1.00 0.00 ? 12 ILE A CG2 8 12
ATOM 8155 C CD1 . ILE A 1 12 ? 3.864 -0.234 -5.210 1.00 0.00 ? 12 ILE A CD1 8 12
ATOM 8156 H H . ILE A 1 12 ? 1.264 2.321 -7.349 1.00 0.00 ? 12 ILE A H 8 12
ATOM 8157 H HA . ILE A 1 12 ? 1.930 -0.458 -7.273 1.00 0.00 ? 12 ILE A HA 8 12
ATOM 8158 H HB . ILE A 1 12 ? 0.882 1.443 -5.244 1.00 0.00 ? 12 ILE A HB 8 12
ATOM 8159 H HG12 . ILE A 1 12 ? 3.230 1.642 -5.965 1.00 0.00 ? 12 ILE A HG12 8 12
ATOM 8160 H HG13 . ILE A 1 12 ? 2.988 1.411 -4.257 1.00 0.00 ? 12 ILE A HG13 8 12
ATOM 8161 H HG21 . ILE A 1 12 ? -0.095 -0.482 -4.520 1.00 0.00 ? 12 ILE A HG21 8 12
ATOM 8162 H HG22 . ILE A 1 12 ? 1.320 -1.459 -4.828 1.00 0.00 ? 12 ILE A HG22 8 12
ATOM 8163 H HG23 . ILE A 1 12 ? 1.312 -0.293 -3.547 1.00 0.00 ? 12 ILE A HG23 8 12
ATOM 8164 H HD11 . ILE A 1 12 ? 4.181 -0.432 -5.683 1.00 0.00 ? 12 ILE A HD11 8 12
ATOM 8165 H HD12 . ILE A 1 12 ? 4.443 -0.318 -4.859 1.00 0.00 ? 12 ILE A HD12 8 12
ATOM 8166 H HD13 . ILE A 1 12 ? 3.710 -0.782 -5.080 1.00 0.00 ? 12 ILE A HD13 8 12
ATOM 8167 N N . ALA A 1 13 ? -1.223 0.291 -7.441 1.00 0.00 ? 13 ALA A N 8 13
ATOM 8168 C CA . ALA A 1 13 ? -2.471 -0.346 -7.784 1.00 0.00 ? 13 ALA A CA 8 13
ATOM 8169 C C . ALA A 1 13 ? -2.483 -1.095 -9.100 1.00 0.00 ? 13 ALA A C 8 13
ATOM 8170 O O . ALA A 1 13 ? -3.261 -2.009 -9.284 1.00 0.00 ? 13 ALA A O 8 13
ATOM 8171 C CB . ALA A 1 13 ? -3.566 0.707 -7.717 1.00 0.00 ? 13 ALA A CB 8 13
ATOM 8172 H H . ALA A 1 13 ? -1.156 1.294 -7.403 1.00 0.00 ? 13 ALA A H 8 13
ATOM 8173 H HA . ALA A 1 13 ? -2.653 -1.075 -7.003 1.00 0.00 ? 13 ALA A HA 8 13
ATOM 8174 H HB1 . ALA A 1 13 ? -3.586 1.126 -6.722 1.00 0.00 ? 13 ALA A HB1 8 13
ATOM 8175 H HB2 . ALA A 1 13 ? -3.353 1.458 -8.457 1.00 0.00 ? 13 ALA A HB2 8 13
ATOM 8176 H HB3 . ALA A 1 13 ? -4.500 0.222 -7.919 1.00 0.00 ? 13 ALA A HB3 8 13
ATOM 8177 N N . ALA A 1 14 ? -1.569 -0.768 -10.000 1.00 0.00 ? 14 ALA A N 8 14
ATOM 8178 C CA . ALA A 1 14 ? -1.298 -1.426 -11.258 1.00 0.00 ? 14 ALA A CA 8 14
ATOM 8179 C C . ALA A 1 14 ? -0.321 -2.570 -11.098 1.00 0.00 ? 14 ALA A C 8 14
ATOM 8180 O O . ALA A 1 14 ? -0.528 -3.645 -11.631 1.00 0.00 ? 14 ALA A O 8 14
ATOM 8181 C CB . ALA A 1 14 ? -0.825 -0.401 -12.277 1.00 0.00 ? 14 ALA A CB 8 14
ATOM 8182 H H . ALA A 1 14 ? -0.926 -0.114 -9.601 1.00 0.00 ? 14 ALA A H 8 14
ATOM 8183 H HA . ALA A 1 14 ? -2.230 -1.833 -11.630 1.00 0.00 ? 14 ALA A HA 8 14
ATOM 8184 H HB1 . ALA A 1 14 ? -1.521 0.402 -12.393 1.00 0.00 ? 14 ALA A HB1 8 14
ATOM 8185 H HB2 . ALA A 1 14 ? 0.117 0.021 -11.963 1.00 0.00 ? 14 ALA A HB2 8 14
ATOM 8186 H HB3 . ALA A 1 14 ? -0.679 -0.829 -13.257 1.00 0.00 ? 14 ALA A HB3 8 14
ATOM 8187 N N . ILE A 1 15 ? 0.729 -2.370 -10.308 1.00 0.00 ? 15 ILE A N 8 15
ATOM 8188 C CA . ILE A 1 15 ? 1.687 -3.365 -9.879 1.00 0.00 ? 15 ILE A CA 8 15
ATOM 8189 C C . ILE A 1 15 ? 0.996 -4.500 -9.143 1.00 0.00 ? 15 ILE A C 8 15
ATOM 8190 O O . ILE A 1 15 ? 1.368 -5.648 -9.338 1.00 0.00 ? 15 ILE A O 8 15
ATOM 8191 C CB . ILE A 1 15 ? 2.806 -2.699 -9.091 1.00 0.00 ? 15 ILE A CB 8 15
ATOM 8192 C CG1 . ILE A 1 15 ? 3.719 -1.927 -10.027 1.00 0.00 ? 15 ILE A CG1 8 15
ATOM 8193 C CG2 . ILE A 1 15 ? 3.607 -3.657 -8.224 1.00 0.00 ? 15 ILE A CG2 8 15
ATOM 8194 C CD1 . ILE A 1 15 ? 4.528 -0.826 -9.360 1.00 0.00 ? 15 ILE A CD1 8 15
ATOM 8195 H H . ILE A 1 15 ? 0.775 -1.461 -9.887 1.00 0.00 ? 15 ILE A H 8 15
ATOM 8196 H HA . ILE A 1 15 ? 2.123 -3.827 -10.759 1.00 0.00 ? 15 ILE A HA 8 15
ATOM 8197 H HB . ILE A 1 15 ? 2.364 -1.988 -8.411 1.00 0.00 ? 15 ILE A HB 8 15
ATOM 8198 H HG12 . ILE A 1 15 ? 4.402 -2.630 -10.504 1.00 0.00 ? 15 ILE A HG12 8 15
ATOM 8199 H HG13 . ILE A 1 15 ? 3.143 -1.455 -10.815 1.00 0.00 ? 15 ILE A HG13 8 15
ATOM 8200 H HG21 . ILE A 1 15 ? 4.388 -3.115 -7.728 1.00 0.00 ? 15 ILE A HG21 8 15
ATOM 8201 H HG22 . ILE A 1 15 ? 2.963 -4.085 -7.482 1.00 0.00 ? 15 ILE A HG22 8 15
ATOM 8202 H HG23 . ILE A 1 15 ? 4.049 -4.408 -8.843 1.00 0.00 ? 15 ILE A HG23 8 15
ATOM 8203 H HD11 . ILE A 1 15 ? 5.041 -0.260 -10.117 1.00 0.00 ? 15 ILE A HD11 8 15
ATOM 8204 H HD12 . ILE A 1 15 ? 3.894 -0.151 -8.816 1.00 0.00 ? 15 ILE A HD12 8 15
ATOM 8205 H HD13 . ILE A 1 15 ? 5.262 -1.253 -8.702 1.00 0.00 ? 15 ILE A HD13 8 15
ATOM 8206 N N . ILE A 1 16 ? 0.001 -4.209 -8.308 1.00 0.00 ? 16 ILE A N 8 16
ATOM 8207 C CA . ILE A 1 16 ? -0.857 -5.180 -7.670 1.00 0.00 ? 16 ILE A CA 8 16
ATOM 8208 C C . ILE A 1 16 ? -1.621 -6.038 -8.660 1.00 0.00 ? 16 ILE A C 8 16
ATOM 8209 O O . ILE A 1 16 ? -1.531 -7.253 -8.585 1.00 0.00 ? 16 ILE A O 8 16
ATOM 8210 C CB . ILE A 1 16 ? -1.768 -4.486 -6.672 1.00 0.00 ? 16 ILE A CB 8 16
ATOM 8211 C CG1 . ILE A 1 16 ? -0.912 -4.092 -5.482 1.00 0.00 ? 16 ILE A CG1 8 16
ATOM 8212 C CG2 . ILE A 1 16 ? -2.923 -5.378 -6.247 1.00 0.00 ? 16 ILE A CG2 8 16
ATOM 8213 C CD1 . ILE A 1 16 ? -1.639 -3.543 -4.272 1.00 0.00 ? 16 ILE A CD1 8 16
ATOM 8214 H H . ILE A 1 16 ? -0.160 -3.246 -8.084 1.00 0.00 ? 16 ILE A H 8 16
ATOM 8215 H HA . ILE A 1 16 ? -0.233 -5.872 -7.118 1.00 0.00 ? 16 ILE A HA 8 16
ATOM 8216 H HB . ILE A 1 16 ? -2.170 -3.597 -7.150 1.00 0.00 ? 16 ILE A HB 8 16
ATOM 8217 H HG12 . ILE A 1 16 ? -0.357 -4.976 -5.167 1.00 0.00 ? 16 ILE A HG12 8 16
ATOM 8218 H HG13 . ILE A 1 16 ? -0.170 -3.366 -5.778 1.00 0.00 ? 16 ILE A HG13 8 16
ATOM 8219 H HG21 . ILE A 1 16 ? -3.599 -5.572 -7.046 1.00 0.00 ? 16 ILE A HG21 8 16
ATOM 8220 H HG22 . ILE A 1 16 ? -2.576 -6.325 -5.880 1.00 0.00 ? 16 ILE A HG22 8 16
ATOM 8221 H HG23 . ILE A 1 16 ? -3.541 -4.914 -5.499 1.00 0.00 ? 16 ILE A HG23 8 16
ATOM 8222 H HD11 . ILE A 1 16 ? -2.053 -4.377 -3.766 1.00 0.00 ? 16 ILE A HD11 8 16
ATOM 8223 H HD12 . ILE A 1 16 ? -0.947 -3.078 -3.634 1.00 0.00 ? 16 ILE A HD12 8 16
ATOM 8224 H HD13 . ILE A 1 16 ? -2.391 -2.848 -4.546 1.00 0.00 ? 16 ILE A HD13 8 16
ATOM 8225 N N . LYS A 1 17 ? -2.322 -5.412 -9.603 1.00 0.00 ? 17 LYS A N 8 17
ATOM 8226 C CA . LYS A 1 17 ? -3.079 -6.095 -10.625 1.00 0.00 ? 17 LYS A CA 8 17
ATOM 8227 C C . LYS A 1 17 ? -2.206 -6.967 -11.490 1.00 0.00 ? 17 LYS A C 8 17
ATOM 8228 O O . LYS A 1 17 ? -2.595 -8.065 -11.835 1.00 0.00 ? 17 LYS A O 8 17
ATOM 8229 C CB . LYS A 1 17 ? -3.782 -5.036 -11.440 1.00 0.00 ? 17 LYS A CB 8 17
ATOM 8230 C CG . LYS A 1 17 ? -4.806 -5.586 -12.388 1.00 0.00 ? 17 LYS A CG 8 17
ATOM 8231 C CD . LYS A 1 17 ? -6.032 -5.486 -12.241 1.00 0.00 ? 17 LYS A CD 8 17
ATOM 8232 C CE . LYS A 1 17 ? -6.376 -4.432 -12.382 1.00 0.00 ? 17 LYS A CE 8 17
ATOM 8233 N NZ . LYS A 1 17 ? -7.540 -4.252 -12.208 1.00 0.00 ? 17 LYS A NZ 8 17
ATOM 8234 H H . LYS A 1 17 ? -2.348 -4.423 -9.545 1.00 0.00 ? 17 LYS A H 8 17
ATOM 8235 H HA . LYS A 1 17 ? -3.794 -6.740 -10.145 1.00 0.00 ? 17 LYS A HA 8 17
ATOM 8236 H HB2 . LYS A 1 17 ? -4.281 -4.353 -10.752 1.00 0.00 ? 17 LYS A HB2 8 17
ATOM 8237 H HB3 . LYS A 1 17 ? -3.095 -4.429 -11.985 1.00 0.00 ? 17 LYS A HB3 8 17
ATOM 8238 H HG2 . LYS A 1 17 ? -4.578 -5.163 -13.367 1.00 0.00 ? 17 LYS A HG2 8 17
ATOM 8239 H HG3 . LYS A 1 17 ? -4.719 -6.355 -12.430 1.00 0.00 ? 17 LYS A HG3 8 17
ATOM 8240 H HD2 . LYS A 1 17 ? -6.589 -6.180 -12.870 1.00 0.00 ? 17 LYS A HD2 8 17
ATOM 8241 H HD3 . LYS A 1 17 ? -6.060 -5.662 -11.425 1.00 0.00 ? 17 LYS A HD3 8 17
ATOM 8242 H HE2 . LYS A 1 17 ? -5.778 -3.756 -11.770 1.00 0.00 ? 17 LYS A HE2 8 17
ATOM 8243 H HE3 . LYS A 1 17 ? -6.337 -4.255 -13.171 1.00 0.00 ? 17 LYS A HE3 8 17
ATOM 8244 H HZ1 . LYS A 1 17 ? -7.575 -4.485 -11.462 1.00 0.00 ? 17 LYS A HZ1 8 17
ATOM 8245 H HZ2 . LYS A 1 17 ? -8.172 -4.638 -12.802 1.00 0.00 ? 17 LYS A HZ2 8 17
ATOM 8246 H HZ3 . LYS A 1 17 ? -7.733 -3.507 -12.283 1.00 0.00 ? 17 LYS A HZ3 8 17
ATOM 8247 N N . ALA A 1 18 ? -0.986 -6.556 -11.796 1.00 0.00 ? 18 ALA A N 8 18
ATOM 8248 C CA . ALA A 1 18 ? 0.024 -7.345 -12.464 1.00 0.00 ? 18 ALA A CA 8 18
ATOM 8249 C C . ALA A 1 18 ? 0.759 -8.339 -11.589 1.00 0.00 ? 18 ALA A C 8 18
ATOM 8250 O O . ALA A 1 18 ? 1.277 -9.322 -12.080 1.00 0.00 ? 18 ALA A O 8 18
ATOM 8251 C CB . ALA A 1 18 ? 1.004 -6.380 -13.101 1.00 0.00 ? 18 ALA A CB 8 18
ATOM 8252 H H . ALA A 1 18 ? -0.753 -5.624 -11.504 1.00 0.00 ? 18 ALA A H 8 18
ATOM 8253 H HA . ALA A 1 18 ? -0.414 -7.889 -13.279 1.00 0.00 ? 18 ALA A HA 8 18
ATOM 8254 H HB1 . ALA A 1 18 ? 0.535 -5.778 -13.842 1.00 0.00 ? 18 ALA A HB1 8 18
ATOM 8255 H HB2 . ALA A 1 18 ? 1.414 -5.732 -12.389 1.00 0.00 ? 18 ALA A HB2 8 18
ATOM 8256 H HB3 . ALA A 1 18 ? 1.810 -6.880 -13.559 1.00 0.00 ? 18 ALA A HB3 8 18
ATOM 8257 N N . GLY A 1 19 ? 0.834 -8.111 -10.286 1.00 0.00 ? 19 GLY A N 8 19
ATOM 8258 C CA . GLY A 1 19 ? 1.574 -8.853 -9.296 1.00 0.00 ? 19 GLY A CA 8 19
ATOM 8259 C C . GLY A 1 19 ? 0.964 -10.199 -8.975 1.00 0.00 ? 19 GLY A C 8 19
ATOM 8260 O O . GLY A 1 19 ? 1.692 -11.119 -8.691 1.00 0.00 ? 19 GLY A O 8 19
ATOM 8261 H H . GLY A 1 19 ? 0.443 -7.246 -10.007 1.00 0.00 ? 19 GLY A H 8 19
ATOM 8262 H HA2 . GLY A 1 19 ? 2.583 -9.020 -9.641 1.00 0.00 ? 19 GLY A HA2 8 19
ATOM 8263 H HA3 . GLY A 1 19 ? 1.629 -8.297 -8.371 1.00 0.00 ? 19 GLY A HA3 8 19
ATOM 8264 N N . GLY A 1 20 ? -0.342 -10.319 -9.002 1.00 0.00 ? 20 GLY A N 8 20
ATOM 8265 C CA . GLY A 1 20 ? -1.043 -11.516 -8.636 1.00 0.00 ? 20 GLY A CA 8 20
ATOM 8266 C C . GLY A 1 20 ? -1.397 -11.639 -7.173 1.00 0.00 ? 20 GLY A C 8 20
ATOM 8267 O O . GLY A 1 20 ? -1.733 -12.716 -6.722 1.00 0.00 ? 20 GLY A O 8 20
ATOM 8268 H H . GLY A 1 20 ? -0.869 -9.541 -9.292 1.00 0.00 ? 20 GLY A H 8 20
ATOM 8269 H HA2 . GLY A 1 20 ? -1.951 -11.534 -9.196 1.00 0.00 ? 20 GLY A HA2 8 20
ATOM 8270 H HA3 . GLY A 1 20 ? -0.455 -12.363 -8.925 1.00 0.00 ? 20 GLY A HA3 8 20
ATOM 8271 N N . TYR A 1 21 ? -1.302 -10.566 -6.403 1.00 0.00 ? 21 TYR A N 8 21
ATOM 8272 C CA . TYR A 1 21 ? -1.562 -10.501 -4.994 1.00 0.00 ? 21 TYR A CA 8 21
ATOM 8273 C C . TYR A 1 21 ? -2.930 -11.020 -4.616 1.00 0.00 ? 21 TYR A C 8 21
ATOM 8274 O O . TYR A 1 21 ? -3.094 -11.579 -3.564 1.00 0.00 ? 21 TYR A O 8 21
ATOM 8275 C CB . TYR A 1 21 ? -1.435 -9.046 -4.580 1.00 0.00 ? 21 TYR A CB 8 21
ATOM 8276 C CG . TYR A 1 21 ? -0.078 -8.507 -4.214 1.00 0.00 ? 21 TYR A CG 8 21
ATOM 8277 C CD1 . TYR A 1 21 ? 0.550 -8.830 -3.016 1.00 0.00 ? 21 TYR A CD1 8 21
ATOM 8278 C CD2 . TYR A 1 21 ? 0.427 -7.529 -5.062 1.00 0.00 ? 21 TYR A CD2 8 21
ATOM 8279 C CE1 . TYR A 1 21 ? 1.636 -8.058 -2.611 1.00 0.00 ? 21 TYR A CE1 8 21
ATOM 8280 C CE2 . TYR A 1 21 ? 1.510 -6.749 -4.661 1.00 0.00 ? 21 TYR A CE2 8 21
ATOM 8281 C CZ . TYR A 1 21 ? 2.075 -7.001 -3.406 1.00 0.00 ? 21 TYR A CZ 8 21
ATOM 8282 O OH . TYR A 1 21 ? 3.137 -6.259 -2.998 1.00 0.00 ? 21 TYR A OH 8 21
ATOM 8283 H H . TYR A 1 21 ? -1.131 -9.689 -6.837 1.00 0.00 ? 21 TYR A H 8 21
ATOM 8284 H HA . TYR A 1 21 ? -0.821 -11.105 -4.501 1.00 0.00 ? 21 TYR A HA 8 21
ATOM 8285 H HB2 . TYR A 1 21 ? -1.805 -8.450 -5.414 1.00 0.00 ? 21 TYR A HB2 8 21
ATOM 8286 H HB3 . TYR A 1 21 ? -2.089 -8.814 -3.748 1.00 0.00 ? 21 TYR A HB3 8 21
ATOM 8287 H HD1 . TYR A 1 21 ? 0.200 -9.592 -2.355 1.00 0.00 ? 21 TYR A HD1 8 21
ATOM 8288 H HD2 . TYR A 1 21 ? -0.099 -7.342 -5.977 1.00 0.00 ? 21 TYR A HD2 8 21
ATOM 8289 H HE1 . TYR A 1 21 ? 2.107 -8.277 -1.683 1.00 0.00 ? 21 TYR A HE1 8 21
ATOM 8290 H HE2 . TYR A 1 21 ? 1.908 -5.968 -5.268 1.00 0.00 ? 21 TYR A HE2 8 21
ATOM 8291 H HH . TYR A 1 21 ? 3.877 -6.539 -3.504 1.00 0.00 ? 21 TYR A HH 8 21
HETATM 8292 N N . NH2 A 1 22 ? -3.946 -10.868 -5.417 1.00 0.00 ? 22 NH2 A N 8 22
HETATM 8293 H HN1 . NH2 A 1 22 ? -4.826 -11.217 -5.126 1.00 0.00 ? 22 NH2 A HN1 8 22
HETATM 8294 H HN2 . NH2 A 1 22 ? -3.829 -10.452 -6.301 1.00 0.00 ? 22 NH2 A HN2 8 22
HETATM 8295 C C . ACE B 1 1 ? 1.424 -13.605 -5.433 1.00 0.00 ? 23 ACE B C 8 1
HETATM 8296 O O . ACE B 1 1 ? 1.938 -12.588 -5.819 1.00 0.00 ? 23 ACE B O 8 1
HETATM 8297 C CH3 . ACE B 1 1 ? 1.046 -14.678 -6.384 1.00 0.00 ? 23 ACE B CH3 8 1
HETATM 8298 H H1 . ACE B 1 1 ? 1.117 -15.189 -6.287 1.00 0.00 ? 23 ACE B H1 8 1
HETATM 8299 H H2 . ACE B 1 1 ? 0.503 -14.757 -6.612 1.00 0.00 ? 23 ACE B H2 8 1
HETATM 8300 H H3 . ACE B 1 1 ? 1.242 -14.790 -6.987 1.00 0.00 ? 23 ACE B H3 8 1
ATOM 8301 N N . ALA B 1 2 ? 1.254 -13.857 -4.160 1.00 0.00 ? 24 ALA B N 8 2
ATOM 8302 C CA . ALA B 1 2 ? 1.615 -12.983 -3.103 1.00 0.00 ? 24 ALA B CA 8 2
ATOM 8303 C C . ALA B 1 2 ? 3.076 -12.618 -3.014 1.00 0.00 ? 24 ALA B C 8 2
ATOM 8304 O O . ALA B 1 2 ? 3.467 -11.694 -2.327 1.00 0.00 ? 24 ALA B O 8 2
ATOM 8305 C CB . ALA B 1 2 ? 1.102 -13.538 -1.816 1.00 0.00 ? 24 ALA B CB 8 2
ATOM 8306 H H . ALA B 1 2 ? 0.841 -14.707 -3.917 1.00 0.00 ? 24 ALA B H 8 2
ATOM 8307 H HA . ALA B 1 2 ? 1.093 -12.090 -3.307 1.00 0.00 ? 24 ALA B HA 8 2
ATOM 8308 H HB1 . ALA B 1 2 ? 0.058 -13.731 -1.905 1.00 0.00 ? 24 ALA B HB1 8 2
ATOM 8309 H HB2 . ALA B 1 2 ? 1.583 -14.429 -1.580 1.00 0.00 ? 24 ALA B HB2 8 2
ATOM 8310 H HB3 . ALA B 1 2 ? 1.251 -12.840 -1.043 1.00 0.00 ? 24 ALA B HB3 8 2
ATOM 8311 N N . LYS B 1 3 ? 3.931 -13.311 -3.732 1.00 0.00 ? 25 LYS B N 8 3
ATOM 8312 C CA . LYS B 1 3 ? 5.329 -13.004 -3.891 1.00 0.00 ? 25 LYS B CA 8 3
ATOM 8313 C C . LYS B 1 3 ? 5.619 -11.689 -4.580 1.00 0.00 ? 25 LYS B C 8 3
ATOM 8314 O O . LYS B 1 3 ? 6.758 -11.248 -4.608 1.00 0.00 ? 25 LYS B O 8 3
ATOM 8315 C CB . LYS B 1 3 ? 6.028 -14.104 -4.657 1.00 0.00 ? 25 LYS B CB 8 3
ATOM 8316 C CG . LYS B 1 3 ? 6.105 -15.414 -3.908 1.00 0.00 ? 25 LYS B CG 8 3
ATOM 8317 C CD . LYS B 1 3 ? 6.824 -16.467 -4.681 1.00 0.00 ? 25 LYS B CD 8 3
ATOM 8318 C CE . LYS B 1 3 ? 7.076 -17.675 -3.869 1.00 0.00 ? 25 LYS B CE 8 3
ATOM 8319 N NZ . LYS B 1 3 ? 7.618 -18.767 -4.561 1.00 0.00 ? 25 LYS B NZ 8 3
ATOM 8320 H H . LYS B 1 3 ? 3.548 -14.045 -4.242 1.00 0.00 ? 25 LYS B H 8 3
ATOM 8321 H HA . LYS B 1 3 ? 5.804 -12.921 -2.933 1.00 0.00 ? 25 LYS B HA 8 3
ATOM 8322 H HB2 . LYS B 1 3 ? 5.520 -14.261 -5.609 1.00 0.00 ? 25 LYS B HB2 8 3
ATOM 8323 H HB3 . LYS B 1 3 ? 7.022 -13.786 -4.863 1.00 0.00 ? 25 LYS B HB3 8 3
ATOM 8324 H HG2 . LYS B 1 3 ? 6.602 -15.257 -2.951 1.00 0.00 ? 25 LYS B HG2 8 3
ATOM 8325 H HG3 . LYS B 1 3 ? 5.138 -15.765 -3.711 1.00 0.00 ? 25 LYS B HG3 8 3
ATOM 8326 H HD2 . LYS B 1 3 ? 6.238 -16.738 -5.560 1.00 0.00 ? 25 LYS B HD2 8 3
ATOM 8327 H HD3 . LYS B 1 3 ? 7.726 -16.074 -5.025 1.00 0.00 ? 25 LYS B HD3 8 3
ATOM 8328 H HE2 . LYS B 1 3 ? 7.743 -17.411 -3.049 1.00 0.00 ? 25 LYS B HE2 8 3
ATOM 8329 H HE3 . LYS B 1 3 ? 6.224 -17.984 -3.477 1.00 0.00 ? 25 LYS B HE3 8 3
ATOM 8330 H HZ1 . LYS B 1 3 ? 7.875 -19.231 -4.395 1.00 0.00 ? 25 LYS B HZ1 8 3
ATOM 8331 H HZ2 . LYS B 1 3 ? 7.393 -19.052 -4.860 1.00 0.00 ? 25 LYS B HZ2 8 3
ATOM 8332 H HZ3 . LYS B 1 3 ? 7.970 -18.853 -4.942 1.00 0.00 ? 25 LYS B HZ3 8 3
ATOM 8333 N N . ALA B 1 4 ? 4.591 -11.043 -5.126 1.00 0.00 ? 26 ALA B N 8 4
ATOM 8334 C CA . ALA B 1 4 ? 4.614 -9.637 -5.460 1.00 0.00 ? 26 ALA B CA 8 4
ATOM 8335 C C . ALA B 1 4 ? 4.906 -8.717 -4.291 1.00 0.00 ? 26 ALA B C 8 4
ATOM 8336 O O . ALA B 1 4 ? 5.073 -7.516 -4.461 1.00 0.00 ? 26 ALA B O 8 4
ATOM 8337 C CB . ALA B 1 4 ? 3.259 -9.316 -6.059 1.00 0.00 ? 26 ALA B CB 8 4
ATOM 8338 H H . ALA B 1 4 ? 3.726 -11.543 -5.183 1.00 0.00 ? 26 ALA B H 8 4
ATOM 8339 H HA . ALA B 1 4 ? 5.380 -9.481 -6.212 1.00 0.00 ? 26 ALA B HA 8 4
ATOM 8340 H HB1 . ALA B 1 4 ? 3.118 -9.926 -6.939 1.00 0.00 ? 26 ALA B HB1 8 4
ATOM 8341 H HB2 . ALA B 1 4 ? 2.469 -9.526 -5.355 1.00 0.00 ? 26 ALA B HB2 8 4
ATOM 8342 H HB3 . ALA B 1 4 ? 3.168 -8.293 -6.372 1.00 0.00 ? 26 ALA B HB3 8 4
ATOM 8343 N N . ALA B 1 5 ? 5.014 -9.262 -3.083 1.00 0.00 ? 27 ALA B N 8 5
ATOM 8344 C CA . ALA B 1 5 ? 5.222 -8.520 -1.866 1.00 0.00 ? 27 ALA B CA 8 5
ATOM 8345 C C . ALA B 1 5 ? 6.506 -7.709 -1.821 1.00 0.00 ? 27 ALA B C 8 5
ATOM 8346 O O . ALA B 1 5 ? 6.494 -6.516 -2.104 1.00 0.00 ? 27 ALA B O 8 5
ATOM 8347 C CB . ALA B 1 5 ? 5.008 -9.466 -0.701 1.00 0.00 ? 27 ALA B CB 8 5
ATOM 8348 H H . ALA B 1 5 ? 4.930 -10.248 -3.014 1.00 0.00 ? 27 ALA B H 8 5
ATOM 8349 H HA . ALA B 1 5 ? 4.457 -7.755 -1.797 1.00 0.00 ? 27 ALA B HA 8 5
ATOM 8350 H HB1 . ALA B 1 5 ? 5.231 -8.945 0.201 1.00 0.00 ? 27 ALA B HB1 8 5
ATOM 8351 H HB2 . ALA B 1 5 ? 3.966 -9.716 -0.679 1.00 0.00 ? 27 ALA B HB2 8 5
ATOM 8352 H HB3 . ALA B 1 5 ? 5.592 -10.366 -0.753 1.00 0.00 ? 27 ALA B HB3 8 5
ATOM 8353 N N . ALA B 1 6 ? 7.639 -8.333 -1.515 1.00 0.00 ? 28 ALA B N 8 6
ATOM 8354 C CA . ALA B 1 6 ? 8.855 -7.653 -1.148 1.00 0.00 ? 28 ALA B CA 8 6
ATOM 8355 C C . ALA B 1 6 ? 9.521 -6.884 -2.271 1.00 0.00 ? 28 ALA B C 8 6
ATOM 8356 O O . ALA B 1 6 ? 10.537 -6.252 -2.059 1.00 0.00 ? 28 ALA B O 8 6
ATOM 8357 C CB . ALA B 1 6 ? 9.780 -8.638 -0.453 1.00 0.00 ? 28 ALA B CB 8 6
ATOM 8358 H H . ALA B 1 6 ? 7.575 -9.320 -1.380 1.00 0.00 ? 28 ALA B H 8 6
ATOM 8359 H HA . ALA B 1 6 ? 8.501 -6.901 -0.457 1.00 0.00 ? 28 ALA B HA 8 6
ATOM 8360 H HB1 . ALA B 1 6 ? 10.154 -9.337 -1.129 1.00 0.00 ? 28 ALA B HB1 8 6
ATOM 8361 H HB2 . ALA B 1 6 ? 10.546 -8.111 0.008 1.00 0.00 ? 28 ALA B HB2 8 6
ATOM 8362 H HB3 . ALA B 1 6 ? 9.301 -9.181 0.290 1.00 0.00 ? 28 ALA B HB3 8 6
ATOM 8363 N N . ALA B 1 7 ? 8.998 -6.842 -3.482 1.00 0.00 ? 29 ALA B N 8 7
ATOM 8364 C CA . ALA B 1 7 ? 9.340 -5.924 -4.538 1.00 0.00 ? 29 ALA B CA 8 7
ATOM 8365 C C . ALA B 1 7 ? 8.548 -4.643 -4.459 1.00 0.00 ? 29 ALA B C 8 7
ATOM 8366 O O . ALA B 1 7 ? 9.128 -3.577 -4.461 1.00 0.00 ? 29 ALA B O 8 7
ATOM 8367 C CB . ALA B 1 7 ? 9.177 -6.607 -5.859 1.00 0.00 ? 29 ALA B CB 8 7
ATOM 8368 H H . ALA B 1 7 ? 8.178 -7.397 -3.559 1.00 0.00 ? 29 ALA B H 8 7
ATOM 8369 H HA . ALA B 1 7 ? 10.384 -5.696 -4.464 1.00 0.00 ? 29 ALA B HA 8 7
ATOM 8370 H HB1 . ALA B 1 7 ? 8.190 -6.917 -5.981 1.00 0.00 ? 29 ALA B HB1 8 7
ATOM 8371 H HB2 . ALA B 1 7 ? 9.363 -5.903 -6.612 1.00 0.00 ? 29 ALA B HB2 8 7
ATOM 8372 H HB3 . ALA B 1 7 ? 9.823 -7.426 -5.967 1.00 0.00 ? 29 ALA B HB3 8 7
ATOM 8373 N N . ALA B 1 8 ? 7.226 -4.740 -4.377 1.00 0.00 ? 30 ALA B N 8 8
ATOM 8374 C CA . ALA B 1 8 ? 6.359 -3.592 -4.465 1.00 0.00 ? 30 ALA B CA 8 8
ATOM 8375 C C . ALA B 1 8 ? 6.236 -2.888 -3.130 1.00 0.00 ? 30 ALA B C 8 8
ATOM 8376 O O . ALA B 1 8 ? 6.285 -1.672 -3.049 1.00 0.00 ? 30 ALA B O 8 8
ATOM 8377 C CB . ALA B 1 8 ? 5.006 -4.072 -4.955 1.00 0.00 ? 30 ALA B CB 8 8
ATOM 8378 H H . ALA B 1 8 ? 6.825 -5.638 -4.242 1.00 0.00 ? 30 ALA B H 8 8
ATOM 8379 H HA . ALA B 1 8 ? 6.751 -2.898 -5.201 1.00 0.00 ? 30 ALA B HA 8 8
ATOM 8380 H HB1 . ALA B 1 8 ? 5.115 -4.662 -5.830 1.00 0.00 ? 30 ALA B HB1 8 8
ATOM 8381 H HB2 . ALA B 1 8 ? 4.583 -4.658 -4.185 1.00 0.00 ? 30 ALA B HB2 8 8
ATOM 8382 H HB3 . ALA B 1 8 ? 4.329 -3.278 -5.118 1.00 0.00 ? 30 ALA B HB3 8 8
ATOM 8383 N N . ILE B 1 9 ? 6.167 -3.657 -2.047 1.00 0.00 ? 31 ILE B N 8 9
ATOM 8384 C CA . ILE B 1 9 ? 6.170 -3.230 -0.669 1.00 0.00 ? 31 ILE B CA 8 9
ATOM 8385 C C . ILE B 1 9 ? 7.441 -2.473 -0.338 1.00 0.00 ? 31 ILE B C 8 9
ATOM 8386 O O . ILE B 1 9 ? 7.391 -1.474 0.361 1.00 0.00 ? 31 ILE B O 8 9
ATOM 8387 C CB . ILE B 1 9 ? 6.015 -4.425 0.262 1.00 0.00 ? 31 ILE B CB 8 9
ATOM 8388 C CG1 . ILE B 1 9 ? 4.725 -5.197 0.054 1.00 0.00 ? 31 ILE B CG1 8 9
ATOM 8389 C CG2 . ILE B 1 9 ? 6.167 -4.048 1.723 1.00 0.00 ? 31 ILE B CG2 8 9
ATOM 8390 C CD1 . ILE B 1 9 ? 3.467 -4.490 0.506 1.00 0.00 ? 31 ILE B CD1 8 9
ATOM 8391 H H . ILE B 1 9 ? 6.164 -4.635 -2.237 1.00 0.00 ? 31 ILE B H 8 9
ATOM 8392 H HA . ILE B 1 9 ? 5.342 -2.554 -0.521 1.00 0.00 ? 31 ILE B HA 8 9
ATOM 8393 H HB . ILE B 1 9 ? 6.872 -5.058 0.066 1.00 0.00 ? 31 ILE B HB 8 9
ATOM 8394 H HG12 . ILE B 1 9 ? 4.626 -5.411 -1.010 1.00 0.00 ? 31 ILE B HG12 8 9
ATOM 8395 H HG13 . ILE B 1 9 ? 4.814 -6.158 0.538 1.00 0.00 ? 31 ILE B HG13 8 9
ATOM 8396 H HG21 . ILE B 1 9 ? 5.472 -3.283 1.997 1.00 0.00 ? 31 ILE B HG21 8 9
ATOM 8397 H HG22 . ILE B 1 9 ? 5.960 -4.926 2.299 1.00 0.00 ? 31 ILE B HG22 8 9
ATOM 8398 H HG23 . ILE B 1 9 ? 7.168 -3.681 1.882 1.00 0.00 ? 31 ILE B HG23 8 9
ATOM 8399 H HD11 . ILE B 1 9 ? 3.406 -3.530 0.070 1.00 0.00 ? 31 ILE B HD11 8 9
ATOM 8400 H HD12 . ILE B 1 9 ? 2.626 -5.050 0.216 1.00 0.00 ? 31 ILE B HD12 8 9
ATOM 8401 H HD13 . ILE B 1 9 ? 3.459 -4.364 1.542 1.00 0.00 ? 31 ILE B HD13 8 9
ATOM 8402 N N . LYS B 1 10 ? 8.580 -2.884 -0.886 1.00 0.00 ? 32 LYS B N 8 10
ATOM 8403 C CA . LYS B 1 10 ? 9.837 -2.185 -0.751 1.00 0.00 ? 32 LYS B CA 8 10
ATOM 8404 C C . LYS B 1 10 ? 9.772 -0.815 -1.396 1.00 0.00 ? 32 LYS B C 8 10
ATOM 8405 O O . LYS B 1 10 ? 10.056 0.174 -0.739 1.00 0.00 ? 32 LYS B O 8 10
ATOM 8406 C CB . LYS B 1 10 ? 10.960 -3.046 -1.299 1.00 0.00 ? 32 LYS B CB 8 10
ATOM 8407 C CG . LYS B 1 10 ? 11.509 -4.005 -0.268 1.00 0.00 ? 32 LYS B CG 8 10
ATOM 8408 C CD . LYS B 1 10 ? 12.338 -3.290 0.767 1.00 0.00 ? 32 LYS B CD 8 10
ATOM 8409 C CE . LYS B 1 10 ? 12.973 -4.331 1.655 1.00 0.00 ? 32 LYS B CE 8 10
ATOM 8410 N NZ . LYS B 1 10 ? 13.867 -3.767 2.616 1.00 0.00 ? 32 LYS B NZ 8 10
ATOM 8411 H H . LYS B 1 10 ? 8.523 -3.684 -1.476 1.00 0.00 ? 32 LYS B H 8 10
ATOM 8412 H HA . LYS B 1 10 ? 10.001 -1.964 0.298 1.00 0.00 ? 32 LYS B HA 8 10
ATOM 8413 H HB2 . LYS B 1 10 ? 10.583 -3.615 -2.149 1.00 0.00 ? 32 LYS B HB2 8 10
ATOM 8414 H HB3 . LYS B 1 10 ? 11.765 -2.447 -1.683 1.00 0.00 ? 32 LYS B HB3 8 10
ATOM 8415 H HG2 . LYS B 1 10 ? 10.691 -4.543 0.213 1.00 0.00 ? 32 LYS B HG2 8 10
ATOM 8416 H HG3 . LYS B 1 10 ? 12.133 -4.715 -0.758 1.00 0.00 ? 32 LYS B HG3 8 10
ATOM 8417 H HD2 . LYS B 1 10 ? 13.105 -2.686 0.282 1.00 0.00 ? 32 LYS B HD2 8 10
ATOM 8418 H HD3 . LYS B 1 10 ? 11.751 -2.619 1.356 1.00 0.00 ? 32 LYS B HD3 8 10
ATOM 8419 H HE2 . LYS B 1 10 ? 12.188 -4.871 2.184 1.00 0.00 ? 32 LYS B HE2 8 10
ATOM 8420 H HE3 . LYS B 1 10 ? 13.467 -5.053 1.049 1.00 0.00 ? 32 LYS B HE3 8 10
ATOM 8421 H HZ1 . LYS B 1 10 ? 14.363 -4.294 3.021 1.00 0.00 ? 32 LYS B HZ1 8 10
ATOM 8422 H HZ2 . LYS B 1 10 ? 13.508 -3.393 3.207 1.00 0.00 ? 32 LYS B HZ2 8 10
ATOM 8423 H HZ3 . LYS B 1 10 ? 14.386 -3.235 2.337 1.00 0.00 ? 32 LYS B HZ3 8 10
ATOM 8424 N N . ALA B 1 11 ? 9.221 -0.761 -2.604 1.00 0.00 ? 33 ALA B N 8 11
ATOM 8425 C CA . ALA B 1 11 ? 8.780 0.423 -3.303 1.00 0.00 ? 33 ALA B CA 8 11
ATOM 8426 C C . ALA B 1 11 ? 7.577 1.131 -2.712 1.00 0.00 ? 33 ALA B C 8 11
ATOM 8427 O O . ALA B 1 11 ? 7.149 2.136 -3.265 1.00 0.00 ? 33 ALA B O 8 11
ATOM 8428 C CB . ALA B 1 11 ? 8.626 0.072 -4.767 1.00 0.00 ? 33 ALA B CB 8 11
ATOM 8429 H H . ALA B 1 11 ? 9.106 -1.634 -3.063 1.00 0.00 ? 33 ALA B H 8 11
ATOM 8430 H HA . ALA B 1 11 ? 9.597 1.131 -3.268 1.00 0.00 ? 33 ALA B HA 8 11
ATOM 8431 H HB1 . ALA B 1 11 ? 7.798 -0.568 -4.881 1.00 0.00 ? 33 ALA B HB1 8 11
ATOM 8432 H HB2 . ALA B 1 11 ? 8.469 0.961 -5.350 1.00 0.00 ? 33 ALA B HB2 8 11
ATOM 8433 H HB3 . ALA B 1 11 ? 9.488 -0.440 -5.128 1.00 0.00 ? 33 ALA B HB3 8 11
ATOM 8434 N N . ILE B 1 12 ? 7.070 0.699 -1.560 1.00 0.00 ? 34 ILE B N 8 12
ATOM 8435 C CA . ILE B 1 12 ? 6.103 1.399 -0.750 1.00 0.00 ? 34 ILE B CA 8 12
ATOM 8436 C C . ILE B 1 12 ? 6.690 1.870 0.565 1.00 0.00 ? 34 ILE B C 8 12
ATOM 8437 O O . ILE B 1 12 ? 6.678 3.074 0.781 1.00 0.00 ? 34 ILE B O 8 12
ATOM 8438 C CB . ILE B 1 12 ? 4.811 0.604 -0.637 1.00 0.00 ? 34 ILE B CB 8 12
ATOM 8439 C CG1 . ILE B 1 12 ? 3.736 1.324 -1.387 1.00 0.00 ? 34 ILE B CG1 8 12
ATOM 8440 C CG2 . ILE B 1 12 ? 4.366 0.147 0.727 1.00 0.00 ? 34 ILE B CG2 8 12
ATOM 8441 C CD1 . ILE B 1 12 ? 3.069 2.469 -0.686 1.00 0.00 ? 34 ILE B CD1 8 12
ATOM 8442 H H . ILE B 1 12 ? 7.353 -0.204 -1.298 1.00 0.00 ? 34 ILE B H 8 12
ATOM 8443 H HA . ILE B 1 12 ? 5.881 2.360 -1.208 1.00 0.00 ? 34 ILE B HA 8 12
ATOM 8444 H HB . ILE B 1 12 ? 4.956 -0.312 -1.174 1.00 0.00 ? 34 ILE B HB 8 12
ATOM 8445 H HG12 . ILE B 1 12 ? 4.157 1.695 -2.321 1.00 0.00 ? 34 ILE B HG12 8 12
ATOM 8446 H HG13 . ILE B 1 12 ? 2.992 0.602 -1.635 1.00 0.00 ? 34 ILE B HG13 8 12
ATOM 8447 H HG21 . ILE B 1 12 ? 3.391 -0.300 0.680 1.00 0.00 ? 34 ILE B HG21 8 12
ATOM 8448 H HG22 . ILE B 1 12 ? 5.048 -0.543 1.153 1.00 0.00 ? 34 ILE B HG22 8 12
ATOM 8449 H HG23 . ILE B 1 12 ? 4.312 1.004 1.360 1.00 0.00 ? 34 ILE B HG23 8 12
ATOM 8450 H HD11 . ILE B 1 12 ? 2.283 2.866 -1.268 1.00 0.00 ? 34 ILE B HD11 8 12
ATOM 8451 H HD12 . ILE B 1 12 ? 2.684 2.186 0.246 1.00 0.00 ? 34 ILE B HD12 8 12
ATOM 8452 H HD13 . ILE B 1 12 ? 3.743 3.258 -0.550 1.00 0.00 ? 34 ILE B HD13 8 12
ATOM 8453 N N . ALA B 1 13 ? 7.266 1.030 1.419 1.00 0.00 ? 35 ALA B N 8 13
ATOM 8454 C CA . ALA B 1 13 ? 7.709 1.387 2.744 1.00 0.00 ? 35 ALA B CA 8 13
ATOM 8455 C C . ALA B 1 13 ? 8.803 2.439 2.755 1.00 0.00 ? 35 ALA B C 8 13
ATOM 8456 O O . ALA B 1 13 ? 8.873 3.278 3.635 1.00 0.00 ? 35 ALA B O 8 13
ATOM 8457 C CB . ALA B 1 13 ? 8.122 0.107 3.444 1.00 0.00 ? 35 ALA B CB 8 13
ATOM 8458 H H . ALA B 1 13 ? 7.311 0.074 1.111 1.00 0.00 ? 35 ALA B H 8 13
ATOM 8459 H HA . ALA B 1 13 ? 6.864 1.831 3.244 1.00 0.00 ? 35 ALA B HA 8 13
ATOM 8460 H HB1 . ALA B 1 13 ? 8.428 0.352 4.426 1.00 0.00 ? 35 ALA B HB1 8 13
ATOM 8461 H HB2 . ALA B 1 13 ? 7.312 -0.579 3.497 1.00 0.00 ? 35 ALA B HB2 8 13
ATOM 8462 H HB3 . ALA B 1 13 ? 8.936 -0.357 2.946 1.00 0.00 ? 35 ALA B HB3 8 13
ATOM 8463 N N . ALA B 1 14 ? 9.587 2.513 1.685 1.00 0.00 ? 36 ALA B N 8 14
ATOM 8464 C CA . ALA B 1 14 ? 10.511 3.584 1.405 1.00 0.00 ? 36 ALA B CA 8 14
ATOM 8465 C C . ALA B 1 14 ? 9.852 4.870 0.962 1.00 0.00 ? 36 ALA B C 8 14
ATOM 8466 O O . ALA B 1 14 ? 10.230 5.956 1.365 1.00 0.00 ? 36 ALA B O 8 14
ATOM 8467 C CB . ALA B 1 14 ? 11.503 3.115 0.380 1.00 0.00 ? 36 ALA B CB 8 14
ATOM 8468 H H . ALA B 1 14 ? 9.336 1.835 0.998 1.00 0.00 ? 36 ALA B H 8 14
ATOM 8469 H HA . ALA B 1 14 ? 11.054 3.832 2.301 1.00 0.00 ? 36 ALA B HA 8 14
ATOM 8470 H HB1 . ALA B 1 14 ? 12.152 3.916 0.166 1.00 0.00 ? 36 ALA B HB1 8 14
ATOM 8471 H HB2 . ALA B 1 14 ? 12.066 2.284 0.733 1.00 0.00 ? 36 ALA B HB2 8 14
ATOM 8472 H HB3 . ALA B 1 14 ? 11.028 2.910 -0.536 1.00 0.00 ? 36 ALA B HB3 8 14
ATOM 8473 N N . ILE B 1 15 ? 8.836 4.738 0.126 1.00 0.00 ? 37 ILE B N 8 15
ATOM 8474 C CA . ILE B 1 15 ? 8.038 5.796 -0.444 1.00 0.00 ? 37 ILE B CA 8 15
ATOM 8475 C C . ILE B 1 15 ? 7.120 6.398 0.604 1.00 0.00 ? 37 ILE B C 8 15
ATOM 8476 O O . ILE B 1 15 ? 6.929 7.599 0.626 1.00 0.00 ? 37 ILE B O 8 15
ATOM 8477 C CB . ILE B 1 15 ? 7.294 5.278 -1.667 1.00 0.00 ? 37 ILE B CB 8 15
ATOM 8478 C CG1 . ILE B 1 15 ? 8.148 5.225 -2.924 1.00 0.00 ? 37 ILE B CG1 8 15
ATOM 8479 C CG2 . ILE B 1 15 ? 6.055 6.083 -2.010 1.00 0.00 ? 37 ILE B CG2 8 15
ATOM 8480 C CD1 . ILE B 1 15 ? 9.397 4.369 -2.865 1.00 0.00 ? 37 ILE B CD1 8 15
ATOM 8481 H H . ILE B 1 15 ? 8.601 3.782 -0.053 1.00 0.00 ? 37 ILE B H 8 15
ATOM 8482 H HA . ILE B 1 15 ? 8.700 6.595 -0.759 1.00 0.00 ? 37 ILE B HA 8 15
ATOM 8483 H HB . ILE B 1 15 ? 6.970 4.256 -1.501 1.00 0.00 ? 37 ILE B HB 8 15
ATOM 8484 H HG12 . ILE B 1 15 ? 7.521 4.827 -3.721 1.00 0.00 ? 37 ILE B HG12 8 15
ATOM 8485 H HG13 . ILE B 1 15 ? 8.412 6.217 -3.258 1.00 0.00 ? 37 ILE B HG13 8 15
ATOM 8486 H HG21 . ILE B 1 15 ? 6.249 7.132 -2.015 1.00 0.00 ? 37 ILE B HG21 8 15
ATOM 8487 H HG22 . ILE B 1 15 ? 5.689 5.797 -2.974 1.00 0.00 ? 37 ILE B HG22 8 15
ATOM 8488 H HG23 . ILE B 1 15 ? 5.298 5.831 -1.302 1.00 0.00 ? 37 ILE B HG23 8 15
ATOM 8489 H HD11 . ILE B 1 15 ? 10.186 4.846 -2.306 1.00 0.00 ? 37 ILE B HD11 8 15
ATOM 8490 H HD12 . ILE B 1 15 ? 9.169 3.444 -2.364 1.00 0.00 ? 37 ILE B HD12 8 15
ATOM 8491 H HD13 . ILE B 1 15 ? 9.732 4.168 -3.872 1.00 0.00 ? 37 ILE B HD13 8 15
ATOM 8492 N N . ILE B 1 16 ? 6.628 5.627 1.569 1.00 0.00 ? 38 ILE B N 8 16
ATOM 8493 C CA . ILE B 1 16 ? 5.940 6.110 2.739 1.00 0.00 ? 38 ILE B CA 8 16
ATOM 8494 C C . ILE B 1 16 ? 6.804 7.099 3.496 1.00 0.00 ? 38 ILE B C 8 16
ATOM 8495 O O . ILE B 1 16 ? 6.364 8.205 3.770 1.00 0.00 ? 38 ILE B O 8 16
ATOM 8496 C CB . ILE B 1 16 ? 5.489 4.953 3.614 1.00 0.00 ? 38 ILE B CB 8 16
ATOM 8497 C CG1 . ILE B 1 16 ? 4.408 4.147 2.907 1.00 0.00 ? 38 ILE B CG1 8 16
ATOM 8498 C CG2 . ILE B 1 16 ? 5.006 5.480 4.958 1.00 0.00 ? 38 ILE B CG2 8 16
ATOM 8499 C CD1 . ILE B 1 16 ? 3.812 2.980 3.648 1.00 0.00 ? 38 ILE B CD1 8 16
ATOM 8500 H H . ILE B 1 16 ? 6.780 4.641 1.490 1.00 0.00 ? 38 ILE B H 8 16
ATOM 8501 H HA . ILE B 1 16 ? 5.067 6.665 2.425 1.00 0.00 ? 38 ILE B HA 8 16
ATOM 8502 H HB . ILE B 1 16 ? 6.366 4.332 3.752 1.00 0.00 ? 38 ILE B HB 8 16
ATOM 8503 H HG12 . ILE B 1 16 ? 3.605 4.828 2.624 1.00 0.00 ? 38 ILE B HG12 8 16
ATOM 8504 H HG13 . ILE B 1 16 ? 4.819 3.724 2.019 1.00 0.00 ? 38 ILE B HG13 8 16
ATOM 8505 H HG21 . ILE B 1 16 ? 4.339 5.799 5.005 1.00 0.00 ? 38 ILE B HG21 8 16
ATOM 8506 H HG22 . ILE B 1 16 ? 4.935 5.025 5.551 1.00 0.00 ? 38 ILE B HG22 8 16
ATOM 8507 H HG23 . ILE B 1 16 ? 5.377 6.051 5.347 1.00 0.00 ? 38 ILE B HG23 8 16
ATOM 8508 H HD11 . ILE B 1 16 ? 3.188 2.394 3.020 1.00 0.00 ? 38 ILE B HD11 8 16
ATOM 8509 H HD12 . ILE B 1 16 ? 4.594 2.399 4.010 1.00 0.00 ? 38 ILE B HD12 8 16
ATOM 8510 H HD13 . ILE B 1 16 ? 3.210 3.317 4.436 1.00 0.00 ? 38 ILE B HD13 8 16
ATOM 8511 N N . LYS B 1 17 ? 8.025 6.695 3.809 1.00 0.00 ? 39 LYS B N 8 17
ATOM 8512 C CA . LYS B 1 17 ? 9.004 7.466 4.537 1.00 0.00 ? 39 LYS B CA 8 17
ATOM 8513 C C . LYS B 1 17 ? 9.478 8.707 3.815 1.00 0.00 ? 39 LYS B C 8 17
ATOM 8514 O O . LYS B 1 17 ? 9.511 9.774 4.398 1.00 0.00 ? 39 LYS B O 8 17
ATOM 8515 C CB . LYS B 1 17 ? 10.137 6.511 4.857 1.00 0.00 ? 39 LYS B CB 8 17
ATOM 8516 C CG . LYS B 1 17 ? 9.777 5.520 5.937 1.00 0.00 ? 39 LYS B CG 8 17
ATOM 8517 C CD . LYS B 1 17 ? 10.790 4.411 6.092 1.00 0.00 ? 39 LYS B CD 8 17
ATOM 8518 C CE . LYS B 1 17 ? 10.341 3.306 6.914 1.00 0.00 ? 39 LYS B CE 8 17
ATOM 8519 N NZ . LYS B 1 17 ? 11.248 2.228 7.065 1.00 0.00 ? 39 LYS B NZ 8 17
ATOM 8520 H H . LYS B 1 17 ? 8.236 5.754 3.550 1.00 0.00 ? 39 LYS B H 8 17
ATOM 8521 H HA . LYS B 1 17 ? 8.560 7.815 5.458 1.00 0.00 ? 39 LYS B HA 8 17
ATOM 8522 H HB2 . LYS B 1 17 ? 10.407 5.968 3.952 1.00 0.00 ? 39 LYS B HB2 8 17
ATOM 8523 H HB3 . LYS B 1 17 ? 11.018 7.045 5.160 1.00 0.00 ? 39 LYS B HB3 8 17
ATOM 8524 H HG2 . LYS B 1 17 ? 9.666 6.046 6.886 1.00 0.00 ? 39 LYS B HG2 8 17
ATOM 8525 H HG3 . LYS B 1 17 ? 8.845 5.068 5.706 1.00 0.00 ? 39 LYS B HG3 8 17
ATOM 8526 H HD2 . LYS B 1 17 ? 11.058 4.035 5.104 1.00 0.00 ? 39 LYS B HD2 8 17
ATOM 8527 H HD3 . LYS B 1 17 ? 11.637 4.787 6.517 1.00 0.00 ? 39 LYS B HD3 8 17
ATOM 8528 H HE2 . LYS B 1 17 ? 10.102 3.684 7.908 1.00 0.00 ? 39 LYS B HE2 8 17
ATOM 8529 H HE3 . LYS B 1 17 ? 9.500 3.029 6.505 1.00 0.00 ? 39 LYS B HE3 8 17
ATOM 8530 H HZ1 . LYS B 1 17 ? 11.749 2.248 7.624 1.00 0.00 ? 39 LYS B HZ1 8 17
ATOM 8531 H HZ2 . LYS B 1 17 ? 10.968 1.576 7.182 1.00 0.00 ? 39 LYS B HZ2 8 17
ATOM 8532 H HZ3 . LYS B 1 17 ? 11.715 1.990 6.529 1.00 0.00 ? 39 LYS B HZ3 8 17
ATOM 8533 N N . ALA B 1 18 ? 9.727 8.610 2.515 1.00 0.00 ? 40 ALA B N 8 18
ATOM 8534 C CA . ALA B 1 18 ? 10.164 9.679 1.657 1.00 0.00 ? 40 ALA B CA 8 18
ATOM 8535 C C . ALA B 1 18 ? 9.060 10.634 1.260 1.00 0.00 ? 40 ALA B C 8 18
ATOM 8536 O O . ALA B 1 18 ? 9.255 11.825 1.142 1.00 0.00 ? 40 ALA B O 8 18
ATOM 8537 C CB . ALA B 1 18 ? 10.801 9.107 0.407 1.00 0.00 ? 40 ALA B CB 8 18
ATOM 8538 H H . ALA B 1 18 ? 9.604 7.711 2.092 1.00 0.00 ? 40 ALA B H 8 18
ATOM 8539 H HA . ALA B 1 18 ? 10.941 10.230 2.164 1.00 0.00 ? 40 ALA B HA 8 18
ATOM 8540 H HB1 . ALA B 1 18 ? 11.198 9.891 -0.203 1.00 0.00 ? 40 ALA B HB1 8 18
ATOM 8541 H HB2 . ALA B 1 18 ? 11.618 8.475 0.644 1.00 0.00 ? 40 ALA B HB2 8 18
ATOM 8542 H HB3 . ALA B 1 18 ? 10.103 8.516 -0.140 1.00 0.00 ? 40 ALA B HB3 8 18
ATOM 8543 N N . GLY B 1 19 ? 7.868 10.110 1.056 1.00 0.00 ? 41 GLY B N 8 19
ATOM 8544 C CA . GLY B 1 19 ? 6.689 10.791 0.606 1.00 0.00 ? 41 GLY B CA 8 19
ATOM 8545 C C . GLY B 1 19 ? 6.024 11.541 1.735 1.00 0.00 ? 41 GLY B C 8 19
ATOM 8546 O O . GLY B 1 19 ? 5.447 12.579 1.498 1.00 0.00 ? 41 GLY B O 8 19
ATOM 8547 H H . GLY B 1 19 ? 7.821 9.115 1.137 1.00 0.00 ? 41 GLY B H 8 19
ATOM 8548 H HA2 . GLY B 1 19 ? 6.948 11.485 -0.184 1.00 0.00 ? 41 GLY B HA2 8 19
ATOM 8549 H HA3 . GLY B 1 19 ? 6.006 10.063 0.190 1.00 0.00 ? 41 GLY B HA3 8 19
ATOM 8550 N N . GLY B 1 20 ? 6.064 11.040 2.963 1.00 0.00 ? 42 GLY B N 8 20
ATOM 8551 C CA . GLY B 1 20 ? 5.472 11.665 4.110 1.00 0.00 ? 42 GLY B CA 8 20
ATOM 8552 C C . GLY B 1 20 ? 3.991 11.520 4.244 1.00 0.00 ? 42 GLY B C 8 20
ATOM 8553 O O . GLY B 1 20 ? 3.340 12.512 4.492 1.00 0.00 ? 42 GLY B O 8 20
ATOM 8554 H H . GLY B 1 20 ? 6.521 10.165 3.084 1.00 0.00 ? 42 GLY B H 8 20
ATOM 8555 H HA2 . GLY B 1 20 ? 5.893 11.309 5.004 1.00 0.00 ? 42 GLY B HA2 8 20
ATOM 8556 H HA3 . GLY B 1 20 ? 5.693 12.697 4.125 1.00 0.00 ? 42 GLY B HA3 8 20
ATOM 8557 N N . TYR B 1 21 ? 3.478 10.303 4.140 1.00 0.00 ? 43 TYR B N 8 21
ATOM 8558 C CA . TYR B 1 21 ? 2.088 10.034 4.231 1.00 0.00 ? 43 TYR B CA 8 21
ATOM 8559 C C . TYR B 1 21 ? 1.398 10.486 5.462 1.00 0.00 ? 43 TYR B C 8 21
ATOM 8560 O O . TYR B 1 21 ? 0.220 10.587 5.528 1.00 0.00 ? 43 TYR B O 8 21
ATOM 8561 C CB . TYR B 1 21 ? 1.849 8.547 4.039 1.00 0.00 ? 43 TYR B CB 8 21
ATOM 8562 C CG . TYR B 1 21 ? 1.636 8.080 2.632 1.00 0.00 ? 43 TYR B CG 8 21
ATOM 8563 C CD1 . TYR B 1 21 ? 0.622 8.565 1.810 1.00 0.00 ? 43 TYR B CD1 8 21
ATOM 8564 C CD2 . TYR B 1 21 ? 2.472 7.098 2.112 1.00 0.00 ? 43 TYR B CD2 8 21
ATOM 8565 C CE1 . TYR B 1 21 ? 0.470 8.095 0.507 1.00 0.00 ? 43 TYR B CE1 8 21
ATOM 8566 C CE2 . TYR B 1 21 ? 2.338 6.590 0.820 1.00 0.00 ? 43 TYR B CE2 8 21
ATOM 8567 C CZ . TYR B 1 21 ? 1.317 7.097 0.008 1.00 0.00 ? 43 TYR B CZ 8 21
ATOM 8568 O OH . TYR B 1 21 ? 1.247 6.680 -1.281 1.00 0.00 ? 43 TYR B OH 8 21
ATOM 8569 H H . TYR B 1 21 ? 4.096 9.540 3.966 1.00 0.00 ? 43 TYR B H 8 21
ATOM 8570 H HA . TYR B 1 21 ? 1.607 10.526 3.422 1.00 0.00 ? 43 TYR B HA 8 21
ATOM 8571 H HB2 . TYR B 1 21 ? 2.696 8.009 4.464 1.00 0.00 ? 43 TYR B HB2 8 21
ATOM 8572 H HB3 . TYR B 1 21 ? 0.961 8.224 4.565 1.00 0.00 ? 43 TYR B HB3 8 21
ATOM 8573 H HD1 . TYR B 1 21 ? -0.028 9.340 2.169 1.00 0.00 ? 43 TYR B HD1 8 21
ATOM 8574 H HD2 . TYR B 1 21 ? 3.179 6.683 2.796 1.00 0.00 ? 43 TYR B HD2 8 21
ATOM 8575 H HE1 . TYR B 1 21 ? -0.307 8.526 -0.096 1.00 0.00 ? 43 TYR B HE1 8 21
ATOM 8576 H HE2 . TYR B 1 21 ? 2.989 5.812 0.466 1.00 0.00 ? 43 TYR B HE2 8 21
ATOM 8577 H HH . TYR B 1 21 ? 1.667 7.307 -1.845 1.00 0.00 ? 43 TYR B HH 8 21
HETATM 8578 N N . NH2 B 1 22 ? 2.109 10.733 6.503 1.00 0.00 ? 44 NH2 B N 8 22
HETATM 8579 H HN1 . NH2 B 1 22 ? 1.709 11.036 7.318 1.00 0.00 ? 44 NH2 B HN1 8 22
HETATM 8580 H HN2 . NH2 B 1 22 ? 3.068 10.624 6.467 1.00 0.00 ? 44 NH2 B HN2 8 22
HETATM 8581 C C . ACE C 1 1 ? -8.073 11.527 -4.123 1.00 0.00 ? 45 ACE C C 8 1
HETATM 8582 O O . ACE C 1 1 ? -8.631 10.806 -3.367 1.00 0.00 ? 45 ACE C O 8 1
HETATM 8583 C CH3 . ACE C 1 1 ? -8.813 12.270 -5.097 1.00 0.00 ? 45 ACE C CH3 8 1
HETATM 8584 H H1 . ACE C 1 1 ? -8.985 12.370 -5.411 1.00 0.00 ? 45 ACE C H1 8 1
HETATM 8585 H H2 . ACE C 1 1 ? -9.072 12.413 -5.275 1.00 0.00 ? 45 ACE C H2 8 1
HETATM 8586 H H3 . ACE C 1 1 ? -8.918 12.509 -5.286 1.00 0.00 ? 45 ACE C H3 8 1
ATOM 8587 N N . ALA C 1 2 ? -6.819 11.758 -4.101 1.00 0.00 ? 46 ALA C N 8 2
ATOM 8588 C CA . ALA C 1 2 ? -5.875 11.129 -3.346 1.00 0.00 ? 46 ALA C CA 8 2
ATOM 8589 C C . ALA C 1 2 ? -5.985 11.229 -1.843 1.00 0.00 ? 46 ALA C C 8 2
ATOM 8590 O O . ALA C 1 2 ? -5.237 10.564 -1.148 1.00 0.00 ? 46 ALA C O 8 2
ATOM 8591 C CB . ALA C 1 2 ? -4.645 11.665 -3.834 1.00 0.00 ? 46 ALA C CB 8 2
ATOM 8592 H H . ALA C 1 2 ? -6.499 12.397 -4.735 1.00 0.00 ? 46 ALA C H 8 2
ATOM 8593 H HA . ALA C 1 2 ? -5.898 10.149 -3.557 1.00 0.00 ? 46 ALA C HA 8 2
ATOM 8594 H HB1 . ALA C 1 2 ? -4.635 11.683 -4.891 1.00 0.00 ? 46 ALA C HB1 8 2
ATOM 8595 H HB2 . ALA C 1 2 ? -4.527 12.591 -3.528 1.00 0.00 ? 46 ALA C HB2 8 2
ATOM 8596 H HB3 . ALA C 1 2 ? -3.882 11.118 -3.498 1.00 0.00 ? 46 ALA C HB3 8 2
ATOM 8597 N N . LYS C 1 3 ? -6.947 11.973 -1.313 1.00 0.00 ? 47 LYS C N 8 3
ATOM 8598 C CA . LYS C 1 3 ? -7.223 12.118 0.087 1.00 0.00 ? 47 LYS C CA 8 3
ATOM 8599 C C . LYS C 1 3 ? -7.549 10.833 0.792 1.00 0.00 ? 47 LYS C C 8 3
ATOM 8600 O O . LYS C 1 3 ? -7.494 10.820 2.000 1.00 0.00 ? 47 LYS C O 8 3
ATOM 8601 C CB . LYS C 1 3 ? -8.375 13.076 0.295 1.00 0.00 ? 47 LYS C CB 8 3
ATOM 8602 C CG . LYS C 1 3 ? -8.026 14.496 -0.018 1.00 0.00 ? 47 LYS C CG 8 3
ATOM 8603 C CD . LYS C 1 3 ? -9.192 15.401 0.221 1.00 0.00 ? 47 LYS C CD 8 3
ATOM 8604 C CE . LYS C 1 3 ? -8.865 16.826 -0.101 1.00 0.00 ? 47 LYS C CE 8 3
ATOM 8605 N NZ . LYS C 1 3 ? -9.964 17.709 0.080 1.00 0.00 ? 47 LYS C NZ 8 3
ATOM 8606 H H . LYS C 1 3 ? -7.517 12.438 -1.975 1.00 0.00 ? 47 LYS C H 8 3
ATOM 8607 H HA . LYS C 1 3 ? -6.351 12.523 0.560 1.00 0.00 ? 47 LYS C HA 8 3
ATOM 8608 H HB2 . LYS C 1 3 ? -9.204 12.772 -0.344 1.00 0.00 ? 47 LYS C HB2 8 3
ATOM 8609 H HB3 . LYS C 1 3 ? -8.735 12.990 1.307 1.00 0.00 ? 47 LYS C HB3 8 3
ATOM 8610 H HG2 . LYS C 1 3 ? -7.181 14.806 0.597 1.00 0.00 ? 47 LYS C HG2 8 3
ATOM 8611 H HG3 . LYS C 1 3 ? -7.739 14.622 -1.031 1.00 0.00 ? 47 LYS C HG3 8 3
ATOM 8612 H HD2 . LYS C 1 3 ? -10.039 15.074 -0.383 1.00 0.00 ? 47 LYS C HD2 8 3
ATOM 8613 H HD3 . LYS C 1 3 ? -9.483 15.325 1.245 1.00 0.00 ? 47 LYS C HD3 8 3
ATOM 8614 H HE2 . LYS C 1 3 ? -8.034 17.156 0.522 1.00 0.00 ? 47 LYS C HE2 8 3
ATOM 8615 H HE3 . LYS C 1 3 ? -8.549 16.873 -1.097 1.00 0.00 ? 47 LYS C HE3 8 3
ATOM 8616 H HZ1 . LYS C 1 3 ? -9.772 18.624 -0.186 1.00 0.00 ? 47 LYS C HZ1 8 3
ATOM 8617 H HZ2 . LYS C 1 3 ? -10.705 17.447 -0.443 1.00 0.00 ? 47 LYS C HZ2 8 3
ATOM 8618 H HZ3 . LYS C 1 3 ? -10.246 17.738 1.007 1.00 0.00 ? 47 LYS C HZ3 8 3
ATOM 8619 N N . ALA C 1 4 ? -7.819 9.732 0.122 1.00 0.00 ? 48 ALA C N 8 4
ATOM 8620 C CA . ALA C 1 4 ? -7.797 8.389 0.647 1.00 0.00 ? 48 ALA C CA 8 4
ATOM 8621 C C . ALA C 1 4 ? -6.509 7.943 1.314 1.00 0.00 ? 48 ALA C C 8 4
ATOM 8622 O O . ALA C 1 4 ? -6.424 6.809 1.775 1.00 0.00 ? 48 ALA C O 8 4
ATOM 8623 C CB . ALA C 1 4 ? -8.169 7.484 -0.506 1.00 0.00 ? 48 ALA C CB 8 4
ATOM 8624 H H . ALA C 1 4 ? -7.907 9.885 -0.860 1.00 0.00 ? 48 ALA C H 8 4
ATOM 8625 H HA . ALA C 1 4 ? -8.571 8.348 1.391 1.00 0.00 ? 48 ALA C HA 8 4
ATOM 8626 H HB1 . ALA C 1 4 ? -9.160 7.706 -0.845 1.00 0.00 ? 48 ALA C HB1 8 4
ATOM 8627 H HB2 . ALA C 1 4 ? -7.457 7.586 -1.294 1.00 0.00 ? 48 ALA C HB2 8 4
ATOM 8628 H HB3 . ALA C 1 4 ? -8.142 6.457 -0.200 1.00 0.00 ? 48 ALA C HB3 8 4
ATOM 8629 N N . ALA C 1 5 ? -5.480 8.782 1.353 1.00 0.00 ? 49 ALA C N 8 5
ATOM 8630 C CA . ALA C 1 5 ? -4.123 8.538 1.780 1.00 0.00 ? 49 ALA C CA 8 5
ATOM 8631 C C . ALA C 1 5 ? -4.060 8.112 3.237 1.00 0.00 ? 49 ALA C C 8 5
ATOM 8632 O O . ALA C 1 5 ? -4.154 6.926 3.520 1.00 0.00 ? 49 ALA C O 8 5
ATOM 8633 C CB . ALA C 1 5 ? -3.272 9.733 1.384 1.00 0.00 ? 49 ALA C CB 8 5
ATOM 8634 H H . ALA C 1 5 ? -5.672 9.722 1.073 1.00 0.00 ? 49 ALA C H 8 5
ATOM 8635 H HA . ALA C 1 5 ? -3.713 7.672 1.278 1.00 0.00 ? 49 ALA C HA 8 5
ATOM 8636 H HB1 . ALA C 1 5 ? -3.726 10.656 1.699 1.00 0.00 ? 49 ALA C HB1 8 5
ATOM 8637 H HB2 . ALA C 1 5 ? -2.296 9.690 1.845 1.00 0.00 ? 49 ALA C HB2 8 5
ATOM 8638 H HB3 . ALA C 1 5 ? -3.185 9.716 0.309 1.00 0.00 ? 49 ALA C HB3 8 5
ATOM 8639 N N . ALA C 1 6 ? -3.864 9.012 4.198 1.00 0.00 ? 50 ALA C N 8 6
ATOM 8640 C CA . ALA C 1 6 ? -3.705 8.596 5.572 1.00 0.00 ? 50 ALA C CA 8 6
ATOM 8641 C C . ALA C 1 6 ? -4.822 7.743 6.143 1.00 0.00 ? 50 ALA C C 8 6
ATOM 8642 O O . ALA C 1 6 ? -4.555 6.822 6.900 1.00 0.00 ? 50 ALA C O 8 6
ATOM 8643 C CB . ALA C 1 6 ? -3.373 9.806 6.426 1.00 0.00 ? 50 ALA C CB 8 6
ATOM 8644 H H . ALA C 1 6 ? -3.775 9.977 3.966 1.00 0.00 ? 50 ALA C H 8 6
ATOM 8645 H HA . ALA C 1 6 ? -2.855 7.926 5.558 1.00 0.00 ? 50 ALA C HA 8 6
ATOM 8646 H HB1 . ALA C 1 6 ? -4.119 10.549 6.350 1.00 0.00 ? 50 ALA C HB1 8 6
ATOM 8647 H HB2 . ALA C 1 6 ? -3.301 9.524 7.449 1.00 0.00 ? 50 ALA C HB2 8 6
ATOM 8648 H HB3 . ALA C 1 6 ? -2.441 10.223 6.131 1.00 0.00 ? 50 ALA C HB3 8 6
ATOM 8649 N N . ALA C 1 7 ? -6.050 7.940 5.672 1.00 0.00 ? 51 ALA C N 8 7
ATOM 8650 C CA . ALA C 1 7 ? -7.186 7.138 6.063 1.00 0.00 ? 51 ALA C CA 8 7
ATOM 8651 C C . ALA C 1 7 ? -7.030 5.669 5.736 1.00 0.00 ? 51 ALA C C 8 7
ATOM 8652 O O . ALA C 1 7 ? -7.690 4.850 6.324 1.00 0.00 ? 51 ALA C O 8 7
ATOM 8653 C CB . ALA C 1 7 ? -8.460 7.709 5.469 1.00 0.00 ? 51 ALA C CB 8 7
ATOM 8654 H H . ALA C 1 7 ? -6.142 8.682 5.018 1.00 0.00 ? 51 ALA C H 8 7
ATOM 8655 H HA . ALA C 1 7 ? -7.237 7.187 7.147 1.00 0.00 ? 51 ALA C HA 8 7
ATOM 8656 H HB1 . ALA C 1 7 ? -8.421 7.699 4.391 1.00 0.00 ? 51 ALA C HB1 8 7
ATOM 8657 H HB2 . ALA C 1 7 ? -9.297 7.117 5.783 1.00 0.00 ? 51 ALA C HB2 8 7
ATOM 8658 H HB3 . ALA C 1 7 ? -8.627 8.721 5.795 1.00 0.00 ? 51 ALA C HB3 8 7
ATOM 8659 N N . ALA C 1 8 ? -6.136 5.299 4.834 1.00 0.00 ? 52 ALA C N 8 8
ATOM 8660 C CA . ALA C 1 8 ? -5.674 3.949 4.650 1.00 0.00 ? 52 ALA C CA 8 8
ATOM 8661 C C . ALA C 1 8 ? -4.267 3.817 5.196 1.00 0.00 ? 52 ALA C C 8 8
ATOM 8662 O O . ALA C 1 8 ? -4.031 3.026 6.097 1.00 0.00 ? 52 ALA C O 8 8
ATOM 8663 C CB . ALA C 1 8 ? -5.735 3.627 3.171 1.00 0.00 ? 52 ALA C CB 8 8
ATOM 8664 H H . ALA C 1 8 ? -5.667 6.021 4.331 1.00 0.00 ? 52 ALA C H 8 8
ATOM 8665 H HA . ALA C 1 8 ? -6.328 3.275 5.191 1.00 0.00 ? 52 ALA C HA 8 8
ATOM 8666 H HB1 . ALA C 1 8 ? -4.913 4.047 2.656 1.00 0.00 ? 52 ALA C HB1 8 8
ATOM 8667 H HB2 . ALA C 1 8 ? -5.698 2.578 3.033 1.00 0.00 ? 52 ALA C HB2 8 8
ATOM 8668 H HB3 . ALA C 1 8 ? -6.599 4.035 2.725 1.00 0.00 ? 52 ALA C HB3 8 8
ATOM 8669 N N . ILE C 1 9 ? -3.316 4.562 4.638 1.00 0.00 ? 53 ILE C N 8 9
ATOM 8670 C CA . ILE C 1 9 ? -1.893 4.370 4.809 1.00 0.00 ? 53 ILE C CA 8 9
ATOM 8671 C C . ILE C 1 9 ? -1.438 4.518 6.250 1.00 0.00 ? 53 ILE C C 8 9
ATOM 8672 O O . ILE C 1 9 ? -0.486 3.873 6.661 1.00 0.00 ? 53 ILE C O 8 9
ATOM 8673 C CB . ILE C 1 9 ? -1.082 5.268 3.890 1.00 0.00 ? 53 ILE C CB 8 9
ATOM 8674 C CG1 . ILE C 1 9 ? -1.467 5.234 2.422 1.00 0.00 ? 53 ILE C CG1 8 9
ATOM 8675 C CG2 . ILE C 1 9 ? 0.390 4.932 3.992 1.00 0.00 ? 53 ILE C CG2 8 9
ATOM 8676 C CD1 . ILE C 1 9 ? -1.483 3.865 1.800 1.00 0.00 ? 53 ILE C CD1 8 9
ATOM 8677 H H . ILE C 1 9 ? -3.634 5.231 3.962 1.00 0.00 ? 53 ILE C H 8 9
ATOM 8678 H HA . ILE C 1 9 ? -1.632 3.356 4.527 1.00 0.00 ? 53 ILE C HA 8 9
ATOM 8679 H HB . ILE C 1 9 ? -1.223 6.274 4.260 1.00 0.00 ? 53 ILE C HB 8 9
ATOM 8680 H HG12 . ILE C 1 9 ? -2.462 5.669 2.325 1.00 0.00 ? 53 ILE C HG12 8 9
ATOM 8681 H HG13 . ILE C 1 9 ? -0.821 5.849 1.835 1.00 0.00 ? 53 ILE C HG13 8 9
ATOM 8682 H HG21 . ILE C 1 9 ? 0.941 5.400 3.200 1.00 0.00 ? 53 ILE C HG21 8 9
ATOM 8683 H HG22 . ILE C 1 9 ? 0.771 5.328 4.915 1.00 0.00 ? 53 ILE C HG22 8 9
ATOM 8684 H HG23 . ILE C 1 9 ? 0.520 3.879 3.916 1.00 0.00 ? 53 ILE C HG23 8 9
ATOM 8685 H HD11 . ILE C 1 9 ? -0.511 3.469 1.779 1.00 0.00 ? 53 ILE C HD11 8 9
ATOM 8686 H HD12 . ILE C 1 9 ? -2.105 3.236 2.360 1.00 0.00 ? 53 ILE C HD12 8 9
ATOM 8687 H HD13 . ILE C 1 9 ? -1.865 3.936 0.811 1.00 0.00 ? 53 ILE C HD13 8 9
ATOM 8688 N N . LYS C 1 10 ? -2.089 5.346 7.059 1.00 0.00 ? 54 LYS C N 8 10
ATOM 8689 C CA . LYS C 1 10 ? -1.656 5.604 8.414 1.00 0.00 ? 54 LYS C CA 8 10
ATOM 8690 C C . LYS C 1 10 ? -1.919 4.403 9.304 1.00 0.00 ? 54 LYS C C 8 10
ATOM 8691 O O . LYS C 1 10 ? -1.053 4.020 10.072 1.00 0.00 ? 54 LYS C O 8 10
ATOM 8692 C CB . LYS C 1 10 ? -2.325 6.901 8.834 1.00 0.00 ? 54 LYS C CB 8 10
ATOM 8693 C CG . LYS C 1 10 ? -1.556 7.799 9.782 1.00 0.00 ? 54 LYS C CG 8 10
ATOM 8694 C CD . LYS C 1 10 ? -1.633 7.440 11.234 1.00 0.00 ? 54 LYS C CD 8 10
ATOM 8695 C CE . LYS C 1 10 ? -2.741 7.719 11.865 1.00 0.00 ? 54 LYS C CE 8 10
ATOM 8696 N NZ . LYS C 1 10 ? -2.716 7.529 13.284 1.00 0.00 ? 54 LYS C NZ 8 10
ATOM 8697 H H . LYS C 1 10 ? -2.939 5.751 6.733 1.00 0.00 ? 54 LYS C H 8 10
ATOM 8698 H HA . LYS C 1 10 ? -0.580 5.732 8.379 1.00 0.00 ? 54 LYS C HA 8 10
ATOM 8699 H HB2 . LYS C 1 10 ? -2.514 7.481 7.930 1.00 0.00 ? 54 LYS C HB2 8 10
ATOM 8700 H HB3 . LYS C 1 10 ? -3.304 6.650 9.207 1.00 0.00 ? 54 LYS C HB3 8 10
ATOM 8701 H HG2 . LYS C 1 10 ? -0.508 7.797 9.483 1.00 0.00 ? 54 LYS C HG2 8 10
ATOM 8702 H HG3 . LYS C 1 10 ? -1.912 8.792 9.662 1.00 0.00 ? 54 LYS C HG3 8 10
ATOM 8703 H HD2 . LYS C 1 10 ? -1.441 6.372 11.330 1.00 0.00 ? 54 LYS C HD2 8 10
ATOM 8704 H HD3 . LYS C 1 10 ? -0.972 7.894 11.713 1.00 0.00 ? 54 LYS C HD3 8 10
ATOM 8705 H HE2 . LYS C 1 10 ? -2.986 8.765 11.680 1.00 0.00 ? 54 LYS C HE2 8 10
ATOM 8706 H HE3 . LYS C 1 10 ? -3.395 7.236 11.431 1.00 0.00 ? 54 LYS C HE3 8 10
ATOM 8707 H HZ1 . LYS C 1 10 ? -3.406 7.720 13.696 1.00 0.00 ? 54 LYS C HZ1 8 10
ATOM 8708 H HZ2 . LYS C 1 10 ? -2.588 6.778 13.502 1.00 0.00 ? 54 LYS C HZ2 8 10
ATOM 8709 H HZ3 . LYS C 1 10 ? -2.149 7.954 13.698 1.00 0.00 ? 54 LYS C HZ3 8 10
ATOM 8710 N N . ALA C 1 11 ? -3.027 3.707 9.073 1.00 0.00 ? 55 ALA C N 8 11
ATOM 8711 C CA . ALA C 1 11 ? -3.263 2.366 9.554 1.00 0.00 ? 55 ALA C CA 8 11
ATOM 8712 C C . ALA C 1 11 ? -2.325 1.332 8.955 1.00 0.00 ? 55 ALA C C 8 11
ATOM 8713 O O . ALA C 1 11 ? -1.717 0.535 9.659 1.00 0.00 ? 55 ALA C O 8 11
ATOM 8714 C CB . ALA C 1 11 ? -4.706 1.946 9.356 1.00 0.00 ? 55 ALA C CB 8 11
ATOM 8715 H H . ALA C 1 11 ? -3.694 4.092 8.426 1.00 0.00 ? 55 ALA C H 8 11
ATOM 8716 H HA . ALA C 1 11 ? -3.090 2.372 10.623 1.00 0.00 ? 55 ALA C HA 8 11
ATOM 8717 H HB1 . ALA C 1 11 ? -4.971 1.869 8.337 1.00 0.00 ? 55 ALA C HB1 8 11
ATOM 8718 H HB2 . ALA C 1 11 ? -4.846 0.990 9.809 1.00 0.00 ? 55 ALA C HB2 8 11
ATOM 8719 H HB3 . ALA C 1 11 ? -5.362 2.676 9.788 1.00 0.00 ? 55 ALA C HB3 8 11
ATOM 8720 N N . ILE C 1 12 ? -2.135 1.380 7.639 1.00 0.00 ? 56 ILE C N 8 12
ATOM 8721 C CA . ILE C 1 12 ? -1.451 0.340 6.899 1.00 0.00 ? 56 ILE C CA 8 12
ATOM 8722 C C . ILE C 1 12 ? 0.036 0.388 7.187 1.00 0.00 ? 56 ILE C C 8 12
ATOM 8723 O O . ILE C 1 12 ? 0.604 -0.672 7.400 1.00 0.00 ? 56 ILE C O 8 12
ATOM 8724 C CB . ILE C 1 12 ? -1.852 0.323 5.437 1.00 0.00 ? 56 ILE C CB 8 12
ATOM 8725 C CG1 . ILE C 1 12 ? -3.274 -0.156 5.244 1.00 0.00 ? 56 ILE C CG1 8 12
ATOM 8726 C CG2 . ILE C 1 12 ? -0.931 -0.478 4.544 1.00 0.00 ? 56 ILE C CG2 8 12
ATOM 8727 C CD1 . ILE C 1 12 ? -3.531 -1.645 5.309 1.00 0.00 ? 56 ILE C CD1 8 12
ATOM 8728 H H . ILE C 1 12 ? -2.515 2.190 7.183 1.00 0.00 ? 56 ILE C H 8 12
ATOM 8729 H HA . ILE C 1 12 ? -1.761 -0.607 7.321 1.00 0.00 ? 56 ILE C HA 8 12
ATOM 8730 H HB . ILE C 1 12 ? -1.829 1.340 5.082 1.00 0.00 ? 56 ILE C HB 8 12
ATOM 8731 H HG12 . ILE C 1 12 ? -3.902 0.334 5.988 1.00 0.00 ? 56 ILE C HG12 8 12
ATOM 8732 H HG13 . ILE C 1 12 ? -3.592 0.171 4.271 1.00 0.00 ? 56 ILE C HG13 8 12
ATOM 8733 H HG21 . ILE C 1 12 ? -0.812 -1.492 4.870 1.00 0.00 ? 56 ILE C HG21 8 12
ATOM 8734 H HG22 . ILE C 1 12 ? -1.261 -0.396 3.527 1.00 0.00 ? 56 ILE C HG22 8 12
ATOM 8735 H HG23 . ILE C 1 12 ? 0.039 -0.038 4.574 1.00 0.00 ? 56 ILE C HG23 8 12
ATOM 8736 H HD11 . ILE C 1 12 ? -3.300 -2.079 5.886 1.00 0.00 ? 56 ILE C HD11 8 12
ATOM 8737 H HD12 . ILE C 1 12 ? -3.289 -2.060 4.778 1.00 0.00 ? 56 ILE C HD12 8 12
ATOM 8738 H HD13 . ILE C 1 12 ? -4.232 -1.914 5.283 1.00 0.00 ? 56 ILE C HD13 8 12
ATOM 8739 N N . ALA C 1 13 ? 0.670 1.536 7.396 1.00 0.00 ? 57 ALA C N 8 13
ATOM 8740 C CA . ALA C 1 13 ? 2.060 1.592 7.757 1.00 0.00 ? 57 ALA C CA 8 13
ATOM 8741 C C . ALA C 1 13 ? 2.373 1.013 9.121 1.00 0.00 ? 57 ALA C C 8 13
ATOM 8742 O O . ALA C 1 13 ? 3.489 0.585 9.347 1.00 0.00 ? 57 ALA C O 8 13
ATOM 8743 C CB . ALA C 1 13 ? 2.520 3.028 7.578 1.00 0.00 ? 57 ALA C CB 8 13
ATOM 8744 H H . ALA C 1 13 ? 0.137 2.374 7.266 1.00 0.00 ? 57 ALA C H 8 13
ATOM 8745 H HA . ALA C 1 13 ? 2.623 1.017 7.047 1.00 0.00 ? 57 ALA C HA 8 13
ATOM 8746 H HB1 . ALA C 1 13 ? 3.551 3.130 7.784 1.00 0.00 ? 57 ALA C HB1 8 13
ATOM 8747 H HB2 . ALA C 1 13 ? 2.339 3.315 6.576 1.00 0.00 ? 57 ALA C HB2 8 13
ATOM 8748 H HB3 . ALA C 1 13 ? 1.994 3.683 8.213 1.00 0.00 ? 57 ALA C HB3 8 13
ATOM 8749 N N . ALA C 1 14 ? 1.380 0.916 9.990 1.00 0.00 ? 58 ALA C N 8 14
ATOM 8750 C CA . ALA C 1 14 ? 1.450 0.247 11.267 1.00 0.00 ? 58 ALA C CA 8 14
ATOM 8751 C C . ALA C 1 14 ? 1.120 -1.223 11.196 1.00 0.00 ? 58 ALA C C 8 14
ATOM 8752 O O . ALA C 1 14 ? 1.782 -2.026 11.836 1.00 0.00 ? 58 ALA C O 8 14
ATOM 8753 C CB . ALA C 1 14 ? 0.549 0.967 12.247 1.00 0.00 ? 58 ALA C CB 8 14
ATOM 8754 H H . ALA C 1 14 ? 0.514 1.217 9.609 1.00 0.00 ? 58 ALA C H 8 14
ATOM 8755 H HA . ALA C 1 14 ? 2.443 0.339 11.664 1.00 0.00 ? 58 ALA C HA 8 14
ATOM 8756 H HB1 . ALA C 1 14 ? 0.622 0.496 13.195 1.00 0.00 ? 58 ALA C HB1 8 14
ATOM 8757 H HB2 . ALA C 1 14 ? 0.842 1.976 12.333 1.00 0.00 ? 58 ALA C HB2 8 14
ATOM 8758 H HB3 . ALA C 1 14 ? -0.460 0.941 11.957 1.00 0.00 ? 58 ALA C HB3 8 14
ATOM 8759 N N . ILE C 1 15 ? 0.171 -1.590 10.344 1.00 0.00 ? 59 ILE C N 8 15
ATOM 8760 C CA . ILE C 1 15 ? -0.157 -2.940 9.950 1.00 0.00 ? 59 ILE C CA 8 15
ATOM 8761 C C . ILE C 1 15 ? 1.008 -3.601 9.236 1.00 0.00 ? 59 ILE C C 8 15
ATOM 8762 O O . ILE C 1 15 ? 1.297 -4.765 9.467 1.00 0.00 ? 59 ILE C O 8 15
ATOM 8763 C CB . ILE C 1 15 ? -1.445 -2.945 9.142 1.00 0.00 ? 59 ILE C CB 8 15
ATOM 8764 C CG1 . ILE C 1 15 ? -2.640 -2.634 10.022 1.00 0.00 ? 59 ILE C CG1 8 15
ATOM 8765 C CG2 . ILE C 1 15 ? -1.703 -4.197 8.329 1.00 0.00 ? 59 ILE C CG2 8 15
ATOM 8766 C CD1 . ILE C 1 15 ? -3.838 -2.046 9.301 1.00 0.00 ? 59 ILE C CD1 8 15
ATOM 8767 H H . ILE C 1 15 ? -0.298 -0.824 9.910 1.00 0.00 ? 59 ILE C H 8 15
ATOM 8768 H HA . ILE C 1 15 ? -0.379 -3.523 10.830 1.00 0.00 ? 59 ILE C HA 8 15
ATOM 8769 H HB . ILE C 1 15 ? -1.374 -2.148 8.413 1.00 0.00 ? 59 ILE C HB 8 15
ATOM 8770 H HG12 . ILE C 1 15 ? -2.946 -3.553 10.523 1.00 0.00 ? 59 ILE C HG12 8 15
ATOM 8771 H HG13 . ILE C 1 15 ? -2.378 -1.927 10.793 1.00 0.00 ? 59 ILE C HG13 8 15
ATOM 8772 H HG21 . ILE C 1 15 ? -0.912 -4.367 7.627 1.00 0.00 ? 59 ILE C HG21 8 15
ATOM 8773 H HG22 . ILE C 1 15 ? -1.795 -5.050 8.962 1.00 0.00 ? 59 ILE C HG22 8 15
ATOM 8774 H HG23 . ILE C 1 15 ? -2.602 -4.089 7.745 1.00 0.00 ? 59 ILE C HG23 8 15
ATOM 8775 H HD11 . ILE C 1 15 ? -3.568 -1.137 8.811 1.00 0.00 ? 59 ILE C HD11 8 15
ATOM 8776 H HD12 . ILE C 1 15 ? -4.266 -2.718 8.596 1.00 0.00 ? 59 ILE C HD12 8 15
ATOM 8777 H HD13 . ILE C 1 15 ? -4.614 -1.806 9.996 1.00 0.00 ? 59 ILE C HD13 8 15
ATOM 8778 N N . ILE C 1 16 ? 1.800 -2.857 8.475 1.00 0.00 ? 60 ILE C N 8 16
ATOM 8779 C CA . ILE C 1 16 ? 3.032 -3.307 7.874 1.00 0.00 ? 60 ILE C CA 8 16
ATOM 8780 C C . ILE C 1 16 ? 4.050 -3.758 8.902 1.00 0.00 ? 60 ILE C C 8 16
ATOM 8781 O O . ILE C 1 16 ? 4.608 -4.830 8.768 1.00 0.00 ? 60 ILE C O 8 16
ATOM 8782 C CB . ILE C 1 16 ? 3.541 -2.194 6.979 1.00 0.00 ? 60 ILE C CB 8 16
ATOM 8783 C CG1 . ILE C 1 16 ? 2.745 -2.292 5.693 1.00 0.00 ? 60 ILE C CG1 8 16
ATOM 8784 C CG2 . ILE C 1 16 ? 5.030 -2.250 6.691 1.00 0.00 ? 60 ILE C CG2 8 16
ATOM 8785 C CD1 . ILE C 1 16 ? 3.104 -1.377 4.536 1.00 0.00 ? 60 ILE C CD1 8 16
ATOM 8786 H H . ILE C 1 16 ? 1.490 -1.932 8.268 1.00 0.00 ? 60 ILE C H 8 16
ATOM 8787 H HA . ILE C 1 16 ? 2.811 -4.214 7.326 1.00 0.00 ? 60 ILE C HA 8 16
ATOM 8788 H HB . ILE C 1 16 ? 3.342 -1.245 7.461 1.00 0.00 ? 60 ILE C HB 8 16
ATOM 8789 H HG12 . ILE C 1 16 ? 2.835 -3.318 5.337 1.00 0.00 ? 60 ILE C HG12 8 16
ATOM 8790 H HG13 . ILE C 1 16 ? 1.704 -2.140 5.913 1.00 0.00 ? 60 ILE C HG13 8 16
ATOM 8791 H HG21 . ILE C 1 16 ? 5.371 -1.461 6.051 1.00 0.00 ? 60 ILE C HG21 8 16
ATOM 8792 H HG22 . ILE C 1 16 ? 5.564 -2.153 7.597 1.00 0.00 ? 60 ILE C HG22 8 16
ATOM 8793 H HG23 . ILE C 1 16 ? 5.286 -3.153 6.199 1.00 0.00 ? 60 ILE C HG23 8 16
ATOM 8794 H HD11 . ILE C 1 16 ? 4.074 -1.654 4.163 1.00 0.00 ? 60 ILE C HD11 8 16
ATOM 8795 H HD12 . ILE C 1 16 ? 2.397 -1.510 3.737 1.00 0.00 ? 60 ILE C HD12 8 16
ATOM 8796 H HD13 . ILE C 1 16 ? 3.107 -0.355 4.854 1.00 0.00 ? 60 ILE C HD13 8 16
ATOM 8797 N N . LYS C 1 17 ? 4.228 -2.968 9.947 1.00 0.00 ? 61 LYS C N 8 17
ATOM 8798 C CA . LYS C 1 17 ? 5.054 -3.237 11.090 1.00 0.00 ? 61 LYS C CA 8 17
ATOM 8799 C C . LYS C 1 17 ? 4.657 -4.477 11.864 1.00 0.00 ? 61 LYS C C 8 17
ATOM 8800 O O . LYS C 1 17 ? 5.511 -5.218 12.297 1.00 0.00 ? 61 LYS C O 8 17
ATOM 8801 C CB . LYS C 1 17 ? 5.111 -1.959 11.915 1.00 0.00 ? 61 LYS C CB 8 17
ATOM 8802 C CG . LYS C 1 17 ? 6.244 -1.970 12.890 1.00 0.00 ? 61 LYS C CG 8 17
ATOM 8803 C CD . LYS C 1 17 ? 6.577 -0.626 13.499 1.00 0.00 ? 61 LYS C CD 8 17
ATOM 8804 C CE . LYS C 1 17 ? 5.472 -0.059 14.318 1.00 0.00 ? 61 LYS C CE 8 17
ATOM 8805 N NZ . LYS C 1 17 ? 5.677 1.256 14.762 1.00 0.00 ? 61 LYS C NZ 8 17
ATOM 8806 H H . LYS C 1 17 ? 3.740 -2.101 9.916 1.00 0.00 ? 61 LYS C H 8 17
ATOM 8807 H HA . LYS C 1 17 ? 6.049 -3.440 10.715 1.00 0.00 ? 61 LYS C HA 8 17
ATOM 8808 H HB2 . LYS C 1 17 ? 5.210 -1.100 11.252 1.00 0.00 ? 61 LYS C HB2 8 17
ATOM 8809 H HB3 . LYS C 1 17 ? 4.189 -1.844 12.450 1.00 0.00 ? 61 LYS C HB3 8 17
ATOM 8810 H HG2 . LYS C 1 17 ? 6.011 -2.672 13.691 1.00 0.00 ? 61 LYS C HG2 8 17
ATOM 8811 H HG3 . LYS C 1 17 ? 7.100 -2.324 12.399 1.00 0.00 ? 61 LYS C HG3 8 17
ATOM 8812 H HD2 . LYS C 1 17 ? 7.463 -0.732 14.124 1.00 0.00 ? 61 LYS C HD2 8 17
ATOM 8813 H HD3 . LYS C 1 17 ? 6.825 0.061 12.738 1.00 0.00 ? 61 LYS C HD3 8 17
ATOM 8814 H HE2 . LYS C 1 17 ? 4.549 -0.087 13.740 1.00 0.00 ? 61 LYS C HE2 8 17
ATOM 8815 H HE3 . LYS C 1 17 ? 5.358 -0.695 15.104 1.00 0.00 ? 61 LYS C HE3 8 17
ATOM 8816 H HZ1 . LYS C 1 17 ? 5.782 1.837 14.061 1.00 0.00 ? 61 LYS C HZ1 8 17
ATOM 8817 H HZ2 . LYS C 1 17 ? 5.010 1.616 15.364 1.00 0.00 ? 61 LYS C HZ2 8 17
ATOM 8818 H HZ3 . LYS C 1 17 ? 6.499 1.302 15.203 1.00 0.00 ? 61 LYS C HZ3 8 17
ATOM 8819 N N . ALA C 1 18 ? 3.356 -4.694 12.010 1.00 0.00 ? 62 ALA C N 8 18
ATOM 8820 C CA . ALA C 1 18 ? 2.775 -5.829 12.683 1.00 0.00 ? 62 ALA C CA 8 18
ATOM 8821 C C . ALA C 1 18 ? 2.854 -7.096 11.861 1.00 0.00 ? 62 ALA C C 8 18
ATOM 8822 O O . ALA C 1 18 ? 3.193 -8.149 12.368 1.00 0.00 ? 62 ALA C O 8 18
ATOM 8823 C CB . ALA C 1 18 ? 1.351 -5.455 13.048 1.00 0.00 ? 62 ALA C CB 8 18
ATOM 8824 H H . ALA C 1 18 ? 2.765 -4.010 11.586 1.00 0.00 ? 62 ALA C H 8 18
ATOM 8825 H HA . ALA C 1 18 ? 3.322 -5.949 13.609 1.00 0.00 ? 62 ALA C HA 8 18
ATOM 8826 H HB1 . ALA C 1 18 ? 0.780 -5.239 12.184 1.00 0.00 ? 62 ALA C HB1 8 18
ATOM 8827 H HB2 . ALA C 1 18 ? 0.927 -6.291 13.553 1.00 0.00 ? 62 ALA C HB2 8 18
ATOM 8828 H HB3 . ALA C 1 18 ? 1.313 -4.601 13.684 1.00 0.00 ? 62 ALA C HB3 8 18
ATOM 8829 N N . GLY C 1 19 ? 2.573 -6.967 10.582 1.00 0.00 ? 63 GLY C N 8 19
ATOM 8830 C CA . GLY C 1 19 ? 2.702 -7.980 9.567 1.00 0.00 ? 63 GLY C CA 8 19
ATOM 8831 C C . GLY C 1 19 ? 4.084 -8.557 9.387 1.00 0.00 ? 63 GLY C C 8 19
ATOM 8832 O O . GLY C 1 19 ? 4.235 -9.738 9.127 1.00 0.00 ? 63 GLY C O 8 19
ATOM 8833 H H . GLY C 1 19 ? 2.252 -6.071 10.293 1.00 0.00 ? 63 GLY C H 8 19
ATOM 8834 H HA2 . GLY C 1 19 ? 2.005 -8.768 9.765 1.00 0.00 ? 63 GLY C HA2 8 19
ATOM 8835 H HA3 . GLY C 1 19 ? 2.420 -7.555 8.625 1.00 0.00 ? 63 GLY C HA3 8 19
ATOM 8836 N N . GLY C 1 20 ? 5.127 -7.757 9.558 1.00 0.00 ? 64 GLY C N 8 20
ATOM 8837 C CA . GLY C 1 20 ? 6.506 -8.164 9.477 1.00 0.00 ? 64 GLY C CA 8 20
ATOM 8838 C C . GLY C 1 20 ? 7.089 -8.163 8.084 1.00 0.00 ? 64 GLY C C 8 20
ATOM 8839 O O . GLY C 1 20 ? 7.916 -8.983 7.739 1.00 0.00 ? 64 GLY C O 8 20
ATOM 8840 H H . GLY C 1 20 ? 4.903 -6.821 9.763 1.00 0.00 ? 64 GLY C H 8 20
ATOM 8841 H HA2 . GLY C 1 20 ? 7.091 -7.501 10.063 1.00 0.00 ? 64 GLY C HA2 8 20
ATOM 8842 H HA3 . GLY C 1 20 ? 6.600 -9.168 9.825 1.00 0.00 ? 64 GLY C HA3 8 20
ATOM 8843 N N . TYR C 1 21 ? 6.626 -7.235 7.255 1.00 0.00 ? 65 TYR C N 8 21
ATOM 8844 C CA . TYR C 1 21 ? 6.933 -7.146 5.871 1.00 0.00 ? 65 TYR C CA 8 21
ATOM 8845 C C . TYR C 1 21 ? 8.362 -6.903 5.550 1.00 0.00 ? 65 TYR C C 8 21
ATOM 8846 O O . TYR C 1 21 ? 8.729 -7.030 4.441 1.00 0.00 ? 65 TYR C O 8 21
ATOM 8847 C CB . TYR C 1 21 ? 6.093 -6.036 5.290 1.00 0.00 ? 65 TYR C CB 8 21
ATOM 8848 C CG . TYR C 1 21 ? 4.785 -6.419 4.658 1.00 0.00 ? 65 TYR C CG 8 21
ATOM 8849 C CD1 . TYR C 1 21 ? 4.744 -7.147 3.479 1.00 0.00 ? 65 TYR C CD1 8 21
ATOM 8850 C CD2 . TYR C 1 21 ? 3.627 -5.869 5.194 1.00 0.00 ? 65 TYR C CD2 8 21
ATOM 8851 C CE1 . TYR C 1 21 ? 3.521 -7.269 2.821 1.00 0.00 ? 65 TYR C CE1 8 21
ATOM 8852 C CE2 . TYR C 1 21 ? 2.401 -5.953 4.532 1.00 0.00 ? 65 TYR C CE2 8 21
ATOM 8853 C CZ . TYR C 1 21 ? 2.369 -6.651 3.322 1.00 0.00 ? 65 TYR C CZ 8 21
ATOM 8854 O OH . TYR C 1 21 ? 1.175 -6.801 2.698 1.00 0.00 ? 65 TYR C OH 8 21
ATOM 8855 H H . TYR C 1 21 ? 5.940 -6.601 7.588 1.00 0.00 ? 65 TYR C H 8 21
ATOM 8856 H HA . TYR C 1 21 ? 6.635 -8.049 5.416 1.00 0.00 ? 65 TYR C HA 8 21
ATOM 8857 H HB2 . TYR C 1 21 ? 5.870 -5.352 6.109 1.00 0.00 ? 65 TYR C HB2 8 21
ATOM 8858 H HB3 . TYR C 1 21 ? 6.620 -5.429 4.571 1.00 0.00 ? 65 TYR C HB3 8 21
ATOM 8859 H HD1 . TYR C 1 21 ? 5.617 -7.596 3.068 1.00 0.00 ? 65 TYR C HD1 8 21
ATOM 8860 H HD2 . TYR C 1 21 ? 3.703 -5.355 6.125 1.00 0.00 ? 65 TYR C HD2 8 21
ATOM 8861 H HE1 . TYR C 1 21 ? 3.464 -7.839 1.923 1.00 0.00 ? 65 TYR C HE1 8 21
ATOM 8862 H HE2 . TYR C 1 21 ? 1.525 -5.500 4.933 1.00 0.00 ? 65 TYR C HE2 8 21
ATOM 8863 H HH . TYR C 1 21 ? 0.575 -7.149 3.340 1.00 0.00 ? 65 TYR C HH 8 21
HETATM 8864 N N . NH2 C 1 22 ? 9.207 -6.479 6.414 1.00 0.00 ? 66 NH2 C N 8 22
HETATM 8865 H HN1 . NH2 C 1 22 ? 10.133 -6.291 6.143 1.00 0.00 ? 66 NH2 C HN1 8 22
HETATM 8866 H HN2 . NH2 C 1 22 ? 8.887 -6.295 7.313 1.00 0.00 ? 66 NH2 C HN2 8 22
HETATM 8867 C C . ACE D 1 1 ? 4.714 -11.718 4.890 1.00 0.00 ? 67 ACE D C 8 1
HETATM 8868 O O . ACE D 1 1 ? 4.096 -11.081 4.099 1.00 0.00 ? 67 ACE D O 8 1
HETATM 8869 C CH3 . ACE D 1 1 ? 5.665 -11.055 5.817 1.00 0.00 ? 67 ACE D CH3 8 1
HETATM 8870 H H1 . ACE D 1 1 ? 6.096 -10.720 5.797 1.00 0.00 ? 67 ACE D H1 8 1
HETATM 8871 H H2 . ACE D 1 1 ? 5.625 -10.723 6.165 1.00 0.00 ? 67 ACE D H2 8 1
HETATM 8872 H H3 . ACE D 1 1 ? 5.947 -11.230 6.152 1.00 0.00 ? 67 ACE D H3 8 1
ATOM 8873 N N . ALA D 1 2 ? 4.606 -13.021 4.969 1.00 0.00 ? 68 ALA D N 8 2
ATOM 8874 C CA . ALA D 1 2 ? 3.786 -13.820 4.121 1.00 0.00 ? 68 ALA D CA 8 2
ATOM 8875 C C . ALA D 1 2 ? 2.310 -13.667 4.368 1.00 0.00 ? 68 ALA D C 8 2
ATOM 8876 O O . ALA D 1 2 ? 1.557 -13.515 3.447 1.00 0.00 ? 68 ALA D O 8 2
ATOM 8877 C CB . ALA D 1 2 ? 4.177 -15.256 4.331 1.00 0.00 ? 68 ALA D CB 8 2
ATOM 8878 H H . ALA D 1 2 ? 5.123 -13.467 5.651 1.00 0.00 ? 68 ALA D H 8 2
ATOM 8879 H HA . ALA D 1 2 ? 3.947 -13.535 3.100 1.00 0.00 ? 68 ALA D HA 8 2
ATOM 8880 H HB1 . ALA D 1 2 ? 5.148 -15.413 4.043 1.00 0.00 ? 68 ALA D HB1 8 2
ATOM 8881 H HB2 . ALA D 1 2 ? 4.106 -15.520 5.325 1.00 0.00 ? 68 ALA D HB2 8 2
ATOM 8882 H HB3 . ALA D 1 2 ? 3.549 -15.868 3.780 1.00 0.00 ? 68 ALA D HB3 8 2
ATOM 8883 N N . LYS D 1 3 ? 1.887 -13.627 5.606 1.00 0.00 ? 69 LYS D N 8 3
ATOM 8884 C CA . LYS D 1 3 ? 0.517 -13.454 5.976 1.00 0.00 ? 69 LYS D CA 8 3
ATOM 8885 C C . LYS D 1 3 ? 0.062 -12.014 5.858 1.00 0.00 ? 69 LYS D C 8 3
ATOM 8886 O O . LYS D 1 3 ? -1.022 -11.753 5.355 1.00 0.00 ? 69 LYS D O 8 3
ATOM 8887 C CB . LYS D 1 3 ? 0.280 -13.948 7.378 1.00 0.00 ? 69 LYS D CB 8 3
ATOM 8888 C CG . LYS D 1 3 ? 0.418 -15.452 7.494 1.00 0.00 ? 69 LYS D CG 8 3
ATOM 8889 C CD . LYS D 1 3 ? 0.095 -15.904 8.887 1.00 0.00 ? 69 LYS D CD 8 3
ATOM 8890 C CE . LYS D 1 3 ? 0.264 -17.391 8.963 1.00 0.00 ? 69 LYS D CE 8 3
ATOM 8891 N NZ . LYS D 1 3 ? -0.102 -17.896 10.259 1.00 0.00 ? 69 LYS D NZ 8 3
ATOM 8892 H H . LYS D 1 3 ? 2.562 -13.690 6.310 1.00 0.00 ? 69 LYS D H 8 3
ATOM 8893 H HA . LYS D 1 3 ? -0.095 -14.040 5.306 1.00 0.00 ? 69 LYS D HA 8 3
ATOM 8894 H HB2 . LYS D 1 3 ? 0.968 -13.461 8.069 1.00 0.00 ? 69 LYS D HB2 8 3
ATOM 8895 H HB3 . LYS D 1 3 ? -0.716 -13.654 7.624 1.00 0.00 ? 69 LYS D HB3 8 3
ATOM 8896 H HG2 . LYS D 1 3 ? -0.233 -15.947 6.774 1.00 0.00 ? 69 LYS D HG2 8 3
ATOM 8897 H HG3 . LYS D 1 3 ? 1.419 -15.724 7.281 1.00 0.00 ? 69 LYS D HG3 8 3
ATOM 8898 H HD2 . LYS D 1 3 ? 0.744 -15.408 9.609 1.00 0.00 ? 69 LYS D HD2 8 3
ATOM 8899 H HD3 . LYS D 1 3 ? -0.905 -15.648 9.128 1.00 0.00 ? 69 LYS D HD3 8 3
ATOM 8900 H HE2 . LYS D 1 3 ? -0.359 -17.865 8.205 1.00 0.00 ? 69 LYS D HE2 8 3
ATOM 8901 H HE3 . LYS D 1 3 ? 1.256 -17.648 8.731 1.00 0.00 ? 69 LYS D HE3 8 3
ATOM 8902 H HZ1 . LYS D 1 3 ? 0.385 -17.516 10.942 1.00 0.00 ? 69 LYS D HZ1 8 3
ATOM 8903 H HZ2 . LYS D 1 3 ? -0.979 -17.722 10.449 1.00 0.00 ? 69 LYS D HZ2 8 3
ATOM 8904 H HZ3 . LYS D 1 3 ? -0.002 -18.830 10.335 1.00 0.00 ? 69 LYS D HZ3 8 3
ATOM 8905 N N . ALA D 1 4 ? 0.959 -11.087 6.178 1.00 0.00 ? 70 ALA D N 8 4
ATOM 8906 C CA . ALA D 1 4 ? 0.863 -9.674 5.896 1.00 0.00 ? 70 ALA D CA 8 4
ATOM 8907 C C . ALA D 1 4 ? 0.428 -9.396 4.469 1.00 0.00 ? 70 ALA D C 8 4
ATOM 8908 O O . ALA D 1 4 ? -0.321 -8.478 4.163 1.00 0.00 ? 70 ALA D O 8 4
ATOM 8909 C CB . ALA D 1 4 ? 2.234 -9.070 6.157 1.00 0.00 ? 70 ALA D CB 8 4
ATOM 8910 H H . ALA D 1 4 ? 1.794 -11.415 6.625 1.00 0.00 ? 70 ALA D H 8 4
ATOM 8911 H HA . ALA D 1 4 ? 0.156 -9.220 6.578 1.00 0.00 ? 70 ALA D HA 8 4
ATOM 8912 H HB1 . ALA D 1 4 ? 2.209 -8.030 6.250 1.00 0.00 ? 70 ALA D HB1 8 4
ATOM 8913 H HB2 . ALA D 1 4 ? 2.670 -9.421 7.037 1.00 0.00 ? 70 ALA D HB2 8 4
ATOM 8914 H HB3 . ALA D 1 4 ? 2.900 -9.319 5.413 1.00 0.00 ? 70 ALA D HB3 8 4
ATOM 8915 N N . ALA D 1 5 ? 0.889 -10.253 3.564 1.00 0.00 ? 71 ALA D N 8 5
ATOM 8916 C CA . ALA D 1 5 ? 0.767 -10.126 2.131 1.00 0.00 ? 71 ALA D CA 8 5
ATOM 8917 C C . ALA D 1 5 ? -0.549 -10.621 1.567 1.00 0.00 ? 71 ALA D C 8 5
ATOM 8918 O O . ALA D 1 5 ? -0.786 -10.550 0.376 1.00 0.00 ? 71 ALA D O 8 5
ATOM 8919 C CB . ALA D 1 5 ? 1.959 -10.737 1.426 1.00 0.00 ? 71 ALA D CB 8 5
ATOM 8920 H H . ALA D 1 5 ? 1.280 -11.082 3.963 1.00 0.00 ? 71 ALA D H 8 5
ATOM 8921 H HA . ALA D 1 5 ? 0.747 -9.065 1.921 1.00 0.00 ? 71 ALA D HA 8 5
ATOM 8922 H HB1 . ALA D 1 5 ? 2.846 -10.303 1.834 1.00 0.00 ? 71 ALA D HB1 8 5
ATOM 8923 H HB2 . ALA D 1 5 ? 1.996 -11.787 1.564 1.00 0.00 ? 71 ALA D HB2 8 5
ATOM 8924 H HB3 . ALA D 1 5 ? 1.904 -10.543 0.384 1.00 0.00 ? 71 ALA D HB3 8 5
ATOM 8925 N N . ALA D 1 6 ? -1.472 -11.047 2.418 1.00 0.00 ? 72 ALA D N 8 6
ATOM 8926 C CA . ALA D 1 6 ? -2.883 -10.997 2.144 1.00 0.00 ? 72 ALA D CA 8 6
ATOM 8927 C C . ALA D 1 6 ? -3.571 -9.938 2.975 1.00 0.00 ? 72 ALA D C 8 6
ATOM 8928 O O . ALA D 1 6 ? -4.122 -8.996 2.424 1.00 0.00 ? 72 ALA D O 8 6
ATOM 8929 C CB . ALA D 1 6 ? -3.470 -12.379 2.308 1.00 0.00 ? 72 ALA D CB 8 6
ATOM 8930 H H . ALA D 1 6 ? -1.182 -11.180 3.359 1.00 0.00 ? 72 ALA D H 8 6
ATOM 8931 H HA . ALA D 1 6 ? -3.013 -10.682 1.125 1.00 0.00 ? 72 ALA D HA 8 6
ATOM 8932 H HB1 . ALA D 1 6 ? -3.069 -12.998 1.562 1.00 0.00 ? 72 ALA D HB1 8 6
ATOM 8933 H HB2 . ALA D 1 6 ? -3.262 -12.781 3.259 1.00 0.00 ? 72 ALA D HB2 8 6
ATOM 8934 H HB3 . ALA D 1 6 ? -4.517 -12.404 2.188 1.00 0.00 ? 72 ALA D HB3 8 6
ATOM 8935 N N . ALA D 1 7 ? -3.458 -9.988 4.299 1.00 0.00 ? 73 ALA D N 8 7
ATOM 8936 C CA . ALA D 1 7 ? -4.226 -9.222 5.252 1.00 0.00 ? 73 ALA D CA 8 7
ATOM 8937 C C . ALA D 1 7 ? -4.132 -7.730 5.037 1.00 0.00 ? 73 ALA D C 8 7
ATOM 8938 O O . ALA D 1 7 ? -5.117 -7.076 5.219 1.00 0.00 ? 73 ALA D O 8 7
ATOM 8939 C CB . ALA D 1 7 ? -3.790 -9.605 6.639 1.00 0.00 ? 73 ALA D CB 8 7
ATOM 8940 H H . ALA D 1 7 ? -2.871 -10.729 4.626 1.00 0.00 ? 73 ALA D H 8 7
ATOM 8941 H HA . ALA D 1 7 ? -5.253 -9.476 5.117 1.00 0.00 ? 73 ALA D HA 8 7
ATOM 8942 H HB1 . ALA D 1 7 ? -4.357 -9.091 7.363 1.00 0.00 ? 73 ALA D HB1 8 7
ATOM 8943 H HB2 . ALA D 1 7 ? -3.913 -10.630 6.788 1.00 0.00 ? 73 ALA D HB2 8 7
ATOM 8944 H HB3 . ALA D 1 7 ? -2.769 -9.389 6.791 1.00 0.00 ? 73 ALA D HB3 8 7
ATOM 8945 N N . ALA D 1 8 ? -2.976 -7.188 4.690 1.00 0.00 ? 74 ALA D N 8 8
ATOM 8946 C CA . ALA D 1 8 ? -2.864 -5.762 4.497 1.00 0.00 ? 74 ALA D CA 8 8
ATOM 8947 C C . ALA D 1 8 ? -3.326 -5.364 3.115 1.00 0.00 ? 74 ALA D C 8 8
ATOM 8948 O O . ALA D 1 8 ? -3.992 -4.367 2.948 1.00 0.00 ? 74 ALA D O 8 8
ATOM 8949 C CB . ALA D 1 8 ? -1.425 -5.375 4.741 1.00 0.00 ? 74 ALA D CB 8 8
ATOM 8950 H H . ALA D 1 8 ? -2.207 -7.781 4.463 1.00 0.00 ? 74 ALA D H 8 8
ATOM 8951 H HA . ALA D 1 8 ? -3.505 -5.255 5.197 1.00 0.00 ? 74 ALA D HA 8 8
ATOM 8952 H HB1 . ALA D 1 8 ? -1.341 -4.313 4.717 1.00 0.00 ? 74 ALA D HB1 8 8
ATOM 8953 H HB2 . ALA D 1 8 ? -1.116 -5.718 5.703 1.00 0.00 ? 74 ALA D HB2 8 8
ATOM 8954 H HB3 . ALA D 1 8 ? -0.807 -5.758 3.975 1.00 0.00 ? 74 ALA D HB3 8 8
ATOM 8955 N N . ILE D 1 9 ? -2.986 -6.172 2.121 1.00 0.00 ? 75 ILE D N 8 9
ATOM 8956 C CA . ILE D 1 9 ? -3.357 -5.960 0.742 1.00 0.00 ? 75 ILE D CA 8 9
ATOM 8957 C C . ILE D 1 9 ? -4.862 -5.985 0.559 1.00 0.00 ? 75 ILE D C 8 9
ATOM 8958 O O . ILE D 1 9 ? -5.407 -5.154 -0.139 1.00 0.00 ? 75 ILE D O 8 9
ATOM 8959 C CB . ILE D 1 9 ? -2.739 -7.040 -0.125 1.00 0.00 ? 75 ILE D CB 8 9
ATOM 8960 C CG1 . ILE D 1 9 ? -1.242 -7.212 0.039 1.00 0.00 ? 75 ILE D CG1 8 9
ATOM 8961 C CG2 . ILE D 1 9 ? -3.088 -6.788 -1.576 1.00 0.00 ? 75 ILE D CG2 8 9
ATOM 8962 C CD1 . ILE D 1 9 ? -0.432 -5.959 -0.215 1.00 0.00 ? 75 ILE D CD1 8 9
ATOM 8963 H H . ILE D 1 9 ? -2.468 -6.981 2.385 1.00 0.00 ? 75 ILE D H 8 9
ATOM 8964 H HA . ILE D 1 9 ? -2.996 -4.981 0.446 1.00 0.00 ? 75 ILE D HA 8 9
ATOM 8965 H HB . ILE D 1 9 ? -3.218 -7.971 0.149 1.00 0.00 ? 75 ILE D HB 8 9
ATOM 8966 H HG12 . ILE D 1 9 ? -1.037 -7.564 1.051 1.00 0.00 ? 75 ILE D HG12 8 9
ATOM 8967 H HG13 . ILE D 1 9 ? -0.911 -7.980 -0.638 1.00 0.00 ? 75 ILE D HG13 8 9
ATOM 8968 H HG21 . ILE D 1 9 ? -3.631 -7.200 -1.845 1.00 0.00 ? 75 ILE D HG21 8 9
ATOM 8969 H HG22 . ILE D 1 9 ? -2.604 -6.970 -2.099 1.00 0.00 ? 75 ILE D HG22 8 9
ATOM 8970 H HG23 . ILE D 1 9 ? -3.289 -6.098 -1.820 1.00 0.00 ? 75 ILE D HG23 8 9
ATOM 8971 H HD11 . ILE D 1 9 ? 0.612 -6.176 -0.128 1.00 0.00 ? 75 ILE D HD11 8 9
ATOM 8972 H HD12 . ILE D 1 9 ? -0.637 -5.575 -1.186 1.00 0.00 ? 75 ILE D HD12 8 9
ATOM 8973 H HD13 . ILE D 1 9 ? -0.688 -5.199 0.485 1.00 0.00 ? 75 ILE D HD13 8 9
ATOM 8974 N N . LYS D 1 10 ? -5.518 -6.946 1.197 1.00 0.00 ? 76 LYS D N 8 10
ATOM 8975 C CA . LYS D 1 10 ? -6.939 -7.185 1.079 1.00 0.00 ? 76 LYS D CA 8 10
ATOM 8976 C C . LYS D 1 10 ? -7.771 -6.052 1.653 1.00 0.00 ? 76 LYS D C 8 10
ATOM 8977 O O . LYS D 1 10 ? -8.774 -5.686 1.075 1.00 0.00 ? 76 LYS D O 8 10
ATOM 8978 C CB . LYS D 1 10 ? -7.229 -8.502 1.783 1.00 0.00 ? 76 LYS D CB 8 10
ATOM 8979 C CG . LYS D 1 10 ? -6.993 -9.696 0.876 1.00 0.00 ? 76 LYS D CG 8 10
ATOM 8980 C CD . LYS D 1 10 ? -7.393 -11.021 1.494 1.00 0.00 ? 76 LYS D CD 8 10
ATOM 8981 C CE . LYS D 1 10 ? -7.330 -12.104 0.441 1.00 0.00 ? 76 LYS D CE 8 10
ATOM 8982 N NZ . LYS D 1 10 ? -7.803 -13.397 0.881 1.00 0.00 ? 76 LYS D NZ 8 10
ATOM 8983 H H . LYS D 1 10 ? -4.945 -7.538 1.762 1.00 0.00 ? 76 LYS D H 8 10
ATOM 8984 H HA . LYS D 1 10 ? -7.205 -7.188 0.028 1.00 0.00 ? 76 LYS D HA 8 10
ATOM 8985 H HB2 . LYS D 1 10 ? -6.610 -8.586 2.676 1.00 0.00 ? 76 LYS D HB2 8 10
ATOM 8986 H HB3 . LYS D 1 10 ? -8.261 -8.530 2.091 1.00 0.00 ? 76 LYS D HB3 8 10
ATOM 8987 H HG2 . LYS D 1 10 ? -7.553 -9.556 -0.048 1.00 0.00 ? 76 LYS D HG2 8 10
ATOM 8988 H HG3 . LYS D 1 10 ? -5.949 -9.711 0.608 1.00 0.00 ? 76 LYS D HG3 8 10
ATOM 8989 H HD2 . LYS D 1 10 ? -6.752 -11.267 2.340 1.00 0.00 ? 76 LYS D HD2 8 10
ATOM 8990 H HD3 . LYS D 1 10 ? -8.393 -10.923 1.834 1.00 0.00 ? 76 LYS D HD3 8 10
ATOM 8991 H HE2 . LYS D 1 10 ? -7.894 -11.791 -0.438 1.00 0.00 ? 76 LYS D HE2 8 10
ATOM 8992 H HE3 . LYS D 1 10 ? -6.319 -12.219 0.177 1.00 0.00 ? 76 LYS D HE3 8 10
ATOM 8993 H HZ1 . LYS D 1 10 ? -7.356 -13.679 1.711 1.00 0.00 ? 76 LYS D HZ1 8 10
ATOM 8994 H HZ2 . LYS D 1 10 ? -8.755 -13.400 1.062 1.00 0.00 ? 76 LYS D HZ2 8 10
ATOM 8995 H HZ3 . LYS D 1 10 ? -7.599 -14.116 0.241 1.00 0.00 ? 76 LYS D HZ3 8 10
ATOM 8996 N N . ALA D 1 11 ? -7.299 -5.476 2.750 1.00 0.00 ? 77 ALA D N 8 11
ATOM 8997 C CA . ALA D 1 11 ? -7.746 -4.168 3.169 1.00 0.00 ? 77 ALA D CA 8 11
ATOM 8998 C C . ALA D 1 11 ? -7.520 -3.132 2.084 1.00 0.00 ? 77 ALA D C 8 11
ATOM 8999 O O . ALA D 1 11 ? -8.448 -2.502 1.599 1.00 0.00 ? 77 ALA D O 8 11
ATOM 9000 C CB . ALA D 1 11 ? -7.112 -3.883 4.520 1.00 0.00 ? 77 ALA D CB 8 11
ATOM 9001 H H . ALA D 1 11 ? -6.501 -5.914 3.165 1.00 0.00 ? 77 ALA D H 8 11
ATOM 9002 H HA . ALA D 1 11 ? -8.818 -4.193 3.312 1.00 0.00 ? 77 ALA D HA 8 11
ATOM 9003 H HB1 . ALA D 1 11 ? -6.749 -4.372 4.901 1.00 0.00 ? 77 ALA D HB1 8 11
ATOM 9004 H HB2 . ALA D 1 11 ? -7.489 -3.700 5.039 1.00 0.00 ? 77 ALA D HB2 8 11
ATOM 9005 H HB3 . ALA D 1 11 ? -6.623 -3.379 4.602 1.00 0.00 ? 77 ALA D HB3 8 11
ATOM 9006 N N . ILE D 1 12 ? -6.285 -2.897 1.646 1.00 0.00 ? 78 ILE D N 8 12
ATOM 9007 C CA . ILE D 1 12 ? -5.914 -1.763 0.837 1.00 0.00 ? 78 ILE D CA 8 12
ATOM 9008 C C . ILE D 1 12 ? -6.512 -1.846 -0.555 1.00 0.00 ? 78 ILE D C 8 12
ATOM 9009 O O . ILE D 1 12 ? -7.045 -0.841 -0.985 1.00 0.00 ? 78 ILE D O 8 12
ATOM 9010 C CB . ILE D 1 12 ? -4.425 -1.466 0.904 1.00 0.00 ? 78 ILE D CB 8 12
ATOM 9011 C CG1 . ILE D 1 12 ? -4.102 -0.062 1.374 1.00 0.00 ? 78 ILE D CG1 8 12
ATOM 9012 C CG2 . ILE D 1 12 ? -3.629 -1.828 -0.334 1.00 0.00 ? 78 ILE D CG2 8 12
ATOM 9013 C CD1 . ILE D 1 12 ? -4.470 1.078 0.450 1.00 0.00 ? 78 ILE D CD1 8 12
ATOM 9014 H H . ILE D 1 12 ? -5.597 -3.592 1.864 1.00 0.00 ? 78 ILE D H 8 12
ATOM 9015 H HA . ILE D 1 12 ? -6.425 -0.920 1.292 1.00 0.00 ? 78 ILE D HA 8 12
ATOM 9016 H HB . ILE D 1 12 ? -4.008 -2.114 1.666 1.00 0.00 ? 78 ILE D HB 8 12
ATOM 9017 H HG12 . ILE D 1 12 ? -4.619 0.102 2.319 1.00 0.00 ? 78 ILE D HG12 8 12
ATOM 9018 H HG13 . ILE D 1 12 ? -3.048 -0.036 1.602 1.00 0.00 ? 78 ILE D HG13 8 12
ATOM 9019 H HG21 . ILE D 1 12 ? -3.805 -2.849 -0.621 1.00 0.00 ? 78 ILE D HG21 8 12
ATOM 9020 H HG22 . ILE D 1 12 ? -3.927 -1.207 -1.143 1.00 0.00 ? 78 ILE D HG22 8 12
ATOM 9021 H HG23 . ILE D 1 12 ? -2.571 -1.676 -0.181 1.00 0.00 ? 78 ILE D HG23 8 12
ATOM 9022 H HD11 . ILE D 1 12 ? -3.937 0.997 -0.464 1.00 0.00 ? 78 ILE D HD11 8 12
ATOM 9023 H HD12 . ILE D 1 12 ? -5.501 1.121 0.279 1.00 0.00 ? 78 ILE D HD12 8 12
ATOM 9024 H HD13 . ILE D 1 12 ? -4.195 2.012 0.867 1.00 0.00 ? 78 ILE D HD13 8 12
ATOM 9025 N N . ALA D 1 13 ? -6.536 -2.995 -1.221 1.00 0.00 ? 79 ALA D N 8 13
ATOM 9026 C CA . ALA D 1 13 ? -7.089 -3.031 -2.553 1.00 0.00 ? 79 ALA D CA 8 13
ATOM 9027 C C . ALA D 1 13 ? -8.585 -2.783 -2.608 1.00 0.00 ? 79 ALA D C 8 13
ATOM 9028 O O . ALA D 1 13 ? -9.105 -2.369 -3.626 1.00 0.00 ? 79 ALA D O 8 13
ATOM 9029 C CB . ALA D 1 13 ? -6.747 -4.350 -3.218 1.00 0.00 ? 79 ALA D CB 8 13
ATOM 9030 H H . ALA D 1 13 ? -6.122 -3.780 -0.766 1.00 0.00 ? 79 ALA D H 8 13
ATOM 9031 H HA . ALA D 1 13 ? -6.627 -2.237 -3.129 1.00 0.00 ? 79 ALA D HA 8 13
ATOM 9032 H HB1 . ALA D 1 13 ? -7.112 -4.380 -4.216 1.00 0.00 ? 79 ALA D HB1 8 13
ATOM 9033 H HB2 . ALA D 1 13 ? -5.694 -4.478 -3.225 1.00 0.00 ? 79 ALA D HB2 8 13
ATOM 9034 H HB3 . ALA D 1 13 ? -7.141 -5.176 -2.667 1.00 0.00 ? 79 ALA D HB3 8 13
ATOM 9035 N N . ALA D 1 14 ? -9.291 -2.952 -1.495 1.00 0.00 ? 80 ALA D N 8 14
ATOM 9036 C CA . ALA D 1 14 ? -10.670 -2.567 -1.295 1.00 0.00 ? 80 ALA D CA 8 14
ATOM 9037 C C . ALA D 1 14 ? -10.816 -1.106 -0.948 1.00 0.00 ? 80 ALA D C 8 14
ATOM 9038 O O . ALA D 1 14 ? -11.608 -0.407 -1.542 1.00 0.00 ? 80 ALA D O 8 14
ATOM 9039 C CB . ALA D 1 14 ? -11.288 -3.446 -0.240 1.00 0.00 ? 80 ALA D CB 8 14
ATOM 9040 H H . ALA D 1 14 ? -8.714 -3.174 -0.707 1.00 0.00 ? 80 ALA D H 8 14
ATOM 9041 H HA . ALA D 1 14 ? -11.218 -2.696 -2.215 1.00 0.00 ? 80 ALA D HA 8 14
ATOM 9042 H HB1 . ALA D 1 14 ? -12.327 -3.250 -0.170 1.00 0.00 ? 80 ALA D HB1 8 14
ATOM 9043 H HB2 . ALA D 1 14 ? -11.213 -4.441 -0.483 1.00 0.00 ? 80 ALA D HB2 8 14
ATOM 9044 H HB3 . ALA D 1 14 ? -10.902 -3.291 0.706 1.00 0.00 ? 80 ALA D HB3 8 14
ATOM 9045 N N . ILE D 1 15 ? -9.990 -0.611 -0.037 1.00 0.00 ? 81 ILE D N 8 15
ATOM 9046 C CA . ILE D 1 15 ? -9.912 0.769 0.387 1.00 0.00 ? 81 ILE D CA 8 15
ATOM 9047 C C . ILE D 1 15 ? -9.427 1.672 -0.730 1.00 0.00 ? 81 ILE D C 8 15
ATOM 9048 O O . ILE D 1 15 ? -9.871 2.804 -0.812 1.00 0.00 ? 81 ILE D O 8 15
ATOM 9049 C CB . ILE D 1 15 ? -9.043 0.886 1.631 1.00 0.00 ? 81 ILE D CB 8 15
ATOM 9050 C CG1 . ILE D 1 15 ? -9.668 0.219 2.843 1.00 0.00 ? 81 ILE D CG1 8 15
ATOM 9051 C CG2 . ILE D 1 15 ? -8.727 2.327 1.986 1.00 0.00 ? 81 ILE D CG2 8 15
ATOM 9052 C CD1 . ILE D 1 15 ? -8.695 -0.177 3.935 1.00 0.00 ? 81 ILE D CD1 8 15
ATOM 9053 H H . ILE D 1 15 ? -9.308 -1.251 0.325 1.00 0.00 ? 81 ILE D H 8 15
ATOM 9054 H HA . ILE D 1 15 ? -10.899 1.123 0.650 1.00 0.00 ? 81 ILE D HA 8 15
ATOM 9055 H HB . ILE D 1 15 ? -8.094 0.423 1.405 1.00 0.00 ? 81 ILE D HB 8 15
ATOM 9056 H HG12 . ILE D 1 15 ? -10.405 0.903 3.265 1.00 0.00 ? 81 ILE D HG12 8 15
ATOM 9057 H HG13 . ILE D 1 15 ? -10.204 -0.673 2.566 1.00 0.00 ? 81 ILE D HG13 8 15
ATOM 9058 H HG21 . ILE D 1 15 ? -8.314 2.420 2.978 1.00 0.00 ? 81 ILE D HG21 8 15
ATOM 9059 H HG22 . ILE D 1 15 ? -8.004 2.730 1.304 1.00 0.00 ? 81 ILE D HG22 8 15
ATOM 9060 H HG23 . ILE D 1 15 ? -9.602 2.919 1.948 1.00 0.00 ? 81 ILE D HG23 8 15
ATOM 9061 H HD11 . ILE D 1 15 ? -8.693 0.107 4.486 1.00 0.00 ? 81 ILE D HD11 8 15
ATOM 9062 H HD12 . ILE D 1 15 ? -8.634 -0.782 4.206 1.00 0.00 ? 81 ILE D HD12 8 15
ATOM 9063 H HD13 . ILE D 1 15 ? -8.026 -0.161 3.899 1.00 0.00 ? 81 ILE D HD13 8 15
ATOM 9064 N N . ILE D 1 16 ? -8.654 1.186 -1.697 1.00 0.00 ? 82 ILE D N 8 16
ATOM 9065 C CA . ILE D 1 16 ? -8.301 1.931 -2.883 1.00 0.00 ? 82 ILE D CA 8 16
ATOM 9066 C C . ILE D 1 16 ? -9.527 2.309 -3.694 1.00 0.00 ? 82 ILE D C 8 16
ATOM 9067 O O . ILE D 1 16 ? -9.716 3.460 -4.034 1.00 0.00 ? 82 ILE D O 8 16
ATOM 9068 C CB . ILE D 1 16 ? -7.256 1.164 -3.680 1.00 0.00 ? 82 ILE D CB 8 16
ATOM 9069 C CG1 . ILE D 1 16 ? -5.915 1.289 -2.990 1.00 0.00 ? 82 ILE D CG1 8 16
ATOM 9070 C CG2 . ILE D 1 16 ? -7.116 1.711 -5.095 1.00 0.00 ? 82 ILE D CG2 8 16
ATOM 9071 C CD1 . ILE D 1 16 ? -4.745 0.534 -3.590 1.00 0.00 ? 82 ILE D CD1 8 16
ATOM 9072 H H . ILE D 1 16 ? -8.222 0.292 -1.549 1.00 0.00 ? 82 ILE D H 8 16
ATOM 9073 H HA . ILE D 1 16 ? -7.858 2.865 -2.555 1.00 0.00 ? 82 ILE D HA 8 16
ATOM 9074 H HB . ILE D 1 16 ? -7.565 0.127 -3.675 1.00 0.00 ? 82 ILE D HB 8 16
ATOM 9075 H HG12 . ILE D 1 16 ? -5.651 2.345 -2.950 1.00 0.00 ? 82 ILE D HG12 8 16
ATOM 9076 H HG13 . ILE D 1 16 ? -6.038 0.946 -1.969 1.00 0.00 ? 82 ILE D HG13 8 16
ATOM 9077 H HG21 . ILE D 1 16 ? -6.829 2.739 -5.069 1.00 0.00 ? 82 ILE D HG21 8 16
ATOM 9078 H HG22 . ILE D 1 16 ? -6.407 1.190 -5.705 1.00 0.00 ? 82 ILE D HG22 8 16
ATOM 9079 H HG23 . ILE D 1 16 ? -8.014 1.633 -5.650 1.00 0.00 ? 82 ILE D HG23 8 16
ATOM 9080 H HD11 . ILE D 1 16 ? -3.900 0.646 -2.954 1.00 0.00 ? 82 ILE D HD11 8 16
ATOM 9081 H HD12 . ILE D 1 16 ? -4.965 -0.503 -3.695 1.00 0.00 ? 82 ILE D HD12 8 16
ATOM 9082 H HD13 . ILE D 1 16 ? -4.488 1.009 -4.514 1.00 0.00 ? 82 ILE D HD13 8 16
ATOM 9083 N N . LYS D 1 17 ? -10.388 1.343 -3.975 1.00 0.00 ? 83 LYS D N 8 17
ATOM 9084 C CA . LYS D 1 17 ? -11.623 1.539 -4.694 1.00 0.00 ? 83 LYS D CA 8 17
ATOM 9085 C C . LYS D 1 17 ? -12.653 2.309 -3.900 1.00 0.00 ? 83 LYS D C 8 17
ATOM 9086 O O . LYS D 1 17 ? -13.271 3.208 -4.444 1.00 0.00 ? 83 LYS D O 8 17
ATOM 9087 C CB . LYS D 1 17 ? -12.109 0.168 -5.111 1.00 0.00 ? 83 LYS D CB 8 17
ATOM 9088 C CG . LYS D 1 17 ? -13.176 0.264 -6.161 1.00 0.00 ? 83 LYS D CG 8 17
ATOM 9089 C CD . LYS D 1 17 ? -13.309 -0.963 -7.016 1.00 0.00 ? 83 LYS D CD 8 17
ATOM 9090 C CE . LYS D 1 17 ? -13.827 -2.108 -6.338 1.00 0.00 ? 83 LYS D CE 8 17
ATOM 9091 N NZ . LYS D 1 17 ? -13.979 -3.286 -7.078 1.00 0.00 ? 83 LYS D NZ 8 17
ATOM 9092 H H . LYS D 1 17 ? -10.105 0.457 -3.640 1.00 0.00 ? 83 LYS D H 8 17
ATOM 9093 H HA . LYS D 1 17 ? -11.396 2.145 -5.559 1.00 0.00 ? 83 LYS D HA 8 17
ATOM 9094 H HB2 . LYS D 1 17 ? -11.271 -0.410 -5.499 1.00 0.00 ? 83 LYS D HB2 8 17
ATOM 9095 H HB3 . LYS D 1 17 ? -12.476 -0.365 -4.274 1.00 0.00 ? 83 LYS D HB3 8 17
ATOM 9096 H HG2 . LYS D 1 17 ? -14.131 0.461 -5.674 1.00 0.00 ? 83 LYS D HG2 8 17
ATOM 9097 H HG3 . LYS D 1 17 ? -12.975 1.087 -6.791 1.00 0.00 ? 83 LYS D HG3 8 17
ATOM 9098 H HD2 . LYS D 1 17 ? -13.958 -0.731 -7.861 1.00 0.00 ? 83 LYS D HD2 8 17
ATOM 9099 H HD3 . LYS D 1 17 ? -12.405 -1.210 -7.395 1.00 0.00 ? 83 LYS D HD3 8 17
ATOM 9100 H HE2 . LYS D 1 17 ? -13.197 -2.314 -5.473 1.00 0.00 ? 83 LYS D HE2 8 17
ATOM 9101 H HE3 . LYS D 1 17 ? -14.690 -1.903 -6.047 1.00 0.00 ? 83 LYS D HE3 8 17
ATOM 9102 H HZ1 . LYS D 1 17 ? -13.975 -3.947 -6.828 1.00 0.00 ? 83 LYS D HZ1 8 17
ATOM 9103 H HZ2 . LYS D 1 17 ? -14.503 -3.415 -7.437 1.00 0.00 ? 83 LYS D HZ2 8 17
ATOM 9104 H HZ3 . LYS D 1 17 ? -13.558 -3.402 -7.540 1.00 0.00 ? 83 LYS D HZ3 8 17
ATOM 9105 N N . ALA D 1 18 ? -12.805 2.022 -2.615 1.00 0.00 ? 84 ALA D N 8 18
ATOM 9106 C CA . ALA D 1 18 ? -13.720 2.693 -1.731 1.00 0.00 ? 84 ALA D CA 8 18
ATOM 9107 C C . ALA D 1 18 ? -13.305 4.098 -1.367 1.00 0.00 ? 84 ALA D C 8 18
ATOM 9108 O O . ALA D 1 18 ? -14.094 5.011 -1.236 1.00 0.00 ? 84 ALA D O 8 18
ATOM 9109 C CB . ALA D 1 18 ? -13.886 1.859 -0.484 1.00 0.00 ? 84 ALA D CB 8 18
ATOM 9110 H H . ALA D 1 18 ? -12.230 1.298 -2.234 1.00 0.00 ? 84 ALA D H 8 18
ATOM 9111 H HA . ALA D 1 18 ? -14.685 2.723 -2.221 1.00 0.00 ? 84 ALA D HA 8 18
ATOM 9112 H HB1 . ALA D 1 18 ? -13.140 1.737 0.033 1.00 0.00 ? 84 ALA D HB1 8 18
ATOM 9113 H HB2 . ALA D 1 18 ? -14.516 2.169 0.077 1.00 0.00 ? 84 ALA D HB2 8 18
ATOM 9114 H HB3 . ALA D 1 18 ? -14.183 1.020 -0.645 1.00 0.00 ? 84 ALA D HB3 8 18
ATOM 9115 N N . GLY D 1 19 ? -12.024 4.299 -1.202 1.00 0.00 ? 85 GLY D N 8 19
ATOM 9116 C CA . GLY D 1 19 ? -11.320 5.533 -0.957 1.00 0.00 ? 85 GLY D CA 8 19
ATOM 9117 C C . GLY D 1 19 ? -11.317 6.411 -2.192 1.00 0.00 ? 85 GLY D C 8 19
ATOM 9118 O O . GLY D 1 19 ? -11.478 7.599 -2.079 1.00 0.00 ? 85 GLY D O 8 19
ATOM 9119 H H . GLY D 1 19 ? -11.457 3.479 -1.282 1.00 0.00 ? 85 GLY D H 8 19
ATOM 9120 H HA2 . GLY D 1 19 ? -11.827 6.067 -0.168 1.00 0.00 ? 85 GLY D HA2 8 19
ATOM 9121 H HA3 . GLY D 1 19 ? -10.301 5.327 -0.650 1.00 0.00 ? 85 GLY D HA3 8 19
ATOM 9122 N N . GLY D 1 20 ? -11.156 5.845 -3.366 1.00 0.00 ? 86 GLY D N 8 20
ATOM 9123 C CA . GLY D 1 20 ? -11.128 6.513 -4.639 1.00 0.00 ? 86 GLY D CA 8 20
ATOM 9124 C C . GLY D 1 20 ? -9.852 7.264 -4.952 1.00 0.00 ? 86 GLY D C 8 20
ATOM 9125 O O . GLY D 1 20 ? -9.926 8.415 -5.337 1.00 0.00 ? 86 GLY D O 8 20
ATOM 9126 H H . GLY D 1 20 ? -11.012 4.883 -3.359 1.00 0.00 ? 86 GLY D H 8 20
ATOM 9127 H HA2 . GLY D 1 20 ? -11.217 5.750 -5.401 1.00 0.00 ? 86 GLY D HA2 8 20
ATOM 9128 H HA3 . GLY D 1 20 ? -11.954 7.211 -4.647 1.00 0.00 ? 86 GLY D HA3 8 20
ATOM 9129 N N . TYR D 1 21 ? -8.711 6.616 -4.810 1.00 0.00 ? 87 TYR D N 8 21
ATOM 9130 C CA . TYR D 1 21 ? -7.413 7.181 -5.030 1.00 0.00 ? 87 TYR D CA 8 21
ATOM 9131 C C . TYR D 1 21 ? -7.151 7.750 -6.391 1.00 0.00 ? 87 TYR D C 8 21
ATOM 9132 O O . TYR D 1 21 ? -6.347 8.646 -6.536 1.00 0.00 ? 87 TYR D O 8 21
ATOM 9133 C CB . TYR D 1 21 ? -6.378 6.132 -4.716 1.00 0.00 ? 87 TYR D CB 8 21
ATOM 9134 C CG . TYR D 1 21 ? -5.853 6.079 -3.310 1.00 0.00 ? 87 TYR D CG 8 21
ATOM 9135 C CD1 . TYR D 1 21 ? -5.068 7.044 -2.703 1.00 0.00 ? 87 TYR D CD1 8 21
ATOM 9136 C CD2 . TYR D 1 21 ? -6.132 4.909 -2.624 1.00 0.00 ? 87 TYR D CD2 8 21
ATOM 9137 C CE1 . TYR D 1 21 ? -4.565 6.800 -1.425 1.00 0.00 ? 87 TYR D CE1 8 21
ATOM 9138 C CE2 . TYR D 1 21 ? -5.614 4.644 -1.353 1.00 0.00 ? 87 TYR D CE2 8 21
ATOM 9139 C CZ . TYR D 1 21 ? -4.822 5.604 -0.745 1.00 0.00 ? 87 TYR D CZ 8 21
ATOM 9140 O OH . TYR D 1 21 ? -4.392 5.407 0.525 1.00 0.00 ? 87 TYR D OH 8 21
ATOM 9141 H H . TYR D 1 21 ? -8.756 5.653 -4.551 1.00 0.00 ? 87 TYR D H 8 21
ATOM 9142 H HA . TYR D 1 21 ? -7.278 7.989 -4.335 1.00 0.00 ? 87 TYR D HA 8 21
ATOM 9143 H HB2 . TYR D 1 21 ? -6.842 5.168 -4.924 1.00 0.00 ? 87 TYR D HB2 8 21
ATOM 9144 H HB3 . TYR D 1 21 ? -5.527 6.154 -5.357 1.00 0.00 ? 87 TYR D HB3 8 21
ATOM 9145 H HD1 . TYR D 1 21 ? -4.836 7.956 -3.191 1.00 0.00 ? 87 TYR D HD1 8 21
ATOM 9146 H HD2 . TYR D 1 21 ? -6.749 4.195 -3.115 1.00 0.00 ? 87 TYR D HD2 8 21
ATOM 9147 H HE1 . TYR D 1 21 ? -4.010 7.558 -0.950 1.00 0.00 ? 87 TYR D HE1 8 21
ATOM 9148 H HE2 . TYR D 1 21 ? -5.846 3.732 -0.845 1.00 0.00 ? 87 TYR D HE2 8 21
ATOM 9149 H HH . TYR D 1 21 ? -5.055 5.717 1.113 1.00 0.00 ? 87 TYR D HH 8 21
HETATM 9150 N N . NH2 D 1 22 ? -7.814 7.272 -7.419 1.00 0.00 ? 88 NH2 D N 8 22
HETATM 9151 H HN1 . NH2 D 1 22 ? -7.656 7.615 -8.322 1.00 0.00 ? 88 NH2 D HN1 8 22
HETATM 9152 H HN2 . NH2 D 1 22 ? -8.501 6.589 -7.269 1.00 0.00 ? 88 NH2 D HN2 8 22
HETATM 9153 C C . ACE A 1 1 ? -0.174 13.039 0.788 1.00 0.00 ? 1 ACE A C 9 1
HETATM 9154 O O . ACE A 1 1 ? -0.940 12.279 1.248 1.00 0.00 ? 1 ACE A O 9 1
HETATM 9155 C CH3 . ACE A 1 1 ? 1.222 12.860 1.125 1.00 0.00 ? 1 ACE A CH3 9 1
HETATM 9156 H H1 . ACE A 1 1 ? 1.528 12.969 1.632 1.00 0.00 ? 1 ACE A H1 9 1
HETATM 9157 H H2 . ACE A 1 1 ? 1.550 12.364 1.197 1.00 0.00 ? 1 ACE A H2 9 1
HETATM 9158 H H3 . ACE A 1 1 ? 1.547 13.081 0.837 1.00 0.00 ? 1 ACE A H3 9 1
ATOM 9159 N N . ALA A 1 2 ? -0.541 14.000 0.006 1.00 0.00 ? 2 ALA A N 9 2
ATOM 9160 C CA . ALA A 1 2 ? 0.158 14.850 -0.858 1.00 0.00 ? 2 ALA A CA 9 2
ATOM 9161 C C . ALA A 1 2 ? 0.912 14.176 -1.964 1.00 0.00 ? 2 ALA A C 9 2
ATOM 9162 O O . ALA A 1 2 ? 0.325 13.431 -2.707 1.00 0.00 ? 2 ALA A O 9 2
ATOM 9163 C CB . ALA A 1 2 ? 0.849 15.876 -0.063 1.00 0.00 ? 2 ALA A CB 9 2
ATOM 9164 H H . ALA A 1 2 ? -1.492 14.037 -0.095 1.00 0.00 ? 2 ALA A H 9 2
ATOM 9165 H HA . ALA A 1 2 ? -0.577 15.381 -1.370 1.00 0.00 ? 2 ALA A HA 9 2
ATOM 9166 H HB1 . ALA A 1 2 ? 0.193 16.270 0.646 1.00 0.00 ? 2 ALA A HB1 9 2
ATOM 9167 H HB2 . ALA A 1 2 ? 1.656 15.547 0.503 1.00 0.00 ? 2 ALA A HB2 9 2
ATOM 9168 H HB3 . ALA A 1 2 ? 1.163 16.627 -0.732 1.00 0.00 ? 2 ALA A HB3 9 2
ATOM 9169 N N . LYS A 1 3 ? 2.202 14.411 -2.116 1.00 0.00 ? 3 LYS A N 9 3
ATOM 9170 C CA . LYS A 1 3 ? 3.092 13.881 -3.108 1.00 0.00 ? 3 LYS A CA 9 3
ATOM 9171 C C . LYS A 1 3 ? 2.991 12.378 -3.259 1.00 0.00 ? 3 LYS A C 9 3
ATOM 9172 O O . LYS A 1 3 ? 2.752 11.880 -4.343 1.00 0.00 ? 3 LYS A O 9 3
ATOM 9173 C CB . LYS A 1 3 ? 4.504 14.194 -2.726 1.00 0.00 ? 3 LYS A CB 9 3
ATOM 9174 C CG . LYS A 1 3 ? 4.895 15.640 -2.805 1.00 0.00 ? 3 LYS A CG 9 3
ATOM 9175 C CD . LYS A 1 3 ? 5.137 16.132 -4.067 1.00 0.00 ? 3 LYS A CD 9 3
ATOM 9176 C CE . LYS A 1 3 ? 5.747 17.480 -4.192 1.00 0.00 ? 3 LYS A CE 9 3
ATOM 9177 N NZ . LYS A 1 3 ? 7.088 17.521 -4.067 1.00 0.00 ? 3 LYS A NZ 9 3
ATOM 9178 H H . LYS A 1 3 ? 2.563 15.091 -1.488 1.00 0.00 ? 3 LYS A H 9 3
ATOM 9179 H HA . LYS A 1 3 ? 2.803 14.278 -4.055 1.00 0.00 ? 3 LYS A HA 9 3
ATOM 9180 H HB2 . LYS A 1 3 ? 4.662 13.855 -1.702 1.00 0.00 ? 3 LYS A HB2 9 3
ATOM 9181 H HB3 . LYS A 1 3 ? 5.151 13.624 -3.324 1.00 0.00 ? 3 LYS A HB3 9 3
ATOM 9182 H HG2 . LYS A 1 3 ? 4.104 16.235 -2.347 1.00 0.00 ? 3 LYS A HG2 9 3
ATOM 9183 H HG3 . LYS A 1 3 ? 5.698 15.784 -2.286 1.00 0.00 ? 3 LYS A HG3 9 3
ATOM 9184 H HD2 . LYS A 1 3 ? 5.778 15.424 -4.594 1.00 0.00 ? 3 LYS A HD2 9 3
ATOM 9185 H HD3 . LYS A 1 3 ? 4.290 16.125 -4.487 1.00 0.00 ? 3 LYS A HD3 9 3
ATOM 9186 H HE2 . LYS A 1 3 ? 5.464 17.901 -5.157 1.00 0.00 ? 3 LYS A HE2 9 3
ATOM 9187 H HE3 . LYS A 1 3 ? 5.409 18.096 -3.480 1.00 0.00 ? 3 LYS A HE3 9 3
ATOM 9188 H HZ1 . LYS A 1 3 ? 7.465 18.386 -4.048 1.00 0.00 ? 3 LYS A HZ1 9 3
ATOM 9189 H HZ2 . LYS A 1 3 ? 7.362 17.109 -3.281 1.00 0.00 ? 3 LYS A HZ2 9 3
ATOM 9190 H HZ3 . LYS A 1 3 ? 7.428 17.062 -4.765 1.00 0.00 ? 3 LYS A HZ3 9 3
ATOM 9191 N N . ALA A 1 4 ? 3.094 11.668 -2.142 1.00 0.00 ? 4 ALA A N 9 4
ATOM 9192 C CA . ALA A 1 4 ? 2.974 10.234 -2.033 1.00 0.00 ? 4 ALA A CA 9 4
ATOM 9193 C C . ALA A 1 4 ? 1.721 9.685 -2.681 1.00 0.00 ? 4 ALA A C 9 4
ATOM 9194 O O . ALA A 1 4 ? 1.704 8.556 -3.152 1.00 0.00 ? 4 ALA A O 9 4
ATOM 9195 C CB . ALA A 1 4 ? 3.002 9.870 -0.562 1.00 0.00 ? 4 ALA A CB 9 4
ATOM 9196 H H . ALA A 1 4 ? 3.267 12.214 -1.324 1.00 0.00 ? 4 ALA A H 9 4
ATOM 9197 H HA . ALA A 1 4 ? 3.824 9.792 -2.535 1.00 0.00 ? 4 ALA A HA 9 4
ATOM 9198 H HB1 . ALA A 1 4 ? 2.004 9.969 -0.168 1.00 0.00 ? 4 ALA A HB1 9 4
ATOM 9199 H HB2 . ALA A 1 4 ? 3.346 8.863 -0.450 1.00 0.00 ? 4 ALA A HB2 9 4
ATOM 9200 H HB3 . ALA A 1 4 ? 3.670 10.511 -0.025 1.00 0.00 ? 4 ALA A HB3 9 4
ATOM 9201 N N . ALA A 1 5 ? 0.663 10.484 -2.731 1.00 0.00 ? 5 ALA A N 9 5
ATOM 9202 C CA . ALA A 1 5 ? -0.701 10.058 -2.927 1.00 0.00 ? 5 ALA A CA 9 5
ATOM 9203 C C . ALA A 1 5 ? -1.171 9.936 -4.354 1.00 0.00 ? 5 ALA A C 9 5
ATOM 9204 O O . ALA A 1 5 ? -2.316 9.623 -4.606 1.00 0.00 ? 5 ALA A O 9 5
ATOM 9205 C CB . ALA A 1 5 ? -1.633 10.913 -2.086 1.00 0.00 ? 5 ALA A CB 9 5
ATOM 9206 H H . ALA A 1 5 ? 0.859 11.445 -2.542 1.00 0.00 ? 5 ALA A H 9 5
ATOM 9207 H HA . ALA A 1 5 ? -0.746 9.043 -2.549 1.00 0.00 ? 5 ALA A HA 9 5
ATOM 9208 H HB1 . ALA A 1 5 ? -1.717 11.895 -2.478 1.00 0.00 ? 5 ALA A HB1 9 5
ATOM 9209 H HB2 . ALA A 1 5 ? -2.616 10.501 -2.056 1.00 0.00 ? 5 ALA A HB2 9 5
ATOM 9210 H HB3 . ALA A 1 5 ? -1.255 10.943 -1.085 1.00 0.00 ? 5 ALA A HB3 9 5
ATOM 9211 N N . ALA A 1 6 ? -0.266 10.053 -5.311 1.00 0.00 ? 6 ALA A N 9 6
ATOM 9212 C CA . ALA A 1 6 ? -0.337 9.393 -6.586 1.00 0.00 ? 6 ALA A CA 9 6
ATOM 9213 C C . ALA A 1 6 ? 0.766 8.361 -6.733 1.00 0.00 ? 6 ALA A C 9 6
ATOM 9214 O O . ALA A 1 6 ? 0.476 7.181 -6.854 1.00 0.00 ? 6 ALA A O 9 6
ATOM 9215 C CB . ALA A 1 6 ? -0.353 10.439 -7.678 1.00 0.00 ? 6 ALA A CB 9 6
ATOM 9216 H H . ALA A 1 6 ? 0.625 10.359 -5.050 1.00 0.00 ? 6 ALA A H 9 6
ATOM 9217 H HA . ALA A 1 6 ? -1.259 8.835 -6.609 1.00 0.00 ? 6 ALA A HA 9 6
ATOM 9218 H HB1 . ALA A 1 6 ? -0.371 9.926 -8.589 1.00 0.00 ? 6 ALA A HB1 9 6
ATOM 9219 H HB2 . ALA A 1 6 ? -1.166 11.112 -7.623 1.00 0.00 ? 6 ALA A HB2 9 6
ATOM 9220 H HB3 . ALA A 1 6 ? 0.518 11.012 -7.662 1.00 0.00 ? 6 ALA A HB3 9 6
ATOM 9221 N N . ALA A 1 7 ? 2.029 8.764 -6.624 1.00 0.00 ? 7 ALA A N 9 7
ATOM 9222 C CA . ALA A 1 7 ? 3.221 7.999 -6.894 1.00 0.00 ? 7 ALA A CA 9 7
ATOM 9223 C C . ALA A 1 7 ? 3.225 6.642 -6.217 1.00 0.00 ? 7 ALA A C 9 7
ATOM 9224 O O . ALA A 1 7 ? 3.566 5.636 -6.810 1.00 0.00 ? 7 ALA A O 9 7
ATOM 9225 C CB . ALA A 1 7 ? 4.437 8.805 -6.480 1.00 0.00 ? 7 ALA A CB 9 7
ATOM 9226 H H . ALA A 1 7 ? 2.143 9.739 -6.425 1.00 0.00 ? 7 ALA A H 9 7
ATOM 9227 H HA . ALA A 1 7 ? 3.299 7.840 -7.958 1.00 0.00 ? 7 ALA A HA 9 7
ATOM 9228 H HB1 . ALA A 1 7 ? 4.350 9.141 -5.477 1.00 0.00 ? 7 ALA A HB1 9 7
ATOM 9229 H HB2 . ALA A 1 7 ? 5.332 8.219 -6.511 1.00 0.00 ? 7 ALA A HB2 9 7
ATOM 9230 H HB3 . ALA A 1 7 ? 4.544 9.666 -7.088 1.00 0.00 ? 7 ALA A HB3 9 7
ATOM 9231 N N . ALA A 1 8 ? 2.815 6.594 -4.959 1.00 0.00 ? 8 ALA A N 9 8
ATOM 9232 C CA . ALA A 1 8 ? 2.814 5.358 -4.211 1.00 0.00 ? 8 ALA A CA 9 8
ATOM 9233 C C . ALA A 1 8 ? 1.579 4.523 -4.478 1.00 0.00 ? 8 ALA A C 9 8
ATOM 9234 O O . ALA A 1 8 ? 1.702 3.326 -4.689 1.00 0.00 ? 8 ALA A O 9 8
ATOM 9235 C CB . ALA A 1 8 ? 2.928 5.659 -2.728 1.00 0.00 ? 8 ALA A CB 9 8
ATOM 9236 H H . ALA A 1 8 ? 2.350 7.402 -4.593 1.00 0.00 ? 8 ALA A H 9 8
ATOM 9237 H HA . ALA A 1 8 ? 3.694 4.791 -4.490 1.00 0.00 ? 8 ALA A HA 9 8
ATOM 9238 H HB1 . ALA A 1 8 ? 3.644 6.392 -2.538 1.00 0.00 ? 8 ALA A HB1 9 8
ATOM 9239 H HB2 . ALA A 1 8 ? 2.026 5.985 -2.380 1.00 0.00 ? 8 ALA A HB2 9 8
ATOM 9240 H HB3 . ALA A 1 8 ? 3.161 4.804 -2.200 1.00 0.00 ? 8 ALA A HB3 9 8
ATOM 9241 N N . ILE A 1 9 ? 0.417 5.165 -4.571 1.00 0.00 ? 9 ILE A N 9 9
ATOM 9242 C CA . ILE A 1 9 ? -0.827 4.529 -4.937 1.00 0.00 ? 9 ILE A CA 9 9
ATOM 9243 C C . ILE A 1 9 ? -0.757 3.880 -6.309 1.00 0.00 ? 9 ILE A C 9 9
ATOM 9244 O O . ILE A 1 9 ? -1.205 2.755 -6.483 1.00 0.00 ? 9 ILE A O 9 9
ATOM 9245 C CB . ILE A 1 9 ? -1.961 5.539 -4.937 1.00 0.00 ? 9 ILE A CB 9 9
ATOM 9246 C CG1 . ILE A 1 9 ? -2.124 6.289 -3.625 1.00 0.00 ? 9 ILE A CG1 9 9
ATOM 9247 C CG2 . ILE A 1 9 ? -3.258 4.919 -5.409 1.00 0.00 ? 9 ILE A CG2 9 9
ATOM 9248 C CD1 . ILE A 1 9 ? -2.249 5.356 -2.436 1.00 0.00 ? 9 ILE A CD1 9 9
ATOM 9249 H H . ILE A 1 9 ? 0.450 6.160 -4.514 1.00 0.00 ? 9 ILE A H 9 9
ATOM 9250 H HA . ILE A 1 9 ? -1.058 3.760 -4.209 1.00 0.00 ? 9 ILE A HA 9 9
ATOM 9251 H HB . ILE A 1 9 ? -1.709 6.235 -5.721 1.00 0.00 ? 9 ILE A HB 9 9
ATOM 9252 H HG12 . ILE A 1 9 ? -1.261 6.938 -3.475 1.00 0.00 ? 9 ILE A HG12 9 9
ATOM 9253 H HG13 . ILE A 1 9 ? -2.983 6.941 -3.702 1.00 0.00 ? 9 ILE A HG13 9 9
ATOM 9254 H HG21 . ILE A 1 9 ? -4.014 5.664 -5.286 1.00 0.00 ? 9 ILE A HG21 9 9
ATOM 9255 H HG22 . ILE A 1 9 ? -3.209 4.641 -6.442 1.00 0.00 ? 9 ILE A HG22 9 9
ATOM 9256 H HG23 . ILE A 1 9 ? -3.474 4.066 -4.835 1.00 0.00 ? 9 ILE A HG23 9 9
ATOM 9257 H HD11 . ILE A 1 9 ? -2.995 4.624 -2.600 1.00 0.00 ? 9 ILE A HD11 9 9
ATOM 9258 H HD12 . ILE A 1 9 ? -1.320 4.860 -2.267 1.00 0.00 ? 9 ILE A HD12 9 9
ATOM 9259 H HD13 . ILE A 1 9 ? -2.472 5.926 -1.568 1.00 0.00 ? 9 ILE A HD13 9 9
ATOM 9260 N N . LYS A 1 10 ? -0.152 4.549 -7.287 1.00 0.00 ? 10 LYS A N 9 10
ATOM 9261 C CA . LYS A 1 10 ? 0.134 4.068 -8.617 1.00 0.00 ? 10 LYS A CA 9 10
ATOM 9262 C C . LYS A 1 10 ? 1.008 2.830 -8.527 1.00 0.00 ? 10 LYS A C 9 10
ATOM 9263 O O . LYS A 1 10 ? 0.590 1.749 -8.907 1.00 0.00 ? 10 LYS A O 9 10
ATOM 9264 C CB . LYS A 1 10 ? 0.742 5.208 -9.408 1.00 0.00 ? 10 LYS A CB 9 10
ATOM 9265 C CG . LYS A 1 10 ? -0.335 6.151 -9.908 1.00 0.00 ? 10 LYS A CG 9 10
ATOM 9266 C CD . LYS A 1 10 ? 0.248 7.255 -10.743 1.00 0.00 ? 10 LYS A CD 9 10
ATOM 9267 C CE . LYS A 1 10 ? -0.784 8.162 -11.329 1.00 0.00 ? 10 LYS A CE 9 10
ATOM 9268 N NZ . LYS A 1 10 ? -0.257 9.211 -12.144 1.00 0.00 ? 10 LYS A NZ 9 10
ATOM 9269 H H . LYS A 1 10 ? 0.158 5.466 -7.027 1.00 0.00 ? 10 LYS A H 9 10
ATOM 9270 H HA . LYS A 1 10 ? -0.790 3.733 -9.071 1.00 0.00 ? 10 LYS A HA 9 10
ATOM 9271 H HB2 . LYS A 1 10 ? 1.454 5.755 -8.790 1.00 0.00 ? 10 LYS A HB2 9 10
ATOM 9272 H HB3 . LYS A 1 10 ? 1.290 4.790 -10.240 1.00 0.00 ? 10 LYS A HB3 9 10
ATOM 9273 H HG2 . LYS A 1 10 ? -1.060 5.591 -10.499 1.00 0.00 ? 10 LYS A HG2 9 10
ATOM 9274 H HG3 . LYS A 1 10 ? -0.879 6.588 -9.084 1.00 0.00 ? 10 LYS A HG3 9 10
ATOM 9275 H HD2 . LYS A 1 10 ? 0.946 7.836 -10.140 1.00 0.00 ? 10 LYS A HD2 9 10
ATOM 9276 H HD3 . LYS A 1 10 ? 0.790 6.824 -11.553 1.00 0.00 ? 10 LYS A HD3 9 10
ATOM 9277 H HE2 . LYS A 1 10 ? -1.473 7.566 -11.928 1.00 0.00 ? 10 LYS A HE2 9 10
ATOM 9278 H HE3 . LYS A 1 10 ? -1.348 8.600 -10.570 1.00 0.00 ? 10 LYS A HE3 9 10
ATOM 9279 H HZ1 . LYS A 1 10 ? -0.955 9.720 -12.545 1.00 0.00 ? 10 LYS A HZ1 9 10
ATOM 9280 H HZ2 . LYS A 1 10 ? 0.286 9.832 -11.657 1.00 0.00 ? 10 LYS A HZ2 9 10
ATOM 9281 H HZ3 . LYS A 1 10 ? 0.275 8.874 -12.856 1.00 0.00 ? 10 LYS A HZ3 9 10
ATOM 9282 N N . ALA A 1 11 ? 2.137 2.961 -7.842 1.00 0.00 ? 11 ALA A N 9 11
ATOM 9283 C CA . ALA A 1 11 ? 3.004 1.867 -7.471 1.00 0.00 ? 11 ALA A CA 9 11
ATOM 9284 C C . ALA A 1 11 ? 2.453 0.892 -6.450 1.00 0.00 ? 11 ALA A C 9 11
ATOM 9285 O O . ALA A 1 11 ? 3.182 0.040 -5.975 1.00 0.00 ? 11 ALA A O 9 11
ATOM 9286 C CB . ALA A 1 11 ? 4.339 2.475 -7.074 1.00 0.00 ? 11 ALA A CB 9 11
ATOM 9287 H H . ALA A 1 11 ? 2.406 3.866 -7.515 1.00 0.00 ? 11 ALA A H 9 11
ATOM 9288 H HA . ALA A 1 11 ? 3.145 1.292 -8.380 1.00 0.00 ? 11 ALA A HA 9 11
ATOM 9289 H HB1 . ALA A 1 11 ? 4.690 3.097 -7.846 1.00 0.00 ? 11 ALA A HB1 9 11
ATOM 9290 H HB2 . ALA A 1 11 ? 4.310 3.018 -6.152 1.00 0.00 ? 11 ALA A HB2 9 11
ATOM 9291 H HB3 . ALA A 1 11 ? 5.050 1.706 -6.956 1.00 0.00 ? 11 ALA A HB3 9 11
ATOM 9292 N N . ILE A 1 12 ? 1.168 0.932 -6.127 1.00 0.00 ? 12 ILE A N 9 12
ATOM 9293 C CA . ILE A 1 12 ? 0.389 -0.097 -5.480 1.00 0.00 ? 12 ILE A CA 9 12
ATOM 9294 C C . ILE A 1 12 ? -0.669 -0.618 -6.437 1.00 0.00 ? 12 ILE A C 9 12
ATOM 9295 O O . ILE A 1 12 ? -0.563 -1.785 -6.793 1.00 0.00 ? 12 ILE A O 9 12
ATOM 9296 C CB . ILE A 1 12 ? -0.157 0.351 -4.132 1.00 0.00 ? 12 ILE A CB 9 12
ATOM 9297 C CG1 . ILE A 1 12 ? 0.955 0.508 -3.114 1.00 0.00 ? 12 ILE A CG1 9 12
ATOM 9298 C CG2 . ILE A 1 12 ? -1.189 -0.601 -3.564 1.00 0.00 ? 12 ILE A CG2 9 12
ATOM 9299 C CD1 . ILE A 1 12 ? 0.615 1.322 -1.891 1.00 0.00 ? 12 ILE A CD1 9 12
ATOM 9300 H H . ILE A 1 12 ? 0.666 1.716 -6.471 1.00 0.00 ? 12 ILE A H 9 12
ATOM 9301 H HA . ILE A 1 12 ? 0.988 -0.995 -5.342 1.00 0.00 ? 12 ILE A HA 9 12
ATOM 9302 H HB . ILE A 1 12 ? -0.667 1.292 -4.267 1.00 0.00 ? 12 ILE A HB 9 12
ATOM 9303 H HG12 . ILE A 1 12 ? 1.287 -0.481 -2.799 1.00 0.00 ? 12 ILE A HG12 9 12
ATOM 9304 H HG13 . ILE A 1 12 ? 1.781 1.000 -3.609 1.00 0.00 ? 12 ILE A HG13 9 12
ATOM 9305 H HG21 . ILE A 1 12 ? -2.061 -0.633 -4.179 1.00 0.00 ? 12 ILE A HG21 9 12
ATOM 9306 H HG22 . ILE A 1 12 ? -0.793 -1.582 -3.440 1.00 0.00 ? 12 ILE A HG22 9 12
ATOM 9307 H HG23 . ILE A 1 12 ? -1.511 -0.272 -2.603 1.00 0.00 ? 12 ILE A HG23 9 12
ATOM 9308 H HD11 . ILE A 1 12 ? 1.175 1.663 -1.498 1.00 0.00 ? 12 ILE A HD11 9 12
ATOM 9309 H HD12 . ILE A 1 12 ? 0.292 0.977 -1.311 1.00 0.00 ? 12 ILE A HD12 9 12
ATOM 9310 H HD13 . ILE A 1 12 ? 0.159 1.927 -1.924 1.00 0.00 ? 12 ILE A HD13 9 12
ATOM 9311 N N . ALA A 1 13 ? -1.670 0.127 -6.904 1.00 0.00 ? 13 ALA A N 9 13
ATOM 9312 C CA . ALA A 1 13 ? -2.767 -0.426 -7.660 1.00 0.00 ? 13 ALA A CA 9 13
ATOM 9313 C C . ALA A 1 13 ? -2.334 -1.021 -8.983 1.00 0.00 ? 13 ALA A C 9 13
ATOM 9314 O O . ALA A 1 13 ? -2.911 -1.976 -9.441 1.00 0.00 ? 13 ALA A O 9 13
ATOM 9315 C CB . ALA A 1 13 ? -3.826 0.651 -7.821 1.00 0.00 ? 13 ALA A CB 9 13
ATOM 9316 H H . ALA A 1 13 ? -1.577 1.110 -6.720 1.00 0.00 ? 13 ALA A H 9 13
ATOM 9317 H HA . ALA A 1 13 ? -3.198 -1.207 -7.041 1.00 0.00 ? 13 ALA A HA 9 13
ATOM 9318 H HB1 . ALA A 1 13 ? -4.714 0.273 -8.282 1.00 0.00 ? 13 ALA A HB1 9 13
ATOM 9319 H HB2 . ALA A 1 13 ? -4.105 1.022 -6.872 1.00 0.00 ? 13 ALA A HB2 9 13
ATOM 9320 H HB3 . ALA A 1 13 ? -3.457 1.466 -8.367 1.00 0.00 ? 13 ALA A HB3 9 13
ATOM 9321 N N . ALA A 1 14 ? -1.241 -0.521 -9.548 1.00 0.00 ? 14 ALA A N 9 14
ATOM 9322 C CA . ALA A 1 14 ? -0.601 -1.085 -10.713 1.00 0.00 ? 14 ALA A CA 9 14
ATOM 9323 C C . ALA A 1 14 ? 0.183 -2.336 -10.376 1.00 0.00 ? 14 ALA A C 9 14
ATOM 9324 O O . ALA A 1 14 ? 0.131 -3.328 -11.085 1.00 0.00 ? 14 ALA A O 9 14
ATOM 9325 C CB . ALA A 1 14 ? 0.264 -0.049 -11.376 1.00 0.00 ? 14 ALA A CB 9 14
ATOM 9326 H H . ALA A 1 14 ? -0.754 0.180 -9.036 1.00 0.00 ? 14 ALA A H 9 14
ATOM 9327 H HA . ALA A 1 14 ? -1.353 -1.400 -11.411 1.00 0.00 ? 14 ALA A HA 9 14
ATOM 9328 H HB1 . ALA A 1 14 ? 0.632 -0.411 -12.305 1.00 0.00 ? 14 ALA A HB1 9 14
ATOM 9329 H HB2 . ALA A 1 14 ? -0.292 0.838 -11.574 1.00 0.00 ? 14 ALA A HB2 9 14
ATOM 9330 H HB3 . ALA A 1 14 ? 1.088 0.197 -10.756 1.00 0.00 ? 14 ALA A HB3 9 14
ATOM 9331 N N . ILE A 1 15 ? 0.862 -2.347 -9.232 1.00 0.00 ? 15 ILE A N 9 15
ATOM 9332 C CA . ILE A 1 15 ? 1.572 -3.464 -8.648 1.00 0.00 ? 15 ILE A CA 9 15
ATOM 9333 C C . ILE A 1 15 ? 0.655 -4.614 -8.277 1.00 0.00 ? 15 ILE A C 9 15
ATOM 9334 O O . ILE A 1 15 ? 0.994 -5.746 -8.578 1.00 0.00 ? 15 ILE A O 9 15
ATOM 9335 C CB . ILE A 1 15 ? 2.366 -2.926 -7.466 1.00 0.00 ? 15 ILE A CB 9 15
ATOM 9336 C CG1 . ILE A 1 15 ? 3.840 -2.803 -7.824 1.00 0.00 ? 15 ILE A CG1 9 15
ATOM 9337 C CG2 . ILE A 1 15 ? 2.217 -3.692 -6.161 1.00 0.00 ? 15 ILE A CG2 9 15
ATOM 9338 C CD1 . ILE A 1 15 ? 4.146 -1.740 -8.863 1.00 0.00 ? 15 ILE A CD1 9 15
ATOM 9339 H H . ILE A 1 15 ? 0.750 -1.545 -8.638 1.00 0.00 ? 15 ILE A H 9 15
ATOM 9340 H HA . ILE A 1 15 ? 2.269 -3.847 -9.383 1.00 0.00 ? 15 ILE A HA 9 15
ATOM 9341 H HB . ILE A 1 15 ? 1.996 -1.939 -7.220 1.00 0.00 ? 15 ILE A HB 9 15
ATOM 9342 H HG12 . ILE A 1 15 ? 4.392 -2.562 -6.916 1.00 0.00 ? 15 ILE A HG12 9 15
ATOM 9343 H HG13 . ILE A 1 15 ? 4.231 -3.750 -8.153 1.00 0.00 ? 15 ILE A HG13 9 15
ATOM 9344 H HG21 . ILE A 1 15 ? 2.662 -4.677 -6.249 1.00 0.00 ? 15 ILE A HG21 9 15
ATOM 9345 H HG22 . ILE A 1 15 ? 2.728 -3.133 -5.385 1.00 0.00 ? 15 ILE A HG22 9 15
ATOM 9346 H HG23 . ILE A 1 15 ? 1.182 -3.768 -5.851 1.00 0.00 ? 15 ILE A HG23 9 15
ATOM 9347 H HD11 . ILE A 1 15 ? 5.206 -1.615 -8.929 1.00 0.00 ? 15 ILE A HD11 9 15
ATOM 9348 H HD12 . ILE A 1 15 ? 3.806 -2.021 -9.837 1.00 0.00 ? 15 ILE A HD12 9 15
ATOM 9349 H HD13 . ILE A 1 15 ? 3.689 -0.819 -8.568 1.00 0.00 ? 15 ILE A HD13 9 15
ATOM 9350 N N . ILE A 1 16 ? -0.527 -4.321 -7.740 1.00 0.00 ? 16 ILE A N 9 16
ATOM 9351 C CA . ILE A 1 16 ? -1.524 -5.309 -7.394 1.00 0.00 ? 16 ILE A CA 9 16
ATOM 9352 C C . ILE A 1 16 ? -1.956 -6.046 -8.648 1.00 0.00 ? 16 ILE A C 9 16
ATOM 9353 O O . ILE A 1 16 ? -2.008 -7.264 -8.686 1.00 0.00 ? 16 ILE A O 9 16
ATOM 9354 C CB . ILE A 1 16 ? -2.680 -4.649 -6.657 1.00 0.00 ? 16 ILE A CB 9 16
ATOM 9355 C CG1 . ILE A 1 16 ? -2.214 -4.124 -5.308 1.00 0.00 ? 16 ILE A CG1 9 16
ATOM 9356 C CG2 . ILE A 1 16 ? -3.794 -5.664 -6.449 1.00 0.00 ? 16 ILE A CG2 9 16
ATOM 9357 C CD1 . ILE A 1 16 ? -3.224 -3.412 -4.421 1.00 0.00 ? 16 ILE A CD1 9 16
ATOM 9358 H H . ILE A 1 16 ? -0.679 -3.358 -7.498 1.00 0.00 ? 16 ILE A H 9 16
ATOM 9359 H HA . ILE A 1 16 ? -1.078 -6.081 -6.772 1.00 0.00 ? 16 ILE A HA 9 16
ATOM 9360 H HB . ILE A 1 16 ? -2.960 -3.789 -7.262 1.00 0.00 ? 16 ILE A HB 9 16
ATOM 9361 H HG12 . ILE A 1 16 ? -1.796 -4.961 -4.748 1.00 0.00 ? 16 ILE A HG12 9 16
ATOM 9362 H HG13 . ILE A 1 16 ? -1.421 -3.400 -5.470 1.00 0.00 ? 16 ILE A HG13 9 16
ATOM 9363 H HG21 . ILE A 1 16 ? -4.279 -5.920 -7.360 1.00 0.00 ? 16 ILE A HG21 9 16
ATOM 9364 H HG22 . ILE A 1 16 ? -3.442 -6.559 -5.986 1.00 0.00 ? 16 ILE A HG22 9 16
ATOM 9365 H HG23 . ILE A 1 16 ? -4.568 -5.312 -5.817 1.00 0.00 ? 16 ILE A HG23 9 16
ATOM 9366 H HD11 . ILE A 1 16 ? -2.704 -3.123 -3.536 1.00 0.00 ? 16 ILE A HD11 9 16
ATOM 9367 H HD12 . ILE A 1 16 ? -3.600 -2.573 -4.953 1.00 0.00 ? 16 ILE A HD12 9 16
ATOM 9368 H HD13 . ILE A 1 16 ? -3.997 -4.083 -4.132 1.00 0.00 ? 16 ILE A HD13 9 16
ATOM 9369 N N . LYS A 1 17 ? -2.225 -5.320 -9.724 1.00 0.00 ? 17 LYS A N 9 17
ATOM 9370 C CA . LYS A 1 17 ? -2.534 -5.843 -11.033 1.00 0.00 ? 17 LYS A CA 9 17
ATOM 9371 C C . LYS A 1 17 ? -1.392 -6.645 -11.621 1.00 0.00 ? 17 LYS A C 9 17
ATOM 9372 O O . LYS A 1 17 ? -1.590 -7.749 -12.069 1.00 0.00 ? 17 LYS A O 9 17
ATOM 9373 C CB . LYS A 1 17 ? -2.971 -4.701 -11.931 1.00 0.00 ? 17 LYS A CB 9 17
ATOM 9374 C CG . LYS A 1 17 ? -3.428 -5.052 -13.328 1.00 0.00 ? 17 LYS A CG 9 17
ATOM 9375 C CD . LYS A 1 17 ? -4.740 -5.793 -13.375 1.00 0.00 ? 17 LYS A CD 9 17
ATOM 9376 C CE . LYS A 1 17 ? -4.632 -7.258 -13.519 1.00 0.00 ? 17 LYS A CE 9 17
ATOM 9377 N NZ . LYS A 1 17 ? -5.918 -7.913 -13.622 1.00 0.00 ? 17 LYS A NZ 9 17
ATOM 9378 H H . LYS A 1 17 ? -2.139 -4.343 -9.590 1.00 0.00 ? 17 LYS A H 9 17
ATOM 9379 H HA . LYS A 1 17 ? -3.367 -6.521 -10.960 1.00 0.00 ? 17 LYS A HA 9 17
ATOM 9380 H HB2 . LYS A 1 17 ? -3.770 -4.155 -11.429 1.00 0.00 ? 17 LYS A HB2 9 17
ATOM 9381 H HB3 . LYS A 1 17 ? -2.136 -4.029 -12.067 1.00 0.00 ? 17 LYS A HB3 9 17
ATOM 9382 H HG2 . LYS A 1 17 ? -3.529 -4.131 -13.902 1.00 0.00 ? 17 LYS A HG2 9 17
ATOM 9383 H HG3 . LYS A 1 17 ? -2.663 -5.628 -13.820 1.00 0.00 ? 17 LYS A HG3 9 17
ATOM 9384 H HD2 . LYS A 1 17 ? -5.307 -5.566 -12.472 1.00 0.00 ? 17 LYS A HD2 9 17
ATOM 9385 H HD3 . LYS A 1 17 ? -5.278 -5.446 -14.186 1.00 0.00 ? 17 LYS A HD3 9 17
ATOM 9386 H HE2 . LYS A 1 17 ? -4.028 -7.504 -14.393 1.00 0.00 ? 17 LYS A HE2 9 17
ATOM 9387 H HE3 . LYS A 1 17 ? -4.132 -7.586 -12.668 1.00 0.00 ? 17 LYS A HE3 9 17
ATOM 9388 H HZ1 . LYS A 1 17 ? -5.822 -8.896 -13.619 1.00 0.00 ? 17 LYS A HZ1 9 17
ATOM 9389 H HZ2 . LYS A 1 17 ? -6.462 -7.683 -12.847 1.00 0.00 ? 17 LYS A HZ2 9 17
ATOM 9390 H HZ3 . LYS A 1 17 ? -6.370 -7.632 -14.455 1.00 0.00 ? 17 LYS A HZ3 9 17
ATOM 9391 N N . ALA A 1 18 ? -0.184 -6.132 -11.585 1.00 0.00 ? 18 ALA A N 9 18
ATOM 9392 C CA . ALA A 1 18 ? 0.944 -6.674 -12.299 1.00 0.00 ? 18 ALA A CA 9 18
ATOM 9393 C C . ALA A 1 18 ? 1.585 -7.822 -11.564 1.00 0.00 ? 18 ALA A C 9 18
ATOM 9394 O O . ALA A 1 18 ? 1.920 -8.821 -12.150 1.00 0.00 ? 18 ALA A O 9 18
ATOM 9395 C CB . ALA A 1 18 ? 1.899 -5.563 -12.637 1.00 0.00 ? 18 ALA A CB 9 18
ATOM 9396 H H . ALA A 1 18 ? -0.037 -5.265 -11.112 1.00 0.00 ? 18 ALA A H 9 18
ATOM 9397 H HA . ALA A 1 18 ? 0.578 -7.071 -13.229 1.00 0.00 ? 18 ALA A HA 9 18
ATOM 9398 H HB1 . ALA A 1 18 ? 2.371 -5.653 -13.278 1.00 0.00 ? 18 ALA A HB1 9 18
ATOM 9399 H HB2 . ALA A 1 18 ? 1.632 -4.882 -12.783 1.00 0.00 ? 18 ALA A HB2 9 18
ATOM 9400 H HB3 . ALA A 1 18 ? 2.429 -5.315 -12.163 1.00 0.00 ? 18 ALA A HB3 9 18
ATOM 9401 N N . GLY A 1 19 ? 1.758 -7.661 -10.278 1.00 0.00 ? 19 GLY A N 9 19
ATOM 9402 C CA . GLY A 1 19 ? 2.223 -8.633 -9.324 1.00 0.00 ? 19 GLY A CA 9 19
ATOM 9403 C C . GLY A 1 19 ? 1.263 -9.782 -9.104 1.00 0.00 ? 19 GLY A C 9 19
ATOM 9404 O O . GLY A 1 19 ? 1.679 -10.891 -8.865 1.00 0.00 ? 19 GLY A O 9 19
ATOM 9405 H H . GLY A 1 19 ? 1.438 -6.789 -9.937 1.00 0.00 ? 19 GLY A H 9 19
ATOM 9406 H HA2 . GLY A 1 19 ? 3.175 -8.996 -9.665 1.00 0.00 ? 19 GLY A HA2 9 19
ATOM 9407 H HA3 . GLY A 1 19 ? 2.386 -8.143 -8.379 1.00 0.00 ? 19 GLY A HA3 9 19
ATOM 9408 N N . GLY A 1 20 ? -0.024 -9.532 -9.185 1.00 0.00 ? 20 GLY A N 9 20
ATOM 9409 C CA . GLY A 1 20 ? -1.052 -10.528 -9.084 1.00 0.00 ? 20 GLY A CA 9 20
ATOM 9410 C C . GLY A 1 20 ? -1.179 -11.043 -7.667 1.00 0.00 ? 20 GLY A C 9 20
ATOM 9411 O O . GLY A 1 20 ? -1.117 -12.236 -7.491 1.00 0.00 ? 20 GLY A O 9 20
ATOM 9412 H H . GLY A 1 20 ? -0.260 -8.601 -9.382 1.00 0.00 ? 20 GLY A H 9 20
ATOM 9413 H HA2 . GLY A 1 20 ? -1.991 -10.113 -9.397 1.00 0.00 ? 20 GLY A HA2 9 20
ATOM 9414 H HA3 . GLY A 1 20 ? -0.832 -11.342 -9.742 1.00 0.00 ? 20 GLY A HA3 9 20
ATOM 9415 N N . TYR A 1 21 ? -1.385 -10.178 -6.693 1.00 0.00 ? 21 TYR A N 9 21
ATOM 9416 C CA . TYR A 1 21 ? -1.432 -10.507 -5.298 1.00 0.00 ? 21 TYR A CA 9 21
ATOM 9417 C C . TYR A 1 21 ? -2.411 -11.576 -4.896 1.00 0.00 ? 21 TYR A C 9 21
ATOM 9418 O O . TYR A 1 21 ? -2.211 -12.228 -3.929 1.00 0.00 ? 21 TYR A O 9 21
ATOM 9419 C CB . TYR A 1 21 ? -1.676 -9.260 -4.475 1.00 0.00 ? 21 TYR A CB 9 21
ATOM 9420 C CG . TYR A 1 21 ? -0.452 -8.528 -3.998 1.00 0.00 ? 21 TYR A CG 9 21
ATOM 9421 C CD1 . TYR A 1 21 ? 0.507 -9.049 -3.131 1.00 0.00 ? 21 TYR A CD1 9 21
ATOM 9422 C CD2 . TYR A 1 21 ? -0.313 -7.219 -4.452 1.00 0.00 ? 21 TYR A CD2 9 21
ATOM 9423 C CE1 . TYR A 1 21 ? 1.610 -8.278 -2.767 1.00 0.00 ? 21 TYR A CE1 9 21
ATOM 9424 C CE2 . TYR A 1 21 ? 0.784 -6.428 -4.104 1.00 0.00 ? 21 TYR A CE2 9 21
ATOM 9425 C CZ . TYR A 1 21 ? 1.759 -6.980 -3.262 1.00 0.00 ? 21 TYR A CZ 9 21
ATOM 9426 O OH . TYR A 1 21 ? 2.851 -6.237 -2.944 1.00 0.00 ? 21 TYR A OH 9 21
ATOM 9427 H H . TYR A 1 21 ? -1.420 -9.227 -6.935 1.00 0.00 ? 21 TYR A H 9 21
ATOM 9428 H HA . TYR A 1 21 ? -0.434 -10.841 -5.063 1.00 0.00 ? 21 TYR A HA 9 21
ATOM 9429 H HB2 . TYR A 1 21 ? -2.301 -8.577 -5.051 1.00 0.00 ? 21 TYR A HB2 9 21
ATOM 9430 H HB3 . TYR A 1 21 ? -2.196 -9.527 -3.577 1.00 0.00 ? 21 TYR A HB3 9 21
ATOM 9431 H HD1 . TYR A 1 21 ? 0.411 -10.042 -2.741 1.00 0.00 ? 21 TYR A HD1 9 21
ATOM 9432 H HD2 . TYR A 1 21 ? -1.121 -6.822 -5.029 1.00 0.00 ? 21 TYR A HD2 9 21
ATOM 9433 H HE1 . TYR A 1 21 ? 2.331 -8.672 -2.081 1.00 0.00 ? 21 TYR A HE1 9 21
ATOM 9434 H HE2 . TYR A 1 21 ? 0.815 -5.409 -4.438 1.00 0.00 ? 21 TYR A HE2 9 21
ATOM 9435 H HH . TYR A 1 21 ? 3.604 -6.666 -3.324 1.00 0.00 ? 21 TYR A HH 9 21
HETATM 9436 N N . NH2 A 1 22 ? -3.456 -11.802 -5.609 1.00 0.00 ? 22 NH2 A N 9 22
HETATM 9437 H HN1 . NH2 A 1 22 ? -4.069 -12.526 -5.350 1.00 0.00 ? 22 NH2 A HN1 9 22
HETATM 9438 H HN2 . NH2 A 1 22 ? -3.559 -11.314 -6.407 1.00 0.00 ? 22 NH2 A HN2 9 22
HETATM 9439 C C . ACE B 1 1 ? 0.822 -13.647 -4.586 1.00 0.00 ? 23 ACE B C 9 1
HETATM 9440 O O . ACE B 1 1 ? 1.453 -12.714 -5.005 1.00 0.00 ? 23 ACE B O 9 1
HETATM 9441 C CH3 . ACE B 1 1 ? 0.091 -14.594 -5.490 1.00 0.00 ? 23 ACE B CH3 9 1
HETATM 9442 H H1 . ACE B 1 1 ? 0.055 -15.171 -5.429 1.00 0.00 ? 23 ACE B H1 9 1
HETATM 9443 H H2 . ACE B 1 1 ? -0.464 -14.558 -5.615 1.00 0.00 ? 23 ACE B H2 9 1
HETATM 9444 H H3 . ACE B 1 1 ? 0.181 -14.735 -6.117 1.00 0.00 ? 23 ACE B H3 9 1
ATOM 9445 N N . ALA B 1 2 ? 0.750 -13.920 -3.308 1.00 0.00 ? 24 ALA B N 9 2
ATOM 9446 C CA . ALA B 1 2 ? 1.319 -13.180 -2.226 1.00 0.00 ? 24 ALA B CA 9 2
ATOM 9447 C C . ALA B 1 2 ? 2.759 -12.790 -2.374 1.00 0.00 ? 24 ALA B C 9 2
ATOM 9448 O O . ALA B 1 2 ? 3.143 -11.740 -1.902 1.00 0.00 ? 24 ALA B O 9 2
ATOM 9449 C CB . ALA B 1 2 ? 1.100 -14.009 -0.998 1.00 0.00 ? 24 ALA B CB 9 2
ATOM 9450 H H . ALA B 1 2 ? 0.238 -14.727 -3.051 1.00 0.00 ? 24 ALA B H 9 2
ATOM 9451 H HA . ALA B 1 2 ? 0.769 -12.270 -2.096 1.00 0.00 ? 24 ALA B HA 9 2
ATOM 9452 H HB1 . ALA B 1 2 ? 1.625 -14.923 -1.107 1.00 0.00 ? 24 ALA B HB1 9 2
ATOM 9453 H HB2 . ALA B 1 2 ? 1.468 -13.483 -0.160 1.00 0.00 ? 24 ALA B HB2 9 2
ATOM 9454 H HB3 . ALA B 1 2 ? 0.071 -14.197 -0.860 1.00 0.00 ? 24 ALA B HB3 9 2
ATOM 9455 N N . LYS B 1 3 ? 3.595 -13.556 -3.048 1.00 0.00 ? 25 LYS B N 9 3
ATOM 9456 C CA . LYS B 1 3 ? 4.994 -13.294 -3.258 1.00 0.00 ? 25 LYS B CA 9 3
ATOM 9457 C C . LYS B 1 3 ? 5.292 -12.081 -4.103 1.00 0.00 ? 25 LYS B C 9 3
ATOM 9458 O O . LYS B 1 3 ? 6.421 -11.629 -4.136 1.00 0.00 ? 25 LYS B O 9 3
ATOM 9459 C CB . LYS B 1 3 ? 5.647 -14.514 -3.860 1.00 0.00 ? 25 LYS B CB 9 3
ATOM 9460 C CG . LYS B 1 3 ? 5.764 -15.645 -2.888 1.00 0.00 ? 25 LYS B CG 9 3
ATOM 9461 C CD . LYS B 1 3 ? 6.364 -16.896 -3.469 1.00 0.00 ? 25 LYS B CD 9 3
ATOM 9462 C CE . LYS B 1 3 ? 6.112 -17.904 -3.062 1.00 0.00 ? 25 LYS B CE 9 3
ATOM 9463 N NZ . LYS B 1 3 ? 6.235 -19.094 -3.357 1.00 0.00 ? 25 LYS B NZ 9 3
ATOM 9464 H H . LYS B 1 3 ? 3.177 -14.384 -3.412 1.00 0.00 ? 25 LYS B H 9 3
ATOM 9465 H HA . LYS B 1 3 ? 5.460 -13.123 -2.296 1.00 0.00 ? 25 LYS B HA 9 3
ATOM 9466 H HB2 . LYS B 1 3 ? 5.099 -14.831 -4.747 1.00 0.00 ? 25 LYS B HB2 9 3
ATOM 9467 H HB3 . LYS B 1 3 ? 6.652 -14.262 -4.132 1.00 0.00 ? 25 LYS B HB3 9 3
ATOM 9468 H HG2 . LYS B 1 3 ? 6.373 -15.324 -2.044 1.00 0.00 ? 25 LYS B HG2 9 3
ATOM 9469 H HG3 . LYS B 1 3 ? 4.792 -15.857 -2.506 1.00 0.00 ? 25 LYS B HG3 9 3
ATOM 9470 H HD2 . LYS B 1 3 ? 6.105 -16.903 -4.528 1.00 0.00 ? 25 LYS B HD2 9 3
ATOM 9471 H HD3 . LYS B 1 3 ? 7.091 -16.941 -3.440 1.00 0.00 ? 25 LYS B HD3 9 3
ATOM 9472 H HE2 . LYS B 1 3 ? 6.616 -17.883 -2.096 1.00 0.00 ? 25 LYS B HE2 9 3
ATOM 9473 H HE3 . LYS B 1 3 ? 5.631 -17.738 -2.951 1.00 0.00 ? 25 LYS B HE3 9 3
ATOM 9474 H HZ1 . LYS B 1 3 ? 6.944 -19.130 -3.810 1.00 0.00 ? 25 LYS B HZ1 9 3
ATOM 9475 H HZ2 . LYS B 1 3 ? 6.234 -19.760 -2.631 1.00 0.00 ? 25 LYS B HZ2 9 3
ATOM 9476 H HZ3 . LYS B 1 3 ? 5.650 -19.290 -3.865 1.00 0.00 ? 25 LYS B HZ3 9 3
ATOM 9477 N N . ALA B 1 4 ? 4.270 -11.459 -4.666 1.00 0.00 ? 26 ALA B N 9 4
ATOM 9478 C CA . ALA B 1 4 ? 4.287 -10.087 -5.108 1.00 0.00 ? 26 ALA B CA 9 4
ATOM 9479 C C . ALA B 1 4 ? 4.638 -9.045 -4.062 1.00 0.00 ? 26 ALA B C 9 4
ATOM 9480 O O . ALA B 1 4 ? 4.704 -7.869 -4.374 1.00 0.00 ? 26 ALA B O 9 4
ATOM 9481 C CB . ALA B 1 4 ? 2.919 -9.800 -5.705 1.00 0.00 ? 26 ALA B CB 9 4
ATOM 9482 H H . ALA B 1 4 ? 3.403 -11.936 -4.617 1.00 0.00 ? 26 ALA B H 9 4
ATOM 9483 H HA . ALA B 1 4 ? 5.063 -9.986 -5.850 1.00 0.00 ? 26 ALA B HA 9 4
ATOM 9484 H HB1 . ALA B 1 4 ? 2.164 -9.956 -4.979 1.00 0.00 ? 26 ALA B HB1 9 4
ATOM 9485 H HB2 . ALA B 1 4 ? 2.876 -8.794 -6.014 1.00 0.00 ? 26 ALA B HB2 9 4
ATOM 9486 H HB3 . ALA B 1 4 ? 2.717 -10.471 -6.509 1.00 0.00 ? 26 ALA B HB3 9 4
ATOM 9487 N N . ALA B 1 5 ? 4.922 -9.458 -2.832 1.00 0.00 ? 27 ALA B N 9 5
ATOM 9488 C CA . ALA B 1 5 ? 5.160 -8.602 -1.696 1.00 0.00 ? 27 ALA B CA 9 5
ATOM 9489 C C . ALA B 1 5 ? 6.491 -7.873 -1.733 1.00 0.00 ? 27 ALA B C 9 5
ATOM 9490 O O . ALA B 1 5 ? 6.541 -6.704 -2.086 1.00 0.00 ? 27 ALA B O 9 5
ATOM 9491 C CB . ALA B 1 5 ? 4.870 -9.399 -0.435 1.00 0.00 ? 27 ALA B CB 9 5
ATOM 9492 H H . ALA B 1 5 ? 4.978 -10.449 -2.720 1.00 0.00 ? 27 ALA B H 9 5
ATOM 9493 H HA . ALA B 1 5 ? 4.446 -7.789 -1.710 1.00 0.00 ? 27 ALA B HA 9 5
ATOM 9494 H HB1 . ALA B 1 5 ? 3.884 -9.783 -0.467 1.00 0.00 ? 27 ALA B HB1 9 5
ATOM 9495 H HB2 . ALA B 1 5 ? 5.535 -10.208 -0.375 1.00 0.00 ? 27 ALA B HB2 9 5
ATOM 9496 H HB3 . ALA B 1 5 ? 4.929 -8.822 0.438 1.00 0.00 ? 27 ALA B HB3 9 5
ATOM 9497 N N . ALA B 1 6 ? 7.595 -8.500 -1.351 1.00 0.00 ? 28 ALA B N 9 6
ATOM 9498 C CA . ALA B 1 6 ? 8.807 -7.805 -1.005 1.00 0.00 ? 28 ALA B CA 9 6
ATOM 9499 C C . ALA B 1 6 ? 9.613 -7.240 -2.154 1.00 0.00 ? 28 ALA B C 9 6
ATOM 9500 O O . ALA B 1 6 ? 10.713 -6.760 -1.933 1.00 0.00 ? 28 ALA B O 9 6
ATOM 9501 C CB . ALA B 1 6 ? 9.644 -8.649 -0.083 1.00 0.00 ? 28 ALA B CB 9 6
ATOM 9502 H H . ALA B 1 6 ? 7.517 -9.479 -1.171 1.00 0.00 ? 28 ALA B H 9 6
ATOM 9503 H HA . ALA B 1 6 ? 8.461 -6.957 -0.437 1.00 0.00 ? 28 ALA B HA 9 6
ATOM 9504 H HB1 . ALA B 1 6 ? 9.081 -8.927 0.792 1.00 0.00 ? 28 ALA B HB1 9 6
ATOM 9505 H HB2 . ALA B 1 6 ? 10.002 -9.513 -0.605 1.00 0.00 ? 28 ALA B HB2 9 6
ATOM 9506 H HB3 . ALA B 1 6 ? 10.514 -8.100 0.231 1.00 0.00 ? 28 ALA B HB3 9 6
ATOM 9507 N N . ALA B 1 7 ? 9.100 -7.240 -3.374 1.00 0.00 ? 29 ALA B N 9 7
ATOM 9508 C CA . ALA B 1 7 ? 9.506 -6.391 -4.462 1.00 0.00 ? 29 ALA B CA 9 7
ATOM 9509 C C . ALA B 1 7 ? 8.776 -5.066 -4.356 1.00 0.00 ? 29 ALA B C 9 7
ATOM 9510 O O . ALA B 1 7 ? 9.390 -4.012 -4.353 1.00 0.00 ? 29 ALA B O 9 7
ATOM 9511 C CB . ALA B 1 7 ? 9.192 -7.060 -5.784 1.00 0.00 ? 29 ALA B CB 9 7
ATOM 9512 H H . ALA B 1 7 ? 8.263 -7.777 -3.474 1.00 0.00 ? 29 ALA B H 9 7
ATOM 9513 H HA . ALA B 1 7 ? 10.568 -6.175 -4.410 1.00 0.00 ? 29 ALA B HA 9 7
ATOM 9514 H HB1 . ALA B 1 7 ? 9.533 -6.453 -6.589 1.00 0.00 ? 29 ALA B HB1 9 7
ATOM 9515 H HB2 . ALA B 1 7 ? 9.732 -7.984 -5.862 1.00 0.00 ? 29 ALA B HB2 9 7
ATOM 9516 H HB3 . ALA B 1 7 ? 8.143 -7.227 -5.933 1.00 0.00 ? 29 ALA B HB3 9 7
ATOM 9517 N N . ALA B 1 8 ? 7.453 -5.112 -4.256 1.00 0.00 ? 30 ALA B N 9 8
ATOM 9518 C CA . ALA B 1 8 ? 6.574 -3.984 -4.433 1.00 0.00 ? 30 ALA B CA 9 8
ATOM 9519 C C . ALA B 1 8 ? 6.539 -3.156 -3.165 1.00 0.00 ? 30 ALA B C 9 8
ATOM 9520 O O . ALA B 1 8 ? 6.762 -1.962 -3.180 1.00 0.00 ? 30 ALA B O 9 8
ATOM 9521 C CB . ALA B 1 8 ? 5.216 -4.555 -4.774 1.00 0.00 ? 30 ALA B CB 9 8
ATOM 9522 H H . ALA B 1 8 ? 7.006 -5.981 -4.032 1.00 0.00 ? 30 ALA B H 9 8
ATOM 9523 H HA . ALA B 1 8 ? 6.890 -3.347 -5.247 1.00 0.00 ? 30 ALA B HA 9 8
ATOM 9524 H HB1 . ALA B 1 8 ? 4.750 -4.838 -4.228 1.00 0.00 ? 30 ALA B HB1 9 8
ATOM 9525 H HB2 . ALA B 1 8 ? 5.203 -5.095 -5.262 1.00 0.00 ? 30 ALA B HB2 9 8
ATOM 9526 H HB3 . ALA B 1 8 ? 4.674 -4.113 -5.040 1.00 0.00 ? 30 ALA B HB3 9 8
ATOM 9527 N N . ILE B 1 9 ? 6.320 -3.828 -2.042 1.00 0.00 ? 31 ILE B N 9 9
ATOM 9528 C CA . ILE B 1 9 ? 6.258 -3.320 -0.693 1.00 0.00 ? 31 ILE B CA 9 9
ATOM 9529 C C . ILE B 1 9 ? 7.552 -2.637 -0.289 1.00 0.00 ? 31 ILE B C 9 9
ATOM 9530 O O . ILE B 1 9 ? 7.494 -1.613 0.383 1.00 0.00 ? 31 ILE B O 9 9
ATOM 9531 C CB . ILE B 1 9 ? 5.983 -4.446 0.292 1.00 0.00 ? 31 ILE B CB 9 9
ATOM 9532 C CG1 . ILE B 1 9 ? 4.711 -5.238 0.024 1.00 0.00 ? 31 ILE B CG1 9 9
ATOM 9533 C CG2 . ILE B 1 9 ? 6.035 -4.017 1.748 1.00 0.00 ? 31 ILE B CG2 9 9
ATOM 9534 C CD1 . ILE B 1 9 ? 3.439 -4.476 0.340 1.00 0.00 ? 31 ILE B CD1 9 9
ATOM 9535 H H . ILE B 1 9 ? 6.216 -4.809 -2.158 1.00 0.00 ? 31 ILE B H 9 9
ATOM 9536 H HA . ILE B 1 9 ? 5.472 -2.581 -0.591 1.00 0.00 ? 31 ILE B HA 9 9
ATOM 9537 H HB . ILE B 1 9 ? 6.843 -5.101 0.206 1.00 0.00 ? 31 ILE B HB 9 9
ATOM 9538 H HG12 . ILE B 1 9 ? 4.690 -5.527 -1.027 1.00 0.00 ? 31 ILE B HG12 9 9
ATOM 9539 H HG13 . ILE B 1 9 ? 4.764 -6.158 0.591 1.00 0.00 ? 31 ILE B HG13 9 9
ATOM 9540 H HG21 . ILE B 1 9 ? 5.365 -3.194 1.944 1.00 0.00 ? 31 ILE B HG21 9 9
ATOM 9541 H HG22 . ILE B 1 9 ? 5.770 -4.854 2.363 1.00 0.00 ? 31 ILE B HG22 9 9
ATOM 9542 H HG23 . ILE B 1 9 ? 7.030 -3.703 2.015 1.00 0.00 ? 31 ILE B HG23 9 9
ATOM 9543 H HD11 . ILE B 1 9 ? 3.414 -4.007 1.071 1.00 0.00 ? 31 ILE B HD11 9 9
ATOM 9544 H HD12 . ILE B 1 9 ? 3.177 -3.932 -0.294 1.00 0.00 ? 31 ILE B HD12 9 9
ATOM 9545 H HD13 . ILE B 1 9 ? 2.776 -5.008 0.462 1.00 0.00 ? 31 ILE B HD13 9 9
ATOM 9546 N N . LYS B 1 10 ? 8.697 -3.155 -0.724 1.00 0.00 ? 32 LYS B N 9 10
ATOM 9547 C CA . LYS B 1 10 ? 9.993 -2.556 -0.495 1.00 0.00 ? 32 LYS B CA 9 10
ATOM 9548 C C . LYS B 1 10 ? 10.063 -1.184 -1.142 1.00 0.00 ? 32 LYS B C 9 10
ATOM 9549 O O . LYS B 1 10 ? 10.323 -0.209 -0.456 1.00 0.00 ? 32 LYS B O 9 10
ATOM 9550 C CB . LYS B 1 10 ? 11.048 -3.536 -0.976 1.00 0.00 ? 32 LYS B CB 9 10
ATOM 9551 C CG . LYS B 1 10 ? 11.612 -4.406 0.118 1.00 0.00 ? 32 LYS B CG 9 10
ATOM 9552 C CD . LYS B 1 10 ? 12.942 -4.992 -0.288 1.00 0.00 ? 32 LYS B CD 9 10
ATOM 9553 C CE . LYS B 1 10 ? 13.480 -5.955 0.691 1.00 0.00 ? 32 LYS B CE 9 10
ATOM 9554 N NZ . LYS B 1 10 ? 14.784 -6.436 0.356 1.00 0.00 ? 32 LYS B NZ 9 10
ATOM 9555 H H . LYS B 1 10 ? 8.610 -4.003 -1.253 1.00 0.00 ? 32 LYS B H 9 10
ATOM 9556 H HA . LYS B 1 10 ? 10.116 -2.368 0.566 1.00 0.00 ? 32 LYS B HA 9 10
ATOM 9557 H HB2 . LYS B 1 10 ? 10.622 -4.173 -1.750 1.00 0.00 ? 32 LYS B HB2 9 10
ATOM 9558 H HB3 . LYS B 1 10 ? 11.831 -2.956 -1.433 1.00 0.00 ? 32 LYS B HB3 9 10
ATOM 9559 H HG2 . LYS B 1 10 ? 11.720 -3.834 1.040 1.00 0.00 ? 32 LYS B HG2 9 10
ATOM 9560 H HG3 . LYS B 1 10 ? 10.916 -5.199 0.290 1.00 0.00 ? 32 LYS B HG3 9 10
ATOM 9561 H HD2 . LYS B 1 10 ? 12.838 -5.488 -1.253 1.00 0.00 ? 32 LYS B HD2 9 10
ATOM 9562 H HD3 . LYS B 1 10 ? 13.599 -4.198 -0.420 1.00 0.00 ? 32 LYS B HD3 9 10
ATOM 9563 H HE2 . LYS B 1 10 ? 13.529 -5.468 1.664 1.00 0.00 ? 32 LYS B HE2 9 10
ATOM 9564 H HE3 . LYS B 1 10 ? 12.843 -6.750 0.811 1.00 0.00 ? 32 LYS B HE3 9 10
ATOM 9565 H HZ1 . LYS B 1 10 ? 14.752 -7.032 -0.339 1.00 0.00 ? 32 LYS B HZ1 9 10
ATOM 9566 H HZ2 . LYS B 1 10 ? 15.388 -5.766 0.103 1.00 0.00 ? 32 LYS B HZ2 9 10
ATOM 9567 H HZ3 . LYS B 1 10 ? 15.195 -6.862 1.085 1.00 0.00 ? 32 LYS B HZ3 9 10
ATOM 9568 N N . ALA B 1 11 ? 9.713 -1.105 -2.420 1.00 0.00 ? 33 ALA B N 9 11
ATOM 9569 C CA . ALA B 1 11 ? 9.504 0.106 -3.180 1.00 0.00 ? 33 ALA B CA 9 11
ATOM 9570 C C . ALA B 1 11 ? 8.251 0.883 -2.823 1.00 0.00 ? 33 ALA B C 9 11
ATOM 9571 O O . ALA B 1 11 ? 7.813 1.730 -3.578 1.00 0.00 ? 33 ALA B O 9 11
ATOM 9572 C CB . ALA B 1 11 ? 9.550 -0.273 -4.643 1.00 0.00 ? 33 ALA B CB 9 11
ATOM 9573 H H . ALA B 1 11 ? 9.525 -1.965 -2.887 1.00 0.00 ? 33 ALA B H 9 11
ATOM 9574 H HA . ALA B 1 11 ? 10.324 0.782 -2.980 1.00 0.00 ? 33 ALA B HA 9 11
ATOM 9575 H HB1 . ALA B 1 11 ? 9.419 0.575 -5.266 1.00 0.00 ? 33 ALA B HB1 9 11
ATOM 9576 H HB2 . ALA B 1 11 ? 10.494 -0.664 -4.876 1.00 0.00 ? 33 ALA B HB2 9 11
ATOM 9577 H HB3 . ALA B 1 11 ? 8.775 -0.941 -4.889 1.00 0.00 ? 33 ALA B HB3 9 11
ATOM 9578 N N . ILE B 1 12 ? 7.662 0.614 -1.665 1.00 0.00 ? 34 ILE B N 9 12
ATOM 9579 C CA . ILE B 1 12 ? 6.551 1.328 -1.082 1.00 0.00 ? 34 ILE B CA 9 12
ATOM 9580 C C . ILE B 1 12 ? 6.836 1.775 0.341 1.00 0.00 ? 34 ILE B C 9 12
ATOM 9581 O O . ILE B 1 12 ? 6.761 2.973 0.562 1.00 0.00 ? 34 ILE B O 9 12
ATOM 9582 C CB . ILE B 1 12 ? 5.235 0.579 -1.239 1.00 0.00 ? 34 ILE B CB 9 12
ATOM 9583 C CG1 . ILE B 1 12 ? 4.729 0.680 -2.670 1.00 0.00 ? 34 ILE B CG1 9 12
ATOM 9584 C CG2 . ILE B 1 12 ? 4.169 0.927 -0.221 1.00 0.00 ? 34 ILE B CG2 9 12
ATOM 9585 C CD1 . ILE B 1 12 ? 4.348 2.065 -3.160 1.00 0.00 ? 34 ILE B CD1 9 12
ATOM 9586 H H . ILE B 1 12 ? 7.998 -0.157 -1.148 1.00 0.00 ? 34 ILE B H 9 12
ATOM 9587 H HA . ILE B 1 12 ? 6.451 2.290 -1.578 1.00 0.00 ? 34 ILE B HA 9 12
ATOM 9588 H HB . ILE B 1 12 ? 5.441 -0.470 -1.061 1.00 0.00 ? 34 ILE B HB 9 12
ATOM 9589 H HG12 . ILE B 1 12 ? 5.503 0.287 -3.329 1.00 0.00 ? 34 ILE B HG12 9 12
ATOM 9590 H HG13 . ILE B 1 12 ? 3.873 0.046 -2.785 1.00 0.00 ? 34 ILE B HG13 9 12
ATOM 9591 H HG21 . ILE B 1 12 ? 3.908 1.969 -0.260 1.00 0.00 ? 34 ILE B HG21 9 12
ATOM 9592 H HG22 . ILE B 1 12 ? 3.276 0.381 -0.444 1.00 0.00 ? 34 ILE B HG22 9 12
ATOM 9593 H HG23 . ILE B 1 12 ? 4.473 0.645 0.769 1.00 0.00 ? 34 ILE B HG23 9 12
ATOM 9594 H HD11 . ILE B 1 12 ? 5.198 2.713 -3.196 1.00 0.00 ? 34 ILE B HD11 9 12
ATOM 9595 H HD12 . ILE B 1 12 ? 3.927 1.997 -4.153 1.00 0.00 ? 34 ILE B HD12 9 12
ATOM 9596 H HD13 . ILE B 1 12 ? 3.618 2.503 -2.511 1.00 0.00 ? 34 ILE B HD13 9 12
ATOM 9597 N N . ALA B 1 13 ? 7.279 0.935 1.271 1.00 0.00 ? 35 ALA B N 9 13
ATOM 9598 C CA . ALA B 1 13 ? 7.515 1.376 2.627 1.00 0.00 ? 35 ALA B CA 9 13
ATOM 9599 C C . ALA B 1 13 ? 8.564 2.461 2.789 1.00 0.00 ? 35 ALA B C 9 13
ATOM 9600 O O . ALA B 1 13 ? 8.507 3.258 3.716 1.00 0.00 ? 35 ALA B O 9 13
ATOM 9601 C CB . ALA B 1 13 ? 7.853 0.144 3.452 1.00 0.00 ? 35 ALA B CB 9 13
ATOM 9602 H H . ALA B 1 13 ? 7.396 -0.029 1.018 1.00 0.00 ? 35 ALA B H 9 13
ATOM 9603 H HA . ALA B 1 13 ? 6.597 1.777 3.045 1.00 0.00 ? 35 ALA B HA 9 13
ATOM 9604 H HB1 . ALA B 1 13 ? 7.943 -0.398 3.301 1.00 0.00 ? 35 ALA B HB1 9 13
ATOM 9605 H HB2 . ALA B 1 13 ? 8.285 0.057 3.802 1.00 0.00 ? 35 ALA B HB2 9 13
ATOM 9606 H HB3 . ALA B 1 13 ? 7.572 -0.072 3.874 1.00 0.00 ? 35 ALA B HB3 9 13
ATOM 9607 N N . ALA B 1 14 ? 9.512 2.508 1.861 1.00 0.00 ? 36 ALA B N 9 14
ATOM 9608 C CA . ALA B 1 14 ? 10.469 3.576 1.698 1.00 0.00 ? 36 ALA B CA 9 14
ATOM 9609 C C . ALA B 1 14 ? 9.847 4.819 1.094 1.00 0.00 ? 36 ALA B C 9 14
ATOM 9610 O O . ALA B 1 14 ? 10.033 5.918 1.584 1.00 0.00 ? 36 ALA B O 9 14
ATOM 9611 C CB . ALA B 1 14 ? 11.609 3.061 0.835 1.00 0.00 ? 36 ALA B CB 9 14
ATOM 9612 H H . ALA B 1 14 ? 9.396 1.797 1.163 1.00 0.00 ? 36 ALA B H 9 14
ATOM 9613 H HA . ALA B 1 14 ? 10.896 3.839 2.654 1.00 0.00 ? 36 ALA B HA 9 14
ATOM 9614 H HB1 . ALA B 1 14 ? 12.327 3.807 0.675 1.00 0.00 ? 36 ALA B HB1 9 14
ATOM 9615 H HB2 . ALA B 1 14 ? 12.082 2.245 1.293 1.00 0.00 ? 36 ALA B HB2 9 14
ATOM 9616 H HB3 . ALA B 1 14 ? 11.288 2.762 -0.122 1.00 0.00 ? 36 ALA B HB3 9 14
ATOM 9617 N N . ILE B 1 15 ? 9.041 4.649 0.054 1.00 0.00 ? 37 ILE B N 9 15
ATOM 9618 C CA . ILE B 1 15 ? 8.265 5.658 -0.633 1.00 0.00 ? 37 ILE B CA 9 15
ATOM 9619 C C . ILE B 1 15 ? 7.229 6.314 0.260 1.00 0.00 ? 37 ILE B C 9 15
ATOM 9620 O O . ILE B 1 15 ? 6.991 7.505 0.129 1.00 0.00 ? 37 ILE B O 9 15
ATOM 9621 C CB . ILE B 1 15 ? 7.695 5.065 -1.912 1.00 0.00 ? 37 ILE B CB 9 15
ATOM 9622 C CG1 . ILE B 1 15 ? 8.659 5.113 -3.076 1.00 0.00 ? 37 ILE B CG1 9 15
ATOM 9623 C CG2 . ILE B 1 15 ? 6.384 5.671 -2.364 1.00 0.00 ? 37 ILE B CG2 9 15
ATOM 9624 C CD1 . ILE B 1 15 ? 9.873 4.214 -2.952 1.00 0.00 ? 37 ILE B CD1 9 15
ATOM 9625 H H . ILE B 1 15 ? 8.865 3.699 -0.185 1.00 0.00 ? 37 ILE B H 9 15
ATOM 9626 H HA . ILE B 1 15 ? 8.946 6.450 -0.925 1.00 0.00 ? 37 ILE B HA 9 15
ATOM 9627 H HB . ILE B 1 15 ? 7.478 4.038 -1.676 1.00 0.00 ? 37 ILE B HB 9 15
ATOM 9628 H HG12 . ILE B 1 15 ? 8.118 4.836 -3.981 1.00 0.00 ? 37 ILE B HG12 9 15
ATOM 9629 H HG13 . ILE B 1 15 ? 8.988 6.129 -3.214 1.00 0.00 ? 37 ILE B HG13 9 15
ATOM 9630 H HG21 . ILE B 1 15 ? 6.480 6.717 -2.563 1.00 0.00 ? 37 ILE B HG21 9 15
ATOM 9631 H HG22 . ILE B 1 15 ? 6.010 5.184 -3.252 1.00 0.00 ? 37 ILE B HG22 9 15
ATOM 9632 H HG23 . ILE B 1 15 ? 5.655 5.544 -1.596 1.00 0.00 ? 37 ILE B HG23 9 15
ATOM 9633 H HD11 . ILE B 1 15 ? 10.602 4.668 -2.310 1.00 0.00 ? 37 ILE B HD11 9 15
ATOM 9634 H HD12 . ILE B 1 15 ? 9.587 3.261 -2.546 1.00 0.00 ? 37 ILE B HD12 9 15
ATOM 9635 H HD13 . ILE B 1 15 ? 10.289 4.099 -3.924 1.00 0.00 ? 37 ILE B HD13 9 15
ATOM 9636 N N . ILE B 1 16 ? 6.631 5.579 1.194 1.00 0.00 ? 38 ILE B N 9 16
ATOM 9637 C CA . ILE B 1 16 ? 5.742 6.087 2.214 1.00 0.00 ? 38 ILE B CA 9 16
ATOM 9638 C C . ILE B 1 16 ? 6.406 7.186 3.016 1.00 0.00 ? 38 ILE B C 9 16
ATOM 9639 O O . ILE B 1 16 ? 5.835 8.254 3.173 1.00 0.00 ? 38 ILE B O 9 16
ATOM 9640 C CB . ILE B 1 16 ? 5.242 4.937 3.077 1.00 0.00 ? 38 ILE B CB 9 16
ATOM 9641 C CG1 . ILE B 1 16 ? 4.223 4.173 2.247 1.00 0.00 ? 38 ILE B CG1 9 16
ATOM 9642 C CG2 . ILE B 1 16 ? 4.672 5.321 4.434 1.00 0.00 ? 38 ILE B CG2 9 16
ATOM 9643 C CD1 . ILE B 1 16 ? 3.414 3.095 2.947 1.00 0.00 ? 38 ILE B CD1 9 16
ATOM 9644 H H . ILE B 1 16 ? 6.836 4.602 1.165 1.00 0.00 ? 38 ILE B H 9 16
ATOM 9645 H HA . ILE B 1 16 ? 4.903 6.586 1.740 1.00 0.00 ? 38 ILE B HA 9 16
ATOM 9646 H HB . ILE B 1 16 ? 6.097 4.291 3.247 1.00 0.00 ? 38 ILE B HB 9 16
ATOM 9647 H HG12 . ILE B 1 16 ? 3.530 4.894 1.815 1.00 0.00 ? 38 ILE B HG12 9 16
ATOM 9648 H HG13 . ILE B 1 16 ? 4.739 3.687 1.430 1.00 0.00 ? 38 ILE B HG13 9 16
ATOM 9649 H HG21 . ILE B 1 16 ? 4.431 4.452 5.013 1.00 0.00 ? 38 ILE B HG21 9 16
ATOM 9650 H HG22 . ILE B 1 16 ? 5.378 5.863 5.035 1.00 0.00 ? 38 ILE B HG22 9 16
ATOM 9651 H HG23 . ILE B 1 16 ? 3.788 5.908 4.338 1.00 0.00 ? 38 ILE B HG23 9 16
ATOM 9652 H HD11 . ILE B 1 16 ? 2.783 2.584 2.236 1.00 0.00 ? 38 ILE B HD11 9 16
ATOM 9653 H HD12 . ILE B 1 16 ? 4.066 2.390 3.413 1.00 0.00 ? 38 ILE B HD12 9 16
ATOM 9654 H HD13 . ILE B 1 16 ? 2.805 3.553 3.699 1.00 0.00 ? 38 ILE B HD13 9 16
ATOM 9655 N N . LYS B 1 17 ? 7.618 6.942 3.502 1.00 0.00 ? 39 LYS B N 9 17
ATOM 9656 C CA . LYS B 1 17 ? 8.431 7.820 4.306 1.00 0.00 ? 39 LYS B CA 9 17
ATOM 9657 C C . LYS B 1 17 ? 8.960 9.012 3.532 1.00 0.00 ? 39 LYS B C 9 17
ATOM 9658 O O . LYS B 1 17 ? 8.914 10.125 4.012 1.00 0.00 ? 39 LYS B O 9 17
ATOM 9659 C CB . LYS B 1 17 ? 9.572 7.028 4.914 1.00 0.00 ? 39 LYS B CB 9 17
ATOM 9660 C CG . LYS B 1 17 ? 10.388 7.697 5.961 1.00 0.00 ? 39 LYS B CG 9 17
ATOM 9661 C CD . LYS B 1 17 ? 9.727 8.034 7.201 1.00 0.00 ? 39 LYS B CD 9 17
ATOM 9662 C CE . LYS B 1 17 ? 9.443 6.874 7.870 1.00 0.00 ? 39 LYS B CE 9 17
ATOM 9663 N NZ . LYS B 1 17 ? 8.760 7.121 9.051 1.00 0.00 ? 39 LYS B NZ 9 17
ATOM 9664 H H . LYS B 1 17 ? 7.976 6.033 3.340 1.00 0.00 ? 39 LYS B H 9 17
ATOM 9665 H HA . LYS B 1 17 ? 7.788 8.188 5.094 1.00 0.00 ? 39 LYS B HA 9 17
ATOM 9666 H HB2 . LYS B 1 17 ? 9.162 6.111 5.338 1.00 0.00 ? 39 LYS B HB2 9 17
ATOM 9667 H HB3 . LYS B 1 17 ? 10.216 6.750 4.129 1.00 0.00 ? 39 LYS B HB3 9 17
ATOM 9668 H HG2 . LYS B 1 17 ? 11.230 7.045 6.196 1.00 0.00 ? 39 LYS B HG2 9 17
ATOM 9669 H HG3 . LYS B 1 17 ? 10.780 8.552 5.570 1.00 0.00 ? 39 LYS B HG3 9 17
ATOM 9670 H HD2 . LYS B 1 17 ? 10.357 8.686 7.807 1.00 0.00 ? 39 LYS B HD2 9 17
ATOM 9671 H HD3 . LYS B 1 17 ? 8.849 8.536 7.004 1.00 0.00 ? 39 LYS B HD3 9 17
ATOM 9672 H HE2 . LYS B 1 17 ? 8.852 6.210 7.239 1.00 0.00 ? 39 LYS B HE2 9 17
ATOM 9673 H HE3 . LYS B 1 17 ? 10.311 6.440 8.036 1.00 0.00 ? 39 LYS B HE3 9 17
ATOM 9674 H HZ1 . LYS B 1 17 ? 8.568 6.428 9.422 1.00 0.00 ? 39 LYS B HZ1 9 17
ATOM 9675 H HZ2 . LYS B 1 17 ? 8.008 7.515 8.948 1.00 0.00 ? 39 LYS B HZ2 9 17
ATOM 9676 H HZ3 . LYS B 1 17 ? 9.202 7.567 9.647 1.00 0.00 ? 39 LYS B HZ3 9 17
ATOM 9677 N N . ALA B 1 18 ? 9.380 8.813 2.291 1.00 0.00 ? 40 ALA B N 9 18
ATOM 9678 C CA . ALA B 1 18 ? 9.859 9.826 1.384 1.00 0.00 ? 40 ALA B CA 9 18
ATOM 9679 C C . ALA B 1 18 ? 8.760 10.691 0.795 1.00 0.00 ? 40 ALA B C 9 18
ATOM 9680 O O . ALA B 1 18 ? 8.952 11.860 0.554 1.00 0.00 ? 40 ALA B O 9 18
ATOM 9681 C CB . ALA B 1 18 ? 10.664 9.133 0.299 1.00 0.00 ? 40 ALA B CB 9 18
ATOM 9682 H H . ALA B 1 18 ? 9.355 7.875 1.937 1.00 0.00 ? 40 ALA B H 9 18
ATOM 9683 H HA . ALA B 1 18 ? 10.524 10.479 1.936 1.00 0.00 ? 40 ALA B HA 9 18
ATOM 9684 H HB1 . ALA B 1 18 ? 11.453 8.550 0.722 1.00 0.00 ? 40 ALA B HB1 9 18
ATOM 9685 H HB2 . ALA B 1 18 ? 10.030 8.463 -0.236 1.00 0.00 ? 40 ALA B HB2 9 18
ATOM 9686 H HB3 . ALA B 1 18 ? 11.054 9.856 -0.366 1.00 0.00 ? 40 ALA B HB3 9 18
ATOM 9687 N N . GLY B 1 19 ? 7.568 10.140 0.631 1.00 0.00 ? 41 GLY B N 9 19
ATOM 9688 C CA . GLY B 1 19 ? 6.372 10.768 0.141 1.00 0.00 ? 41 GLY B CA 9 19
ATOM 9689 C C . GLY B 1 19 ? 5.648 11.589 1.177 1.00 0.00 ? 41 GLY B C 9 19
ATOM 9690 O O . GLY B 1 19 ? 4.920 12.485 0.820 1.00 0.00 ? 41 GLY B O 9 19
ATOM 9691 H H . GLY B 1 19 ? 7.537 9.161 0.797 1.00 0.00 ? 41 GLY B H 9 19
ATOM 9692 H HA2 . GLY B 1 19 ? 6.578 11.395 -0.699 1.00 0.00 ? 41 GLY B HA2 9 19
ATOM 9693 H HA3 . GLY B 1 19 ? 5.706 9.994 -0.186 1.00 0.00 ? 41 GLY B HA3 9 19
ATOM 9694 N N . GLY B 1 20 ? 5.824 11.281 2.449 1.00 0.00 ? 42 GLY B N 9 20
ATOM 9695 C CA . GLY B 1 20 ? 5.281 12.019 3.551 1.00 0.00 ? 42 GLY B CA 9 20
ATOM 9696 C C . GLY B 1 20 ? 3.865 11.700 3.918 1.00 0.00 ? 42 GLY B C 9 20
ATOM 9697 O O . GLY B 1 20 ? 3.161 12.575 4.327 1.00 0.00 ? 42 GLY B O 9 20
ATOM 9698 H H . GLY B 1 20 ? 6.400 10.493 2.617 1.00 0.00 ? 42 GLY B H 9 20
ATOM 9699 H HA2 . GLY B 1 20 ? 5.885 11.871 4.404 1.00 0.00 ? 42 GLY B HA2 9 20
ATOM 9700 H HA3 . GLY B 1 20 ? 5.348 13.066 3.338 1.00 0.00 ? 42 GLY B HA3 9 20
ATOM 9701 N N . TYR B 1 21 ? 3.418 10.459 3.876 1.00 0.00 ? 43 TYR B N 9 21
ATOM 9702 C CA . TYR B 1 21 ? 2.160 9.998 4.350 1.00 0.00 ? 43 TYR B CA 9 21
ATOM 9703 C C . TYR B 1 21 ? 1.929 10.192 5.791 1.00 0.00 ? 43 TYR B C 9 21
ATOM 9704 O O . TYR B 1 21 ? 1.499 9.964 6.214 1.00 0.00 ? 43 TYR B O 9 21
ATOM 9705 C CB . TYR B 1 21 ? 2.033 8.536 3.982 1.00 0.00 ? 43 TYR B CB 9 21
ATOM 9706 C CG . TYR B 1 21 ? 1.538 8.251 2.590 1.00 0.00 ? 43 TYR B CG 9 21
ATOM 9707 C CD1 . TYR B 1 21 ? 0.362 8.802 2.077 1.00 0.00 ? 43 TYR B CD1 9 21
ATOM 9708 C CD2 . TYR B 1 21 ? 2.251 7.307 1.857 1.00 0.00 ? 43 TYR B CD2 9 21
ATOM 9709 C CE1 . TYR B 1 21 ? -0.078 8.423 0.808 1.00 0.00 ? 43 TYR B CE1 9 21
ATOM 9710 C CE2 . TYR B 1 21 ? 1.824 6.917 0.586 1.00 0.00 ? 43 TYR B CE2 9 21
ATOM 9711 C CZ . TYR B 1 21 ? 0.663 7.500 0.052 1.00 0.00 ? 43 TYR B CZ 9 21
ATOM 9712 O OH . TYR B 1 21 ? 0.276 7.232 -1.220 1.00 0.00 ? 43 TYR B OH 9 21
ATOM 9713 H H . TYR B 1 21 ? 4.046 9.771 3.545 1.00 0.00 ? 43 TYR B H 9 21
ATOM 9714 H HA . TYR B 1 21 ? 1.403 10.547 3.844 1.00 0.00 ? 43 TYR B HA 9 21
ATOM 9715 H HB2 . TYR B 1 21 ? 3.010 8.069 4.107 1.00 0.00 ? 43 TYR B HB2 9 21
ATOM 9716 H HB3 . TYR B 1 21 ? 1.352 8.025 4.649 1.00 0.00 ? 43 TYR B HB3 9 21
ATOM 9717 H HD1 . TYR B 1 21 ? -0.192 9.544 2.622 1.00 0.00 ? 43 TYR B HD1 9 21
ATOM 9718 H HD2 . TYR B 1 21 ? 3.119 6.881 2.320 1.00 0.00 ? 43 TYR B HD2 9 21
ATOM 9719 H HE1 . TYR B 1 21 ? -0.960 8.793 0.324 1.00 0.00 ? 43 TYR B HE1 9 21
ATOM 9720 H HE2 . TYR B 1 21 ? 2.436 6.221 0.050 1.00 0.00 ? 43 TYR B HE2 9 21
ATOM 9721 H HH . TYR B 1 21 ? 0.964 7.501 -1.809 1.00 0.00 ? 43 TYR B HH 9 21
HETATM 9722 N N . NH2 B 1 22 ? 2.197 10.670 6.595 1.00 0.00 ? 44 NH2 B N 9 22
HETATM 9723 H HN1 . NH2 B 1 22 ? 2.580 10.903 6.258 1.00 0.00 ? 44 NH2 B HN1 9 22
HETATM 9724 H HN2 . NH2 B 1 22 ? 2.023 10.849 7.524 1.00 0.00 ? 44 NH2 B HN2 9 22
HETATM 9725 C C . ACE C 1 1 ? -7.965 13.273 -3.667 1.00 0.00 ? 45 ACE C C 9 1
HETATM 9726 O O . ACE C 1 1 ? -7.358 14.092 -3.050 1.00 0.00 ? 45 ACE C O 9 1
HETATM 9727 C CH3 . ACE C 1 1 ? -9.176 13.681 -4.419 1.00 0.00 ? 45 ACE C CH3 9 1
HETATM 9728 H H1 . ACE C 1 1 ? -9.638 14.104 -4.276 1.00 0.00 ? 45 ACE C H1 9 1
HETATM 9729 H H2 . ACE C 1 1 ? -9.176 13.920 -4.929 1.00 0.00 ? 45 ACE C H2 9 1
HETATM 9730 H H3 . ACE C 1 1 ? -9.576 13.350 -4.570 1.00 0.00 ? 45 ACE C H3 9 1
ATOM 9731 N N . ALA C 1 2 ? -7.608 12.019 -3.700 1.00 0.00 ? 46 ALA C N 9 2
ATOM 9732 C CA . ALA C 1 2 ? -6.527 11.404 -3.023 1.00 0.00 ? 46 ALA C CA 9 2
ATOM 9733 C C . ALA C 1 2 ? -6.543 11.526 -1.519 1.00 0.00 ? 46 ALA C C 9 2
ATOM 9734 O O . ALA C 1 2 ? -5.627 11.085 -0.861 1.00 0.00 ? 46 ALA C O 9 2
ATOM 9735 C CB . ALA C 1 2 ? -5.251 11.813 -3.681 1.00 0.00 ? 46 ALA C CB 9 2
ATOM 9736 H H . ALA C 1 2 ? -8.188 11.406 -4.173 1.00 0.00 ? 46 ALA C H 9 2
ATOM 9737 H HA . ALA C 1 2 ? -6.604 10.365 -3.161 1.00 0.00 ? 46 ALA C HA 9 2
ATOM 9738 H HB1 . ALA C 1 2 ? -5.223 12.058 -4.268 1.00 0.00 ? 46 ALA C HB1 9 2
ATOM 9739 H HB2 . ALA C 1 2 ? -4.857 12.219 -3.464 1.00 0.00 ? 46 ALA C HB2 9 2
ATOM 9740 H HB3 . ALA C 1 2 ? -4.756 11.445 -3.833 1.00 0.00 ? 46 ALA C HB3 9 2
ATOM 9741 N N . LYS C 1 3 ? -7.591 12.069 -0.909 1.00 0.00 ? 47 LYS C N 9 3
ATOM 9742 C CA . LYS C 1 3 ? -7.753 12.234 0.513 1.00 0.00 ? 47 LYS C CA 9 3
ATOM 9743 C C . LYS C 1 3 ? -7.880 10.933 1.270 1.00 0.00 ? 47 LYS C C 9 3
ATOM 9744 O O . LYS C 1 3 ? -7.647 10.889 2.468 1.00 0.00 ? 47 LYS C O 9 3
ATOM 9745 C CB . LYS C 1 3 ? -9.002 13.032 0.809 1.00 0.00 ? 47 LYS C CB 9 3
ATOM 9746 C CG . LYS C 1 3 ? -9.195 14.324 0.046 1.00 0.00 ? 47 LYS C CG 9 3
ATOM 9747 C CD . LYS C 1 3 ? -8.118 15.341 0.282 1.00 0.00 ? 47 LYS C CD 9 3
ATOM 9748 C CE . LYS C 1 3 ? -8.346 16.568 -0.516 1.00 0.00 ? 47 LYS C CE 9 3
ATOM 9749 N NZ . LYS C 1 3 ? -7.215 17.392 -0.632 1.00 0.00 ? 47 LYS C NZ 9 3
ATOM 9750 H H . LYS C 1 3 ? -8.341 12.316 -1.491 1.00 0.00 ? 47 LYS C H 9 3
ATOM 9751 H HA . LYS C 1 3 ? -6.921 12.775 0.939 1.00 0.00 ? 47 LYS C HA 9 3
ATOM 9752 H HB2 . LYS C 1 3 ? -9.869 12.397 0.624 1.00 0.00 ? 47 LYS C HB2 9 3
ATOM 9753 H HB3 . LYS C 1 3 ? -8.976 13.244 1.860 1.00 0.00 ? 47 LYS C HB3 9 3
ATOM 9754 H HG2 . LYS C 1 3 ? -9.269 14.112 -1.020 1.00 0.00 ? 47 LYS C HG2 9 3
ATOM 9755 H HG3 . LYS C 1 3 ? -10.118 14.755 0.378 1.00 0.00 ? 47 LYS C HG3 9 3
ATOM 9756 H HD2 . LYS C 1 3 ? -8.063 15.587 1.343 1.00 0.00 ? 47 LYS C HD2 9 3
ATOM 9757 H HD3 . LYS C 1 3 ? -7.202 14.945 -0.012 1.00 0.00 ? 47 LYS C HD3 9 3
ATOM 9758 H HE2 . LYS C 1 3 ? -8.674 16.283 -1.515 1.00 0.00 ? 47 LYS C HE2 9 3
ATOM 9759 H HE3 . LYS C 1 3 ? -9.105 17.088 -0.097 1.00 0.00 ? 47 LYS C HE3 9 3
ATOM 9760 H HZ1 . LYS C 1 3 ? -6.674 17.299 -0.245 1.00 0.00 ? 47 LYS C HZ1 9 3
ATOM 9761 H HZ2 . LYS C 1 3 ? -7.285 18.045 -0.557 1.00 0.00 ? 47 LYS C HZ2 9 3
ATOM 9762 H HZ3 . LYS C 1 3 ? -6.880 17.456 -1.204 1.00 0.00 ? 47 LYS C HZ3 9 3
ATOM 9763 N N . ALA C 1 4 ? -8.176 9.848 0.566 1.00 0.00 ? 48 ALA C N 9 4
ATOM 9764 C CA . ALA C 1 4 ? -8.109 8.481 1.019 1.00 0.00 ? 48 ALA C CA 9 4
ATOM 9765 C C . ALA C 1 4 ? -6.771 8.073 1.603 1.00 0.00 ? 48 ALA C C 9 4
ATOM 9766 O O . ALA C 1 4 ? -6.676 6.941 2.050 1.00 0.00 ? 48 ALA C O 9 4
ATOM 9767 C CB . ALA C 1 4 ? -8.463 7.587 -0.157 1.00 0.00 ? 48 ALA C CB 9 4
ATOM 9768 H H . ALA C 1 4 ? -8.423 10.005 -0.389 1.00 0.00 ? 48 ALA C H 9 4
ATOM 9769 H HA . ALA C 1 4 ? -8.852 8.344 1.788 1.00 0.00 ? 48 ALA C HA 9 4
ATOM 9770 H HB1 . ALA C 1 4 ? -9.460 7.779 -0.488 1.00 0.00 ? 48 ALA C HB1 9 4
ATOM 9771 H HB2 . ALA C 1 4 ? -7.812 7.717 -1.001 1.00 0.00 ? 48 ALA C HB2 9 4
ATOM 9772 H HB3 . ALA C 1 4 ? -8.401 6.566 0.144 1.00 0.00 ? 48 ALA C HB3 9 4
ATOM 9773 N N . ALA C 1 5 ? -5.758 8.937 1.573 1.00 0.00 ? 49 ALA C N 9 5
ATOM 9774 C CA . ALA C 1 5 ? -4.371 8.679 1.884 1.00 0.00 ? 49 ALA C CA 9 5
ATOM 9775 C C . ALA C 1 5 ? -4.188 8.187 3.309 1.00 0.00 ? 49 ALA C C 9 5
ATOM 9776 O O . ALA C 1 5 ? -4.272 6.984 3.525 1.00 0.00 ? 49 ALA C O 9 5
ATOM 9777 C CB . ALA C 1 5 ? -3.577 9.909 1.460 1.00 0.00 ? 49 ALA C CB 9 5
ATOM 9778 H H . ALA C 1 5 ? -5.989 9.878 1.322 1.00 0.00 ? 49 ALA C H 9 5
ATOM 9779 H HA . ALA C 1 5 ? -3.998 7.847 1.296 1.00 0.00 ? 49 ALA C HA 9 5
ATOM 9780 H HB1 . ALA C 1 5 ? -4.005 10.803 1.857 1.00 0.00 ? 49 ALA C HB1 9 5
ATOM 9781 H HB2 . ALA C 1 5 ? -2.543 9.812 1.734 1.00 0.00 ? 49 ALA C HB2 9 5
ATOM 9782 H HB3 . ALA C 1 5 ? -3.670 9.945 0.398 1.00 0.00 ? 49 ALA C HB3 9 5
ATOM 9783 N N . ALA C 1 6 ? -3.923 9.030 4.301 1.00 0.00 ? 50 ALA C N 9 6
ATOM 9784 C CA . ALA C 1 6 ? -3.685 8.539 5.638 1.00 0.00 ? 50 ALA C CA 9 6
ATOM 9785 C C . ALA C 1 6 ? -4.822 7.725 6.229 1.00 0.00 ? 50 ALA C C 9 6
ATOM 9786 O O . ALA C 1 6 ? -4.576 6.762 6.939 1.00 0.00 ? 50 ALA C O 9 6
ATOM 9787 C CB . ALA C 1 6 ? -3.247 9.718 6.490 1.00 0.00 ? 50 ALA C CB 9 6
ATOM 9788 H H . ALA C 1 6 ? -3.865 10.006 4.107 1.00 0.00 ? 50 ALA C H 9 6
ATOM 9789 H HA . ALA C 1 6 ? -2.866 7.849 5.496 1.00 0.00 ? 50 ALA C HA 9 6
ATOM 9790 H HB1 . ALA C 1 6 ? -2.431 10.219 6.078 1.00 0.00 ? 50 ALA C HB1 9 6
ATOM 9791 H HB2 . ALA C 1 6 ? -4.038 10.406 6.605 1.00 0.00 ? 50 ALA C HB2 9 6
ATOM 9792 H HB3 . ALA C 1 6 ? -2.916 9.408 7.429 1.00 0.00 ? 50 ALA C HB3 9 6
ATOM 9793 N N . ALA C 1 7 ? -6.066 7.940 5.817 1.00 0.00 ? 51 ALA C N 9 7
ATOM 9794 C CA . ALA C 1 7 ? -7.198 7.132 6.199 1.00 0.00 ? 51 ALA C CA 9 7
ATOM 9795 C C . ALA C 1 7 ? -7.078 5.668 5.829 1.00 0.00 ? 51 ALA C C 9 7
ATOM 9796 O O . ALA C 1 7 ? -7.652 4.841 6.512 1.00 0.00 ? 51 ALA C O 9 7
ATOM 9797 C CB . ALA C 1 7 ? -8.476 7.710 5.634 1.00 0.00 ? 51 ALA C CB 9 7
ATOM 9798 H H . ALA C 1 7 ? -6.166 8.729 5.208 1.00 0.00 ? 51 ALA C H 9 7
ATOM 9799 H HA . ALA C 1 7 ? -7.242 7.147 7.280 1.00 0.00 ? 51 ALA C HA 9 7
ATOM 9800 H HB1 . ALA C 1 7 ? -9.293 7.072 5.822 1.00 0.00 ? 51 ALA C HB1 9 7
ATOM 9801 H HB2 . ALA C 1 7 ? -8.686 8.646 6.103 1.00 0.00 ? 51 ALA C HB2 9 7
ATOM 9802 H HB3 . ALA C 1 7 ? -8.400 7.854 4.581 1.00 0.00 ? 51 ALA C HB3 9 7
ATOM 9803 N N . ALA C 1 8 ? -6.283 5.321 4.824 1.00 0.00 ? 52 ALA C N 9 8
ATOM 9804 C CA . ALA C 1 8 ? -5.820 3.966 4.621 1.00 0.00 ? 52 ALA C CA 9 8
ATOM 9805 C C . ALA C 1 8 ? -4.425 3.784 5.187 1.00 0.00 ? 52 ALA C C 9 8
ATOM 9806 O O . ALA C 1 8 ? -4.171 2.979 6.069 1.00 0.00 ? 52 ALA C O 9 8
ATOM 9807 C CB . ALA C 1 8 ? -5.892 3.600 3.152 1.00 0.00 ? 52 ALA C CB 9 8
ATOM 9808 H H . ALA C 1 8 ? -5.820 6.046 4.319 1.00 0.00 ? 52 ALA C H 9 8
ATOM 9809 H HA . ALA C 1 8 ? -6.448 3.274 5.173 1.00 0.00 ? 52 ALA C HA 9 8
ATOM 9810 H HB1 . ALA C 1 8 ? -5.823 2.527 3.069 1.00 0.00 ? 52 ALA C HB1 9 8
ATOM 9811 H HB2 . ALA C 1 8 ? -6.805 3.980 2.747 1.00 0.00 ? 52 ALA C HB2 9 8
ATOM 9812 H HB3 . ALA C 1 8 ? -5.089 4.021 2.589 1.00 0.00 ? 52 ALA C HB3 9 8
ATOM 9813 N N . ILE C 1 9 ? -3.479 4.535 4.631 1.00 0.00 ? 53 ILE C N 9 9
ATOM 9814 C CA . ILE C 1 9 ? -2.061 4.275 4.721 1.00 0.00 ? 53 ILE C CA 9 9
ATOM 9815 C C . ILE C 1 9 ? -1.549 4.372 6.147 1.00 0.00 ? 53 ILE C C 9 9
ATOM 9816 O O . ILE C 1 9 ? -0.547 3.733 6.443 1.00 0.00 ? 53 ILE C O 9 9
ATOM 9817 C CB . ILE C 1 9 ? -1.292 5.226 3.815 1.00 0.00 ? 53 ILE C CB 9 9
ATOM 9818 C CG1 . ILE C 1 9 ? -1.778 5.281 2.374 1.00 0.00 ? 53 ILE C CG1 9 9
ATOM 9819 C CG2 . ILE C 1 9 ? 0.183 4.865 3.774 1.00 0.00 ? 53 ILE C CG2 9 9
ATOM 9820 C CD1 . ILE C 1 9 ? -1.745 3.974 1.623 1.00 0.00 ? 53 ILE C CD1 9 9
ATOM 9821 H H . ILE C 1 9 ? -3.814 5.221 3.983 1.00 0.00 ? 53 ILE C H 9 9
ATOM 9822 H HA . ILE C 1 9 ? -1.864 3.263 4.395 1.00 0.00 ? 53 ILE C HA 9 9
ATOM 9823 H HB . ILE C 1 9 ? -1.355 6.209 4.270 1.00 0.00 ? 53 ILE C HB 9 9
ATOM 9824 H HG12 . ILE C 1 9 ? -2.805 5.647 2.377 1.00 0.00 ? 53 ILE C HG12 9 9
ATOM 9825 H HG13 . ILE C 1 9 ? -1.206 5.998 1.827 1.00 0.00 ? 53 ILE C HG13 9 9
ATOM 9826 H HG21 . ILE C 1 9 ? 0.643 5.184 4.690 1.00 0.00 ? 53 ILE C HG21 9 9
ATOM 9827 H HG22 . ILE C 1 9 ? 0.296 3.810 3.659 1.00 0.00 ? 53 ILE C HG22 9 9
ATOM 9828 H HG23 . ILE C 1 9 ? 0.681 5.359 2.959 1.00 0.00 ? 53 ILE C HG23 9 9
ATOM 9829 H HD11 . ILE C 1 9 ? -0.763 3.635 1.540 1.00 0.00 ? 53 ILE C HD11 9 9
ATOM 9830 H HD12 . ILE C 1 9 ? -2.358 3.250 2.092 1.00 0.00 ? 53 ILE C HD12 9 9
ATOM 9831 H HD13 . ILE C 1 9 ? -2.126 4.159 0.647 1.00 0.00 ? 53 ILE C HD13 9 9
ATOM 9832 N N . LYS C 1 10 ? -2.194 5.132 7.031 1.00 0.00 ? 54 LYS C N 9 10
ATOM 9833 C CA . LYS C 1 10 ? -1.726 5.347 8.377 1.00 0.00 ? 54 LYS C CA 9 10
ATOM 9834 C C . LYS C 1 10 ? -2.020 4.142 9.250 1.00 0.00 ? 54 LYS C C 9 10
ATOM 9835 O O . LYS C 1 10 ? -1.190 3.751 10.052 1.00 0.00 ? 54 LYS C O 9 10
ATOM 9836 C CB . LYS C 1 10 ? -2.404 6.624 8.853 1.00 0.00 ? 54 LYS C CB 9 10
ATOM 9837 C CG . LYS C 1 10 ? -1.685 7.495 9.867 1.00 0.00 ? 54 LYS C CG 9 10
ATOM 9838 C CD . LYS C 1 10 ? -1.698 6.996 11.234 1.00 0.00 ? 54 LYS C CD 9 10
ATOM 9839 C CE . LYS C 1 10 ? -0.956 7.907 12.161 1.00 0.00 ? 54 LYS C CE 9 10
ATOM 9840 N NZ . LYS C 1 10 ? -1.429 8.039 13.196 1.00 0.00 ? 54 LYS C NZ 9 10
ATOM 9841 H H . LYS C 1 10 ? -3.065 5.549 6.760 1.00 0.00 ? 54 LYS C H 9 10
ATOM 9842 H HA . LYS C 1 10 ? -0.652 5.475 8.401 1.00 0.00 ? 54 LYS C HA 9 10
ATOM 9843 H HB2 . LYS C 1 10 ? -2.564 7.243 7.970 1.00 0.00 ? 54 LYS C HB2 9 10
ATOM 9844 H HB3 . LYS C 1 10 ? -3.401 6.379 9.193 1.00 0.00 ? 54 LYS C HB3 9 10
ATOM 9845 H HG2 . LYS C 1 10 ? -0.650 7.612 9.547 1.00 0.00 ? 54 LYS C HG2 9 10
ATOM 9846 H HG3 . LYS C 1 10 ? -2.103 8.448 9.896 1.00 0.00 ? 54 LYS C HG3 9 10
ATOM 9847 H HD2 . LYS C 1 10 ? -2.724 6.868 11.578 1.00 0.00 ? 54 LYS C HD2 9 10
ATOM 9848 H HD3 . LYS C 1 10 ? -1.244 6.090 11.229 1.00 0.00 ? 54 LYS C HD3 9 10
ATOM 9849 H HE2 . LYS C 1 10 ? 0.042 7.492 12.301 1.00 0.00 ? 54 LYS C HE2 9 10
ATOM 9850 H HE3 . LYS C 1 10 ? -0.820 8.655 11.877 1.00 0.00 ? 54 LYS C HE3 9 10
ATOM 9851 H HZ1 . LYS C 1 10 ? -2.231 8.208 13.059 1.00 0.00 ? 54 LYS C HZ1 9 10
ATOM 9852 H HZ2 . LYS C 1 10 ? -0.961 8.685 13.784 1.00 0.00 ? 54 LYS C HZ2 9 10
ATOM 9853 H HZ3 . LYS C 1 10 ? -1.478 7.322 13.556 1.00 0.00 ? 54 LYS C HZ3 9 10
ATOM 9854 N N . ALA C 1 11 ? -3.151 3.486 9.038 1.00 0.00 ? 55 ALA C N 9 11
ATOM 9855 C CA . ALA C 1 11 ? -3.381 2.137 9.498 1.00 0.00 ? 55 ALA C CA 9 11
ATOM 9856 C C . ALA C 1 11 ? -2.504 1.118 8.798 1.00 0.00 ? 55 ALA C C 9 11
ATOM 9857 O O . ALA C 1 11 ? -1.815 0.348 9.448 1.00 0.00 ? 55 ALA C O 9 11
ATOM 9858 C CB . ALA C 1 11 ? -4.851 1.818 9.327 1.00 0.00 ? 55 ALA C CB 9 11
ATOM 9859 H H . ALA C 1 11 ? -3.816 3.882 8.407 1.00 0.00 ? 55 ALA C H 9 11
ATOM 9860 H HA . ALA C 1 11 ? -3.140 2.080 10.548 1.00 0.00 ? 55 ALA C HA 9 11
ATOM 9861 H HB1 . ALA C 1 11 ? -5.159 1.940 8.330 1.00 0.00 ? 55 ALA C HB1 9 11
ATOM 9862 H HB2 . ALA C 1 11 ? -5.015 0.802 9.600 1.00 0.00 ? 55 ALA C HB2 9 11
ATOM 9863 H HB3 . ALA C 1 11 ? -5.411 2.475 9.935 1.00 0.00 ? 55 ALA C HB3 9 11
ATOM 9864 N N . ILE C 1 12 ? -2.390 1.162 7.472 1.00 0.00 ? 56 ILE C N 9 12
ATOM 9865 C CA . ILE C 1 12 ? -1.732 0.133 6.698 1.00 0.00 ? 56 ILE C CA 9 12
ATOM 9866 C C . ILE C 1 12 ? -0.242 0.108 6.993 1.00 0.00 ? 56 ILE C C 9 12
ATOM 9867 O O . ILE C 1 12 ? 0.321 -0.967 7.165 1.00 0.00 ? 56 ILE C O 9 12
ATOM 9868 C CB . ILE C 1 12 ? -2.165 0.112 5.242 1.00 0.00 ? 56 ILE C CB 9 12
ATOM 9869 C CG1 . ILE C 1 12 ? -3.377 -0.772 5.030 1.00 0.00 ? 56 ILE C CG1 9 12
ATOM 9870 C CG2 . ILE C 1 12 ? -1.078 -0.336 4.301 1.00 0.00 ? 56 ILE C CG2 9 12
ATOM 9871 C CD1 . ILE C 1 12 ? -4.697 -0.254 5.510 1.00 0.00 ? 56 ILE C CD1 9 12
ATOM 9872 H H . ILE C 1 12 ? -2.850 1.913 6.998 1.00 0.00 ? 56 ILE C H 9 12
ATOM 9873 H HA . ILE C 1 12 ? -2.019 -0.831 7.104 1.00 0.00 ? 56 ILE C HA 9 12
ATOM 9874 H HB . ILE C 1 12 ? -2.407 1.102 4.900 1.00 0.00 ? 56 ILE C HB 9 12
ATOM 9875 H HG12 . ILE C 1 12 ? -3.467 -0.958 3.960 1.00 0.00 ? 56 ILE C HG12 9 12
ATOM 9876 H HG13 . ILE C 1 12 ? -3.193 -1.723 5.474 1.00 0.00 ? 56 ILE C HG13 9 12
ATOM 9877 H HG21 . ILE C 1 12 ? -0.723 -1.298 4.571 1.00 0.00 ? 56 ILE C HG21 9 12
ATOM 9878 H HG22 . ILE C 1 12 ? -1.449 -0.284 3.309 1.00 0.00 ? 56 ILE C HG22 9 12
ATOM 9879 H HG23 . ILE C 1 12 ? -0.232 0.307 4.364 1.00 0.00 ? 56 ILE C HG23 9 12
ATOM 9880 H HD11 . ILE C 1 12 ? -4.673 -0.123 6.570 1.00 0.00 ? 56 ILE C HD11 9 12
ATOM 9881 H HD12 . ILE C 1 12 ? -4.934 0.661 5.026 1.00 0.00 ? 56 ILE C HD12 9 12
ATOM 9882 H HD13 . ILE C 1 12 ? -5.498 -0.922 5.262 1.00 0.00 ? 56 ILE C HD13 9 12
ATOM 9883 N N . ALA C 1 13 ? 0.412 1.252 7.155 1.00 0.00 ? 57 ALA C N 9 13
ATOM 9884 C CA . ALA C 1 13 ? 1.817 1.302 7.490 1.00 0.00 ? 57 ALA C CA 9 13
ATOM 9885 C C . ALA C 1 13 ? 2.156 0.736 8.858 1.00 0.00 ? 57 ALA C C 9 13
ATOM 9886 O O . ALA C 1 13 ? 3.270 0.302 9.079 1.00 0.00 ? 57 ALA C O 9 13
ATOM 9887 C CB . ALA C 1 13 ? 2.291 2.736 7.356 1.00 0.00 ? 57 ALA C CB 9 13
ATOM 9888 H H . ALA C 1 13 ? -0.151 2.075 7.063 1.00 0.00 ? 57 ALA C H 9 13
ATOM 9889 H HA . ALA C 1 13 ? 2.361 0.711 6.763 1.00 0.00 ? 57 ALA C HA 9 13
ATOM 9890 H HB1 . ALA C 1 13 ? 2.145 3.082 6.355 1.00 0.00 ? 57 ALA C HB1 9 13
ATOM 9891 H HB2 . ALA C 1 13 ? 1.744 3.383 8.006 1.00 0.00 ? 57 ALA C HB2 9 13
ATOM 9892 H HB3 . ALA C 1 13 ? 3.350 2.804 7.561 1.00 0.00 ? 57 ALA C HB3 9 13
ATOM 9893 N N . ALA C 1 14 ? 1.184 0.678 9.759 1.00 0.00 ? 58 ALA C N 9 14
ATOM 9894 C CA . ALA C 1 14 ? 1.306 0.030 11.038 1.00 0.00 ? 58 ALA C CA 9 14
ATOM 9895 C C . ALA C 1 14 ? 0.966 -1.448 11.020 1.00 0.00 ? 58 ALA C C 9 14
ATOM 9896 O O . ALA C 1 14 ? 1.625 -2.263 11.629 1.00 0.00 ? 58 ALA C O 9 14
ATOM 9897 C CB . ALA C 1 14 ? 0.455 0.768 12.046 1.00 0.00 ? 58 ALA C CB 9 14
ATOM 9898 H H . ALA C 1 14 ? 0.279 0.948 9.423 1.00 0.00 ? 58 ALA C H 9 14
ATOM 9899 H HA . ALA C 1 14 ? 2.333 0.109 11.358 1.00 0.00 ? 58 ALA C HA 9 14
ATOM 9900 H HB1 . ALA C 1 14 ? 0.801 1.776 12.127 1.00 0.00 ? 58 ALA C HB1 9 14
ATOM 9901 H HB2 . ALA C 1 14 ? -0.574 0.752 11.767 1.00 0.00 ? 58 ALA C HB2 9 14
ATOM 9902 H HB3 . ALA C 1 14 ? 0.541 0.309 13.006 1.00 0.00 ? 58 ALA C HB3 9 14
ATOM 9903 N N . ILE C 1 15 ? -0.033 -1.821 10.229 1.00 0.00 ? 59 ILE C N 9 15
ATOM 9904 C CA . ILE C 1 15 ? -0.364 -3.176 9.855 1.00 0.00 ? 59 ILE C CA 9 15
ATOM 9905 C C . ILE C 1 15 ? 0.797 -3.827 9.127 1.00 0.00 ? 59 ILE C C 9 15
ATOM 9906 O O . ILE C 1 15 ? 1.098 -4.982 9.375 1.00 0.00 ? 59 ILE C O 9 15
ATOM 9907 C CB . ILE C 1 15 ? -1.654 -3.169 9.048 1.00 0.00 ? 59 ILE C CB 9 15
ATOM 9908 C CG1 . ILE C 1 15 ? -2.856 -2.868 9.918 1.00 0.00 ? 59 ILE C CG1 9 15
ATOM 9909 C CG2 . ILE C 1 15 ? -1.907 -4.442 8.256 1.00 0.00 ? 59 ILE C CG2 9 15
ATOM 9910 C CD1 . ILE C 1 15 ? -4.029 -2.265 9.187 1.00 0.00 ? 59 ILE C CD1 9 15
ATOM 9911 H H . ILE C 1 15 ? -0.490 -1.051 9.778 1.00 0.00 ? 59 ILE C H 9 15
ATOM 9912 H HA . ILE C 1 15 ? -0.552 -3.770 10.739 1.00 0.00 ? 59 ILE C HA 9 15
ATOM 9913 H HB . ILE C 1 15 ? -1.561 -2.366 8.334 1.00 0.00 ? 59 ILE C HB 9 15
ATOM 9914 H HG12 . ILE C 1 15 ? -3.176 -3.785 10.412 1.00 0.00 ? 59 ILE C HG12 9 15
ATOM 9915 H HG13 . ILE C 1 15 ? -2.559 -2.171 10.677 1.00 0.00 ? 59 ILE C HG13 9 15
ATOM 9916 H HG21 . ILE C 1 15 ? -1.150 -4.582 7.509 1.00 0.00 ? 59 ILE C HG21 9 15
ATOM 9917 H HG22 . ILE C 1 15 ? -1.930 -5.325 8.870 1.00 0.00 ? 59 ILE C HG22 9 15
ATOM 9918 H HG23 . ILE C 1 15 ? -2.849 -4.342 7.744 1.00 0.00 ? 59 ILE C HG23 9 15
ATOM 9919 H HD11 . ILE C 1 15 ? -4.262 -2.620 8.422 1.00 0.00 ? 59 ILE C HD11 9 15
ATOM 9920 H HD12 . ILE C 1 15 ? -4.782 -2.299 9.658 1.00 0.00 ? 59 ILE C HD12 9 15
ATOM 9921 H HD13 . ILE C 1 15 ? -3.938 -1.414 9.006 1.00 0.00 ? 59 ILE C HD13 9 15
ATOM 9922 N N . ILE C 1 16 ? 1.550 -3.098 8.312 1.00 0.00 ? 60 ILE C N 9 16
ATOM 9923 C CA . ILE C 1 16 ? 2.786 -3.551 7.719 1.00 0.00 ? 60 ILE C CA 9 16
ATOM 9924 C C . ILE C 1 16 ? 3.820 -3.951 8.750 1.00 0.00 ? 60 ILE C C 9 16
ATOM 9925 O O . ILE C 1 16 ? 4.330 -5.065 8.729 1.00 0.00 ? 60 ILE C O 9 16
ATOM 9926 C CB . ILE C 1 16 ? 3.294 -2.533 6.709 1.00 0.00 ? 60 ILE C CB 9 16
ATOM 9927 C CG1 . ILE C 1 16 ? 2.447 -2.649 5.450 1.00 0.00 ? 60 ILE C CG1 9 16
ATOM 9928 C CG2 . ILE C 1 16 ? 4.773 -2.606 6.382 1.00 0.00 ? 60 ILE C CG2 9 16
ATOM 9929 C CD1 . ILE C 1 16 ? 2.880 -1.846 4.240 1.00 0.00 ? 60 ILE C CD1 9 16
ATOM 9930 H H . ILE C 1 16 ? 1.183 -2.191 8.099 1.00 0.00 ? 60 ILE C H 9 16
ATOM 9931 H HA . ILE C 1 16 ? 2.539 -4.456 7.173 1.00 0.00 ? 60 ILE C HA 9 16
ATOM 9932 H HB . ILE C 1 16 ? 3.131 -1.558 7.152 1.00 0.00 ? 60 ILE C HB 9 16
ATOM 9933 H HG12 . ILE C 1 16 ? 2.392 -3.700 5.167 1.00 0.00 ? 60 ILE C HG12 9 16
ATOM 9934 H HG13 . ILE C 1 16 ? 1.457 -2.311 5.704 1.00 0.00 ? 60 ILE C HG13 9 16
ATOM 9935 H HG21 . ILE C 1 16 ? 5.007 -3.490 5.849 1.00 0.00 ? 60 ILE C HG21 9 16
ATOM 9936 H HG22 . ILE C 1 16 ? 5.101 -1.744 5.836 1.00 0.00 ? 60 ILE C HG22 9 16
ATOM 9937 H HG23 . ILE C 1 16 ? 5.361 -2.606 7.266 1.00 0.00 ? 60 ILE C HG23 9 16
ATOM 9938 H HD11 . ILE C 1 16 ? 3.819 -2.258 3.909 1.00 0.00 ? 60 ILE C HD11 9 16
ATOM 9939 H HD12 . ILE C 1 16 ? 2.150 -1.958 3.465 1.00 0.00 ? 60 ILE C HD12 9 16
ATOM 9940 H HD13 . ILE C 1 16 ? 2.966 -0.808 4.514 1.00 0.00 ? 60 ILE C HD13 9 16
ATOM 9941 N N . LYS C 1 17 ? 4.118 -3.034 9.666 1.00 0.00 ? 61 LYS C N 9 17
ATOM 9942 C CA . LYS C 1 17 ? 5.078 -3.204 10.727 1.00 0.00 ? 61 LYS C CA 9 17
ATOM 9943 C C . LYS C 1 17 ? 4.772 -4.424 11.575 1.00 0.00 ? 61 LYS C C 9 17
ATOM 9944 O O . LYS C 1 17 ? 5.665 -5.163 11.920 1.00 0.00 ? 61 LYS C O 9 17
ATOM 9945 C CB . LYS C 1 17 ? 5.154 -1.936 11.546 1.00 0.00 ? 61 LYS C CB 9 17
ATOM 9946 C CG . LYS C 1 17 ? 6.174 -1.878 12.664 1.00 0.00 ? 61 LYS C CG 9 17
ATOM 9947 C CD . LYS C 1 17 ? 7.608 -1.819 12.209 1.00 0.00 ? 61 LYS C CD 9 17
ATOM 9948 C CE . LYS C 1 17 ? 8.267 -3.140 12.007 1.00 0.00 ? 61 LYS C CE 9 17
ATOM 9949 N NZ . LYS C 1 17 ? 9.651 -3.011 11.669 1.00 0.00 ? 61 LYS C NZ 9 17
ATOM 9950 H H . LYS C 1 17 ? 3.661 -2.152 9.540 1.00 0.00 ? 61 LYS C H 9 17
ATOM 9951 H HA . LYS C 1 17 ? 6.028 -3.433 10.275 1.00 0.00 ? 61 LYS C HA 9 17
ATOM 9952 H HB2 . LYS C 1 17 ? 5.324 -1.095 10.873 1.00 0.00 ? 61 LYS C HB2 9 17
ATOM 9953 H HB3 . LYS C 1 17 ? 4.195 -1.827 12.006 1.00 0.00 ? 61 LYS C HB3 9 17
ATOM 9954 H HG2 . LYS C 1 17 ? 5.971 -0.994 13.269 1.00 0.00 ? 61 LYS C HG2 9 17
ATOM 9955 H HG3 . LYS C 1 17 ? 6.030 -2.718 13.310 1.00 0.00 ? 61 LYS C HG3 9 17
ATOM 9956 H HD2 . LYS C 1 17 ? 7.668 -1.245 11.285 1.00 0.00 ? 61 LYS C HD2 9 17
ATOM 9957 H HD3 . LYS C 1 17 ? 8.144 -1.310 12.958 1.00 0.00 ? 61 LYS C HD3 9 17
ATOM 9958 H HE2 . LYS C 1 17 ? 8.163 -3.746 12.908 1.00 0.00 ? 61 LYS C HE2 9 17
ATOM 9959 H HE3 . LYS C 1 17 ? 7.789 -3.627 11.239 1.00 0.00 ? 61 LYS C HE3 9 17
ATOM 9960 H HZ1 . LYS C 1 17 ? 9.846 -2.681 11.012 1.00 0.00 ? 61 LYS C HZ1 9 17
ATOM 9961 H HZ2 . LYS C 1 17 ? 10.104 -2.610 12.114 1.00 0.00 ? 61 LYS C HZ2 9 17
ATOM 9962 H HZ3 . LYS C 1 17 ? 10.046 -3.654 11.637 1.00 0.00 ? 61 LYS C HZ3 9 17
ATOM 9963 N N . ALA C 1 18 ? 3.507 -4.668 11.867 1.00 0.00 ? 62 ALA C N 9 18
ATOM 9964 C CA . ALA C 1 18 ? 3.024 -5.826 12.582 1.00 0.00 ? 62 ALA C CA 9 18
ATOM 9965 C C . ALA C 1 18 ? 2.894 -7.050 11.695 1.00 0.00 ? 62 ALA C C 9 18
ATOM 9966 O O . ALA C 1 18 ? 2.893 -8.152 12.188 1.00 0.00 ? 62 ALA C O 9 18
ATOM 9967 C CB . ALA C 1 18 ? 1.705 -5.464 13.246 1.00 0.00 ? 62 ALA C CB 9 18
ATOM 9968 H H . ALA C 1 18 ? 2.831 -4.010 11.529 1.00 0.00 ? 62 ALA C H 9 18
ATOM 9969 H HA . ALA C 1 18 ? 3.734 -6.057 13.367 1.00 0.00 ? 62 ALA C HA 9 18
ATOM 9970 H HB1 . ALA C 1 18 ? 1.318 -6.273 13.793 1.00 0.00 ? 62 ALA C HB1 9 18
ATOM 9971 H HB2 . ALA C 1 18 ? 1.846 -4.609 13.858 1.00 0.00 ? 62 ALA C HB2 9 18
ATOM 9972 H HB3 . ALA C 1 18 ? 0.969 -5.287 12.498 1.00 0.00 ? 62 ALA C HB3 9 18
ATOM 9973 N N . GLY C 1 19 ? 2.773 -6.902 10.388 1.00 0.00 ? 63 GLY C N 9 19
ATOM 9974 C CA . GLY C 1 19 ? 2.590 -7.925 9.392 1.00 0.00 ? 63 GLY C CA 9 19
ATOM 9975 C C . GLY C 1 19 ? 3.802 -8.791 9.164 1.00 0.00 ? 63 GLY C C 9 19
ATOM 9976 O O . GLY C 1 19 ? 3.644 -9.886 8.772 1.00 0.00 ? 63 GLY C O 9 19
ATOM 9977 H H . GLY C 1 19 ? 2.698 -5.967 10.057 1.00 0.00 ? 63 GLY C H 9 19
ATOM 9978 H HA2 . GLY C 1 19 ? 1.762 -8.560 9.648 1.00 0.00 ? 63 GLY C HA2 9 19
ATOM 9979 H HA3 . GLY C 1 19 ? 2.320 -7.483 8.448 1.00 0.00 ? 63 GLY C HA3 9 19
ATOM 9980 N N . GLY C 1 20 ? 4.999 -8.291 9.345 1.00 0.00 ? 64 GLY C N 9 20
ATOM 9981 C CA . GLY C 1 20 ? 6.217 -9.003 9.064 1.00 0.00 ? 64 GLY C CA 9 20
ATOM 9982 C C . GLY C 1 20 ? 6.748 -8.866 7.658 1.00 0.00 ? 64 GLY C C 9 20
ATOM 9983 O O . GLY C 1 20 ? 7.601 -9.624 7.235 1.00 0.00 ? 64 GLY C O 9 20
ATOM 9984 H H . GLY C 1 20 ? 5.029 -7.358 9.659 1.00 0.00 ? 64 GLY C H 9 20
ATOM 9985 H HA2 . GLY C 1 20 ? 6.976 -8.675 9.744 1.00 0.00 ? 64 GLY C HA2 9 20
ATOM 9986 H HA3 . GLY C 1 20 ? 6.072 -10.035 9.294 1.00 0.00 ? 64 GLY C HA3 9 20
ATOM 9987 N N . TYR C 1 21 ? 6.266 -7.874 6.920 1.00 0.00 ? 65 TYR C N 9 21
ATOM 9988 C CA . TYR C 1 21 ? 6.657 -7.523 5.586 1.00 0.00 ? 65 TYR C CA 9 21
ATOM 9989 C C . TYR C 1 21 ? 8.102 -7.115 5.420 1.00 0.00 ? 65 TYR C C 9 21
ATOM 9990 O O . TYR C 1 21 ? 8.614 -7.239 4.336 1.00 0.00 ? 65 TYR C O 9 21
ATOM 9991 C CB . TYR C 1 21 ? 5.752 -6.379 5.168 1.00 0.00 ? 65 TYR C CB 9 21
ATOM 9992 C CG . TYR C 1 21 ? 4.425 -6.709 4.534 1.00 0.00 ? 65 TYR C CG 9 21
ATOM 9993 C CD1 . TYR C 1 21 ? 4.350 -7.341 3.295 1.00 0.00 ? 65 TYR C CD1 9 21
ATOM 9994 C CD2 . TYR C 1 21 ? 3.277 -6.235 5.164 1.00 0.00 ? 65 TYR C CD2 9 21
ATOM 9995 C CE1 . TYR C 1 21 ? 3.105 -7.433 2.669 1.00 0.00 ? 65 TYR C CE1 9 21
ATOM 9996 C CE2 . TYR C 1 21 ? 2.031 -6.301 4.537 1.00 0.00 ? 65 TYR C CE2 9 21
ATOM 9997 C CZ . TYR C 1 21 ? 1.964 -6.891 3.270 1.00 0.00 ? 65 TYR C CZ 9 21
ATOM 9998 O OH . TYR C 1 21 ? 0.758 -6.952 2.650 1.00 0.00 ? 65 TYR C OH 9 21
ATOM 9999 H H . TYR C 1 21 ? 5.609 -7.271 7.319 1.00 0.00 ? 65 TYR C H 9 21
ATOM 10000 H HA . TYR C 1 21 ? 6.480 -8.348 4.915 1.00 0.00 ? 65 TYR C HA 9 21
ATOM 10001 H HB2 . TYR C 1 21 ? 5.551 -5.783 6.059 1.00 0.00 ? 65 TYR C HB2 9 21
ATOM 10002 H HB3 . TYR C 1 21 ? 6.284 -5.731 4.485 1.00 0.00 ? 65 TYR C HB3 9 21
ATOM 10003 H HD1 . TYR C 1 21 ? 5.236 -7.700 2.818 1.00 0.00 ? 65 TYR C HD1 9 21
ATOM 10004 H HD2 . TYR C 1 21 ? 3.398 -5.758 6.115 1.00 0.00 ? 65 TYR C HD2 9 21
ATOM 10005 H HE1 . TYR C 1 21 ? 3.005 -7.863 1.700 1.00 0.00 ? 65 TYR C HE1 9 21
ATOM 10006 H HE2 . TYR C 1 21 ? 1.176 -5.904 5.039 1.00 0.00 ? 65 TYR C HE2 9 21
ATOM 10007 H HH . TYR C 1 21 ? 0.157 -7.345 3.242 1.00 0.00 ? 65 TYR C HH 9 21
HETATM 10008 N N . NH2 C 1 22 ? 8.778 -6.651 6.444 1.00 0.00 ? 66 NH2 C N 9 22
HETATM 10009 H HN1 . NH2 C 1 22 ? 9.709 -6.388 6.299 1.00 0.00 ? 66 NH2 C HN1 9 22
HETATM 10010 H HN2 . NH2 C 1 22 ? 8.389 -6.607 7.328 1.00 0.00 ? 66 NH2 C HN2 9 22
HETATM 10011 C C . ACE D 1 1 ? 7.125 -13.018 5.348 1.00 0.00 ? 67 ACE D C 9 1
HETATM 10012 O O . ACE D 1 1 ? 6.887 -13.905 4.548 1.00 0.00 ? 67 ACE D O 9 1
HETATM 10013 C CH3 . ACE D 1 1 ? 7.982 -13.325 6.537 1.00 0.00 ? 67 ACE D CH3 9 1
HETATM 10014 H H1 . ACE D 1 1 ? 8.530 -13.714 6.437 1.00 0.00 ? 67 ACE D H1 9 1
HETATM 10015 H H2 . ACE D 1 1 ? 7.733 -13.680 7.027 1.00 0.00 ? 67 ACE D H2 9 1
HETATM 10016 H H3 . ACE D 1 1 ? 8.272 -12.858 6.929 1.00 0.00 ? 67 ACE D H3 9 1
ATOM 10017 N N . ALA D 1 2 ? 6.706 -11.766 5.228 1.00 0.00 ? 68 ALA D N 9 2
ATOM 10018 C CA . ALA D 1 2 ? 5.811 -11.239 4.237 1.00 0.00 ? 68 ALA D CA 9 2
ATOM 10019 C C . ALA D 1 2 ? 4.490 -11.951 4.029 1.00 0.00 ? 68 ALA D C 9 2
ATOM 10020 O O . ALA D 1 2 ? 3.810 -11.704 3.063 1.00 0.00 ? 68 ALA D O 9 2
ATOM 10021 C CB . ALA D 1 2 ? 6.606 -11.027 2.970 1.00 0.00 ? 68 ALA D CB 9 2
ATOM 10022 H H . ALA D 1 2 ? 6.978 -11.146 5.945 1.00 0.00 ? 68 ALA D H 9 2
ATOM 10023 H HA . ALA D 1 2 ? 5.540 -10.254 4.577 1.00 0.00 ? 68 ALA D HA 9 2
ATOM 10024 H HB1 . ALA D 1 2 ? 6.022 -10.520 2.275 1.00 0.00 ? 68 ALA D HB1 9 2
ATOM 10025 H HB2 . ALA D 1 2 ? 7.465 -10.484 3.179 1.00 0.00 ? 68 ALA D HB2 9 2
ATOM 10026 H HB3 . ALA D 1 2 ? 6.916 -11.937 2.551 1.00 0.00 ? 68 ALA D HB3 9 2
ATOM 10027 N N . LYS D 1 3 ? 4.054 -12.782 4.955 1.00 0.00 ? 69 LYS D N 9 3
ATOM 10028 C CA . LYS D 1 3 ? 2.808 -13.503 4.869 1.00 0.00 ? 69 LYS D CA 9 3
ATOM 10029 C C . LYS D 1 3 ? 1.587 -12.610 4.997 1.00 0.00 ? 69 LYS D C 9 3
ATOM 10030 O O . LYS D 1 3 ? 0.513 -13.008 4.588 1.00 0.00 ? 69 LYS D O 9 3
ATOM 10031 C CB . LYS D 1 3 ? 2.700 -14.549 5.962 1.00 0.00 ? 69 LYS D CB 9 3
ATOM 10032 C CG . LYS D 1 3 ? 3.816 -15.562 5.963 1.00 0.00 ? 69 LYS D CG 9 3
ATOM 10033 C CD . LYS D 1 3 ? 3.774 -16.627 5.945 1.00 0.00 ? 69 LYS D CD 9 3
ATOM 10034 C CE . LYS D 1 3 ? 4.961 -17.538 5.976 1.00 0.00 ? 69 LYS D CE 9 3
ATOM 10035 N NZ . LYS D 1 3 ? 5.494 -17.852 6.901 1.00 0.00 ? 69 LYS D NZ 9 3
ATOM 10036 H H . LYS D 1 3 ? 4.664 -12.908 5.734 1.00 0.00 ? 69 LYS D H 9 3
ATOM 10037 H HA . LYS D 1 3 ? 2.702 -14.008 3.923 1.00 0.00 ? 69 LYS D HA 9 3
ATOM 10038 H HB2 . LYS D 1 3 ? 2.668 -14.051 6.931 1.00 0.00 ? 69 LYS D HB2 9 3
ATOM 10039 H HB3 . LYS D 1 3 ? 1.775 -15.077 5.833 1.00 0.00 ? 69 LYS D HB3 9 3
ATOM 10040 H HG2 . LYS D 1 3 ? 4.418 -15.298 5.094 1.00 0.00 ? 69 LYS D HG2 9 3
ATOM 10041 H HG3 . LYS D 1 3 ? 4.280 -15.579 6.510 1.00 0.00 ? 69 LYS D HG3 9 3
ATOM 10042 H HD2 . LYS D 1 3 ? 3.170 -16.915 6.805 1.00 0.00 ? 69 LYS D HD2 9 3
ATOM 10043 H HD3 . LYS D 1 3 ? 3.303 -16.660 5.360 1.00 0.00 ? 69 LYS D HD3 9 3
ATOM 10044 H HE2 . LYS D 1 3 ? 4.630 -18.466 5.510 1.00 0.00 ? 69 LYS D HE2 9 3
ATOM 10045 H HE3 . LYS D 1 3 ? 5.545 -17.305 5.539 1.00 0.00 ? 69 LYS D HE3 9 3
ATOM 10046 H HZ1 . LYS D 1 3 ? 5.613 -17.197 7.268 1.00 0.00 ? 69 LYS D HZ1 9 3
ATOM 10047 H HZ2 . LYS D 1 3 ? 6.279 -18.381 6.784 1.00 0.00 ? 69 LYS D HZ2 9 3
ATOM 10048 H HZ3 . LYS D 1 3 ? 5.034 -18.193 7.328 1.00 0.00 ? 69 LYS D HZ3 9 3
ATOM 10049 N N . ALA D 1 4 ? 1.759 -11.383 5.485 1.00 0.00 ? 70 ALA D N 9 4
ATOM 10050 C CA . ALA D 1 4 ? 0.833 -10.283 5.546 1.00 0.00 ? 70 ALA D CA 9 4
ATOM 10051 C C . ALA D 1 4 ? 0.246 -9.858 4.215 1.00 0.00 ? 70 ALA D C 9 4
ATOM 10052 O O . ALA D 1 4 ? -0.557 -8.939 4.162 1.00 0.00 ? 70 ALA D O 9 4
ATOM 10053 C CB . ALA D 1 4 ? 1.555 -9.129 6.210 1.00 0.00 ? 70 ALA D CB 9 4
ATOM 10054 H H . ALA D 1 4 ? 2.695 -11.202 5.783 1.00 0.00 ? 70 ALA D H 9 4
ATOM 10055 H HA . ALA D 1 4 ? 0.008 -10.552 6.190 1.00 0.00 ? 70 ALA D HA 9 4
ATOM 10056 H HB1 . ALA D 1 4 ? 1.789 -9.412 7.204 1.00 0.00 ? 70 ALA D HB1 9 4
ATOM 10057 H HB2 . ALA D 1 4 ? 2.454 -8.847 5.704 1.00 0.00 ? 70 ALA D HB2 9 4
ATOM 10058 H HB3 . ALA D 1 4 ? 0.893 -8.288 6.232 1.00 0.00 ? 70 ALA D HB3 9 4
ATOM 10059 N N . ALA D 1 5 ? 0.651 -10.517 3.133 1.00 0.00 ? 71 ALA D N 9 5
ATOM 10060 C CA . ALA D 1 5 ? 0.420 -10.175 1.751 1.00 0.00 ? 71 ALA D CA 9 5
ATOM 10061 C C . ALA D 1 5 ? -0.896 -10.653 1.169 1.00 0.00 ? 71 ALA D C 9 5
ATOM 10062 O O . ALA D 1 5 ? -1.132 -10.562 -0.022 1.00 0.00 ? 71 ALA D O 9 5
ATOM 10063 C CB . ALA D 1 5 ? 1.620 -10.677 0.973 1.00 0.00 ? 71 ALA D CB 9 5
ATOM 10064 H H . ALA D 1 5 ? 1.164 -11.349 3.335 1.00 0.00 ? 71 ALA D H 9 5
ATOM 10065 H HA . ALA D 1 5 ? 0.356 -9.102 1.645 1.00 0.00 ? 71 ALA D HA 9 5
ATOM 10066 H HB1 . ALA D 1 5 ? 1.493 -10.384 -0.050 1.00 0.00 ? 71 ALA D HB1 9 5
ATOM 10067 H HB2 . ALA D 1 5 ? 2.511 -10.220 1.349 1.00 0.00 ? 71 ALA D HB2 9 5
ATOM 10068 H HB3 . ALA D 1 5 ? 1.734 -11.740 1.028 1.00 0.00 ? 71 ALA D HB3 9 5
ATOM 10069 N N . ALA D 1 6 ? -1.845 -11.080 1.994 1.00 0.00 ? 72 ALA D N 9 6
ATOM 10070 C CA . ALA D 1 6 ? -3.257 -11.003 1.713 1.00 0.00 ? 72 ALA D CA 9 6
ATOM 10071 C C . ALA D 1 6 ? -3.911 -9.957 2.595 1.00 0.00 ? 72 ALA D C 9 6
ATOM 10072 O O . ALA D 1 6 ? -4.364 -8.936 2.094 1.00 0.00 ? 72 ALA D O 9 6
ATOM 10073 C CB . ALA D 1 6 ? -3.869 -12.388 1.787 1.00 0.00 ? 72 ALA D CB 9 6
ATOM 10074 H H . ALA D 1 6 ? -1.579 -11.242 2.931 1.00 0.00 ? 72 ALA D H 9 6
ATOM 10075 H HA . ALA D 1 6 ? -3.400 -10.642 0.706 1.00 0.00 ? 72 ALA D HA 9 6
ATOM 10076 H HB1 . ALA D 1 6 ? -3.547 -12.968 1.097 1.00 0.00 ? 72 ALA D HB1 9 6
ATOM 10077 H HB2 . ALA D 1 6 ? -3.700 -12.816 2.645 1.00 0.00 ? 72 ALA D HB2 9 6
ATOM 10078 H HB3 . ALA D 1 6 ? -4.837 -12.351 1.713 1.00 0.00 ? 72 ALA D HB3 9 6
ATOM 10079 N N . ALA D 1 7 ? -3.838 -10.055 3.915 1.00 0.00 ? 73 ALA D N 9 7
ATOM 10080 C CA . ALA D 1 7 ? -4.549 -9.299 4.917 1.00 0.00 ? 73 ALA D CA 9 7
ATOM 10081 C C . ALA D 1 7 ? -4.501 -7.797 4.734 1.00 0.00 ? 73 ALA D C 9 7
ATOM 10082 O O . ALA D 1 7 ? -5.512 -7.116 4.813 1.00 0.00 ? 73 ALA D O 9 7
ATOM 10083 C CB . ALA D 1 7 ? -3.973 -9.668 6.259 1.00 0.00 ? 73 ALA D CB 9 7
ATOM 10084 H H . ALA D 1 7 ? -3.258 -10.805 4.233 1.00 0.00 ? 73 ALA D H 9 7
ATOM 10085 H HA . ALA D 1 7 ? -5.581 -9.601 4.890 1.00 0.00 ? 73 ALA D HA 9 7
ATOM 10086 H HB1 . ALA D 1 7 ? -4.065 -10.720 6.418 1.00 0.00 ? 73 ALA D HB1 9 7
ATOM 10087 H HB2 . ALA D 1 7 ? -2.932 -9.460 6.276 1.00 0.00 ? 73 ALA D HB2 9 7
ATOM 10088 H HB3 . ALA D 1 7 ? -4.489 -9.134 7.031 1.00 0.00 ? 73 ALA D HB3 9 7
ATOM 10089 N N . ALA D 1 8 ? -3.313 -7.273 4.453 1.00 0.00 ? 74 ALA D N 9 8
ATOM 10090 C CA . ALA D 1 8 ? -3.126 -5.844 4.334 1.00 0.00 ? 74 ALA D CA 9 8
ATOM 10091 C C . ALA D 1 8 ? -3.498 -5.335 2.952 1.00 0.00 ? 74 ALA D C 9 8
ATOM 10092 O O . ALA D 1 8 ? -4.019 -4.241 2.795 1.00 0.00 ? 74 ALA D O 9 8
ATOM 10093 C CB . ALA D 1 8 ? -1.684 -5.469 4.651 1.00 0.00 ? 74 ALA D CB 9 8
ATOM 10094 H H . ALA D 1 8 ? -2.558 -7.896 4.222 1.00 0.00 ? 74 ALA D H 9 8
ATOM 10095 H HA . ALA D 1 8 ? -3.765 -5.362 5.069 1.00 0.00 ? 74 ALA D HA 9 8
ATOM 10096 H HB1 . ALA D 1 8 ? -1.223 -5.596 4.448 1.00 0.00 ? 74 ALA D HB1 9 8
ATOM 10097 H HB2 . ALA D 1 8 ? -1.398 -4.989 4.578 1.00 0.00 ? 74 ALA D HB2 9 8
ATOM 10098 H HB3 . ALA D 1 8 ? -1.350 -5.494 5.121 1.00 0.00 ? 74 ALA D HB3 9 8
ATOM 10099 N N . ILE D 1 9 ? -3.278 -6.159 1.931 1.00 0.00 ? 75 ILE D N 9 9
ATOM 10100 C CA . ILE D 1 9 ? -3.608 -5.881 0.557 1.00 0.00 ? 75 ILE D CA 9 9
ATOM 10101 C C . ILE D 1 9 ? -5.110 -5.914 0.336 1.00 0.00 ? 75 ILE D C 9 9
ATOM 10102 O O . ILE D 1 9 ? -5.620 -5.092 -0.407 1.00 0.00 ? 75 ILE D O 9 9
ATOM 10103 C CB . ILE D 1 9 ? -2.976 -6.961 -0.306 1.00 0.00 ? 75 ILE D CB 9 9
ATOM 10104 C CG1 . ILE D 1 9 ? -1.480 -7.150 -0.113 1.00 0.00 ? 75 ILE D CG1 9 9
ATOM 10105 C CG2 . ILE D 1 9 ? -3.325 -6.780 -1.771 1.00 0.00 ? 75 ILE D CG2 9 9
ATOM 10106 C CD1 . ILE D 1 9 ? -0.675 -5.890 -0.384 1.00 0.00 ? 75 ILE D CD1 9 9
ATOM 10107 H H . ILE D 1 9 ? -2.917 -7.066 2.150 1.00 0.00 ? 75 ILE D H 9 9
ATOM 10108 H HA . ILE D 1 9 ? -3.239 -4.903 0.279 1.00 0.00 ? 75 ILE D HA 9 9
ATOM 10109 H HB . ILE D 1 9 ? -3.471 -7.887 -0.040 1.00 0.00 ? 75 ILE D HB 9 9
ATOM 10110 H HG12 . ILE D 1 9 ? -1.289 -7.487 0.906 1.00 0.00 ? 75 ILE D HG12 9 9
ATOM 10111 H HG13 . ILE D 1 9 ? -1.137 -7.928 -0.781 1.00 0.00 ? 75 ILE D HG13 9 9
ATOM 10112 H HG21 . ILE D 1 9 ? -2.759 -7.501 -2.334 1.00 0.00 ? 75 ILE D HG21 9 9
ATOM 10113 H HG22 . ILE D 1 9 ? -4.377 -6.973 -1.903 1.00 0.00 ? 75 ILE D HG22 9 9
ATOM 10114 H HG23 . ILE D 1 9 ? -3.088 -5.771 -2.062 1.00 0.00 ? 75 ILE D HG23 9 9
ATOM 10115 H HD11 . ILE D 1 9 ? 0.349 -6.109 -0.261 1.00 0.00 ? 75 ILE D HD11 9 9
ATOM 10116 H HD12 . ILE D 1 9 ? -0.834 -5.533 -1.355 1.00 0.00 ? 75 ILE D HD12 9 9
ATOM 10117 H HD13 . ILE D 1 9 ? -0.910 -5.140 0.303 1.00 0.00 ? 75 ILE D HD13 9 9
ATOM 10118 N N . LYS D 1 10 ? -5.797 -6.854 0.960 1.00 0.00 ? 76 LYS D N 9 10
ATOM 10119 C CA . LYS D 1 10 ? -7.225 -7.046 0.914 1.00 0.00 ? 76 LYS D CA 9 10
ATOM 10120 C C . LYS D 1 10 ? -8.019 -5.927 1.551 1.00 0.00 ? 76 LYS D C 9 10
ATOM 10121 O O . LYS D 1 10 ? -9.028 -5.553 1.010 1.00 0.00 ? 76 LYS D O 9 10
ATOM 10122 C CB . LYS D 1 10 ? -7.523 -8.369 1.600 1.00 0.00 ? 76 LYS D CB 9 10
ATOM 10123 C CG . LYS D 1 10 ? -7.347 -9.560 0.674 1.00 0.00 ? 76 LYS D CG 9 10
ATOM 10124 C CD . LYS D 1 10 ? -8.548 -9.942 -0.084 1.00 0.00 ? 76 LYS D CD 9 10
ATOM 10125 C CE . LYS D 1 10 ? -8.430 -11.203 -0.859 1.00 0.00 ? 76 LYS D CE 9 10
ATOM 10126 N NZ . LYS D 1 10 ? -7.673 -11.042 -2.022 1.00 0.00 ? 76 LYS D NZ 9 10
ATOM 10127 H H . LYS D 1 10 ? -5.273 -7.463 1.547 1.00 0.00 ? 76 LYS D H 9 10
ATOM 10128 H HA . LYS D 1 10 ? -7.540 -7.023 -0.121 1.00 0.00 ? 76 LYS D HA 9 10
ATOM 10129 H HB2 . LYS D 1 10 ? -6.870 -8.484 2.464 1.00 0.00 ? 76 LYS D HB2 9 10
ATOM 10130 H HB3 . LYS D 1 10 ? -8.542 -8.348 1.970 1.00 0.00 ? 76 LYS D HB3 9 10
ATOM 10131 H HG2 . LYS D 1 10 ? -6.535 -9.347 -0.022 1.00 0.00 ? 76 LYS D HG2 9 10
ATOM 10132 H HG3 . LYS D 1 10 ? -7.087 -10.408 1.227 1.00 0.00 ? 76 LYS D HG3 9 10
ATOM 10133 H HD2 . LYS D 1 10 ? -9.368 -10.056 0.625 1.00 0.00 ? 76 LYS D HD2 9 10
ATOM 10134 H HD3 . LYS D 1 10 ? -8.836 -9.189 -0.712 1.00 0.00 ? 76 LYS D HD3 9 10
ATOM 10135 H HE2 . LYS D 1 10 ? -7.994 -11.979 -0.230 1.00 0.00 ? 76 LYS D HE2 9 10
ATOM 10136 H HE3 . LYS D 1 10 ? -9.378 -11.535 -1.186 1.00 0.00 ? 76 LYS D HE3 9 10
ATOM 10137 H HZ1 . LYS D 1 10 ? -7.727 -11.838 -2.499 1.00 0.00 ? 76 LYS D HZ1 9 10
ATOM 10138 H HZ2 . LYS D 1 10 ? -8.000 -10.368 -2.587 1.00 0.00 ? 76 LYS D HZ2 9 10
ATOM 10139 H HZ3 . LYS D 1 10 ? -6.735 -10.857 -1.885 1.00 0.00 ? 76 LYS D HZ3 9 10
ATOM 10140 N N . ALA D 1 11 ? -7.515 -5.356 2.636 1.00 0.00 ? 77 ALA D N 9 11
ATOM 10141 C CA . ALA D 1 11 ? -7.867 -4.026 3.076 1.00 0.00 ? 77 ALA D CA 9 11
ATOM 10142 C C . ALA D 1 11 ? -7.659 -2.980 2.000 1.00 0.00 ? 77 ALA D C 9 11
ATOM 10143 O O . ALA D 1 11 ? -8.621 -2.393 1.519 1.00 0.00 ? 77 ALA D O 9 11
ATOM 10144 C CB . ALA D 1 11 ? -7.116 -3.739 4.361 1.00 0.00 ? 77 ALA D CB 9 11
ATOM 10145 H H . ALA D 1 11 ? -6.699 -5.798 2.970 1.00 0.00 ? 77 ALA D H 9 11
ATOM 10146 H HA . ALA D 1 11 ? -8.917 -4.008 3.327 1.00 0.00 ? 77 ALA D HA 9 11
ATOM 10147 H HB1 . ALA D 1 11 ? -7.326 -4.365 5.112 1.00 0.00 ? 77 ALA D HB1 9 11
ATOM 10148 H HB2 . ALA D 1 11 ? -6.127 -3.738 4.251 1.00 0.00 ? 77 ALA D HB2 9 11
ATOM 10149 H HB3 . ALA D 1 11 ? -7.377 -2.862 4.746 1.00 0.00 ? 77 ALA D HB3 9 11
ATOM 10150 N N . ILE D 1 12 ? -6.419 -2.764 1.572 1.00 0.00 ? 78 ILE D N 9 12
ATOM 10151 C CA . ILE D 1 12 ? -6.057 -1.603 0.792 1.00 0.00 ? 78 ILE D CA 9 12
ATOM 10152 C C . ILE D 1 12 ? -6.701 -1.643 -0.581 1.00 0.00 ? 78 ILE D C 9 12
ATOM 10153 O O . ILE D 1 12 ? -7.313 -0.659 -0.973 1.00 0.00 ? 78 ILE D O 9 12
ATOM 10154 C CB . ILE D 1 12 ? -4.559 -1.337 0.775 1.00 0.00 ? 78 ILE D CB 9 12
ATOM 10155 C CG1 . ILE D 1 12 ? -4.193 0.047 1.273 1.00 0.00 ? 78 ILE D CG1 9 12
ATOM 10156 C CG2 . ILE D 1 12 ? -3.821 -1.694 -0.499 1.00 0.00 ? 78 ILE D CG2 9 12
ATOM 10157 C CD1 . ILE D 1 12 ? -4.664 1.205 0.423 1.00 0.00 ? 78 ILE D CD1 9 12
ATOM 10158 H H . ILE D 1 12 ? -5.709 -3.445 1.755 1.00 0.00 ? 78 ILE D H 9 12
ATOM 10159 H HA . ILE D 1 12 ? -6.550 -0.742 1.231 1.00 0.00 ? 78 ILE D HA 9 12
ATOM 10160 H HB . ILE D 1 12 ? -4.126 -1.973 1.525 1.00 0.00 ? 78 ILE D HB 9 12
ATOM 10161 H HG12 . ILE D 1 12 ? -4.620 0.167 2.269 1.00 0.00 ? 78 ILE D HG12 9 12
ATOM 10162 H HG13 . ILE D 1 12 ? -3.121 0.116 1.405 1.00 0.00 ? 78 ILE D HG13 9 12
ATOM 10163 H HG21 . ILE D 1 12 ? -2.773 -1.497 -0.373 1.00 0.00 ? 78 ILE D HG21 9 12
ATOM 10164 H HG22 . ILE D 1 12 ? -3.964 -2.732 -0.757 1.00 0.00 ? 78 ILE D HG22 9 12
ATOM 10165 H HG23 . ILE D 1 12 ? -4.173 -1.090 -1.309 1.00 0.00 ? 78 ILE D HG23 9 12
ATOM 10166 H HD11 . ILE D 1 12 ? -4.257 2.114 0.797 1.00 0.00 ? 78 ILE D HD11 9 12
ATOM 10167 H HD12 . ILE D 1 12 ? -4.314 1.079 -0.581 1.00 0.00 ? 78 ILE D HD12 9 12
ATOM 10168 H HD13 . ILE D 1 12 ? -5.728 1.304 0.442 1.00 0.00 ? 78 ILE D HD13 9 12
ATOM 10169 N N . ALA D 1 13 ? -6.733 -2.770 -1.293 1.00 0.00 ? 79 ALA D N 9 13
ATOM 10170 C CA . ALA D 1 13 ? -7.430 -2.861 -2.553 1.00 0.00 ? 79 ALA D CA 9 13
ATOM 10171 C C . ALA D 1 13 ? -8.921 -2.593 -2.534 1.00 0.00 ? 79 ALA D C 9 13
ATOM 10172 O O . ALA D 1 13 ? -9.492 -2.159 -3.512 1.00 0.00 ? 79 ALA D O 9 13
ATOM 10173 C CB . ALA D 1 13 ? -7.108 -4.220 -3.157 1.00 0.00 ? 79 ALA D CB 9 13
ATOM 10174 H H . ALA D 1 13 ? -6.305 -3.574 -0.871 1.00 0.00 ? 79 ALA D H 9 13
ATOM 10175 H HA . ALA D 1 13 ? -7.017 -2.098 -3.202 1.00 0.00 ? 79 ALA D HA 9 13
ATOM 10176 H HB1 . ALA D 1 13 ? -6.056 -4.372 -3.135 1.00 0.00 ? 79 ALA D HB1 9 13
ATOM 10177 H HB2 . ALA D 1 13 ? -7.651 -4.985 -2.649 1.00 0.00 ? 79 ALA D HB2 9 13
ATOM 10178 H HB3 . ALA D 1 13 ? -7.419 -4.200 -4.176 1.00 0.00 ? 79 ALA D HB3 9 13
ATOM 10179 N N . ALA D 1 14 ? -9.550 -2.796 -1.390 1.00 0.00 ? 80 ALA D N 9 14
ATOM 10180 C CA . ALA D 1 14 ? -10.949 -2.524 -1.153 1.00 0.00 ? 80 ALA D CA 9 14
ATOM 10181 C C . ALA D 1 14 ? -11.143 -1.084 -0.722 1.00 0.00 ? 80 ALA D C 9 14
ATOM 10182 O O . ALA D 1 14 ? -12.056 -0.413 -1.190 1.00 0.00 ? 80 ALA D O 9 14
ATOM 10183 C CB . ALA D 1 14 ? -11.444 -3.486 -0.097 1.00 0.00 ? 80 ALA D CB 9 14
ATOM 10184 H H . ALA D 1 14 ? -8.946 -3.048 -0.633 1.00 0.00 ? 80 ALA D H 9 14
ATOM 10185 H HA . ALA D 1 14 ? -11.497 -2.695 -2.071 1.00 0.00 ? 80 ALA D HA 9 14
ATOM 10186 H HB1 . ALA D 1 14 ? -11.280 -4.497 -0.402 1.00 0.00 ? 80 ALA D HB1 9 14
ATOM 10187 H HB2 . ALA D 1 14 ? -10.991 -3.283 0.858 1.00 0.00 ? 80 ALA D HB2 9 14
ATOM 10188 H HB3 . ALA D 1 14 ? -12.509 -3.359 -0.025 1.00 0.00 ? 80 ALA D HB3 9 14
ATOM 10189 N N . ILE D 1 15 ? -10.224 -0.546 0.073 1.00 0.00 ? 81 ILE D N 9 15
ATOM 10190 C CA . ILE D 1 15 ? -10.139 0.809 0.561 1.00 0.00 ? 81 ILE D CA 9 15
ATOM 10191 C C . ILE D 1 15 ? -9.786 1.759 -0.569 1.00 0.00 ? 81 ILE D C 9 15
ATOM 10192 O O . ILE D 1 15 ? -10.318 2.861 -0.609 1.00 0.00 ? 81 ILE D O 9 15
ATOM 10193 C CB . ILE D 1 15 ? -9.191 0.884 1.746 1.00 0.00 ? 81 ILE D CB 9 15
ATOM 10194 C CG1 . ILE D 1 15 ? -9.708 0.124 2.952 1.00 0.00 ? 81 ILE D CG1 9 15
ATOM 10195 C CG2 . ILE D 1 15 ? -8.927 2.334 2.121 1.00 0.00 ? 81 ILE D CG2 9 15
ATOM 10196 C CD1 . ILE D 1 15 ? -8.657 -0.236 3.983 1.00 0.00 ? 81 ILE D CD1 9 15
ATOM 10197 H H . ILE D 1 15 ? -9.501 -1.171 0.348 1.00 0.00 ? 81 ILE D H 9 15
ATOM 10198 H HA . ILE D 1 15 ? -11.105 1.090 0.968 1.00 0.00 ? 81 ILE D HA 9 15
ATOM 10199 H HB . ILE D 1 15 ? -8.250 0.440 1.460 1.00 0.00 ? 81 ILE D HB 9 15
ATOM 10200 H HG12 . ILE D 1 15 ? -10.477 0.729 3.432 1.00 0.00 ? 81 ILE D HG12 9 15
ATOM 10201 H HG13 . ILE D 1 15 ? -10.175 -0.794 2.665 1.00 0.00 ? 81 ILE D HG13 9 15
ATOM 10202 H HG21 . ILE D 1 15 ? -9.850 2.857 2.294 1.00 0.00 ? 81 ILE D HG21 9 15
ATOM 10203 H HG22 . ILE D 1 15 ? -8.390 2.394 3.047 1.00 0.00 ? 81 ILE D HG22 9 15
ATOM 10204 H HG23 . ILE D 1 15 ? -8.337 2.873 1.398 1.00 0.00 ? 81 ILE D HG23 9 15
ATOM 10205 H HD11 . ILE D 1 15 ? -7.834 -0.693 3.554 1.00 0.00 ? 81 ILE D HD11 9 15
ATOM 10206 H HD12 . ILE D 1 15 ? -8.353 0.587 4.532 1.00 0.00 ? 81 ILE D HD12 9 15
ATOM 10207 H HD13 . ILE D 1 15 ? -9.066 -0.912 4.659 1.00 0.00 ? 81 ILE D HD13 9 15
ATOM 10208 N N . ILE D 1 16 ? -8.978 1.350 -1.545 1.00 0.00 ? 82 ILE D N 9 16
ATOM 10209 C CA . ILE D 1 16 ? -8.744 2.087 -2.766 1.00 0.00 ? 82 ILE D CA 9 16
ATOM 10210 C C . ILE D 1 16 ? -10.031 2.365 -3.521 1.00 0.00 ? 82 ILE D C 9 16
ATOM 10211 O O . ILE D 1 16 ? -10.325 3.496 -3.858 1.00 0.00 ? 82 ILE D O 9 16
ATOM 10212 C CB . ILE D 1 16 ? -7.708 1.383 -3.629 1.00 0.00 ? 82 ILE D CB 9 16
ATOM 10213 C CG1 . ILE D 1 16 ? -6.349 1.551 -2.974 1.00 0.00 ? 82 ILE D CG1 9 16
ATOM 10214 C CG2 . ILE D 1 16 ? -7.665 1.968 -5.033 1.00 0.00 ? 82 ILE D CG2 9 16
ATOM 10215 C CD1 . ILE D 1 16 ? -5.131 0.961 -3.664 1.00 0.00 ? 82 ILE D CD1 9 16
ATOM 10216 H H . ILE D 1 16 ? -8.536 0.467 -1.422 1.00 0.00 ? 82 ILE D H 9 16
ATOM 10217 H HA . ILE D 1 16 ? -8.363 3.070 -2.514 1.00 0.00 ? 82 ILE D HA 9 16
ATOM 10218 H HB . ILE D 1 16 ? -7.968 0.331 -3.628 1.00 0.00 ? 82 ILE D HB 9 16
ATOM 10219 H HG12 . ILE D 1 16 ? -6.175 2.623 -2.879 1.00 0.00 ? 82 ILE D HG12 9 16
ATOM 10220 H HG13 . ILE D 1 16 ? -6.375 1.180 -1.959 1.00 0.00 ? 82 ILE D HG13 9 16
ATOM 10221 H HG21 . ILE D 1 16 ? -7.491 3.029 -5.004 1.00 0.00 ? 82 ILE D HG21 9 16
ATOM 10222 H HG22 . ILE D 1 16 ? -6.900 1.491 -5.628 1.00 0.00 ? 82 ILE D HG22 9 16
ATOM 10223 H HG23 . ILE D 1 16 ? -8.603 1.827 -5.536 1.00 0.00 ? 82 ILE D HG23 9 16
ATOM 10224 H HD11 . ILE D 1 16 ? -4.928 1.477 -4.583 1.00 0.00 ? 82 ILE D HD11 9 16
ATOM 10225 H HD12 . ILE D 1 16 ? -4.275 1.073 -3.037 1.00 0.00 ? 82 ILE D HD12 9 16
ATOM 10226 H HD13 . ILE D 1 16 ? -5.276 -0.078 -3.805 1.00 0.00 ? 82 ILE D HD13 9 16
ATOM 10227 N N . LYS D 1 17 ? -10.781 1.306 -3.807 1.00 0.00 ? 83 LYS D N 9 17
ATOM 10228 C CA . LYS D 1 17 ? -12.060 1.351 -4.468 1.00 0.00 ? 83 LYS D CA 9 17
ATOM 10229 C C . LYS D 1 17 ? -13.102 2.183 -3.749 1.00 0.00 ? 83 LYS D C 9 17
ATOM 10230 O O . LYS D 1 17 ? -13.779 2.958 -4.391 1.00 0.00 ? 83 LYS D O 9 17
ATOM 10231 C CB . LYS D 1 17 ? -12.495 -0.092 -4.644 1.00 0.00 ? 83 LYS D CB 9 17
ATOM 10232 C CG . LYS D 1 17 ? -11.785 -0.779 -5.789 1.00 0.00 ? 83 LYS D CG 9 17
ATOM 10233 C CD . LYS D 1 17 ? -12.228 -2.191 -5.990 1.00 0.00 ? 83 LYS D CD 9 17
ATOM 10234 C CE . LYS D 1 17 ? -11.645 -2.851 -7.211 1.00 0.00 ? 83 LYS D CE 9 17
ATOM 10235 N NZ . LYS D 1 17 ? -12.242 -2.441 -8.416 1.00 0.00 ? 83 LYS D NZ 9 17
ATOM 10236 H H . LYS D 1 17 ? -10.421 0.444 -3.453 1.00 0.00 ? 83 LYS D H 9 17
ATOM 10237 H HA . LYS D 1 17 ? -11.956 1.816 -5.441 1.00 0.00 ? 83 LYS D HA 9 17
ATOM 10238 H HB2 . LYS D 1 17 ? -12.301 -0.641 -3.723 1.00 0.00 ? 83 LYS D HB2 9 17
ATOM 10239 H HB3 . LYS D 1 17 ? -13.558 -0.116 -4.801 1.00 0.00 ? 83 LYS D HB3 9 17
ATOM 10240 H HG2 . LYS D 1 17 ? -11.959 -0.213 -6.704 1.00 0.00 ? 83 LYS D HG2 9 17
ATOM 10241 H HG3 . LYS D 1 17 ? -10.729 -0.785 -5.622 1.00 0.00 ? 83 LYS D HG3 9 17
ATOM 10242 H HD2 . LYS D 1 17 ? -11.962 -2.775 -5.109 1.00 0.00 ? 83 LYS D HD2 9 17
ATOM 10243 H HD3 . LYS D 1 17 ? -13.293 -2.201 -6.068 1.00 0.00 ? 83 LYS D HD3 9 17
ATOM 10244 H HE2 . LYS D 1 17 ? -10.580 -2.622 -7.254 1.00 0.00 ? 83 LYS D HE2 9 17
ATOM 10245 H HE3 . LYS D 1 17 ? -11.714 -3.880 -7.132 1.00 0.00 ? 83 LYS D HE3 9 17
ATOM 10246 H HZ1 . LYS D 1 17 ? -12.422 -2.615 -8.885 1.00 0.00 ? 83 LYS D HZ1 9 17
ATOM 10247 H HZ2 . LYS D 1 17 ? -12.572 -2.234 -8.450 1.00 0.00 ? 83 LYS D HZ2 9 17
ATOM 10248 H HZ3 . LYS D 1 17 ? -12.124 -2.156 -8.832 1.00 0.00 ? 83 LYS D HZ3 9 17
ATOM 10249 N N . ALA D 1 18 ? -13.166 2.078 -2.428 1.00 0.00 ? 84 ALA D N 9 18
ATOM 10250 C CA . ALA D 1 18 ? -14.059 2.874 -1.620 1.00 0.00 ? 84 ALA D CA 9 18
ATOM 10251 C C . ALA D 1 18 ? -13.593 4.298 -1.408 1.00 0.00 ? 84 ALA D C 9 18
ATOM 10252 O O . ALA D 1 18 ? -14.390 5.193 -1.346 1.00 0.00 ? 84 ALA D O 9 18
ATOM 10253 C CB . ALA D 1 18 ? -14.261 2.163 -0.297 1.00 0.00 ? 84 ALA D CB 9 18
ATOM 10254 H H . ALA D 1 18 ? -12.532 1.439 -1.994 1.00 0.00 ? 84 ALA D H 9 18
ATOM 10255 H HA . ALA D 1 18 ? -14.999 2.900 -2.153 1.00 0.00 ? 84 ALA D HA 9 18
ATOM 10256 H HB1 . ALA D 1 18 ? -14.850 2.753 0.391 1.00 0.00 ? 84 ALA D HB1 9 18
ATOM 10257 H HB2 . ALA D 1 18 ? -14.757 1.225 -0.456 1.00 0.00 ? 84 ALA D HB2 9 18
ATOM 10258 H HB3 . ALA D 1 18 ? -13.307 1.958 0.157 1.00 0.00 ? 84 ALA D HB3 9 18
ATOM 10259 N N . GLY D 1 19 ? -12.300 4.536 -1.318 1.00 0.00 ? 85 GLY D N 9 19
ATOM 10260 C CA . GLY D 1 19 ? -11.638 5.796 -1.064 1.00 0.00 ? 85 GLY D CA 9 19
ATOM 10261 C C . GLY D 1 19 ? -11.539 6.692 -2.282 1.00 0.00 ? 85 GLY D C 9 19
ATOM 10262 O O . GLY D 1 19 ? -11.337 7.879 -2.115 1.00 0.00 ? 85 GLY D O 9 19
ATOM 10263 H H . GLY D 1 19 ? -11.718 3.732 -1.346 1.00 0.00 ? 85 GLY D H 9 19
ATOM 10264 H HA2 . GLY D 1 19 ? -12.134 6.347 -0.279 1.00 0.00 ? 85 GLY D HA2 9 19
ATOM 10265 H HA3 . GLY D 1 19 ? -10.632 5.586 -0.732 1.00 0.00 ? 85 GLY D HA3 9 19
ATOM 10266 N N . GLY D 1 20 ? -11.675 6.154 -3.486 1.00 0.00 ? 86 GLY D N 9 20
ATOM 10267 C CA . GLY D 1 20 ? -11.641 6.891 -4.720 1.00 0.00 ? 86 GLY D CA 9 20
ATOM 10268 C C . GLY D 1 20 ? -10.333 7.625 -4.956 1.00 0.00 ? 86 GLY D C 9 20
ATOM 10269 O O . GLY D 1 20 ? -10.344 8.822 -5.131 1.00 0.00 ? 86 GLY D O 9 20
ATOM 10270 H H . GLY D 1 20 ? -11.838 5.175 -3.507 1.00 0.00 ? 86 GLY D H 9 20
ATOM 10271 H HA2 . GLY D 1 20 ? -11.754 6.203 -5.537 1.00 0.00 ? 86 GLY D HA2 9 20
ATOM 10272 H HA3 . GLY D 1 20 ? -12.445 7.609 -4.729 1.00 0.00 ? 86 GLY D HA3 9 20
ATOM 10273 N N . TYR D 1 21 ? -9.215 6.930 -4.861 1.00 0.00 ? 87 TYR D N 9 21
ATOM 10274 C CA . TYR D 1 21 ? -7.894 7.492 -4.878 1.00 0.00 ? 87 TYR D CA 9 21
ATOM 10275 C C . TYR D 1 21 ? -7.528 8.237 -6.122 1.00 0.00 ? 87 TYR D C 9 21
ATOM 10276 O O . TYR D 1 21 ? -6.611 8.985 -6.138 1.00 0.00 ? 87 TYR D O 9 21
ATOM 10277 C CB . TYR D 1 21 ? -6.896 6.389 -4.593 1.00 0.00 ? 87 TYR D CB 9 21
ATOM 10278 C CG . TYR D 1 21 ? -6.392 6.333 -3.176 1.00 0.00 ? 87 TYR D CG 9 21
ATOM 10279 C CD1 . TYR D 1 21 ? -5.586 7.297 -2.591 1.00 0.00 ? 87 TYR D CD1 9 21
ATOM 10280 C CD2 . TYR D 1 21 ? -6.736 5.177 -2.492 1.00 0.00 ? 87 TYR D CD2 9 21
ATOM 10281 C CE1 . TYR D 1 21 ? -5.042 7.016 -1.337 1.00 0.00 ? 87 TYR D CE1 9 21
ATOM 10282 C CE2 . TYR D 1 21 ? -6.194 4.884 -1.241 1.00 0.00 ? 87 TYR D CE2 9 21
ATOM 10283 C CZ . TYR D 1 21 ? -5.336 5.821 -0.668 1.00 0.00 ? 87 TYR D CZ 9 21
ATOM 10284 O OH . TYR D 1 21 ? -4.799 5.582 0.560 1.00 0.00 ? 87 TYR D OH 9 21
ATOM 10285 H H . TYR D 1 21 ? -9.302 5.951 -4.704 1.00 0.00 ? 87 TYR D H 9 21
ATOM 10286 H HA . TYR D 1 21 ? -7.805 8.202 -4.085 1.00 0.00 ? 87 TYR D HA 9 21
ATOM 10287 H HB2 . TYR D 1 21 ? -7.374 5.438 -4.826 1.00 0.00 ? 87 TYR D HB2 9 21
ATOM 10288 H HB3 . TYR D 1 21 ? -6.031 6.448 -5.231 1.00 0.00 ? 87 TYR D HB3 9 21
ATOM 10289 H HD1 . TYR D 1 21 ? -5.302 8.192 -3.089 1.00 0.00 ? 87 TYR D HD1 9 21
ATOM 10290 H HD2 . TYR D 1 21 ? -7.345 4.498 -3.015 1.00 0.00 ? 87 TYR D HD2 9 21
ATOM 10291 H HE1 . TYR D 1 21 ? -4.414 7.750 -0.885 1.00 0.00 ? 87 TYR D HE1 9 21
ATOM 10292 H HE2 . TYR D 1 21 ? -6.448 3.976 -0.737 1.00 0.00 ? 87 TYR D HE2 9 21
ATOM 10293 H HH . TYR D 1 21 ? -5.414 5.845 1.218 1.00 0.00 ? 87 TYR D HH 9 21
HETATM 10294 N N . NH2 D 1 22 ? -8.168 8.034 -7.215 1.00 0.00 ? 88 NH2 D N 9 22
HETATM 10295 H HN1 . NH2 D 1 22 ? -7.885 8.548 -8.011 1.00 0.00 ? 88 NH2 D HN1 9 22
HETATM 10296 H HN2 . NH2 D 1 22 ? -8.926 7.466 -7.225 1.00 0.00 ? 88 NH2 D HN2 9 22
HETATM 10297 C C . ACE A 1 1 ? 0.875 15.587 1.965 1.00 0.00 ? 1 ACE A C 10 1
HETATM 10298 O O . ACE A 1 1 ? -0.059 15.935 1.277 1.00 0.00 ? 1 ACE A O 10 1
HETATM 10299 C CH3 . ACE A 1 1 ? 1.703 16.592 2.718 1.00 0.00 ? 1 ACE A CH3 10 1
HETATM 10300 H H1 . ACE A 1 1 ? 1.978 16.808 2.966 1.00 0.00 ? 1 ACE A H1 10 1
HETATM 10301 H H2 . ACE A 1 1 ? 1.905 16.834 2.835 1.00 0.00 ? 1 ACE A H2 10 1
HETATM 10302 H H3 . ACE A 1 1 ? 1.828 16.823 2.898 1.00 0.00 ? 1 ACE A H3 10 1
ATOM 10303 N N . ALA A 1 2 ? 1.185 14.319 2.164 1.00 0.00 ? 2 ALA A N 10 2
ATOM 10304 C CA . ALA A 1 2 ? 0.644 13.150 1.526 1.00 0.00 ? 2 ALA A CA 10 2
ATOM 10305 C C . ALA A 1 2 ? 0.498 13.164 0.022 1.00 0.00 ? 2 ALA A C 10 2
ATOM 10306 O O . ALA A 1 2 ? -0.202 12.363 -0.570 1.00 0.00 ? 2 ALA A O 10 2
ATOM 10307 C CB . ALA A 1 2 ? -0.652 12.798 2.216 1.00 0.00 ? 2 ALA A CB 10 2
ATOM 10308 H H . ALA A 1 2 ? 2.019 14.151 2.681 1.00 0.00 ? 2 ALA A H 10 2
ATOM 10309 H HA . ALA A 1 2 ? 1.320 12.340 1.737 1.00 0.00 ? 2 ALA A HA 10 2
ATOM 10310 H HB1 . ALA A 1 2 ? -1.379 13.575 2.059 1.00 0.00 ? 2 ALA A HB1 10 2
ATOM 10311 H HB2 . ALA A 1 2 ? -1.023 11.878 1.802 1.00 0.00 ? 2 ALA A HB2 10 2
ATOM 10312 H HB3 . ALA A 1 2 ? -0.505 12.681 3.279 1.00 0.00 ? 2 ALA A HB3 10 2
ATOM 10313 N N . LYS A 1 3 ? 1.209 14.025 -0.671 1.00 0.00 ? 3 LYS A N 10 3
ATOM 10314 C CA . LYS A 1 3 ? 1.284 14.098 -2.107 1.00 0.00 ? 3 LYS A CA 10 3
ATOM 10315 C C . LYS A 1 3 ? 1.786 12.850 -2.795 1.00 0.00 ? 3 LYS A C 10 3
ATOM 10316 O O . LYS A 1 3 ? 1.512 12.628 -3.964 1.00 0.00 ? 3 LYS A O 10 3
ATOM 10317 C CB . LYS A 1 3 ? 2.182 15.221 -2.561 1.00 0.00 ? 3 LYS A CB 10 3
ATOM 10318 C CG . LYS A 1 3 ? 1.856 16.584 -2.053 1.00 0.00 ? 3 LYS A CG 10 3
ATOM 10319 C CD . LYS A 1 3 ? 2.740 17.588 -2.641 1.00 0.00 ? 3 LYS A CD 10 3
ATOM 10320 C CE . LYS A 1 3 ? 2.613 18.964 -2.119 1.00 0.00 ? 3 LYS A CE 10 3
ATOM 10321 N NZ . LYS A 1 3 ? 3.505 19.882 -2.643 1.00 0.00 ? 3 LYS A NZ 10 3
ATOM 10322 H H . LYS A 1 3 ? 1.805 14.585 -0.113 1.00 0.00 ? 3 LYS A H 10 3
ATOM 10323 H HA . LYS A 1 3 ? 0.298 14.284 -2.473 1.00 0.00 ? 3 LYS A HA 10 3
ATOM 10324 H HB2 . LYS A 1 3 ? 3.213 14.989 -2.295 1.00 0.00 ? 3 LYS A HB2 10 3
ATOM 10325 H HB3 . LYS A 1 3 ? 2.086 15.198 -3.620 1.00 0.00 ? 3 LYS A HB3 10 3
ATOM 10326 H HG2 . LYS A 1 3 ? 0.817 16.819 -2.282 1.00 0.00 ? 3 LYS A HG2 10 3
ATOM 10327 H HG3 . LYS A 1 3 ? 1.970 16.657 -1.023 1.00 0.00 ? 3 LYS A HG3 10 3
ATOM 10328 H HD2 . LYS A 1 3 ? 3.768 17.264 -2.477 1.00 0.00 ? 3 LYS A HD2 10 3
ATOM 10329 H HD3 . LYS A 1 3 ? 2.610 17.591 -3.645 1.00 0.00 ? 3 LYS A HD3 10 3
ATOM 10330 H HE2 . LYS A 1 3 ? 1.601 19.318 -2.314 1.00 0.00 ? 3 LYS A HE2 10 3
ATOM 10331 H HE3 . LYS A 1 3 ? 2.725 18.930 -1.112 1.00 0.00 ? 3 LYS A HE3 10 3
ATOM 10332 H HZ1 . LYS A 1 3 ? 3.447 20.766 -2.239 1.00 0.00 ? 3 LYS A HZ1 10 3
ATOM 10333 H HZ2 . LYS A 1 3 ? 4.354 19.590 -2.530 1.00 0.00 ? 3 LYS A HZ2 10 3
ATOM 10334 H HZ3 . LYS A 1 3 ? 3.348 19.994 -3.541 1.00 0.00 ? 3 LYS A HZ3 10 3
ATOM 10335 N N . ALA A 1 4 ? 2.502 12.011 -2.054 1.00 0.00 ? 4 ALA A N 10 4
ATOM 10336 C CA . ALA A 1 4 ? 2.934 10.689 -2.404 1.00 0.00 ? 4 ALA A CA 10 4
ATOM 10337 C C . ALA A 1 4 ? 1.813 9.741 -2.779 1.00 0.00 ? 4 ALA A C 10 4
ATOM 10338 O O . ALA A 1 4 ? 2.077 8.638 -3.235 1.00 0.00 ? 4 ALA A O 10 4
ATOM 10339 C CB . ALA A 1 4 ? 3.710 10.156 -1.222 1.00 0.00 ? 4 ALA A CB 10 4
ATOM 10340 H H . ALA A 1 4 ? 2.775 12.377 -1.167 1.00 0.00 ? 4 ALA A H 10 4
ATOM 10341 H HA . ALA A 1 4 ? 3.589 10.775 -3.248 1.00 0.00 ? 4 ALA A HA 10 4
ATOM 10342 H HB1 . ALA A 1 4 ? 4.561 10.795 -1.075 1.00 0.00 ? 4 ALA A HB1 10 4
ATOM 10343 H HB2 . ALA A 1 4 ? 3.143 10.156 -0.311 1.00 0.00 ? 4 ALA A HB2 10 4
ATOM 10344 H HB3 . ALA A 1 4 ? 4.047 9.155 -1.404 1.00 0.00 ? 4 ALA A HB3 10 4
ATOM 10345 N N . ALA A 1 5 ? 0.569 10.171 -2.600 1.00 0.00 ? 5 ALA A N 10 5
ATOM 10346 C CA . ALA A 1 5 ? -0.665 9.456 -2.826 1.00 0.00 ? 5 ALA A CA 10 5
ATOM 10347 C C . ALA A 1 5 ? -0.792 8.878 -4.225 1.00 0.00 ? 5 ALA A C 10 5
ATOM 10348 O O . ALA A 1 5 ? -0.306 7.787 -4.493 1.00 0.00 ? 5 ALA A O 10 5
ATOM 10349 C CB . ALA A 1 5 ? -1.854 10.254 -2.312 1.00 0.00 ? 5 ALA A CB 10 5
ATOM 10350 H H . ALA A 1 5 ? 0.493 11.124 -2.293 1.00 0.00 ? 5 ALA A H 10 5
ATOM 10351 H HA . ALA A 1 5 ? -0.622 8.564 -2.210 1.00 0.00 ? 5 ALA A HA 10 5
ATOM 10352 H HB1 . ALA A 1 5 ? -2.761 9.693 -2.474 1.00 0.00 ? 5 ALA A HB1 10 5
ATOM 10353 H HB2 . ALA A 1 5 ? -1.753 10.424 -1.255 1.00 0.00 ? 5 ALA A HB2 10 5
ATOM 10354 H HB3 . ALA A 1 5 ? -1.891 11.188 -2.836 1.00 0.00 ? 5 ALA A HB3 10 5
ATOM 10355 N N . ALA A 1 6 ? -1.336 9.620 -5.186 1.00 0.00 ? 6 ALA A N 10 6
ATOM 10356 C CA . ALA A 1 6 ? -1.503 9.140 -6.536 1.00 0.00 ? 6 ALA A CA 10 6
ATOM 10357 C C . ALA A 1 6 ? -0.230 9.239 -7.356 1.00 0.00 ? 6 ALA A C 10 6
ATOM 10358 O O . ALA A 1 6 ? -0.246 9.503 -8.543 1.00 0.00 ? 6 ALA A O 10 6
ATOM 10359 C CB . ALA A 1 6 ? -2.698 9.832 -7.170 1.00 0.00 ? 6 ALA A CB 10 6
ATOM 10360 H H . ALA A 1 6 ? -1.563 10.562 -4.942 1.00 0.00 ? 6 ALA A H 10 6
ATOM 10361 H HA . ALA A 1 6 ? -1.749 8.094 -6.425 1.00 0.00 ? 6 ALA A HA 10 6
ATOM 10362 H HB1 . ALA A 1 6 ? -3.531 9.807 -6.489 1.00 0.00 ? 6 ALA A HB1 10 6
ATOM 10363 H HB2 . ALA A 1 6 ? -2.448 10.838 -7.416 1.00 0.00 ? 6 ALA A HB2 10 6
ATOM 10364 H HB3 . ALA A 1 6 ? -2.967 9.336 -8.087 1.00 0.00 ? 6 ALA A HB3 10 6
ATOM 10365 N N . ALA A 1 7 ? 0.905 9.005 -6.722 1.00 0.00 ? 7 ALA A N 10 7
ATOM 10366 C CA . ALA A 1 7 ? 2.251 8.806 -7.209 1.00 0.00 ? 7 ALA A CA 10 7
ATOM 10367 C C . ALA A 1 7 ? 2.751 7.411 -6.884 1.00 0.00 ? 7 ALA A C 10 7
ATOM 10368 O O . ALA A 1 7 ? 3.338 6.785 -7.745 1.00 0.00 ? 7 ALA A O 10 7
ATOM 10369 C CB . ALA A 1 7 ? 3.171 9.852 -6.600 1.00 0.00 ? 7 ALA A CB 10 7
ATOM 10370 H H . ALA A 1 7 ? 0.721 8.738 -5.775 1.00 0.00 ? 7 ALA A H 10 7
ATOM 10371 H HA . ALA A 1 7 ? 2.275 8.922 -8.286 1.00 0.00 ? 7 ALA A HA 10 7
ATOM 10372 H HB1 . ALA A 1 7 ? 3.260 9.725 -5.544 1.00 0.00 ? 7 ALA A HB1 10 7
ATOM 10373 H HB2 . ALA A 1 7 ? 4.140 9.749 -7.042 1.00 0.00 ? 7 ALA A HB2 10 7
ATOM 10374 H HB3 . ALA A 1 7 ? 2.797 10.837 -6.789 1.00 0.00 ? 7 ALA A HB3 10 7
ATOM 10375 N N . ALA A 1 8 ? 2.444 6.878 -5.714 1.00 0.00 ? 8 ALA A N 10 8
ATOM 10376 C CA . ALA A 1 8 ? 2.800 5.550 -5.272 1.00 0.00 ? 8 ALA A CA 10 8
ATOM 10377 C C . ALA A 1 8 ? 1.626 4.600 -5.406 1.00 0.00 ? 8 ALA A C 10 8
ATOM 10378 O O . ALA A 1 8 ? 1.793 3.505 -5.902 1.00 0.00 ? 8 ALA A O 10 8
ATOM 10379 C CB . ALA A 1 8 ? 3.246 5.623 -3.823 1.00 0.00 ? 8 ALA A CB 10 8
ATOM 10380 H H . ALA A 1 8 ? 1.925 7.435 -5.062 1.00 0.00 ? 8 ALA A H 10 8
ATOM 10381 H HA . ALA A 1 8 ? 3.617 5.159 -5.862 1.00 0.00 ? 8 ALA A HA 10 8
ATOM 10382 H HB1 . ALA A 1 8 ? 2.874 5.988 -3.296 1.00 0.00 ? 8 ALA A HB1 10 8
ATOM 10383 H HB2 . ALA A 1 8 ? 3.882 5.894 -3.656 1.00 0.00 ? 8 ALA A HB2 10 8
ATOM 10384 H HB3 . ALA A 1 8 ? 3.322 5.010 -3.450 1.00 0.00 ? 8 ALA A HB3 10 8
ATOM 10385 N N . ILE A 1 9 ? 0.431 5.004 -4.988 1.00 0.00 ? 9 ILE A N 10 9
ATOM 10386 C CA . ILE A 1 9 ? -0.779 4.218 -5.075 1.00 0.00 ? 9 ILE A CA 10 9
ATOM 10387 C C . ILE A 1 9 ? -1.108 3.879 -6.519 1.00 0.00 ? 9 ILE A C 10 9
ATOM 10388 O O . ILE A 1 9 ? -1.614 2.797 -6.770 1.00 0.00 ? 9 ILE A O 10 9
ATOM 10389 C CB . ILE A 1 9 ? -1.963 4.928 -4.438 1.00 0.00 ? 9 ILE A CB 10 9
ATOM 10390 C CG1 . ILE A 1 9 ? -1.717 5.356 -3.004 1.00 0.00 ? 9 ILE A CG1 10 9
ATOM 10391 C CG2 . ILE A 1 9 ? -3.269 4.151 -4.511 1.00 0.00 ? 9 ILE A CG2 10 9
ATOM 10392 C CD1 . ILE A 1 9 ? -1.444 4.266 -2.046 1.00 0.00 ? 9 ILE A CD1 10 9
ATOM 10393 H H . ILE A 1 9 ? 0.353 5.932 -4.617 1.00 0.00 ? 9 ILE A H 10 9
ATOM 10394 H HA . ILE A 1 9 ? -0.624 3.294 -4.529 1.00 0.00 ? 9 ILE A HA 10 9
ATOM 10395 H HB . ILE A 1 9 ? -2.110 5.801 -5.063 1.00 0.00 ? 9 ILE A HB 10 9
ATOM 10396 H HG12 . ILE A 1 9 ? -0.881 6.054 -2.989 1.00 0.00 ? 9 ILE A HG12 10 9
ATOM 10397 H HG13 . ILE A 1 9 ? -2.567 5.866 -2.639 1.00 0.00 ? 9 ILE A HG13 10 9
ATOM 10398 H HG21 . ILE A 1 9 ? -3.626 4.125 -5.498 1.00 0.00 ? 9 ILE A HG21 10 9
ATOM 10399 H HG22 . ILE A 1 9 ? -3.130 3.152 -4.189 1.00 0.00 ? 9 ILE A HG22 10 9
ATOM 10400 H HG23 . ILE A 1 9 ? -3.991 4.615 -3.908 1.00 0.00 ? 9 ILE A HG23 10 9
ATOM 10401 H HD11 . ILE A 1 9 ? -1.302 4.671 -1.082 1.00 0.00 ? 9 ILE A HD11 10 9
ATOM 10402 H HD12 . ILE A 1 9 ? -2.205 3.612 -2.049 1.00 0.00 ? 9 ILE A HD12 10 9
ATOM 10403 H HD13 . ILE A 1 9 ? -0.605 3.790 -2.331 1.00 0.00 ? 9 ILE A HD13 10 9
ATOM 10404 N N . LYS A 1 10 ? -0.799 4.754 -7.469 1.00 0.00 ? 10 LYS A N 10 10
ATOM 10405 C CA . LYS A 1 10 ? -1.030 4.499 -8.873 1.00 0.00 ? 10 LYS A CA 10 10
ATOM 10406 C C . LYS A 1 10 ? -0.332 3.234 -9.345 1.00 0.00 ? 10 LYS A C 10 10
ATOM 10407 O O . LYS A 1 10 ? -0.958 2.293 -9.816 1.00 0.00 ? 10 LYS A O 10 10
ATOM 10408 C CB . LYS A 1 10 ? -0.641 5.722 -9.690 1.00 0.00 ? 10 LYS A CB 10 10
ATOM 10409 C CG . LYS A 1 10 ? 0.738 6.352 -9.617 1.00 0.00 ? 10 LYS A CG 10 10
ATOM 10410 C CD . LYS A 1 10 ? 0.894 7.317 -10.775 1.00 0.00 ? 10 LYS A CD 10 10
ATOM 10411 C CE . LYS A 1 10 ? 2.278 7.858 -10.903 1.00 0.00 ? 10 LYS A CE 10 10
ATOM 10412 N NZ . LYS A 1 10 ? 2.556 8.138 -12.142 1.00 0.00 ? 10 LYS A NZ 10 10
ATOM 10413 H H . LYS A 1 10 ? -0.404 5.616 -7.163 1.00 0.00 ? 10 LYS A H 10 10
ATOM 10414 H HA . LYS A 1 10 ? -2.087 4.268 -8.964 1.00 0.00 ? 10 LYS A HA 10 10
ATOM 10415 H HB2 . LYS A 1 10 ? -0.829 5.477 -10.735 1.00 0.00 ? 10 LYS A HB2 10 10
ATOM 10416 H HB3 . LYS A 1 10 ? -1.306 6.527 -9.409 1.00 0.00 ? 10 LYS A HB3 10 10
ATOM 10417 H HG2 . LYS A 1 10 ? 0.869 6.867 -8.666 1.00 0.00 ? 10 LYS A HG2 10 10
ATOM 10418 H HG3 . LYS A 1 10 ? 1.517 5.607 -9.696 1.00 0.00 ? 10 LYS A HG3 10 10
ATOM 10419 H HD2 . LYS A 1 10 ? 0.615 6.807 -11.697 1.00 0.00 ? 10 LYS A HD2 10 10
ATOM 10420 H HD3 . LYS A 1 10 ? 0.266 8.160 -10.687 1.00 0.00 ? 10 LYS A HD3 10 10
ATOM 10421 H HE2 . LYS A 1 10 ? 2.381 8.753 -10.289 1.00 0.00 ? 10 LYS A HE2 10 10
ATOM 10422 H HE3 . LYS A 1 10 ? 2.933 7.202 -10.574 1.00 0.00 ? 10 LYS A HE3 10 10
ATOM 10423 H HZ1 . LYS A 1 10 ? 2.227 8.281 -12.793 1.00 0.00 ? 10 LYS A HZ1 10 10
ATOM 10424 H HZ2 . LYS A 1 10 ? 2.823 8.518 -12.209 1.00 0.00 ? 10 LYS A HZ2 10 10
ATOM 10425 H HZ3 . LYS A 1 10 ? 2.815 7.837 -12.337 1.00 0.00 ? 10 LYS A HZ3 10 10
ATOM 10426 N N . ALA A 1 11 ? 0.979 3.256 -9.120 1.00 0.00 ? 11 ALA A N 10 11
ATOM 10427 C CA . ALA A 1 11 ? 1.878 2.140 -9.265 1.00 0.00 ? 11 ALA A CA 10 11
ATOM 10428 C C . ALA A 1 11 ? 1.386 0.926 -8.499 1.00 0.00 ? 11 ALA A C 10 11
ATOM 10429 O O . ALA A 1 11 ? 1.277 -0.138 -9.090 1.00 0.00 ? 11 ALA A O 10 11
ATOM 10430 C CB . ALA A 1 11 ? 3.300 2.524 -8.907 1.00 0.00 ? 11 ALA A CB 10 11
ATOM 10431 H H . ALA A 1 11 ? 1.309 4.166 -8.851 1.00 0.00 ? 11 ALA A H 10 11
ATOM 10432 H HA . ALA A 1 11 ? 1.860 1.852 -10.309 1.00 0.00 ? 11 ALA A HA 10 11
ATOM 10433 H HB1 . ALA A 1 11 ? 3.978 1.728 -9.157 1.00 0.00 ? 11 ALA A HB1 10 11
ATOM 10434 H HB2 . ALA A 1 11 ? 3.608 3.390 -9.470 1.00 0.00 ? 11 ALA A HB2 10 11
ATOM 10435 H HB3 . ALA A 1 11 ? 3.396 2.767 -7.865 1.00 0.00 ? 11 ALA A HB3 10 11
ATOM 10436 N N . ILE A 1 12 ? 0.995 1.076 -7.236 1.00 0.00 ? 12 ILE A N 10 12
ATOM 10437 C CA . ILE A 1 12 ? 0.609 -0.014 -6.370 1.00 0.00 ? 12 ILE A CA 10 12
ATOM 10438 C C . ILE A 1 12 ? -0.687 -0.651 -6.836 1.00 0.00 ? 12 ILE A C 10 12
ATOM 10439 O O . ILE A 1 12 ? -0.710 -1.861 -6.978 1.00 0.00 ? 12 ILE A O 10 12
ATOM 10440 C CB . ILE A 1 12 ? 0.638 0.347 -4.895 1.00 0.00 ? 12 ILE A CB 10 12
ATOM 10441 C CG1 . ILE A 1 12 ? 1.638 -0.517 -4.165 1.00 0.00 ? 12 ILE A CG1 10 12
ATOM 10442 C CG2 . ILE A 1 12 ? -0.684 0.302 -4.163 1.00 0.00 ? 12 ILE A CG2 10 12
ATOM 10443 C CD1 . ILE A 1 12 ? 1.358 -2.001 -4.090 1.00 0.00 ? 12 ILE A CD1 10 12
ATOM 10444 H H . ILE A 1 12 ? 0.920 2.009 -6.878 1.00 0.00 ? 12 ILE A H 10 12
ATOM 10445 H HA . ILE A 1 12 ? 1.326 -0.806 -6.552 1.00 0.00 ? 12 ILE A HA 10 12
ATOM 10446 H HB . ILE A 1 12 ? 1.036 1.340 -4.780 1.00 0.00 ? 12 ILE A HB 10 12
ATOM 10447 H HG12 . ILE A 1 12 ? 2.601 -0.386 -4.657 1.00 0.00 ? 12 ILE A HG12 10 12
ATOM 10448 H HG13 . ILE A 1 12 ? 1.772 -0.165 -3.154 1.00 0.00 ? 12 ILE A HG13 10 12
ATOM 10449 H HG21 . ILE A 1 12 ? -1.108 -0.680 -4.208 1.00 0.00 ? 12 ILE A HG21 10 12
ATOM 10450 H HG22 . ILE A 1 12 ? -0.568 0.560 -3.131 1.00 0.00 ? 12 ILE A HG22 10 12
ATOM 10451 H HG23 . ILE A 1 12 ? -1.351 0.996 -4.628 1.00 0.00 ? 12 ILE A HG23 10 12
ATOM 10452 H HD11 . ILE A 1 12 ? 1.373 -2.422 -5.074 1.00 0.00 ? 12 ILE A HD11 10 12
ATOM 10453 H HD12 . ILE A 1 12 ? 2.098 -2.498 -3.507 1.00 0.00 ? 12 ILE A HD12 10 12
ATOM 10454 H HD13 . ILE A 1 12 ? 0.410 -2.195 -3.652 1.00 0.00 ? 12 ILE A HD13 10 12
ATOM 10455 N N . ALA A 1 13 ? -1.713 0.088 -7.251 1.00 0.00 ? 13 ALA A N 10 13
ATOM 10456 C CA . ALA A 1 13 ? -2.917 -0.528 -7.754 1.00 0.00 ? 13 ALA A CA 10 13
ATOM 10457 C C . ALA A 1 13 ? -2.729 -1.271 -9.062 1.00 0.00 ? 13 ALA A C 10 13
ATOM 10458 O O . ALA A 1 13 ? -3.504 -2.155 -9.374 1.00 0.00 ? 13 ALA A O 10 13
ATOM 10459 C CB . ALA A 1 13 ? -3.981 0.557 -7.798 1.00 0.00 ? 13 ALA A CB 10 13
ATOM 10460 H H . ALA A 1 13 ? -1.599 1.080 -7.176 1.00 0.00 ? 13 ALA A H 10 13
ATOM 10461 H HA . ALA A 1 13 ? -3.216 -1.276 -7.032 1.00 0.00 ? 13 ALA A HA 10 13
ATOM 10462 H HB1 . ALA A 1 13 ? -4.082 0.970 -6.818 1.00 0.00 ? 13 ALA A HB1 10 13
ATOM 10463 H HB2 . ALA A 1 13 ? -3.658 1.365 -8.418 1.00 0.00 ? 13 ALA A HB2 10 13
ATOM 10464 H HB3 . ALA A 1 13 ? -4.912 0.152 -8.086 1.00 0.00 ? 13 ALA A HB3 10 13
ATOM 10465 N N . ALA A 1 14 ? -1.663 -0.991 -9.800 1.00 0.00 ? 14 ALA A N 10 14
ATOM 10466 C CA . ALA A 1 14 ? -1.234 -1.750 -10.952 1.00 0.00 ? 14 ALA A CA 10 14
ATOM 10467 C C . ALA A 1 14 ? -0.391 -2.949 -10.573 1.00 0.00 ? 14 ALA A C 10 14
ATOM 10468 O O . ALA A 1 14 ? -0.585 -4.035 -11.089 1.00 0.00 ? 14 ALA A O 10 14
ATOM 10469 C CB . ALA A 1 14 ? -0.551 -0.799 -11.910 1.00 0.00 ? 14 ALA A CB 10 14
ATOM 10470 H H . ALA A 1 14 ? -1.046 -0.321 -9.399 1.00 0.00 ? 14 ALA A H 10 14
ATOM 10471 H HA . ALA A 1 14 ? -2.136 -2.109 -11.429 1.00 0.00 ? 14 ALA A HA 10 14
ATOM 10472 H HB1 . ALA A 1 14 ? 0.334 -0.383 -11.490 1.00 0.00 ? 14 ALA A HB1 10 14
ATOM 10473 H HB2 . ALA A 1 14 ? -0.254 -1.324 -12.799 1.00 0.00 ? 14 ALA A HB2 10 14
ATOM 10474 H HB3 . ALA A 1 14 ? -1.233 -0.015 -12.169 1.00 0.00 ? 14 ALA A HB3 10 14
ATOM 10475 N N . ILE A 1 15 ? 0.543 -2.773 -9.643 1.00 0.00 ? 15 ILE A N 10 15
ATOM 10476 C CA . ILE A 1 15 ? 1.470 -3.765 -9.143 1.00 0.00 ? 15 ILE A CA 10 15
ATOM 10477 C C . ILE A 1 15 ? 0.707 -4.802 -8.335 1.00 0.00 ? 15 ILE A C 10 15
ATOM 10478 O O . ILE A 1 15 ? 1.119 -5.951 -8.328 1.00 0.00 ? 15 ILE A O 10 15
ATOM 10479 C CB . ILE A 1 15 ? 2.563 -3.078 -8.337 1.00 0.00 ? 15 ILE A CB 10 15
ATOM 10480 C CG1 . ILE A 1 15 ? 3.531 -2.322 -9.228 1.00 0.00 ? 15 ILE A CG1 10 15
ATOM 10481 C CG2 . ILE A 1 15 ? 3.353 -4.056 -7.483 1.00 0.00 ? 15 ILE A CG2 10 15
ATOM 10482 C CD1 . ILE A 1 15 ? 4.293 -1.243 -8.482 1.00 0.00 ? 15 ILE A CD1 10 15
ATOM 10483 H H . ILE A 1 15 ? 0.562 -1.854 -9.263 1.00 0.00 ? 15 ILE A H 10 15
ATOM 10484 H HA . ILE A 1 15 ? 1.934 -4.293 -9.966 1.00 0.00 ? 15 ILE A HA 10 15
ATOM 10485 H HB . ILE A 1 15 ? 2.089 -2.385 -7.662 1.00 0.00 ? 15 ILE A HB 10 15
ATOM 10486 H HG12 . ILE A 1 15 ? 4.234 -3.023 -9.677 1.00 0.00 ? 15 ILE A HG12 10 15
ATOM 10487 H HG13 . ILE A 1 15 ? 2.980 -1.847 -10.030 1.00 0.00 ? 15 ILE A HG13 10 15
ATOM 10488 H HG21 . ILE A 1 15 ? 3.808 -4.816 -8.085 1.00 0.00 ? 15 ILE A HG21 10 15
ATOM 10489 H HG22 . ILE A 1 15 ? 4.126 -3.501 -6.991 1.00 0.00 ? 15 ILE A HG22 10 15
ATOM 10490 H HG23 . ILE A 1 15 ? 2.782 -4.527 -6.707 1.00 0.00 ? 15 ILE A HG23 10 15
ATOM 10491 H HD11 . ILE A 1 15 ? 4.427 -0.654 -8.718 1.00 0.00 ? 15 ILE A HD11 10 15
ATOM 10492 H HD12 . ILE A 1 15 ? 4.896 -1.331 -8.263 1.00 0.00 ? 15 ILE A HD12 10 15
ATOM 10493 H HD13 . ILE A 1 15 ? 4.086 -0.984 -7.925 1.00 0.00 ? 15 ILE A HD13 10 15
ATOM 10494 N N . ILE A 1 16 ? -0.419 -4.481 -7.707 1.00 0.00 ? 16 ILE A N 10 16
ATOM 10495 C CA . ILE A 1 16 ? -1.296 -5.454 -7.093 1.00 0.00 ? 16 ILE A CA 10 16
ATOM 10496 C C . ILE A 1 16 ? -1.743 -6.491 -8.105 1.00 0.00 ? 16 ILE A C 10 16
ATOM 10497 O O . ILE A 1 16 ? -1.594 -7.682 -7.888 1.00 0.00 ? 16 ILE A O 10 16
ATOM 10498 C CB . ILE A 1 16 ? -2.466 -4.741 -6.434 1.00 0.00 ? 16 ILE A CB 10 16
ATOM 10499 C CG1 . ILE A 1 16 ? -1.971 -4.062 -5.172 1.00 0.00 ? 16 ILE A CG1 10 16
ATOM 10500 C CG2 . ILE A 1 16 ? -3.581 -5.707 -6.094 1.00 0.00 ? 16 ILE A CG2 10 16
ATOM 10501 C CD1 . ILE A 1 16 ? -3.004 -3.285 -4.386 1.00 0.00 ? 16 ILE A CD1 10 16
ATOM 10502 H H . ILE A 1 16 ? -0.679 -3.513 -7.699 1.00 0.00 ? 16 ILE A H 10 16
ATOM 10503 H HA . ILE A 1 16 ? -0.711 -5.992 -6.354 1.00 0.00 ? 16 ILE A HA 10 16
ATOM 10504 H HB . ILE A 1 16 ? -2.801 -3.937 -7.079 1.00 0.00 ? 16 ILE A HB 10 16
ATOM 10505 H HG12 . ILE A 1 16 ? -1.572 -4.836 -4.516 1.00 0.00 ? 16 ILE A HG12 10 16
ATOM 10506 H HG13 . ILE A 1 16 ? -1.133 -3.435 -5.407 1.00 0.00 ? 16 ILE A HG13 10 16
ATOM 10507 H HG21 . ILE A 1 16 ? -4.406 -5.212 -5.654 1.00 0.00 ? 16 ILE A HG21 10 16
ATOM 10508 H HG22 . ILE A 1 16 ? -3.946 -6.192 -6.949 1.00 0.00 ? 16 ILE A HG22 10 16
ATOM 10509 H HG23 . ILE A 1 16 ? -3.245 -6.436 -5.423 1.00 0.00 ? 16 ILE A HG23 10 16
ATOM 10510 H HD11 . ILE A 1 16 ? -2.568 -2.779 -3.552 1.00 0.00 ? 16 ILE A HD11 10 16
ATOM 10511 H HD12 . ILE A 1 16 ? -3.488 -2.559 -4.995 1.00 0.00 ? 16 ILE A HD12 10 16
ATOM 10512 H HD13 . ILE A 1 16 ? -3.706 -3.955 -3.964 1.00 0.00 ? 16 ILE A HD13 10 16
ATOM 10513 N N . LYS A 1 17 ? -2.271 -6.013 -9.230 1.00 0.00 ? 17 LYS A N 10 17
ATOM 10514 C CA . LYS A 1 17 ? -2.708 -6.800 -10.357 1.00 0.00 ? 17 LYS A CA 10 17
ATOM 10515 C C . LYS A 1 17 ? -1.581 -7.531 -11.057 1.00 0.00 ? 17 LYS A C 10 17
ATOM 10516 O O . LYS A 1 17 ? -1.731 -8.688 -11.396 1.00 0.00 ? 17 LYS A O 10 17
ATOM 10517 C CB . LYS A 1 17 ? -3.454 -5.900 -11.328 1.00 0.00 ? 17 LYS A CB 10 17
ATOM 10518 C CG . LYS A 1 17 ? -4.905 -5.775 -10.914 1.00 0.00 ? 17 LYS A CG 10 17
ATOM 10519 C CD . LYS A 1 17 ? -5.708 -4.915 -11.853 1.00 0.00 ? 17 LYS A CD 10 17
ATOM 10520 C CE . LYS A 1 17 ? -7.166 -5.019 -11.589 1.00 0.00 ? 17 LYS A CE 10 17
ATOM 10521 N NZ . LYS A 1 17 ? -7.794 -4.302 -11.708 1.00 0.00 ? 17 LYS A NZ 10 17
ATOM 10522 H H . LYS A 1 17 ? -2.338 -5.025 -9.326 1.00 0.00 ? 17 LYS A H 10 17
ATOM 10523 H HA . LYS A 1 17 ? -3.377 -7.574 -10.007 1.00 0.00 ? 17 LYS A HA 10 17
ATOM 10524 H HB2 . LYS A 1 17 ? -2.984 -4.917 -11.375 1.00 0.00 ? 17 LYS A HB2 10 17
ATOM 10525 H HB3 . LYS A 1 17 ? -3.416 -6.345 -12.315 1.00 0.00 ? 17 LYS A HB3 10 17
ATOM 10526 H HG2 . LYS A 1 17 ? -5.345 -6.771 -10.872 1.00 0.00 ? 17 LYS A HG2 10 17
ATOM 10527 H HG3 . LYS A 1 17 ? -5.006 -5.359 -9.944 1.00 0.00 ? 17 LYS A HG3 10 17
ATOM 10528 H HD2 . LYS A 1 17 ? -5.389 -3.876 -11.774 1.00 0.00 ? 17 LYS A HD2 10 17
ATOM 10529 H HD3 . LYS A 1 17 ? -5.516 -5.251 -12.831 1.00 0.00 ? 17 LYS A HD3 10 17
ATOM 10530 H HE2 . LYS A 1 17 ? -7.529 -5.830 -12.220 1.00 0.00 ? 17 LYS A HE2 10 17
ATOM 10531 H HE3 . LYS A 1 17 ? -7.334 -5.193 -10.970 1.00 0.00 ? 17 LYS A HE3 10 17
ATOM 10532 H HZ1 . LYS A 1 17 ? -7.603 -3.943 -11.392 1.00 0.00 ? 17 LYS A HZ1 10 17
ATOM 10533 H HZ2 . LYS A 1 17 ? -7.537 -4.139 -12.194 1.00 0.00 ? 17 LYS A HZ2 10 17
ATOM 10534 H HZ3 . LYS A 1 17 ? -8.739 -4.338 -11.618 1.00 0.00 ? 17 LYS A HZ3 10 17
ATOM 10535 N N . ALA A 1 18 ? -0.451 -6.872 -11.280 1.00 0.00 ? 18 ALA A N 10 18
ATOM 10536 C CA . ALA A 1 18 ? 0.642 -7.378 -12.073 1.00 0.00 ? 18 ALA A CA 10 18
ATOM 10537 C C . ALA A 1 18 ? 1.582 -8.252 -11.283 1.00 0.00 ? 18 ALA A C 10 18
ATOM 10538 O O . ALA A 1 18 ? 2.150 -9.180 -11.808 1.00 0.00 ? 18 ALA A O 10 18
ATOM 10539 C CB . ALA A 1 18 ? 1.349 -6.215 -12.720 1.00 0.00 ? 18 ALA A CB 10 18
ATOM 10540 H H . ALA A 1 18 ? -0.437 -5.909 -11.028 1.00 0.00 ? 18 ALA A H 10 18
ATOM 10541 H HA . ALA A 1 18 ? 0.240 -7.983 -12.870 1.00 0.00 ? 18 ALA A HA 10 18
ATOM 10542 H HB1 . ALA A 1 18 ? 2.162 -6.559 -13.334 1.00 0.00 ? 18 ALA A HB1 10 18
ATOM 10543 H HB2 . ALA A 1 18 ? 0.673 -5.672 -13.323 1.00 0.00 ? 18 ALA A HB2 10 18
ATOM 10544 H HB3 . ALA A 1 18 ? 1.793 -5.589 -11.993 1.00 0.00 ? 18 ALA A HB3 10 18
ATOM 10545 N N . GLY A 1 19 ? 1.744 -7.980 -10.000 1.00 0.00 ? 19 GLY A N 10 19
ATOM 10546 C CA . GLY A 1 19 ? 2.401 -8.765 -8.994 1.00 0.00 ? 19 GLY A CA 10 19
ATOM 10547 C C . GLY A 1 19 ? 1.615 -10.019 -8.687 1.00 0.00 ? 19 GLY A C 10 19
ATOM 10548 O O . GLY A 1 19 ? 2.177 -11.093 -8.730 1.00 0.00 ? 19 GLY A O 10 19
ATOM 10549 H H . GLY A 1 19 ? 1.275 -7.164 -9.674 1.00 0.00 ? 19 GLY A H 10 19
ATOM 10550 H HA2 . GLY A 1 19 ? 3.369 -9.049 -9.384 1.00 0.00 ? 19 GLY A HA2 10 19
ATOM 10551 H HA3 . GLY A 1 19 ? 2.564 -8.206 -8.093 1.00 0.00 ? 19 GLY A HA3 10 19
ATOM 10552 N N . GLY A 1 20 ? 0.313 -9.913 -8.468 1.00 0.00 ? 20 GLY A N 10 20
ATOM 10553 C CA . GLY A 1 20 ? -0.609 -10.992 -8.297 1.00 0.00 ? 20 GLY A CA 10 20
ATOM 10554 C C . GLY A 1 20 ? -1.027 -11.271 -6.888 1.00 0.00 ? 20 GLY A C 10 20
ATOM 10555 O O . GLY A 1 20 ? -1.187 -12.411 -6.537 1.00 0.00 ? 20 GLY A O 10 20
ATOM 10556 H H . GLY A 1 20 ? -0.082 -9.016 -8.441 1.00 0.00 ? 20 GLY A H 10 20
ATOM 10557 H HA2 . GLY A 1 20 ? -1.476 -10.767 -8.851 1.00 0.00 ? 20 GLY A HA2 10 20
ATOM 10558 H HA3 . GLY A 1 20 ? -0.208 -11.875 -8.692 1.00 0.00 ? 20 GLY A HA3 10 20
ATOM 10559 N N . TYR A 1 21 ? -1.189 -10.271 -6.037 1.00 0.00 ? 21 TYR A N 10 21
ATOM 10560 C CA . TYR A 1 21 ? -1.673 -10.444 -4.696 1.00 0.00 ? 21 TYR A CA 10 21
ATOM 10561 C C . TYR A 1 21 ? -3.012 -11.131 -4.674 1.00 0.00 ? 21 TYR A C 10 21
ATOM 10562 O O . TYR A 1 21 ? -3.892 -10.845 -5.435 1.00 0.00 ? 21 TYR A O 10 21
ATOM 10563 C CB . TYR A 1 21 ? -1.729 -9.100 -4.001 1.00 0.00 ? 21 TYR A CB 10 21
ATOM 10564 C CG . TYR A 1 21 ? -0.438 -8.427 -3.624 1.00 0.00 ? 21 TYR A CG 10 21
ATOM 10565 C CD1 . TYR A 1 21 ? 0.493 -8.986 -2.753 1.00 0.00 ? 21 TYR A CD1 10 21
ATOM 10566 C CD2 . TYR A 1 21 ? -0.274 -7.110 -4.023 1.00 0.00 ? 21 TYR A CD2 10 21
ATOM 10567 C CE1 . TYR A 1 21 ? 1.579 -8.222 -2.326 1.00 0.00 ? 21 TYR A CE1 10 21
ATOM 10568 C CE2 . TYR A 1 21 ? 0.805 -6.324 -3.617 1.00 0.00 ? 21 TYR A CE2 10 21
ATOM 10569 C CZ . TYR A 1 21 ? 1.744 -6.905 -2.754 1.00 0.00 ? 21 TYR A CZ 10 21
ATOM 10570 O OH . TYR A 1 21 ? 2.836 -6.190 -2.366 1.00 0.00 ? 21 TYR A OH 10 21
ATOM 10571 H H . TYR A 1 21 ? -1.083 -9.329 -6.336 1.00 0.00 ? 21 TYR A H 10 21
ATOM 10572 H HA . TYR A 1 21 ? -0.971 -11.066 -4.156 1.00 0.00 ? 21 TYR A HA 10 21
ATOM 10573 H HB2 . TYR A 1 21 ? -2.285 -8.422 -4.649 1.00 0.00 ? 21 TYR A HB2 10 21
ATOM 10574 H HB3 . TYR A 1 21 ? -2.277 -9.173 -3.076 1.00 0.00 ? 21 TYR A HB3 10 21
ATOM 10575 H HD1 . TYR A 1 21 ? 0.383 -9.977 -2.359 1.00 0.00 ? 21 TYR A HD1 10 21
ATOM 10576 H HD2 . TYR A 1 21 ? -1.062 -6.706 -4.631 1.00 0.00 ? 21 TYR A HD2 10 21
ATOM 10577 H HE1 . TYR A 1 21 ? 2.303 -8.626 -1.646 1.00 0.00 ? 21 TYR A HE1 10 21
ATOM 10578 H HE2 . TYR A 1 21 ? 0.850 -5.307 -3.945 1.00 0.00 ? 21 TYR A HE2 10 21
ATOM 10579 H HH . TYR A 1 21 ? 3.551 -6.465 -2.911 1.00 0.00 ? 21 TYR A HH 10 21
HETATM 10580 N N . NH2 A 1 22 ? -3.211 -12.009 -3.736 1.00 0.00 ? 22 NH2 A N 10 22
HETATM 10581 H HN1 . NH2 A 1 22 ? -4.076 -12.455 -3.733 1.00 0.00 ? 22 NH2 A HN1 10 22
HETATM 10582 H HN2 . NH2 A 1 22 ? -2.474 -12.251 -3.120 1.00 0.00 ? 22 NH2 A HN2 10 22
HETATM 10583 C C . ACE B 1 1 ? 1.919 -13.647 -5.381 1.00 0.00 ? 23 ACE B C 10 1
HETATM 10584 O O . ACE B 1 1 ? 2.287 -12.513 -5.551 1.00 0.00 ? 23 ACE B O 10 1
HETATM 10585 C CH3 . ACE B 1 1 ? 1.427 -14.462 -6.532 1.00 0.00 ? 23 ACE B CH3 10 1
HETATM 10586 H H1 . ACE B 1 1 ? 1.157 -14.619 -6.676 1.00 0.00 ? 23 ACE B H1 10 1
HETATM 10587 H H2 . ACE B 1 1 ? 1.340 -14.611 -6.949 1.00 0.00 ? 23 ACE B H2 10 1
HETATM 10588 H H3 . ACE B 1 1 ? 1.424 -14.810 -6.778 1.00 0.00 ? 23 ACE B H3 10 1
ATOM 10589 N N . ALA B 1 2 ? 1.915 -14.208 -4.188 1.00 0.00 ? 24 ALA B N 10 2
ATOM 10590 C CA . ALA B 1 2 ? 2.276 -13.577 -2.949 1.00 0.00 ? 24 ALA B CA 10 2
ATOM 10591 C C . ALA B 1 2 ? 3.635 -12.929 -2.883 1.00 0.00 ? 24 ALA B C 10 2
ATOM 10592 O O . ALA B 1 2 ? 3.820 -11.998 -2.132 1.00 0.00 ? 24 ALA B O 10 2
ATOM 10593 C CB . ALA B 1 2 ? 2.127 -14.573 -1.861 1.00 0.00 ? 24 ALA B CB 10 2
ATOM 10594 H H . ALA B 1 2 ? 1.564 -15.109 -4.121 1.00 0.00 ? 24 ALA B H 10 2
ATOM 10595 H HA . ALA B 1 2 ? 1.561 -12.806 -2.790 1.00 0.00 ? 24 ALA B HA 10 2
ATOM 10596 H HB1 . ALA B 1 2 ? 2.883 -15.302 -1.906 1.00 0.00 ? 24 ALA B HB1 10 2
ATOM 10597 H HB2 . ALA B 1 2 ? 2.184 -14.080 -0.943 1.00 0.00 ? 24 ALA B HB2 10 2
ATOM 10598 H HB3 . ALA B 1 2 ? 1.184 -15.048 -1.915 1.00 0.00 ? 24 ALA B HB3 10 2
ATOM 10599 N N . LYS B 1 3 ? 4.586 -13.333 -3.700 1.00 0.00 ? 25 LYS B N 10 3
ATOM 10600 C CA . LYS B 1 3 ? 5.868 -12.703 -3.851 1.00 0.00 ? 25 LYS B CA 10 3
ATOM 10601 C C . LYS B 1 3 ? 5.848 -11.269 -4.350 1.00 0.00 ? 25 LYS B C 10 3
ATOM 10602 O O . LYS B 1 3 ? 6.827 -10.578 -4.159 1.00 0.00 ? 25 LYS B O 10 3
ATOM 10603 C CB . LYS B 1 3 ? 6.766 -13.468 -4.775 1.00 0.00 ? 25 LYS B CB 10 3
ATOM 10604 C CG . LYS B 1 3 ? 7.124 -14.828 -4.286 1.00 0.00 ? 25 LYS B CG 10 3
ATOM 10605 C CD . LYS B 1 3 ? 8.108 -15.520 -5.191 1.00 0.00 ? 25 LYS B CD 10 3
ATOM 10606 C CE . LYS B 1 3 ? 7.802 -16.371 -6.055 1.00 0.00 ? 25 LYS B CE 10 3
ATOM 10607 N NZ . LYS B 1 3 ? 8.753 -17.081 -6.856 1.00 0.00 ? 25 LYS B NZ 10 3
ATOM 10608 H H . LYS B 1 3 ? 4.368 -14.101 -4.298 1.00 0.00 ? 25 LYS B H 10 3
ATOM 10609 H HA . LYS B 1 3 ? 6.334 -12.678 -2.881 1.00 0.00 ? 25 LYS B HA 10 3
ATOM 10610 H HB2 . LYS B 1 3 ? 6.287 -13.551 -5.751 1.00 0.00 ? 25 LYS B HB2 10 3
ATOM 10611 H HB3 . LYS B 1 3 ? 7.681 -12.922 -4.904 1.00 0.00 ? 25 LYS B HB3 10 3
ATOM 10612 H HG2 . LYS B 1 3 ? 7.551 -14.755 -3.285 1.00 0.00 ? 25 LYS B HG2 10 3
ATOM 10613 H HG3 . LYS B 1 3 ? 6.214 -15.385 -4.196 1.00 0.00 ? 25 LYS B HG3 10 3
ATOM 10614 H HD2 . LYS B 1 3 ? 8.635 -14.725 -5.720 1.00 0.00 ? 25 LYS B HD2 10 3
ATOM 10615 H HD3 . LYS B 1 3 ? 8.679 -15.946 -4.778 1.00 0.00 ? 25 LYS B HD3 10 3
ATOM 10616 H HE2 . LYS B 1 3 ? 7.209 -17.133 -5.550 1.00 0.00 ? 25 LYS B HE2 10 3
ATOM 10617 H HE3 . LYS B 1 3 ? 7.285 -15.916 -6.502 1.00 0.00 ? 25 LYS B HE3 10 3
ATOM 10618 H HZ1 . LYS B 1 3 ? 9.132 -17.168 -7.000 1.00 0.00 ? 25 LYS B HZ1 10 3
ATOM 10619 H HZ2 . LYS B 1 3 ? 8.885 -17.345 -6.918 1.00 0.00 ? 25 LYS B HZ2 10 3
ATOM 10620 H HZ3 . LYS B 1 3 ? 8.982 -17.191 -7.266 1.00 0.00 ? 25 LYS B HZ3 10 3
ATOM 10621 N N . ALA B 1 4 ? 4.708 -10.782 -4.819 1.00 0.00 ? 26 ALA B N 10 4
ATOM 10622 C CA . ALA B 1 4 ? 4.370 -9.388 -4.967 1.00 0.00 ? 26 ALA B CA 10 4
ATOM 10623 C C . ALA B 1 4 ? 4.670 -8.544 -3.746 1.00 0.00 ? 26 ALA B C 10 4
ATOM 10624 O O . ALA B 1 4 ? 4.763 -7.333 -3.843 1.00 0.00 ? 26 ALA B O 10 4
ATOM 10625 C CB . ALA B 1 4 ? 2.896 -9.289 -5.330 1.00 0.00 ? 26 ALA B CB 10 4
ATOM 10626 H H . ALA B 1 4 ? 3.989 -11.457 -4.957 1.00 0.00 ? 26 ALA B H 10 4
ATOM 10627 H HA . ALA B 1 4 ? 4.933 -8.958 -5.774 1.00 0.00 ? 26 ALA B HA 10 4
ATOM 10628 H HB1 . ALA B 1 4 ? 2.754 -9.818 -6.258 1.00 0.00 ? 26 ALA B HB1 10 4
ATOM 10629 H HB2 . ALA B 1 4 ? 2.244 -9.718 -4.594 1.00 0.00 ? 26 ALA B HB2 10 4
ATOM 10630 H HB3 . ALA B 1 4 ? 2.602 -8.266 -5.469 1.00 0.00 ? 26 ALA B HB3 10 4
ATOM 10631 N N . ALA B 1 5 ? 4.862 -9.168 -2.589 1.00 0.00 ? 27 ALA B N 10 5
ATOM 10632 C CA . ALA B 1 5 ? 5.021 -8.590 -1.281 1.00 0.00 ? 27 ALA B CA 10 5
ATOM 10633 C C . ALA B 1 5 ? 6.256 -7.718 -1.143 1.00 0.00 ? 27 ALA B C 10 5
ATOM 10634 O O . ALA B 1 5 ? 6.178 -6.541 -1.465 1.00 0.00 ? 27 ALA B O 10 5
ATOM 10635 C CB . ALA B 1 5 ? 4.937 -9.713 -0.263 1.00 0.00 ? 27 ALA B CB 10 5
ATOM 10636 H H . ALA B 1 5 ? 4.884 -10.165 -2.646 1.00 0.00 ? 27 ALA B H 10 5
ATOM 10637 H HA . ALA B 1 5 ? 4.192 -7.918 -1.107 1.00 0.00 ? 27 ALA B HA 10 5
ATOM 10638 H HB1 . ALA B 1 5 ? 5.110 -9.344 0.723 1.00 0.00 ? 27 ALA B HB1 10 5
ATOM 10639 H HB2 . ALA B 1 5 ? 3.950 -10.131 -0.299 1.00 0.00 ? 27 ALA B HB2 10 5
ATOM 10640 H HB3 . ALA B 1 5 ? 5.647 -10.499 -0.456 1.00 0.00 ? 27 ALA B HB3 10 5
ATOM 10641 N N . ALA B 1 6 ? 7.394 -8.283 -0.750 1.00 0.00 ? 28 ALA B N 10 6
ATOM 10642 C CA . ALA B 1 6 ? 8.619 -7.532 -0.619 1.00 0.00 ? 28 ALA B CA 10 6
ATOM 10643 C C . ALA B 1 6 ? 9.307 -7.345 -1.954 1.00 0.00 ? 28 ALA B C 10 6
ATOM 10644 O O . ALA B 1 6 ? 10.510 -7.291 -2.041 1.00 0.00 ? 28 ALA B O 10 6
ATOM 10645 C CB . ALA B 1 6 ? 9.473 -8.217 0.421 1.00 0.00 ? 28 ALA B CB 10 6
ATOM 10646 H H . ALA B 1 6 ? 7.400 -9.268 -0.614 1.00 0.00 ? 28 ALA B H 10 6
ATOM 10647 H HA . ALA B 1 6 ? 8.310 -6.564 -0.236 1.00 0.00 ? 28 ALA B HA 10 6
ATOM 10648 H HB1 . ALA B 1 6 ? 10.314 -7.622 0.672 1.00 0.00 ? 28 ALA B HB1 10 6
ATOM 10649 H HB2 . ALA B 1 6 ? 8.891 -8.408 1.297 1.00 0.00 ? 28 ALA B HB2 10 6
ATOM 10650 H HB3 . ALA B 1 6 ? 9.812 -9.155 0.068 1.00 0.00 ? 28 ALA B HB3 10 6
ATOM 10651 N N . ALA B 1 7 ? 8.513 -7.183 -2.996 1.00 0.00 ? 29 ALA B N 10 7
ATOM 10652 C CA . ALA B 1 7 ? 8.840 -6.614 -4.284 1.00 0.00 ? 29 ALA B CA 10 7
ATOM 10653 C C . ALA B 1 7 ? 8.180 -5.267 -4.500 1.00 0.00 ? 29 ALA B C 10 7
ATOM 10654 O O . ALA B 1 7 ? 8.768 -4.420 -5.126 1.00 0.00 ? 29 ALA B O 10 7
ATOM 10655 C CB . ALA B 1 7 ? 8.396 -7.601 -5.349 1.00 0.00 ? 29 ALA B CB 10 7
ATOM 10656 H H . ALA B 1 7 ? 7.556 -7.237 -2.734 1.00 0.00 ? 29 ALA B H 10 7
ATOM 10657 H HA . ALA B 1 7 ? 9.907 -6.452 -4.359 1.00 0.00 ? 29 ALA B HA 10 7
ATOM 10658 H HB1 . ALA B 1 7 ? 7.340 -7.761 -5.318 1.00 0.00 ? 29 ALA B HB1 10 7
ATOM 10659 H HB2 . ALA B 1 7 ? 8.671 -7.245 -6.318 1.00 0.00 ? 29 ALA B HB2 10 7
ATOM 10660 H HB3 . ALA B 1 7 ? 8.900 -8.519 -5.159 1.00 0.00 ? 29 ALA B HB3 10 7
ATOM 10661 N N . ALA B 1 8 ? 6.970 -5.069 -3.996 1.00 0.00 ? 30 ALA B N 10 8
ATOM 10662 C CA . ALA B 1 8 ? 6.297 -3.788 -4.004 1.00 0.00 ? 30 ALA B CA 10 8
ATOM 10663 C C . ALA B 1 8 ? 6.468 -3.046 -2.693 1.00 0.00 ? 30 ALA B C 10 8
ATOM 10664 O O . ALA B 1 8 ? 6.948 -1.927 -2.626 1.00 0.00 ? 30 ALA B O 10 8
ATOM 10665 C CB . ALA B 1 8 ? 4.837 -3.986 -4.355 1.00 0.00 ? 30 ALA B CB 10 8
ATOM 10666 H H . ALA B 1 8 ? 6.517 -5.808 -3.501 1.00 0.00 ? 30 ALA B H 10 8
ATOM 10667 H HA . ALA B 1 8 ? 6.738 -3.149 -4.760 1.00 0.00 ? 30 ALA B HA 10 8
ATOM 10668 H HB1 . ALA B 1 8 ? 4.325 -4.434 -3.522 1.00 0.00 ? 30 ALA B HB1 10 8
ATOM 10669 H HB2 . ALA B 1 8 ? 4.395 -3.031 -4.599 1.00 0.00 ? 30 ALA B HB2 10 8
ATOM 10670 H HB3 . ALA B 1 8 ? 4.757 -4.663 -5.179 1.00 0.00 ? 30 ALA B HB3 10 8
ATOM 10671 N N . ILE B 1 9 ? 6.101 -3.701 -1.599 1.00 0.00 ? 31 ILE B N 10 9
ATOM 10672 C CA . ILE B 1 9 ? 6.115 -3.198 -0.245 1.00 0.00 ? 31 ILE B CA 10 9
ATOM 10673 C C . ILE B 1 9 ? 7.468 -2.645 0.165 1.00 0.00 ? 31 ILE B C 10 9
ATOM 10674 O O . ILE B 1 9 ? 7.529 -1.672 0.894 1.00 0.00 ? 31 ILE B O 10 9
ATOM 10675 C CB . ILE B 1 9 ? 5.648 -4.240 0.759 1.00 0.00 ? 31 ILE B CB 10 9
ATOM 10676 C CG1 . ILE B 1 9 ? 4.290 -4.865 0.484 1.00 0.00 ? 31 ILE B CG1 10 9
ATOM 10677 C CG2 . ILE B 1 9 ? 5.676 -3.682 2.171 1.00 0.00 ? 31 ILE B CG2 10 9
ATOM 10678 C CD1 . ILE B 1 9 ? 3.204 -3.881 0.245 1.00 0.00 ? 31 ILE B CD1 10 9
ATOM 10679 H H . ILE B 1 9 ? 5.776 -4.638 -1.712 1.00 0.00 ? 31 ILE B H 10 9
ATOM 10680 H HA . ILE B 1 9 ? 5.412 -2.374 -0.189 1.00 0.00 ? 31 ILE B HA 10 9
ATOM 10681 H HB . ILE B 1 9 ? 6.415 -5.006 0.747 1.00 0.00 ? 31 ILE B HB 10 9
ATOM 10682 H HG12 . ILE B 1 9 ? 4.377 -5.509 -0.390 1.00 0.00 ? 31 ILE B HG12 10 9
ATOM 10683 H HG13 . ILE B 1 9 ? 4.005 -5.485 1.281 1.00 0.00 ? 31 ILE B HG13 10 9
ATOM 10684 H HG21 . ILE B 1 9 ? 5.217 -4.408 2.829 1.00 0.00 ? 31 ILE B HG21 10 9
ATOM 10685 H HG22 . ILE B 1 9 ? 6.698 -3.541 2.497 1.00 0.00 ? 31 ILE B HG22 10 9
ATOM 10686 H HG23 . ILE B 1 9 ? 5.164 -2.734 2.171 1.00 0.00 ? 31 ILE B HG23 10 9
ATOM 10687 H HD11 . ILE B 1 9 ? 3.406 -3.391 -0.620 1.00 0.00 ? 31 ILE B HD11 10 9
ATOM 10688 H HD12 . ILE B 1 9 ? 2.283 -4.366 0.138 1.00 0.00 ? 31 ILE B HD12 10 9
ATOM 10689 H HD13 . ILE B 1 9 ? 3.159 -3.222 1.026 1.00 0.00 ? 31 ILE B HD13 10 9
ATOM 10690 N N . LYS B 1 10 ? 8.550 -3.238 -0.334 1.00 0.00 ? 32 LYS B N 10 10
ATOM 10691 C CA . LYS B 1 10 ? 9.906 -2.778 -0.135 1.00 0.00 ? 32 LYS B CA 10 10
ATOM 10692 C C . LYS B 1 10 ? 10.123 -1.314 -0.478 1.00 0.00 ? 32 LYS B C 10 10
ATOM 10693 O O . LYS B 1 10 ? 10.472 -0.476 0.343 1.00 0.00 ? 32 LYS B O 10 10
ATOM 10694 C CB . LYS B 1 10 ? 10.884 -3.707 -0.841 1.00 0.00 ? 32 LYS B CB 10 10
ATOM 10695 C CG . LYS B 1 10 ? 10.799 -3.961 -2.330 1.00 0.00 ? 32 LYS B CG 10 10
ATOM 10696 C CD . LYS B 1 10 ? 12.014 -4.667 -2.884 1.00 0.00 ? 32 LYS B CD 10 10
ATOM 10697 C CE . LYS B 1 10 ? 12.820 -4.219 -3.547 1.00 0.00 ? 32 LYS B CE 10 10
ATOM 10698 N NZ . LYS B 1 10 ? 13.929 -4.882 -4.155 1.00 0.00 ? 32 LYS B NZ 10 10
ATOM 10699 H H . LYS B 1 10 ? 8.342 -3.997 -0.956 1.00 0.00 ? 32 LYS B H 10 10
ATOM 10700 H HA . LYS B 1 10 ? 10.057 -2.786 0.936 1.00 0.00 ? 32 LYS B HA 10 10
ATOM 10701 H HB2 . LYS B 1 10 ? 11.892 -3.352 -0.626 1.00 0.00 ? 32 LYS B HB2 10 10
ATOM 10702 H HB3 . LYS B 1 10 ? 10.746 -4.663 -0.368 1.00 0.00 ? 32 LYS B HB3 10 10
ATOM 10703 H HG2 . LYS B 1 10 ? 9.912 -4.563 -2.528 1.00 0.00 ? 32 LYS B HG2 10 10
ATOM 10704 H HG3 . LYS B 1 10 ? 10.689 -3.057 -2.913 1.00 0.00 ? 32 LYS B HG3 10 10
ATOM 10705 H HD2 . LYS B 1 10 ? 12.529 -5.071 -2.012 1.00 0.00 ? 32 LYS B HD2 10 10
ATOM 10706 H HD3 . LYS B 1 10 ? 11.935 -5.203 -3.335 1.00 0.00 ? 32 LYS B HD3 10 10
ATOM 10707 H HE2 . LYS B 1 10 ? 12.290 -3.757 -4.380 1.00 0.00 ? 32 LYS B HE2 10 10
ATOM 10708 H HE3 . LYS B 1 10 ? 12.937 -3.709 -3.094 1.00 0.00 ? 32 LYS B HE3 10 10
ATOM 10709 H HZ1 . LYS B 1 10 ? 13.972 -5.465 -4.160 1.00 0.00 ? 32 LYS B HZ1 10 10
ATOM 10710 H HZ2 . LYS B 1 10 ? 14.162 -4.920 -4.756 1.00 0.00 ? 32 LYS B HZ2 10 10
ATOM 10711 H HZ3 . LYS B 1 10 ? 14.442 -4.819 -3.991 1.00 0.00 ? 32 LYS B HZ3 10 10
ATOM 10712 N N . ALA B 1 11 ? 9.875 -1.045 -1.757 1.00 0.00 ? 33 ALA B N 10 11
ATOM 10713 C CA . ALA B 1 11 ? 9.824 0.280 -2.333 1.00 0.00 ? 33 ALA B CA 10 11
ATOM 10714 C C . ALA B 1 11 ? 8.789 1.132 -1.621 1.00 0.00 ? 33 ALA B C 10 11
ATOM 10715 O O . ALA B 1 11 ? 9.103 2.241 -1.222 1.00 0.00 ? 33 ALA B O 10 11
ATOM 10716 C CB . ALA B 1 11 ? 9.581 0.198 -3.828 1.00 0.00 ? 33 ALA B CB 10 11
ATOM 10717 H H . ALA B 1 11 ? 9.675 -1.869 -2.290 1.00 0.00 ? 33 ALA B H 10 11
ATOM 10718 H HA . ALA B 1 11 ? 10.776 0.774 -2.199 1.00 0.00 ? 33 ALA B HA 10 11
ATOM 10719 H HB1 . ALA B 1 11 ? 9.486 0.910 -4.227 1.00 0.00 ? 33 ALA B HB1 10 11
ATOM 10720 H HB2 . ALA B 1 11 ? 8.925 -0.176 -4.050 1.00 0.00 ? 33 ALA B HB2 10 11
ATOM 10721 H HB3 . ALA B 1 11 ? 10.164 -0.177 -4.242 1.00 0.00 ? 33 ALA B HB3 10 11
ATOM 10722 N N . ILE B 1 12 ? 7.591 0.618 -1.356 1.00 0.00 ? 34 ILE B N 10 12
ATOM 10723 C CA . ILE B 1 12 ? 6.490 1.376 -0.821 1.00 0.00 ? 34 ILE B CA 10 12
ATOM 10724 C C . ILE B 1 12 ? 6.778 1.798 0.604 1.00 0.00 ? 34 ILE B C 10 12
ATOM 10725 O O . ILE B 1 12 ? 6.565 2.963 0.902 1.00 0.00 ? 34 ILE B O 10 12
ATOM 10726 C CB . ILE B 1 12 ? 5.156 0.683 -1.024 1.00 0.00 ? 34 ILE B CB 10 12
ATOM 10727 C CG1 . ILE B 1 12 ? 4.770 0.618 -2.488 1.00 0.00 ? 34 ILE B CG1 10 12
ATOM 10728 C CG2 . ILE B 1 12 ? 3.993 1.239 -0.225 1.00 0.00 ? 34 ILE B CG2 10 12
ATOM 10729 C CD1 . ILE B 1 12 ? 4.338 1.885 -3.187 1.00 0.00 ? 34 ILE B CD1 10 12
ATOM 10730 H H . ILE B 1 12 ? 7.514 -0.367 -1.537 1.00 0.00 ? 34 ILE B H 10 12
ATOM 10731 H HA . ILE B 1 12 ? 6.437 2.317 -1.356 1.00 0.00 ? 34 ILE B HA 10 12
ATOM 10732 H HB . ILE B 1 12 ? 5.309 -0.339 -0.693 1.00 0.00 ? 34 ILE B HB 10 12
ATOM 10733 H HG12 . ILE B 1 12 ? 5.620 0.212 -3.036 1.00 0.00 ? 34 ILE B HG12 10 12
ATOM 10734 H HG13 . ILE B 1 12 ? 3.973 -0.088 -2.577 1.00 0.00 ? 34 ILE B HG13 10 12
ATOM 10735 H HG21 . ILE B 1 12 ? 3.073 0.809 -0.555 1.00 0.00 ? 34 ILE B HG21 10 12
ATOM 10736 H HG22 . ILE B 1 12 ? 4.100 0.994 0.812 1.00 0.00 ? 34 ILE B HG22 10 12
ATOM 10737 H HG23 . ILE B 1 12 ? 3.918 2.298 -0.323 1.00 0.00 ? 34 ILE B HG23 10 12
ATOM 10738 H HD11 . ILE B 1 12 ? 3.461 2.228 -2.777 1.00 0.00 ? 34 ILE B HD11 10 12
ATOM 10739 H HD12 . ILE B 1 12 ? 5.076 2.593 -3.062 1.00 0.00 ? 34 ILE B HD12 10 12
ATOM 10740 H HD13 . ILE B 1 12 ? 4.160 1.750 -4.200 1.00 0.00 ? 34 ILE B HD13 10 12
ATOM 10741 N N . ALA B 1 13 ? 7.303 0.951 1.482 1.00 0.00 ? 35 ALA B N 10 13
ATOM 10742 C CA . ALA B 1 13 ? 7.580 1.388 2.832 1.00 0.00 ? 35 ALA B CA 10 13
ATOM 10743 C C . ALA B 1 13 ? 8.681 2.420 2.946 1.00 0.00 ? 35 ALA B C 10 13
ATOM 10744 O O . ALA B 1 13 ? 8.737 3.147 3.909 1.00 0.00 ? 35 ALA B O 10 13
ATOM 10745 C CB . ALA B 1 13 ? 7.872 0.157 3.664 1.00 0.00 ? 35 ALA B CB 10 13
ATOM 10746 H H . ALA B 1 13 ? 7.524 0.037 1.132 1.00 0.00 ? 35 ALA B H 10 13
ATOM 10747 H HA . ALA B 1 13 ? 6.690 1.848 3.232 1.00 0.00 ? 35 ALA B HA 10 13
ATOM 10748 H HB1 . ALA B 1 13 ? 7.039 -0.497 3.644 1.00 0.00 ? 35 ALA B HB1 10 13
ATOM 10749 H HB2 . ALA B 1 13 ? 8.732 -0.362 3.319 1.00 0.00 ? 35 ALA B HB2 10 13
ATOM 10750 H HB3 . ALA B 1 13 ? 8.039 0.490 4.668 1.00 0.00 ? 35 ALA B HB3 10 13
ATOM 10751 N N . ALA B 1 14 ? 9.504 2.553 1.914 1.00 0.00 ? 36 ALA B N 10 14
ATOM 10752 C CA . ALA B 1 14 ? 10.558 3.530 1.774 1.00 0.00 ? 36 ALA B CA 10 14
ATOM 10753 C C . ALA B 1 14 ? 10.091 4.800 1.093 1.00 0.00 ? 36 ALA B C 10 14
ATOM 10754 O O . ALA B 1 14 ? 10.405 5.908 1.482 1.00 0.00 ? 36 ALA B O 10 14
ATOM 10755 C CB . ALA B 1 14 ? 11.730 2.863 1.081 1.00 0.00 ? 36 ALA B CB 10 14
ATOM 10756 H H . ALA B 1 14 ? 9.235 1.990 1.155 1.00 0.00 ? 36 ALA B H 10 14
ATOM 10757 H HA . ALA B 1 14 ? 10.905 3.847 2.745 1.00 0.00 ? 36 ALA B HA 10 14
ATOM 10758 H HB1 . ALA B 1 14 ? 12.591 3.464 1.083 1.00 0.00 ? 36 ALA B HB1 10 14
ATOM 10759 H HB2 . ALA B 1 14 ? 11.966 1.976 1.558 1.00 0.00 ? 36 ALA B HB2 10 14
ATOM 10760 H HB3 . ALA B 1 14 ? 11.507 2.642 0.086 1.00 0.00 ? 36 ALA B HB3 10 14
ATOM 10761 N N . ILE B 1 15 ? 9.207 4.643 0.115 1.00 0.00 ? 37 ILE B N 10 15
ATOM 10762 C CA . ILE B 1 15 ? 8.479 5.684 -0.570 1.00 0.00 ? 37 ILE B CA 10 15
ATOM 10763 C C . ILE B 1 15 ? 7.542 6.400 0.386 1.00 0.00 ? 37 ILE B C 10 15
ATOM 10764 O O . ILE B 1 15 ? 7.393 7.607 0.304 1.00 0.00 ? 37 ILE B O 10 15
ATOM 10765 C CB . ILE B 1 15 ? 7.767 5.099 -1.778 1.00 0.00 ? 37 ILE B CB 10 15
ATOM 10766 C CG1 . ILE B 1 15 ? 8.732 4.858 -2.925 1.00 0.00 ? 37 ILE B CG1 10 15
ATOM 10767 C CG2 . ILE B 1 15 ? 6.544 5.867 -2.251 1.00 0.00 ? 37 ILE B CG2 10 15
ATOM 10768 C CD1 . ILE B 1 15 ? 8.251 3.883 -3.983 1.00 0.00 ? 37 ILE B CD1 10 15
ATOM 10769 H H . ILE B 1 15 ? 8.993 3.696 -0.116 1.00 0.00 ? 37 ILE B H 10 15
ATOM 10770 H HA . ILE B 1 15 ? 9.180 6.427 -0.936 1.00 0.00 ? 37 ILE B HA 10 15
ATOM 10771 H HB . ILE B 1 15 ? 7.390 4.125 -1.490 1.00 0.00 ? 37 ILE B HB 10 15
ATOM 10772 H HG12 . ILE B 1 15 ? 8.975 5.812 -3.392 1.00 0.00 ? 37 ILE B HG12 10 15
ATOM 10773 H HG13 . ILE B 1 15 ? 9.639 4.412 -2.543 1.00 0.00 ? 37 ILE B HG13 10 15
ATOM 10774 H HG21 . ILE B 1 15 ? 6.081 5.386 -3.099 1.00 0.00 ? 37 ILE B HG21 10 15
ATOM 10775 H HG22 . ILE B 1 15 ? 5.813 5.885 -1.461 1.00 0.00 ? 37 ILE B HG22 10 15
ATOM 10776 H HG23 . ILE B 1 15 ? 6.817 6.884 -2.479 1.00 0.00 ? 37 ILE B HG23 10 15
ATOM 10777 H HD11 . ILE B 1 15 ? 7.930 2.961 -3.588 1.00 0.00 ? 37 ILE B HD11 10 15
ATOM 10778 H HD12 . ILE B 1 15 ? 7.459 4.305 -4.541 1.00 0.00 ? 37 ILE B HD12 10 15
ATOM 10779 H HD13 . ILE B 1 15 ? 9.045 3.661 -4.653 1.00 0.00 ? 37 ILE B HD13 10 15
ATOM 10780 N N . ILE B 1 16 ? 6.926 5.668 1.309 1.00 0.00 ? 38 ILE B N 10 16
ATOM 10781 C CA . ILE B 1 16 ? 6.085 6.236 2.332 1.00 0.00 ? 38 ILE B CA 10 16
ATOM 10782 C C . ILE B 1 16 ? 6.849 7.169 3.248 1.00 0.00 ? 38 ILE B C 10 16
ATOM 10783 O O . ILE B 1 16 ? 6.478 8.325 3.406 1.00 0.00 ? 38 ILE B O 10 16
ATOM 10784 C CB . ILE B 1 16 ? 5.326 5.150 3.077 1.00 0.00 ? 38 ILE B CB 10 16
ATOM 10785 C CG1 . ILE B 1 16 ? 4.240 4.676 2.123 1.00 0.00 ? 38 ILE B CG1 10 16
ATOM 10786 C CG2 . ILE B 1 16 ? 4.729 5.669 4.374 1.00 0.00 ? 38 ILE B CG2 10 16
ATOM 10787 C CD1 . ILE B 1 16 ? 3.241 3.695 2.695 1.00 0.00 ? 38 ILE B CD1 10 16
ATOM 10788 H H . ILE B 1 16 ? 7.014 4.680 1.245 1.00 0.00 ? 38 ILE B H 10 16
ATOM 10789 H HA . ILE B 1 16 ? 5.353 6.856 1.826 1.00 0.00 ? 38 ILE B HA 10 16
ATOM 10790 H HB . ILE B 1 16 ? 6.046 4.362 3.268 1.00 0.00 ? 38 ILE B HB 10 16
ATOM 10791 H HG12 . ILE B 1 16 ? 3.693 5.551 1.773 1.00 0.00 ? 38 ILE B HG12 10 16
ATOM 10792 H HG13 . ILE B 1 16 ? 4.704 4.242 1.250 1.00 0.00 ? 38 ILE B HG13 10 16
ATOM 10793 H HG21 . ILE B 1 16 ? 4.036 6.468 4.148 1.00 0.00 ? 38 ILE B HG21 10 16
ATOM 10794 H HG22 . ILE B 1 16 ? 4.212 4.885 4.906 1.00 0.00 ? 38 ILE B HG22 10 16
ATOM 10795 H HG23 . ILE B 1 16 ? 5.494 6.004 5.056 1.00 0.00 ? 38 ILE B HG23 10 16
ATOM 10796 H HD11 . ILE B 1 16 ? 2.615 3.355 1.892 1.00 0.00 ? 38 ILE B HD11 10 16
ATOM 10797 H HD12 . ILE B 1 16 ? 3.752 2.884 3.171 1.00 0.00 ? 38 ILE B HD12 10 16
ATOM 10798 H HD13 . ILE B 1 16 ? 2.629 4.224 3.389 1.00 0.00 ? 38 ILE B HD13 10 16
ATOM 10799 N N . LYS B 1 17 ? 7.970 6.689 3.774 1.00 0.00 ? 39 LYS B N 10 17
ATOM 10800 C CA . LYS B 1 17 ? 8.899 7.445 4.575 1.00 0.00 ? 39 LYS B CA 10 17
ATOM 10801 C C . LYS B 1 17 ? 9.365 8.708 3.887 1.00 0.00 ? 39 LYS B C 10 17
ATOM 10802 O O . LYS B 1 17 ? 9.369 9.742 4.516 1.00 0.00 ? 39 LYS B O 10 17
ATOM 10803 C CB . LYS B 1 17 ? 10.056 6.548 4.968 1.00 0.00 ? 39 LYS B CB 10 17
ATOM 10804 C CG . LYS B 1 17 ? 10.975 7.083 6.030 1.00 0.00 ? 39 LYS B CG 10 17
ATOM 10805 C CD . LYS B 1 17 ? 10.363 7.307 7.377 1.00 0.00 ? 39 LYS B CD 10 17
ATOM 10806 C CE . LYS B 1 17 ? 9.871 6.081 8.021 1.00 0.00 ? 39 LYS B CE 10 17
ATOM 10807 N NZ . LYS B 1 17 ? 9.403 6.260 9.329 1.00 0.00 ? 39 LYS B NZ 10 17
ATOM 10808 H H . LYS B 1 17 ? 8.133 5.715 3.624 1.00 0.00 ? 39 LYS B H 10 17
ATOM 10809 H HA . LYS B 1 17 ? 8.372 7.737 5.475 1.00 0.00 ? 39 LYS B HA 10 17
ATOM 10810 H HB2 . LYS B 1 17 ? 9.641 5.605 5.324 1.00 0.00 ? 39 LYS B HB2 10 17
ATOM 10811 H HB3 . LYS B 1 17 ? 10.656 6.298 4.110 1.00 0.00 ? 39 LYS B HB3 10 17
ATOM 10812 H HG2 . LYS B 1 17 ? 11.809 6.391 6.143 1.00 0.00 ? 39 LYS B HG2 10 17
ATOM 10813 H HG3 . LYS B 1 17 ? 11.382 8.012 5.686 1.00 0.00 ? 39 LYS B HG3 10 17
ATOM 10814 H HD2 . LYS B 1 17 ? 11.123 7.746 8.023 1.00 0.00 ? 39 LYS B HD2 10 17
ATOM 10815 H HD3 . LYS B 1 17 ? 9.604 8.030 7.332 1.00 0.00 ? 39 LYS B HD3 10 17
ATOM 10816 H HE2 . LYS B 1 17 ? 9.062 5.668 7.418 1.00 0.00 ? 39 LYS B HE2 10 17
ATOM 10817 H HE3 . LYS B 1 17 ? 10.623 5.391 8.014 1.00 0.00 ? 39 LYS B HE3 10 17
ATOM 10818 H HZ1 . LYS B 1 17 ? 9.679 6.277 9.742 1.00 0.00 ? 39 LYS B HZ1 10 17
ATOM 10819 H HZ2 . LYS B 1 17 ? 9.161 6.644 9.537 1.00 0.00 ? 39 LYS B HZ2 10 17
ATOM 10820 H HZ3 . LYS B 1 17 ? 9.050 6.024 9.724 1.00 0.00 ? 39 LYS B HZ3 10 17
ATOM 10821 N N . ALA B 1 18 ? 9.665 8.673 2.602 1.00 0.00 ? 40 ALA B N 10 18
ATOM 10822 C CA . ALA B 1 18 ? 10.020 9.800 1.770 1.00 0.00 ? 40 ALA B CA 10 18
ATOM 10823 C C . ALA B 1 18 ? 8.865 10.662 1.294 1.00 0.00 ? 40 ALA B C 10 18
ATOM 10824 O O . ALA B 1 18 ? 9.059 11.751 0.829 1.00 0.00 ? 40 ALA B O 10 18
ATOM 10825 C CB . ALA B 1 18 ? 10.817 9.256 0.607 1.00 0.00 ? 40 ALA B CB 10 18
ATOM 10826 H H . ALA B 1 18 ? 9.568 7.779 2.175 1.00 0.00 ? 40 ALA B H 10 18
ATOM 10827 H HA . ALA B 1 18 ? 10.672 10.441 2.340 1.00 0.00 ? 40 ALA B HA 10 18
ATOM 10828 H HB1 . ALA B 1 18 ? 11.179 10.072 0.020 1.00 0.00 ? 40 ALA B HB1 10 18
ATOM 10829 H HB2 . ALA B 1 18 ? 11.664 8.697 0.964 1.00 0.00 ? 40 ALA B HB2 10 18
ATOM 10830 H HB3 . ALA B 1 18 ? 10.197 8.642 -0.014 1.00 0.00 ? 40 ALA B HB3 10 18
ATOM 10831 N N . GLY B 1 19 ? 7.647 10.163 1.356 1.00 0.00 ? 41 GLY B N 10 19
ATOM 10832 C CA . GLY B 1 19 ? 6.451 10.652 0.715 1.00 0.00 ? 41 GLY B CA 10 19
ATOM 10833 C C . GLY B 1 19 ? 5.629 11.666 1.481 1.00 0.00 ? 41 GLY B C 10 19
ATOM 10834 O O . GLY B 1 19 ? 4.781 12.314 0.905 1.00 0.00 ? 41 GLY B O 10 19
ATOM 10835 H H . GLY B 1 19 ? 7.620 9.240 1.673 1.00 0.00 ? 41 GLY B H 10 19
ATOM 10836 H HA2 . GLY B 1 19 ? 6.690 11.111 -0.230 1.00 0.00 ? 41 GLY B HA2 10 19
ATOM 10837 H HA3 . GLY B 1 19 ? 5.807 9.812 0.509 1.00 0.00 ? 41 GLY B HA3 10 19
ATOM 10838 N N . GLY B 1 20 ? 5.832 11.779 2.787 1.00 0.00 ? 42 GLY B N 10 20
ATOM 10839 C CA . GLY B 1 20 ? 5.128 12.722 3.613 1.00 0.00 ? 42 GLY B CA 10 20
ATOM 10840 C C . GLY B 1 20 ? 3.717 12.307 3.925 1.00 0.00 ? 42 GLY B C 10 20
ATOM 10841 O O . GLY B 1 20 ? 2.901 13.127 4.297 1.00 0.00 ? 42 GLY B O 10 20
ATOM 10842 H H . GLY B 1 20 ? 6.557 11.242 3.191 1.00 0.00 ? 42 GLY B H 10 20
ATOM 10843 H HA2 . GLY B 1 20 ? 5.684 12.814 4.519 1.00 0.00 ? 42 GLY B HA2 10 20
ATOM 10844 H HA3 . GLY B 1 20 ? 5.121 13.697 3.162 1.00 0.00 ? 42 GLY B HA3 10 20
ATOM 10845 N N . TYR B 1 21 ? 3.363 11.040 3.749 1.00 0.00 ? 43 TYR B N 10 21
ATOM 10846 C CA . TYR B 1 21 ? 2.119 10.427 4.101 1.00 0.00 ? 43 TYR B CA 10 21
ATOM 10847 C C . TYR B 1 21 ? 1.760 10.487 5.544 1.00 0.00 ? 43 TYR B C 10 21
ATOM 10848 O O . TYR B 1 21 ? 0.652 10.442 5.869 1.00 0.00 ? 43 TYR B O 10 21
ATOM 10849 C CB . TYR B 1 21 ? 2.226 8.996 3.612 1.00 0.00 ? 43 TYR B CB 10 21
ATOM 10850 C CG . TYR B 1 21 ? 1.863 8.700 2.182 1.00 0.00 ? 43 TYR B CG 10 21
ATOM 10851 C CD1 . TYR B 1 21 ? 0.567 8.809 1.686 1.00 0.00 ? 43 TYR B CD1 10 21
ATOM 10852 C CD2 . TYR B 1 21 ? 2.863 8.084 1.437 1.00 0.00 ? 43 TYR B CD2 10 21
ATOM 10853 C CE1 . TYR B 1 21 ? 0.250 8.229 0.462 1.00 0.00 ? 43 TYR B CE1 10 21
ATOM 10854 C CE2 . TYR B 1 21 ? 2.553 7.471 0.223 1.00 0.00 ? 43 TYR B CE2 10 21
ATOM 10855 C CZ . TYR B 1 21 ? 1.238 7.541 -0.250 1.00 0.00 ? 43 TYR B CZ 10 21
ATOM 10856 O OH . TYR B 1 21 ? 0.934 6.928 -1.422 1.00 0.00 ? 43 TYR B OH 10 21
ATOM 10857 H H . TYR B 1 21 ? 4.043 10.375 3.446 1.00 0.00 ? 43 TYR B H 10 21
ATOM 10858 H HA . TYR B 1 21 ? 1.317 10.906 3.580 1.00 0.00 ? 43 TYR B HA 10 21
ATOM 10859 H HB2 . TYR B 1 21 ? 3.265 8.695 3.744 1.00 0.00 ? 43 TYR B HB2 10 21
ATOM 10860 H HB3 . TYR B 1 21 ? 1.662 8.335 4.256 1.00 0.00 ? 43 TYR B HB3 10 21
ATOM 10861 H HD1 . TYR B 1 21 ? -0.207 9.240 2.271 1.00 0.00 ? 43 TYR B HD1 10 21
ATOM 10862 H HD2 . TYR B 1 21 ? 3.830 7.963 1.870 1.00 0.00 ? 43 TYR B HD2 10 21
ATOM 10863 H HE1 . TYR B 1 21 ? -0.757 8.213 0.118 1.00 0.00 ? 43 TYR B HE1 10 21
ATOM 10864 H HE2 . TYR B 1 21 ? 3.306 6.931 -0.298 1.00 0.00 ? 43 TYR B HE2 10 21
ATOM 10865 H HH . TYR B 1 21 ? 1.467 7.304 -2.094 1.00 0.00 ? 43 TYR B HH 10 21
HETATM 10866 N N . NH2 B 1 22 ? 2.668 10.611 6.428 1.00 0.00 ? 44 NH2 B N 10 22
HETATM 10867 H HN1 . NH2 B 1 22 ? 2.437 10.653 7.361 1.00 0.00 ? 44 NH2 B HN1 10 22
HETATM 10868 H HN2 . NH2 B 1 22 ? 3.552 10.754 6.131 1.00 0.00 ? 44 NH2 B HN2 10 22
HETATM 10869 C C . ACE C 1 1 ? -8.031 13.113 -4.193 1.00 0.00 ? 45 ACE C C 10 1
HETATM 10870 O O . ACE C 1 1 ? -7.412 13.953 -3.591 1.00 0.00 ? 45 ACE C O 10 1
HETATM 10871 C CH3 . ACE C 1 1 ? -9.206 13.518 -5.030 1.00 0.00 ? 45 ACE C CH3 10 1
HETATM 10872 H H1 . ACE C 1 1 ? -9.262 14.033 -5.421 1.00 0.00 ? 45 ACE C H1 10 1
HETATM 10873 H H2 . ACE C 1 1 ? -9.498 13.217 -5.470 1.00 0.00 ? 45 ACE C H2 10 1
HETATM 10874 H H3 . ACE C 1 1 ? -9.764 13.655 -4.844 1.00 0.00 ? 45 ACE C H3 10 1
ATOM 10875 N N . ALA C 1 2 ? -7.744 11.829 -4.141 1.00 0.00 ? 46 ALA C N 10 2
ATOM 10876 C CA . ALA C 1 2 ? -6.719 11.172 -3.394 1.00 0.00 ? 46 ALA C CA 10 2
ATOM 10877 C C . ALA C 1 2 ? -6.738 11.434 -1.908 1.00 0.00 ? 46 ALA C C 10 2
ATOM 10878 O O . ALA C 1 2 ? -5.788 11.108 -1.236 1.00 0.00 ? 46 ALA C O 10 2
ATOM 10879 C CB . ALA C 1 2 ? -5.392 11.444 -4.058 1.00 0.00 ? 46 ALA C CB 10 2
ATOM 10880 H H . ALA C 1 2 ? -8.344 11.251 -4.670 1.00 0.00 ? 46 ALA C H 10 2
ATOM 10881 H HA . ALA C 1 2 ? -6.891 10.121 -3.494 1.00 0.00 ? 46 ALA C HA 10 2
ATOM 10882 H HB1 . ALA C 1 2 ? -4.826 10.960 -4.074 1.00 0.00 ? 46 ALA C HB1 10 2
ATOM 10883 H HB2 . ALA C 1 2 ? -5.033 11.956 -3.831 1.00 0.00 ? 46 ALA C HB2 10 2
ATOM 10884 H HB3 . ALA C 1 2 ? -5.298 11.575 -4.757 1.00 0.00 ? 46 ALA C HB3 10 2
ATOM 10885 N N . LYS C 1 3 ? -7.801 11.979 -1.341 1.00 0.00 ? 47 LYS C N 10 3
ATOM 10886 C CA . LYS C 1 3 ? -8.013 12.235 0.062 1.00 0.00 ? 47 LYS C CA 10 3
ATOM 10887 C C . LYS C 1 3 ? -8.008 10.984 0.911 1.00 0.00 ? 47 LYS C C 10 3
ATOM 10888 O O . LYS C 1 3 ? -7.837 11.083 2.114 1.00 0.00 ? 47 LYS C O 10 3
ATOM 10889 C CB . LYS C 1 3 ? -9.342 12.924 0.294 1.00 0.00 ? 47 LYS C CB 10 3
ATOM 10890 C CG . LYS C 1 3 ? -9.685 14.070 -0.621 1.00 0.00 ? 47 LYS C CG 10 3
ATOM 10891 C CD . LYS C 1 3 ? -8.794 15.271 -0.522 1.00 0.00 ? 47 LYS C CD 10 3
ATOM 10892 C CE . LYS C 1 3 ? -9.190 16.281 -1.533 1.00 0.00 ? 47 LYS C CE 10 3
ATOM 10893 N NZ . LYS C 1 3 ? -8.432 17.461 -1.436 1.00 0.00 ? 47 LYS C NZ 10 3
ATOM 10894 H H . LYS C 1 3 ? -8.557 12.165 -1.953 1.00 0.00 ? 47 LYS C H 10 3
ATOM 10895 H HA . LYS C 1 3 ? -7.224 12.889 0.400 1.00 0.00 ? 47 LYS C HA 10 3
ATOM 10896 H HB2 . LYS C 1 3 ? -10.130 12.175 0.211 1.00 0.00 ? 47 LYS C HB2 10 3
ATOM 10897 H HB3 . LYS C 1 3 ? -9.372 13.298 1.301 1.00 0.00 ? 47 LYS C HB3 10 3
ATOM 10898 H HG2 . LYS C 1 3 ? -9.699 13.718 -1.652 1.00 0.00 ? 47 LYS C HG2 10 3
ATOM 10899 H HG3 . LYS C 1 3 ? -10.675 14.384 -0.338 1.00 0.00 ? 47 LYS C HG3 10 3
ATOM 10900 H HD2 . LYS C 1 3 ? -8.838 15.696 0.481 1.00 0.00 ? 47 LYS C HD2 10 3
ATOM 10901 H HD3 . LYS C 1 3 ? -7.794 14.976 -0.720 1.00 0.00 ? 47 LYS C HD3 10 3
ATOM 10902 H HE2 . LYS C 1 3 ? -9.079 15.853 -2.530 1.00 0.00 ? 47 LYS C HE2 10 3
ATOM 10903 H HE3 . LYS C 1 3 ? -10.186 16.556 -1.423 1.00 0.00 ? 47 LYS C HE3 10 3
ATOM 10904 H HZ1 . LYS C 1 3 ? -8.674 17.960 -0.692 1.00 0.00 ? 47 LYS C HZ1 10 3
ATOM 10905 H HZ2 . LYS C 1 3 ? -7.534 17.237 -1.394 1.00 0.00 ? 47 LYS C HZ2 10 3
ATOM 10906 H HZ3 . LYS C 1 3 ? -8.546 18.031 -2.181 1.00 0.00 ? 47 LYS C HZ3 10 3
ATOM 10907 N N . ALA C 1 4 ? -8.164 9.812 0.313 1.00 0.00 ? 48 ALA C N 10 4
ATOM 10908 C CA . ALA C 1 4 ? -8.088 8.485 0.865 1.00 0.00 ? 48 ALA C CA 10 4
ATOM 10909 C C . ALA C 1 4 ? -6.770 8.157 1.536 1.00 0.00 ? 48 ALA C C 10 4
ATOM 10910 O O . ALA C 1 4 ? -6.586 7.069 2.052 1.00 0.00 ? 48 ALA C O 10 4
ATOM 10911 C CB . ALA C 1 4 ? -8.435 7.523 -0.256 1.00 0.00 ? 48 ALA C CB 10 4
ATOM 10912 H H . ALA C 1 4 ? -8.335 9.902 -0.673 1.00 0.00 ? 48 ALA C H 10 4
ATOM 10913 H HA . ALA C 1 4 ? -8.859 8.407 1.607 1.00 0.00 ? 48 ALA C HA 10 4
ATOM 10914 H HB1 . ALA C 1 4 ? -9.442 7.700 -0.520 1.00 0.00 ? 48 ALA C HB1 10 4
ATOM 10915 H HB2 . ALA C 1 4 ? -7.832 7.619 -1.122 1.00 0.00 ? 48 ALA C HB2 10 4
ATOM 10916 H HB3 . ALA C 1 4 ? -8.337 6.518 0.092 1.00 0.00 ? 48 ALA C HB3 10 4
ATOM 10917 N N . ALA C 1 5 ? -5.823 9.085 1.477 1.00 0.00 ? 49 ALA C N 10 5
ATOM 10918 C CA . ALA C 1 5 ? -4.410 8.926 1.722 1.00 0.00 ? 49 ALA C CA 10 5
ATOM 10919 C C . ALA C 1 5 ? -4.060 8.617 3.166 1.00 0.00 ? 49 ALA C C 10 5
ATOM 10920 O O . ALA C 1 5 ? -3.877 7.458 3.507 1.00 0.00 ? 49 ALA C O 10 5
ATOM 10921 C CB . ALA C 1 5 ? -3.658 10.087 1.097 1.00 0.00 ? 49 ALA C CB 10 5
ATOM 10922 H H . ALA C 1 5 ? -6.140 9.990 1.199 1.00 0.00 ? 49 ALA C H 10 5
ATOM 10923 H HA . ALA C 1 5 ? -4.095 8.032 1.193 1.00 0.00 ? 49 ALA C HA 10 5
ATOM 10924 H HB1 . ALA C 1 5 ? -3.971 11.034 1.481 1.00 0.00 ? 49 ALA C HB1 10 5
ATOM 10925 H HB2 . ALA C 1 5 ? -2.630 9.949 1.304 1.00 0.00 ? 49 ALA C HB2 10 5
ATOM 10926 H HB3 . ALA C 1 5 ? -3.856 10.094 0.043 1.00 0.00 ? 49 ALA C HB3 10 5
ATOM 10927 N N . ALA C 1 6 ? -4.017 9.616 4.043 1.00 0.00 ? 50 ALA C N 10 6
ATOM 10928 C CA . ALA C 1 6 ? -3.681 9.479 5.440 1.00 0.00 ? 50 ALA C CA 10 6
ATOM 10929 C C . ALA C 1 6 ? -4.664 8.699 6.289 1.00 0.00 ? 50 ALA C C 10 6
ATOM 10930 O O . ALA C 1 6 ? -4.414 8.497 7.466 1.00 0.00 ? 50 ALA C O 10 6
ATOM 10931 C CB . ALA C 1 6 ? -3.410 10.854 6.013 1.00 0.00 ? 50 ALA C CB 10 6
ATOM 10932 H H . ALA C 1 6 ? -4.213 10.533 3.701 1.00 0.00 ? 50 ALA C H 10 6
ATOM 10933 H HA . ALA C 1 6 ? -2.762 8.916 5.435 1.00 0.00 ? 50 ALA C HA 10 6
ATOM 10934 H HB1 . ALA C 1 6 ? -2.685 11.317 5.452 1.00 0.00 ? 50 ALA C HB1 10 6
ATOM 10935 H HB2 . ALA C 1 6 ? -4.252 11.416 6.042 1.00 0.00 ? 50 ALA C HB2 10 6
ATOM 10936 H HB3 . ALA C 1 6 ? -3.038 10.799 6.974 1.00 0.00 ? 50 ALA C HB3 10 6
ATOM 10937 N N . ALA C 1 7 ? -5.761 8.200 5.734 1.00 0.00 ? 51 ALA C N 10 7
ATOM 10938 C CA . ALA C 1 7 ? -6.542 7.122 6.284 1.00 0.00 ? 51 ALA C CA 10 7
ATOM 10939 C C . ALA C 1 7 ? -5.894 5.790 5.956 1.00 0.00 ? 51 ALA C C 10 7
ATOM 10940 O O . ALA C 1 7 ? -5.495 5.096 6.865 1.00 0.00 ? 51 ALA C O 10 7
ATOM 10941 C CB . ALA C 1 7 ? -7.979 7.226 5.811 1.00 0.00 ? 51 ALA C CB 10 7
ATOM 10942 H H . ALA C 1 7 ? -5.956 8.459 4.798 1.00 0.00 ? 51 ALA C H 10 7
ATOM 10943 H HA . ALA C 1 7 ? -6.561 7.201 7.365 1.00 0.00 ? 51 ALA C HA 10 7
ATOM 10944 H HB1 . ALA C 1 7 ? -8.049 7.132 4.746 1.00 0.00 ? 51 ALA C HB1 10 7
ATOM 10945 H HB2 . ALA C 1 7 ? -8.555 6.481 6.287 1.00 0.00 ? 51 ALA C HB2 10 7
ATOM 10946 H HB3 . ALA C 1 7 ? -8.409 8.161 6.102 1.00 0.00 ? 51 ALA C HB3 10 7
ATOM 10947 N N . ALA C 1 8 ? -5.815 5.410 4.695 1.00 0.00 ? 52 ALA C N 10 8
ATOM 10948 C CA . ALA C 1 8 ? -5.418 4.085 4.286 1.00 0.00 ? 52 ALA C CA 10 8
ATOM 10949 C C . ALA C 1 8 ? -4.000 3.753 4.712 1.00 0.00 ? 52 ALA C C 10 8
ATOM 10950 O O . ALA C 1 8 ? -3.812 2.776 5.414 1.00 0.00 ? 52 ALA C O 10 8
ATOM 10951 C CB . ALA C 1 8 ? -5.503 3.899 2.781 1.00 0.00 ? 52 ALA C CB 10 8
ATOM 10952 H H . ALA C 1 8 ? -6.042 6.070 3.985 1.00 0.00 ? 52 ALA C H 10 8
ATOM 10953 H HA . ALA C 1 8 ? -6.073 3.364 4.751 1.00 0.00 ? 52 ALA C HA 10 8
ATOM 10954 H HB1 . ALA C 1 8 ? -5.425 2.864 2.559 1.00 0.00 ? 52 ALA C HB1 10 8
ATOM 10955 H HB2 . ALA C 1 8 ? -6.452 4.247 2.404 1.00 0.00 ? 52 ALA C HB2 10 8
ATOM 10956 H HB3 . ALA C 1 8 ? -4.700 4.428 2.321 1.00 0.00 ? 52 ALA C HB3 10 8
ATOM 10957 N N . ILE C 1 9 ? -2.993 4.494 4.262 1.00 0.00 ? 53 ILE C N 10 9
ATOM 10958 C CA . ILE C 1 9 ? -1.611 4.077 4.357 1.00 0.00 ? 53 ILE C CA 10 9
ATOM 10959 C C . ILE C 1 9 ? -1.122 4.092 5.793 1.00 0.00 ? 53 ILE C C 10 9
ATOM 10960 O O . ILE C 1 9 ? -0.093 3.503 6.089 1.00 0.00 ? 53 ILE C O 10 9
ATOM 10961 C CB . ILE C 1 9 ? -0.679 4.825 3.413 1.00 0.00 ? 53 ILE C CB 10 9
ATOM 10962 C CG1 . ILE C 1 9 ? 0.032 6.018 4.013 1.00 0.00 ? 53 ILE C CG1 10 9
ATOM 10963 C CG2 . ILE C 1 9 ? -1.291 5.230 2.088 1.00 0.00 ? 53 ILE C CG2 10 9
ATOM 10964 C CD1 . ILE C 1 9 ? -0.882 7.075 4.588 1.00 0.00 ? 53 ILE C CD1 10 9
ATOM 10965 H H . ILE C 1 9 ? -3.157 5.365 3.796 1.00 0.00 ? 53 ILE C H 10 9
ATOM 10966 H HA . ILE C 1 9 ? -1.600 3.059 3.987 1.00 0.00 ? 53 ILE C HA 10 9
ATOM 10967 H HB . ILE C 1 9 ? 0.117 4.124 3.200 1.00 0.00 ? 53 ILE C HB 10 9
ATOM 10968 H HG12 . ILE C 1 9 ? 0.723 5.681 4.785 1.00 0.00 ? 53 ILE C HG12 10 9
ATOM 10969 H HG13 . ILE C 1 9 ? 0.593 6.450 3.208 1.00 0.00 ? 53 ILE C HG13 10 9
ATOM 10970 H HG21 . ILE C 1 9 ? -1.978 6.043 2.235 1.00 0.00 ? 53 ILE C HG21 10 9
ATOM 10971 H HG22 . ILE C 1 9 ? -0.482 5.547 1.453 1.00 0.00 ? 53 ILE C HG22 10 9
ATOM 10972 H HG23 . ILE C 1 9 ? -1.784 4.387 1.660 1.00 0.00 ? 53 ILE C HG23 10 9
ATOM 10973 H HD11 . ILE C 1 9 ? -1.755 6.628 5.019 1.00 0.00 ? 53 ILE C HD11 10 9
ATOM 10974 H HD12 . ILE C 1 9 ? -0.419 7.614 5.339 1.00 0.00 ? 53 ILE C HD12 10 9
ATOM 10975 H HD13 . ILE C 1 9 ? -1.185 7.701 3.815 1.00 0.00 ? 53 ILE C HD13 10 9
ATOM 10976 N N . LYS C 1 10 ? -1.888 4.729 6.673 1.00 0.00 ? 54 LYS C N 10 10
ATOM 10977 C CA . LYS C 1 10 ? -1.522 5.139 8.010 1.00 0.00 ? 54 LYS C CA 10 10
ATOM 10978 C C . LYS C 1 10 ? -1.860 4.012 8.968 1.00 0.00 ? 54 LYS C C 10 10
ATOM 10979 O O . LYS C 1 10 ? -1.023 3.663 9.780 1.00 0.00 ? 54 LYS C O 10 10
ATOM 10980 C CB . LYS C 1 10 ? -2.306 6.424 8.220 1.00 0.00 ? 54 LYS C CB 10 10
ATOM 10981 C CG . LYS C 1 10 ? -1.795 7.434 9.202 1.00 0.00 ? 54 LYS C CG 10 10
ATOM 10982 C CD . LYS C 1 10 ? -1.973 7.055 10.628 1.00 0.00 ? 54 LYS C CD 10 10
ATOM 10983 C CE . LYS C 1 10 ? -1.713 8.190 11.524 1.00 0.00 ? 54 LYS C CE 10 10
ATOM 10984 N NZ . LYS C 1 10 ? -1.921 7.818 12.892 1.00 0.00 ? 54 LYS C NZ 10 10
ATOM 10985 H H . LYS C 1 10 ? -2.737 5.113 6.325 1.00 0.00 ? 54 LYS C H 10 10
ATOM 10986 H HA . LYS C 1 10 ? -0.454 5.325 8.016 1.00 0.00 ? 54 LYS C HA 10 10
ATOM 10987 H HB2 . LYS C 1 10 ? -2.331 6.930 7.254 1.00 0.00 ? 54 LYS C HB2 10 10
ATOM 10988 H HB3 . LYS C 1 10 ? -3.318 6.193 8.398 1.00 0.00 ? 54 LYS C HB3 10 10
ATOM 10989 H HG2 . LYS C 1 10 ? -0.738 7.622 9.012 1.00 0.00 ? 54 LYS C HG2 10 10
ATOM 10990 H HG3 . LYS C 1 10 ? -2.341 8.341 9.010 1.00 0.00 ? 54 LYS C HG3 10 10
ATOM 10991 H HD2 . LYS C 1 10 ? -2.990 6.693 10.782 1.00 0.00 ? 54 LYS C HD2 10 10
ATOM 10992 H HD3 . LYS C 1 10 ? -1.326 6.266 10.884 1.00 0.00 ? 54 LYS C HD3 10 10
ATOM 10993 H HE2 . LYS C 1 10 ? -0.690 8.540 11.391 1.00 0.00 ? 54 LYS C HE2 10 10
ATOM 10994 H HE3 . LYS C 1 10 ? -2.351 8.984 11.256 1.00 0.00 ? 54 LYS C HE3 10 10
ATOM 10995 H HZ1 . LYS C 1 10 ? -1.942 8.238 13.352 1.00 0.00 ? 54 LYS C HZ1 10 10
ATOM 10996 H HZ2 . LYS C 1 10 ? -2.426 7.493 13.135 1.00 0.00 ? 54 LYS C HZ2 10 10
ATOM 10997 H HZ3 . LYS C 1 10 ? -1.514 7.463 13.203 1.00 0.00 ? 54 LYS C HZ3 10 10
ATOM 10998 N N . ALA C 1 11 ? -2.990 3.352 8.777 1.00 0.00 ? 55 ALA C N 10 11
ATOM 10999 C CA . ALA C 1 11 ? -3.253 2.045 9.327 1.00 0.00 ? 55 ALA C CA 10 11
ATOM 11000 C C . ALA C 1 11 ? -2.324 1.008 8.727 1.00 0.00 ? 55 ALA C C 10 11
ATOM 11001 O O . ALA C 1 11 ? -1.735 0.204 9.432 1.00 0.00 ? 55 ALA C O 10 11
ATOM 11002 C CB . ALA C 1 11 ? -4.714 1.714 9.141 1.00 0.00 ? 55 ALA C CB 10 11
ATOM 11003 H H . ALA C 1 11 ? -3.544 3.645 7.993 1.00 0.00 ? 55 ALA C H 10 11
ATOM 11004 H HA . ALA C 1 11 ? -3.056 2.033 10.389 1.00 0.00 ? 55 ALA C HA 10 11
ATOM 11005 H HB1 . ALA C 1 11 ? -5.291 2.348 9.625 1.00 0.00 ? 55 ALA C HB1 10 11
ATOM 11006 H HB2 . ALA C 1 11 ? -4.974 1.676 8.167 1.00 0.00 ? 55 ALA C HB2 10 11
ATOM 11007 H HB3 . ALA C 1 11 ? -4.946 0.814 9.511 1.00 0.00 ? 55 ALA C HB3 10 11
ATOM 11008 N N . ILE C 1 12 ? -2.154 0.985 7.408 1.00 0.00 ? 56 ILE C N 10 12
ATOM 11009 C CA . ILE C 1 12 ? -1.415 -0.036 6.698 1.00 0.00 ? 56 ILE C CA 10 12
ATOM 11010 C C . ILE C 1 12 ? 0.048 -0.031 7.099 1.00 0.00 ? 56 ILE C C 10 12
ATOM 11011 O O . ILE C 1 12 ? 0.568 -1.101 7.379 1.00 0.00 ? 56 ILE C O 10 12
ATOM 11012 C CB . ILE C 1 12 ? -1.717 0.013 5.210 1.00 0.00 ? 56 ILE C CB 10 12
ATOM 11013 C CG1 . ILE C 1 12 ? -2.853 -0.924 4.871 1.00 0.00 ? 56 ILE C CG1 10 12
ATOM 11014 C CG2 . ILE C 1 12 ? -0.551 -0.383 4.329 1.00 0.00 ? 56 ILE C CG2 10 12
ATOM 11015 C CD1 . ILE C 1 12 ? -4.202 -0.542 5.348 1.00 0.00 ? 56 ILE C CD1 10 12
ATOM 11016 H H . ILE C 1 12 ? -2.497 1.770 6.886 1.00 0.00 ? 56 ILE C H 10 12
ATOM 11017 H HA . ILE C 1 12 ? -1.739 -1.012 7.047 1.00 0.00 ? 56 ILE C HA 10 12
ATOM 11018 H HB . ILE C 1 12 ? -2.019 1.006 4.919 1.00 0.00 ? 56 ILE C HB 10 12
ATOM 11019 H HG12 . ILE C 1 12 ? -2.885 -1.032 3.787 1.00 0.00 ? 56 ILE C HG12 10 12
ATOM 11020 H HG13 . ILE C 1 12 ? -2.696 -1.874 5.270 1.00 0.00 ? 56 ILE C HG13 10 12
ATOM 11021 H HG21 . ILE C 1 12 ? -0.247 -1.389 4.530 1.00 0.00 ? 56 ILE C HG21 10 12
ATOM 11022 H HG22 . ILE C 1 12 ? -0.856 -0.325 3.297 1.00 0.00 ? 56 ILE C HG22 10 12
ATOM 11023 H HG23 . ILE C 1 12 ? 0.285 0.273 4.460 1.00 0.00 ? 56 ILE C HG23 10 12
ATOM 11024 H HD11 . ILE C 1 12 ? -4.210 -0.501 6.389 1.00 0.00 ? 56 ILE C HD11 10 12
ATOM 11025 H HD12 . ILE C 1 12 ? -4.486 0.348 4.925 1.00 0.00 ? 56 ILE C HD12 10 12
ATOM 11026 H HD13 . ILE C 1 12 ? -4.922 -1.267 5.042 1.00 0.00 ? 56 ILE C HD13 10 12
ATOM 11027 N N . ALA C 1 13 ? 0.696 1.113 7.306 1.00 0.00 ? 57 ALA C N 10 13
ATOM 11028 C CA . ALA C 1 13 ? 2.072 1.103 7.734 1.00 0.00 ? 57 ALA C CA 10 13
ATOM 11029 C C . ALA C 1 13 ? 2.338 0.453 9.075 1.00 0.00 ? 57 ALA C C 10 13
ATOM 11030 O O . ALA C 1 13 ? 3.428 -0.049 9.318 1.00 0.00 ? 57 ALA C O 10 13
ATOM 11031 C CB . ALA C 1 13 ? 2.574 2.531 7.737 1.00 0.00 ? 57 ALA C CB 10 13
ATOM 11032 H H . ALA C 1 13 ? 0.185 1.964 7.186 1.00 0.00 ? 57 ALA C H 10 13
ATOM 11033 H HA . ALA C 1 13 ? 2.659 0.551 7.012 1.00 0.00 ? 57 ALA C HA 10 13
ATOM 11034 H HB1 . ALA C 1 13 ? 3.583 2.542 8.082 1.00 0.00 ? 57 ALA C HB1 10 13
ATOM 11035 H HB2 . ALA C 1 13 ? 2.523 2.947 6.752 1.00 0.00 ? 57 ALA C HB2 10 13
ATOM 11036 H HB3 . ALA C 1 13 ? 1.978 3.115 8.398 1.00 0.00 ? 57 ALA C HB3 10 13
ATOM 11037 N N . ALA C 1 14 ? 1.343 0.388 9.953 1.00 0.00 ? 58 ALA C N 10 14
ATOM 11038 C CA . ALA C 1 14 ? 1.394 -0.284 11.231 1.00 0.00 ? 58 ALA C CA 10 14
ATOM 11039 C C . ALA C 1 14 ? 1.036 -1.754 11.110 1.00 0.00 ? 58 ALA C C 10 14
ATOM 11040 O O . ALA C 1 14 ? 1.674 -2.621 11.663 1.00 0.00 ? 58 ALA C O 10 14
ATOM 11041 C CB . ALA C 1 14 ? 0.471 0.470 12.169 1.00 0.00 ? 58 ALA C CB 10 14
ATOM 11042 H H . ALA C 1 14 ? 0.476 0.718 9.580 1.00 0.00 ? 58 ALA C H 10 14
ATOM 11043 H HA . ALA C 1 14 ? 2.393 -0.235 11.634 1.00 0.00 ? 58 ALA C HA 10 14
ATOM 11044 H HB1 . ALA C 1 14 ? 0.537 0.040 13.122 1.00 0.00 ? 58 ALA C HB1 10 14
ATOM 11045 H HB2 . ALA C 1 14 ? 0.749 1.483 12.263 1.00 0.00 ? 58 ALA C HB2 10 14
ATOM 11046 H HB3 . ALA C 1 14 ? -0.528 0.439 11.847 1.00 0.00 ? 58 ALA C HB3 10 14
ATOM 11047 N N . ILE C 1 15 ? 0.080 -2.081 10.250 1.00 0.00 ? 59 ILE C N 10 15
ATOM 11048 C CA . ILE C 1 15 ? -0.267 -3.418 9.841 1.00 0.00 ? 59 ILE C CA 10 15
ATOM 11049 C C . ILE C 1 15 ? 0.884 -4.085 9.117 1.00 0.00 ? 59 ILE C C 10 15
ATOM 11050 O O . ILE C 1 15 ? 1.079 -5.277 9.267 1.00 0.00 ? 59 ILE C O 10 15
ATOM 11051 C CB . ILE C 1 15 ? -1.547 -3.344 9.029 1.00 0.00 ? 59 ILE C CB 10 15
ATOM 11052 C CG1 . ILE C 1 15 ? -2.751 -3.003 9.890 1.00 0.00 ? 59 ILE C CG1 10 15
ATOM 11053 C CG2 . ILE C 1 15 ? -1.816 -4.600 8.219 1.00 0.00 ? 59 ILE C CG2 10 15
ATOM 11054 C CD1 . ILE C 1 15 ? -3.909 -2.381 9.136 1.00 0.00 ? 59 ILE C CD1 10 15
ATOM 11055 H H . ILE C 1 15 ? -0.362 -1.296 9.825 1.00 0.00 ? 59 ILE C H 10 15
ATOM 11056 H HA . ILE C 1 15 ? -0.495 -3.992 10.732 1.00 0.00 ? 59 ILE C HA 10 15
ATOM 11057 H HB . ILE C 1 15 ? -1.392 -2.551 8.308 1.00 0.00 ? 59 ILE C HB 10 15
ATOM 11058 H HG12 . ILE C 1 15 ? -3.093 -3.906 10.396 1.00 0.00 ? 59 ILE C HG12 10 15
ATOM 11059 H HG13 . ILE C 1 15 ? -2.454 -2.294 10.638 1.00 0.00 ? 59 ILE C HG13 10 15
ATOM 11060 H HG21 . ILE C 1 15 ? -1.072 -4.699 7.443 1.00 0.00 ? 59 ILE C HG21 10 15
ATOM 11061 H HG22 . ILE C 1 15 ? -1.820 -5.466 8.839 1.00 0.00 ? 59 ILE C HG22 10 15
ATOM 11062 H HG23 . ILE C 1 15 ? -2.759 -4.518 7.709 1.00 0.00 ? 59 ILE C HG23 10 15
ATOM 11063 H HD11 . ILE C 1 15 ? -3.580 -1.520 8.608 1.00 0.00 ? 59 ILE C HD11 10 15
ATOM 11064 H HD12 . ILE C 1 15 ? -4.309 -3.074 8.456 1.00 0.00 ? 59 ILE C HD12 10 15
ATOM 11065 H HD13 . ILE C 1 15 ? -4.672 -2.093 9.825 1.00 0.00 ? 59 ILE C HD13 10 15
ATOM 11066 N N . ILE C 1 16 ? 1.678 -3.339 8.358 1.00 0.00 ? 60 ILE C N 10 16
ATOM 11067 C CA . ILE C 1 16 ? 2.894 -3.803 7.728 1.00 0.00 ? 60 ILE C CA 10 16
ATOM 11068 C C . ILE C 1 16 ? 3.923 -4.281 8.728 1.00 0.00 ? 60 ILE C C 10 16
ATOM 11069 O O . ILE C 1 16 ? 4.456 -5.367 8.581 1.00 0.00 ? 60 ILE C O 10 16
ATOM 11070 C CB . ILE C 1 16 ? 3.451 -2.727 6.812 1.00 0.00 ? 60 ILE C CB 10 16
ATOM 11071 C CG1 . ILE C 1 16 ? 2.602 -2.704 5.556 1.00 0.00 ? 60 ILE C CG1 10 16
ATOM 11072 C CG2 . ILE C 1 16 ? 4.918 -2.858 6.454 1.00 0.00 ? 60 ILE C CG2 10 16
ATOM 11073 C CD1 . ILE C 1 16 ? 3.055 -1.776 4.445 1.00 0.00 ? 60 ILE C CD1 10 16
ATOM 11074 H H . ILE C 1 16 ? 1.387 -2.397 8.195 1.00 0.00 ? 60 ILE C H 10 16
ATOM 11075 H HA . ILE C 1 16 ? 2.634 -4.674 7.141 1.00 0.00 ? 60 ILE C HA 10 16
ATOM 11076 H HB . ILE C 1 16 ? 3.304 -1.804 7.361 1.00 0.00 ? 60 ILE C HB 10 16
ATOM 11077 H HG12 . ILE C 1 16 ? 2.575 -3.717 5.156 1.00 0.00 ? 60 ILE C HG12 10 16
ATOM 11078 H HG13 . ILE C 1 16 ? 1.589 -2.460 5.810 1.00 0.00 ? 60 ILE C HG13 10 16
ATOM 11079 H HG21 . ILE C 1 16 ? 5.064 -3.725 5.851 1.00 0.00 ? 60 ILE C HG21 10 16
ATOM 11080 H HG22 . ILE C 1 16 ? 5.276 -2.020 5.907 1.00 0.00 ? 60 ILE C HG22 10 16
ATOM 11081 H HG23 . ILE C 1 16 ? 5.522 -2.932 7.318 1.00 0.00 ? 60 ILE C HG23 10 16
ATOM 11082 H HD11 . ILE C 1 16 ? 2.429 -1.818 3.706 1.00 0.00 ? 60 ILE C HD11 10 16
ATOM 11083 H HD12 . ILE C 1 16 ? 3.101 -0.855 4.733 1.00 0.00 ? 60 ILE C HD12 10 16
ATOM 11084 H HD13 . ILE C 1 16 ? 3.937 -2.035 4.095 1.00 0.00 ? 60 ILE C HD13 10 16
ATOM 11085 N N . LYS C 1 17 ? 4.184 -3.463 9.737 1.00 0.00 ? 61 LYS C N 10 17
ATOM 11086 C CA . LYS C 1 17 ? 5.118 -3.782 10.783 1.00 0.00 ? 61 LYS C CA 10 17
ATOM 11087 C C . LYS C 1 17 ? 4.725 -4.968 11.621 1.00 0.00 ? 61 LYS C C 10 17
ATOM 11088 O O . LYS C 1 17 ? 5.560 -5.802 11.889 1.00 0.00 ? 61 LYS C O 10 17
ATOM 11089 C CB . LYS C 1 17 ? 5.292 -2.558 11.636 1.00 0.00 ? 61 LYS C CB 10 17
ATOM 11090 C CG . LYS C 1 17 ? 6.425 -1.681 11.238 1.00 0.00 ? 61 LYS C CG 10 17
ATOM 11091 C CD . LYS C 1 17 ? 7.771 -2.202 11.618 1.00 0.00 ? 61 LYS C CD 10 17
ATOM 11092 C CE . LYS C 1 17 ? 8.808 -1.247 11.302 1.00 0.00 ? 61 LYS C CE 10 17
ATOM 11093 N NZ . LYS C 1 17 ? 10.123 -1.751 11.454 1.00 0.00 ? 61 LYS C NZ 10 17
ATOM 11094 H H . LYS C 1 17 ? 3.716 -2.584 9.701 1.00 0.00 ? 61 LYS C H 10 17
ATOM 11095 H HA . LYS C 1 17 ? 6.072 -4.024 10.364 1.00 0.00 ? 61 LYS C HA 10 17
ATOM 11096 H HB2 . LYS C 1 17 ? 4.373 -1.975 11.584 1.00 0.00 ? 61 LYS C HB2 10 17
ATOM 11097 H HB3 . LYS C 1 17 ? 5.406 -2.821 12.669 1.00 0.00 ? 61 LYS C HB3 10 17
ATOM 11098 H HG2 . LYS C 1 17 ? 6.390 -1.509 10.162 1.00 0.00 ? 61 LYS C HG2 10 17
ATOM 11099 H HG3 . LYS C 1 17 ? 6.309 -0.766 11.732 1.00 0.00 ? 61 LYS C HG3 10 17
ATOM 11100 H HD2 . LYS C 1 17 ? 7.791 -2.415 12.687 1.00 0.00 ? 61 LYS C HD2 10 17
ATOM 11101 H HD3 . LYS C 1 17 ? 7.933 -3.083 11.151 1.00 0.00 ? 61 LYS C HD3 10 17
ATOM 11102 H HE2 . LYS C 1 17 ? 8.675 -0.908 10.275 1.00 0.00 ? 61 LYS C HE2 10 17
ATOM 11103 H HE3 . LYS C 1 17 ? 8.710 -0.461 11.881 1.00 0.00 ? 61 LYS C HE3 10 17
ATOM 11104 H HZ1 . LYS C 1 17 ? 10.803 -1.130 11.301 1.00 0.00 ? 61 LYS C HZ1 10 17
ATOM 11105 H HZ2 . LYS C 1 17 ? 10.265 -2.078 12.300 1.00 0.00 ? 61 LYS C HZ2 10 17
ATOM 11106 H HZ3 . LYS C 1 17 ? 10.268 -2.443 10.895 1.00 0.00 ? 61 LYS C HZ3 10 17
ATOM 11107 N N . ALA C 1 18 ? 3.449 -5.123 11.929 1.00 0.00 ? 62 ALA C N 10 18
ATOM 11108 C CA . ALA C 1 18 ? 2.843 -6.316 12.454 1.00 0.00 ? 62 ALA C CA 10 18
ATOM 11109 C C . ALA C 1 18 ? 2.852 -7.478 11.500 1.00 0.00 ? 62 ALA C C 10 18
ATOM 11110 O O . ALA C 1 18 ? 2.885 -8.604 11.923 1.00 0.00 ? 62 ALA C O 10 18
ATOM 11111 C CB . ALA C 1 18 ? 1.448 -5.970 12.879 1.00 0.00 ? 62 ALA C CB 10 18
ATOM 11112 H H . ALA C 1 18 ? 2.883 -4.368 11.602 1.00 0.00 ? 62 ALA C H 10 18
ATOM 11113 H HA . ALA C 1 18 ? 3.371 -6.605 13.335 1.00 0.00 ? 62 ALA C HA 10 18
ATOM 11114 H HB1 . ALA C 1 18 ? 1.263 -5.561 12.780 1.00 0.00 ? 62 ALA C HB1 10 18
ATOM 11115 H HB2 . ALA C 1 18 ? 0.914 -6.224 12.779 1.00 0.00 ? 62 ALA C HB2 10 18
ATOM 11116 H HB3 . ALA C 1 18 ? 1.099 -5.913 13.418 1.00 0.00 ? 62 ALA C HB3 10 18
ATOM 11117 N N . GLY C 1 19 ? 2.777 -7.225 10.210 1.00 0.00 ? 63 GLY C N 10 19
ATOM 11118 C CA . GLY C 1 19 ? 2.664 -8.161 9.127 1.00 0.00 ? 63 GLY C CA 10 19
ATOM 11119 C C . GLY C 1 19 ? 3.916 -8.921 8.781 1.00 0.00 ? 63 GLY C C 10 19
ATOM 11120 O O . GLY C 1 19 ? 3.877 -9.895 8.121 1.00 0.00 ? 63 GLY C O 10 19
ATOM 11121 H H . GLY C 1 19 ? 2.654 -6.266 10.004 1.00 0.00 ? 63 GLY C H 10 19
ATOM 11122 H HA2 . GLY C 1 19 ? 1.940 -8.901 9.415 1.00 0.00 ? 63 GLY C HA2 10 19
ATOM 11123 H HA3 . GLY C 1 19 ? 2.302 -7.669 8.246 1.00 0.00 ? 63 GLY C HA3 10 19
ATOM 11124 N N . GLY C 1 20 ? 5.062 -8.467 9.188 1.00 0.00 ? 64 GLY C N 10 20
ATOM 11125 C CA . GLY C 1 20 ? 6.331 -9.096 8.927 1.00 0.00 ? 64 GLY C CA 10 20
ATOM 11126 C C . GLY C 1 20 ? 6.827 -8.977 7.517 1.00 0.00 ? 64 GLY C C 10 20
ATOM 11127 O O . GLY C 1 20 ? 7.629 -9.783 7.081 1.00 0.00 ? 64 GLY C O 10 20
ATOM 11128 H H . GLY C 1 20 ? 5.030 -7.658 9.726 1.00 0.00 ? 64 GLY C H 10 20
ATOM 11129 H HA2 . GLY C 1 20 ? 7.051 -8.602 9.533 1.00 0.00 ? 64 GLY C HA2 10 20
ATOM 11130 H HA3 . GLY C 1 20 ? 6.325 -10.123 9.205 1.00 0.00 ? 64 GLY C HA3 10 20
ATOM 11131 N N . TYR C 1 21 ? 6.332 -8.016 6.746 1.00 0.00 ? 65 TYR C N 10 21
ATOM 11132 C CA . TYR C 1 21 ? 6.703 -7.699 5.393 1.00 0.00 ? 65 TYR C CA 10 21
ATOM 11133 C C . TYR C 1 21 ? 8.141 -7.334 5.151 1.00 0.00 ? 65 TYR C C 10 21
ATOM 11134 O O . TYR C 1 21 ? 8.603 -7.474 4.041 1.00 0.00 ? 65 TYR C O 10 21
ATOM 11135 C CB . TYR C 1 21 ? 5.815 -6.539 4.976 1.00 0.00 ? 65 TYR C CB 10 21
ATOM 11136 C CG . TYR C 1 21 ? 4.497 -6.880 4.336 1.00 0.00 ? 65 TYR C CG 10 21
ATOM 11137 C CD1 . TYR C 1 21 ? 4.378 -7.587 3.146 1.00 0.00 ? 65 TYR C CD1 10 21
ATOM 11138 C CD2 . TYR C 1 21 ? 3.392 -6.276 4.908 1.00 0.00 ? 65 TYR C CD2 10 21
ATOM 11139 C CE1 . TYR C 1 21 ? 3.133 -7.692 2.526 1.00 0.00 ? 65 TYR C CE1 10 21
ATOM 11140 C CE2 . TYR C 1 21 ? 2.151 -6.316 4.270 1.00 0.00 ? 65 TYR C CE2 10 21
ATOM 11141 C CZ . TYR C 1 21 ? 2.041 -6.998 3.055 1.00 0.00 ? 65 TYR C CZ 10 21
ATOM 11142 O OH . TYR C 1 21 ? 0.826 -7.084 2.464 1.00 0.00 ? 65 TYR C OH 10 21
ATOM 11143 H H . TYR C 1 21 ? 5.685 -7.379 7.174 1.00 0.00 ? 65 TYR C H 10 21
ATOM 11144 H HA . TYR C 1 21 ? 6.501 -8.533 4.736 1.00 0.00 ? 65 TYR C HA 10 21
ATOM 11145 H HB2 . TYR C 1 21 ? 5.607 -5.958 5.874 1.00 0.00 ? 65 TYR C HB2 10 21
ATOM 11146 H HB3 . TYR C 1 21 ? 6.309 -5.850 4.300 1.00 0.00 ? 65 TYR C HB3 10 21
ATOM 11147 H HD1 . TYR C 1 21 ? 5.234 -8.034 2.694 1.00 0.00 ? 65 TYR C HD1 10 21
ATOM 11148 H HD2 . TYR C 1 21 ? 3.497 -5.759 5.838 1.00 0.00 ? 65 TYR C HD2 10 21
ATOM 11149 H HE1 . TYR C 1 21 ? 2.998 -8.235 1.621 1.00 0.00 ? 65 TYR C HE1 10 21
ATOM 11150 H HE2 . TYR C 1 21 ? 1.338 -5.802 4.743 1.00 0.00 ? 65 TYR C HE2 10 21
ATOM 11151 H HH . TYR C 1 21 ? 0.223 -7.413 3.084 1.00 0.00 ? 65 TYR C HH 10 21
HETATM 11152 N N . NH2 C 1 22 ? 8.869 -6.887 6.148 1.00 0.00 ? 66 NH2 C N 10 22
HETATM 11153 H HN1 . NH2 C 1 22 ? 9.833 -6.687 5.988 1.00 0.00 ? 66 NH2 C HN1 10 22
HETATM 11154 H HN2 . NH2 C 1 22 ? 8.444 -6.779 7.021 1.00 0.00 ? 66 NH2 C HN2 10 22
HETATM 11155 C C . ACE D 1 1 ? 6.780 -13.306 5.621 1.00 0.00 ? 67 ACE D C 10 1
HETATM 11156 O O . ACE D 1 1 ? 6.430 -14.192 4.855 1.00 0.00 ? 67 ACE D O 10 1
HETATM 11157 C CH3 . ACE D 1 1 ? 7.555 -13.661 6.867 1.00 0.00 ? 67 ACE D CH3 10 1
HETATM 11158 H H1 . ACE D 1 1 ? 7.825 -13.537 7.125 1.00 0.00 ? 67 ACE D H1 10 1
HETATM 11159 H H2 . ACE D 1 1 ? 7.579 -13.757 7.293 1.00 0.00 ? 67 ACE D H2 10 1
HETATM 11160 H H3 . ACE D 1 1 ? 7.830 -13.903 7.044 1.00 0.00 ? 67 ACE D H3 10 1
ATOM 11161 N N . ALA D 1 2 ? 6.467 -12.029 5.447 1.00 0.00 ? 68 ALA D N 10 2
ATOM 11162 C CA . ALA D 1 2 ? 5.676 -11.437 4.404 1.00 0.00 ? 68 ALA D CA 10 2
ATOM 11163 C C . ALA D 1 2 ? 4.335 -12.082 4.133 1.00 0.00 ? 68 ALA D C 10 2
ATOM 11164 O O . ALA D 1 2 ? 3.723 -11.784 3.134 1.00 0.00 ? 68 ALA D O 10 2
ATOM 11165 C CB . ALA D 1 2 ? 6.514 -11.292 3.152 1.00 0.00 ? 68 ALA D CB 10 2
ATOM 11166 H H . ALA D 1 2 ? 6.855 -11.378 6.098 1.00 0.00 ? 68 ALA D H 10 2
ATOM 11167 H HA . ALA D 1 2 ? 5.434 -10.443 4.729 1.00 0.00 ? 68 ALA D HA 10 2
ATOM 11168 H HB1 . ALA D 1 2 ? 7.136 -10.720 3.236 1.00 0.00 ? 68 ALA D HB1 10 2
ATOM 11169 H HB2 . ALA D 1 2 ? 6.936 -12.013 2.867 1.00 0.00 ? 68 ALA D HB2 10 2
ATOM 11170 H HB3 . ALA D 1 2 ? 6.087 -11.028 2.472 1.00 0.00 ? 68 ALA D HB3 10 2
ATOM 11171 N N . LYS D 1 3 ? 3.814 -12.907 5.036 1.00 0.00 ? 69 LYS D N 10 3
ATOM 11172 C CA . LYS D 1 3 ? 2.505 -13.504 4.962 1.00 0.00 ? 69 LYS D CA 10 3
ATOM 11173 C C . LYS D 1 3 ? 1.329 -12.550 5.039 1.00 0.00 ? 69 LYS D C 10 3
ATOM 11174 O O . LYS D 1 3 ? 0.252 -12.941 4.632 1.00 0.00 ? 69 LYS D O 10 3
ATOM 11175 C CB . LYS D 1 3 ? 2.363 -14.586 6.014 1.00 0.00 ? 69 LYS D CB 10 3
ATOM 11176 C CG . LYS D 1 3 ? 3.432 -15.657 6.048 1.00 0.00 ? 69 LYS D CG 10 3
ATOM 11177 C CD . LYS D 1 3 ? 3.564 -16.387 4.740 1.00 0.00 ? 69 LYS D CD 10 3
ATOM 11178 C CE . LYS D 1 3 ? 4.588 -17.502 4.773 1.00 0.00 ? 69 LYS D CE 10 3
ATOM 11179 N NZ . LYS D 1 3 ? 5.917 -17.042 4.936 1.00 0.00 ? 69 LYS D NZ 10 3
ATOM 11180 H H . LYS D 1 3 ? 4.350 -13.064 5.865 1.00 0.00 ? 69 LYS D H 10 3
ATOM 11181 H HA . LYS D 1 3 ? 2.393 -13.954 3.985 1.00 0.00 ? 69 LYS D HA 10 3
ATOM 11182 H HB2 . LYS D 1 3 ? 2.346 -14.104 6.991 1.00 0.00 ? 69 LYS D HB2 10 3
ATOM 11183 H HB3 . LYS D 1 3 ? 1.400 -15.034 5.885 1.00 0.00 ? 69 LYS D HB3 10 3
ATOM 11184 H HG2 . LYS D 1 3 ? 4.388 -15.193 6.289 1.00 0.00 ? 69 LYS D HG2 10 3
ATOM 11185 H HG3 . LYS D 1 3 ? 3.228 -16.345 6.845 1.00 0.00 ? 69 LYS D HG3 10 3
ATOM 11186 H HD2 . LYS D 1 3 ? 2.593 -16.802 4.473 1.00 0.00 ? 69 LYS D HD2 10 3
ATOM 11187 H HD3 . LYS D 1 3 ? 3.838 -15.723 3.952 1.00 0.00 ? 69 LYS D HD3 10 3
ATOM 11188 H HE2 . LYS D 1 3 ? 4.343 -18.201 5.573 1.00 0.00 ? 69 LYS D HE2 10 3
ATOM 11189 H HE3 . LYS D 1 3 ? 4.523 -18.012 3.857 1.00 0.00 ? 69 LYS D HE3 10 3
ATOM 11190 H HZ1 . LYS D 1 3 ? 6.131 -16.743 5.669 1.00 0.00 ? 69 LYS D HZ1 10 3
ATOM 11191 H HZ2 . LYS D 1 3 ? 6.531 -17.630 4.846 1.00 0.00 ? 69 LYS D HZ2 10 3
ATOM 11192 H HZ3 . LYS D 1 3 ? 6.085 -16.464 4.422 1.00 0.00 ? 69 LYS D HZ3 10 3
ATOM 11193 N N . ALA D 1 4 ? 1.542 -11.309 5.463 1.00 0.00 ? 70 ALA D N 10 4
ATOM 11194 C CA . ALA D 1 4 ? 0.594 -10.221 5.423 1.00 0.00 ? 70 ALA D CA 10 4
ATOM 11195 C C . ALA D 1 4 ? 0.044 -9.865 4.061 1.00 0.00 ? 70 ALA D C 10 4
ATOM 11196 O O . ALA D 1 4 ? -0.704 -8.910 3.928 1.00 0.00 ? 70 ALA D O 10 4
ATOM 11197 C CB . ALA D 1 4 ? 1.278 -9.031 6.065 1.00 0.00 ? 70 ALA D CB 10 4
ATOM 11198 H H . ALA D 1 4 ? 2.463 -11.128 5.795 1.00 0.00 ? 70 ALA D H 10 4
ATOM 11199 H HA . ALA D 1 4 ? -0.236 -10.508 6.053 1.00 0.00 ? 70 ALA D HA 10 4
ATOM 11200 H HB1 . ALA D 1 4 ? 2.212 -8.797 5.600 1.00 0.00 ? 70 ALA D HB1 10 4
ATOM 11201 H HB2 . ALA D 1 4 ? 0.650 -8.163 6.057 1.00 0.00 ? 70 ALA D HB2 10 4
ATOM 11202 H HB3 . ALA D 1 4 ? 1.505 -9.279 7.082 1.00 0.00 ? 70 ALA D HB3 10 4
ATOM 11203 N N . ALA D 1 5 ? 0.460 -10.591 3.032 1.00 0.00 ? 71 ALA D N 10 5
ATOM 11204 C CA . ALA D 1 5 ? 0.315 -10.283 1.629 1.00 0.00 ? 71 ALA D CA 10 5
ATOM 11205 C C . ALA D 1 5 ? -1.033 -10.626 1.020 1.00 0.00 ? 71 ALA D C 10 5
ATOM 11206 O O . ALA D 1 5 ? -1.218 -10.400 -0.161 1.00 0.00 ? 71 ALA D O 10 5
ATOM 11207 C CB . ALA D 1 5 ? 1.483 -10.905 0.891 1.00 0.00 ? 71 ALA D CB 10 5
ATOM 11208 H H . ALA D 1 5 ? 0.949 -11.415 3.298 1.00 0.00 ? 71 ALA D H 10 5
ATOM 11209 H HA . ALA D 1 5 ? 0.376 -9.207 1.509 1.00 0.00 ? 71 ALA D HA 10 5
ATOM 11210 H HB1 . ALA D 1 5 ? 1.462 -11.967 0.996 1.00 0.00 ? 71 ALA D HB1 10 5
ATOM 11211 H HB2 . ALA D 1 5 ? 1.473 -10.647 -0.143 1.00 0.00 ? 71 ALA D HB2 10 5
ATOM 11212 H HB3 . ALA D 1 5 ? 2.406 -10.546 1.308 1.00 0.00 ? 71 ALA D HB3 10 5
ATOM 11213 N N . ALA D 1 6 ? -1.991 -11.057 1.827 1.00 0.00 ? 72 ALA D N 10 6
ATOM 11214 C CA . ALA D 1 6 ? -3.384 -10.894 1.515 1.00 0.00 ? 72 ALA D CA 10 6
ATOM 11215 C C . ALA D 1 6 ? -4.007 -9.833 2.398 1.00 0.00 ? 72 ALA D C 10 6
ATOM 11216 O O . ALA D 1 6 ? -4.501 -8.836 1.902 1.00 0.00 ? 72 ALA D O 10 6
ATOM 11217 C CB . ALA D 1 6 ? -4.089 -12.235 1.574 1.00 0.00 ? 72 ALA D CB 10 6
ATOM 11218 H H . ALA D 1 6 ? -1.756 -11.332 2.759 1.00 0.00 ? 72 ALA D H 10 6
ATOM 11219 H HA . ALA D 1 6 ? -3.485 -10.512 0.504 1.00 0.00 ? 72 ALA D HA 10 6
ATOM 11220 H HB1 . ALA D 1 6 ? -3.575 -12.945 1.013 1.00 0.00 ? 72 ALA D HB1 10 6
ATOM 11221 H HB2 . ALA D 1 6 ? -4.163 -12.624 2.549 1.00 0.00 ? 72 ALA D HB2 10 6
ATOM 11222 H HB3 . ALA D 1 6 ? -5.058 -12.139 1.171 1.00 0.00 ? 72 ALA D HB3 10 6
ATOM 11223 N N . ALA D 1 7 ? -3.922 -9.957 3.718 1.00 0.00 ? 73 ALA D N 10 7
ATOM 11224 C CA . ALA D 1 7 ? -4.652 -9.197 4.704 1.00 0.00 ? 73 ALA D CA 10 7
ATOM 11225 C C . ALA D 1 7 ? -4.465 -7.699 4.583 1.00 0.00 ? 73 ALA D C 10 7
ATOM 11226 O O . ALA D 1 7 ? -5.393 -6.947 4.716 1.00 0.00 ? 73 ALA D O 10 7
ATOM 11227 C CB . ALA D 1 7 ? -4.261 -9.693 6.078 1.00 0.00 ? 73 ALA D CB 10 7
ATOM 11228 H H . ALA D 1 7 ? -3.405 -10.765 4.013 1.00 0.00 ? 73 ALA D H 10 7
ATOM 11229 H HA . ALA D 1 7 ? -5.710 -9.408 4.606 1.00 0.00 ? 73 ALA D HA 10 7
ATOM 11230 H HB1 . ALA D 1 7 ? -4.874 -9.246 6.832 1.00 0.00 ? 73 ALA D HB1 10 7
ATOM 11231 H HB2 . ALA D 1 7 ? -4.429 -10.743 6.149 1.00 0.00 ? 73 ALA D HB2 10 7
ATOM 11232 H HB3 . ALA D 1 7 ? -3.221 -9.526 6.294 1.00 0.00 ? 73 ALA D HB3 10 7
ATOM 11233 N N . ALA D 1 8 ? -3.252 -7.242 4.314 1.00 0.00 ? 74 ALA D N 10 8
ATOM 11234 C CA . ALA D 1 8 ? -2.963 -5.830 4.244 1.00 0.00 ? 74 ALA D CA 10 8
ATOM 11235 C C . ALA D 1 8 ? -3.371 -5.263 2.902 1.00 0.00 ? 74 ALA D C 10 8
ATOM 11236 O O . ALA D 1 8 ? -3.907 -4.174 2.779 1.00 0.00 ? 74 ALA D O 10 8
ATOM 11237 C CB . ALA D 1 8 ? -1.496 -5.578 4.528 1.00 0.00 ? 74 ALA D CB 10 8
ATOM 11238 H H . ALA D 1 8 ? -2.555 -7.902 4.043 1.00 0.00 ? 74 ALA D H 10 8
ATOM 11239 H HA . ALA D 1 8 ? -3.553 -5.336 5.003 1.00 0.00 ? 74 ALA D HA 10 8
ATOM 11240 H HB1 . ALA D 1 8 ? -1.193 -5.998 5.453 1.00 0.00 ? 74 ALA D HB1 10 8
ATOM 11241 H HB2 . ALA D 1 8 ? -0.888 -5.932 3.746 1.00 0.00 ? 74 ALA D HB2 10 8
ATOM 11242 H HB3 . ALA D 1 8 ? -1.320 -4.532 4.569 1.00 0.00 ? 74 ALA D HB3 10 8
ATOM 11243 N N . ILE D 1 9 ? -3.202 -6.060 1.849 1.00 0.00 ? 75 ILE D N 10 9
ATOM 11244 C CA . ILE D 1 9 ? -3.630 -5.744 0.504 1.00 0.00 ? 75 ILE D CA 10 9
ATOM 11245 C C . ILE D 1 9 ? -5.138 -5.698 0.348 1.00 0.00 ? 75 ILE D C 10 9
ATOM 11246 O O . ILE D 1 9 ? -5.676 -4.784 -0.249 1.00 0.00 ? 75 ILE D O 10 9
ATOM 11247 C CB . ILE D 1 9 ? -3.066 -6.772 -0.466 1.00 0.00 ? 75 ILE D CB 10 9
ATOM 11248 C CG1 . ILE D 1 9 ? -1.572 -7.008 -0.311 1.00 0.00 ? 75 ILE D CG1 10 9
ATOM 11249 C CG2 . ILE D 1 9 ? -3.421 -6.325 -1.874 1.00 0.00 ? 75 ILE D CG2 10 9
ATOM 11250 C CD1 . ILE D 1 9 ? -0.726 -5.756 -0.396 1.00 0.00 ? 75 ILE D CD1 10 9
ATOM 11251 H H . ILE D 1 9 ? -2.825 -6.969 2.015 1.00 0.00 ? 75 ILE D H 10 9
ATOM 11252 H HA . ILE D 1 9 ? -3.231 -4.764 0.277 1.00 0.00 ? 75 ILE D HA 10 9
ATOM 11253 H HB . ILE D 1 9 ? -3.601 -7.701 -0.294 1.00 0.00 ? 75 ILE D HB 10 9
ATOM 11254 H HG12 . ILE D 1 9 ? -1.393 -7.489 0.651 1.00 0.00 ? 75 ILE D HG12 10 9
ATOM 11255 H HG13 . ILE D 1 9 ? -1.229 -7.691 -1.072 1.00 0.00 ? 75 ILE D HG13 10 9
ATOM 11256 H HG21 . ILE D 1 9 ? -2.886 -6.942 -2.568 1.00 0.00 ? 75 ILE D HG21 10 9
ATOM 11257 H HG22 . ILE D 1 9 ? -4.466 -6.520 -2.051 1.00 0.00 ? 75 ILE D HG22 10 9
ATOM 11258 H HG23 . ILE D 1 9 ? -3.199 -5.285 -1.984 1.00 0.00 ? 75 ILE D HG23 10 9
ATOM 11259 H HD11 . ILE D 1 9 ? 0.319 -5.994 -0.427 1.00 0.00 ? 75 ILE D HD11 10 9
ATOM 11260 H HD12 . ILE D 1 9 ? -0.950 -5.206 -1.278 1.00 0.00 ? 75 ILE D HD12 10 9
ATOM 11261 H HD13 . ILE D 1 9 ? -0.931 -5.136 0.434 1.00 0.00 ? 75 ILE D HD13 10 9
ATOM 11262 N N . LYS D 1 10 ? -5.847 -6.664 0.917 1.00 0.00 ? 76 LYS D N 10 10
ATOM 11263 C CA . LYS D 1 10 ? -7.282 -6.807 0.837 1.00 0.00 ? 76 LYS D CA 10 10
ATOM 11264 C C . LYS D 1 10 ? -8.012 -5.676 1.531 1.00 0.00 ? 76 LYS D C 10 10
ATOM 11265 O O . LYS D 1 10 ? -9.080 -5.286 1.092 1.00 0.00 ? 76 LYS D O 10 10
ATOM 11266 C CB . LYS D 1 10 ? -7.663 -8.140 1.456 1.00 0.00 ? 76 LYS D CB 10 10
ATOM 11267 C CG . LYS D 1 10 ? -7.495 -9.267 0.464 1.00 0.00 ? 76 LYS D CG 10 10
ATOM 11268 C CD . LYS D 1 10 ? -8.071 -10.531 1.011 1.00 0.00 ? 76 LYS D CD 10 10
ATOM 11269 C CE . LYS D 1 10 ? -7.923 -11.716 0.110 1.00 0.00 ? 76 LYS D CE 10 10
ATOM 11270 N NZ . LYS D 1 10 ? -8.573 -11.588 -1.108 1.00 0.00 ? 76 LYS D NZ 10 10
ATOM 11271 H H . LYS D 1 10 ? -5.279 -7.344 1.388 1.00 0.00 ? 76 LYS D H 10 10
ATOM 11272 H HA . LYS D 1 10 ? -7.586 -6.710 -0.197 1.00 0.00 ? 76 LYS D HA 10 10
ATOM 11273 H HB2 . LYS D 1 10 ? -7.062 -8.328 2.345 1.00 0.00 ? 76 LYS D HB2 10 10
ATOM 11274 H HB3 . LYS D 1 10 ? -8.704 -8.109 1.748 1.00 0.00 ? 76 LYS D HB3 10 10
ATOM 11275 H HG2 . LYS D 1 10 ? -7.992 -9.008 -0.470 1.00 0.00 ? 76 LYS D HG2 10 10
ATOM 11276 H HG3 . LYS D 1 10 ? -6.462 -9.424 0.229 1.00 0.00 ? 76 LYS D HG3 10 10
ATOM 11277 H HD2 . LYS D 1 10 ? -7.593 -10.752 1.965 1.00 0.00 ? 76 LYS D HD2 10 10
ATOM 11278 H HD3 . LYS D 1 10 ? -9.091 -10.384 1.203 1.00 0.00 ? 76 LYS D HD3 10 10
ATOM 11279 H HE2 . LYS D 1 10 ? -6.863 -11.902 -0.065 1.00 0.00 ? 76 LYS D HE2 10 10
ATOM 11280 H HE3 . LYS D 1 10 ? -8.319 -12.547 0.580 1.00 0.00 ? 76 LYS D HE3 10 10
ATOM 11281 H HZ1 . LYS D 1 10 ? -9.250 -11.188 -1.165 1.00 0.00 ? 76 LYS D HZ1 10 10
ATOM 11282 H HZ2 . LYS D 1 10 ? -8.774 -12.266 -1.417 1.00 0.00 ? 76 LYS D HZ2 10 10
ATOM 11283 H HZ3 . LYS D 1 10 ? -8.182 -11.227 -1.668 1.00 0.00 ? 76 LYS D HZ3 10 10
ATOM 11284 N N . ALA D 1 11 ? -7.405 -5.134 2.578 1.00 0.00 ? 77 ALA D N 10 11
ATOM 11285 C CA . ALA D 1 11 ? -7.727 -3.822 3.092 1.00 0.00 ? 77 ALA D CA 10 11
ATOM 11286 C C . ALA D 1 11 ? -7.553 -2.763 2.021 1.00 0.00 ? 77 ALA D C 10 11
ATOM 11287 O O . ALA D 1 11 ? -8.510 -2.149 1.566 1.00 0.00 ? 77 ALA D O 10 11
ATOM 11288 C CB . ALA D 1 11 ? -6.967 -3.604 4.385 1.00 0.00 ? 77 ALA D CB 10 11
ATOM 11289 H H . ALA D 1 11 ? -6.648 -5.640 2.992 1.00 0.00 ? 77 ALA D H 10 11
ATOM 11290 H HA . ALA D 1 11 ? -8.785 -3.854 3.337 1.00 0.00 ? 77 ALA D HA 10 11
ATOM 11291 H HB1 . ALA D 1 11 ? -7.261 -2.707 4.885 1.00 0.00 ? 77 ALA D HB1 10 11
ATOM 11292 H HB2 . ALA D 1 11 ? -7.185 -4.385 5.059 1.00 0.00 ? 77 ALA D HB2 10 11
ATOM 11293 H HB3 . ALA D 1 11 ? -5.932 -3.579 4.229 1.00 0.00 ? 77 ALA D HB3 10 11
ATOM 11294 N N . ILE D 1 12 ? -6.334 -2.547 1.534 1.00 0.00 ? 78 ILE D N 10 12
ATOM 11295 C CA . ILE D 1 12 ? -5.989 -1.369 0.772 1.00 0.00 ? 78 ILE D CA 10 12
ATOM 11296 C C . ILE D 1 12 ? -6.663 -1.385 -0.588 1.00 0.00 ? 78 ILE D C 10 12
ATOM 11297 O O . ILE D 1 12 ? -7.235 -0.375 -0.971 1.00 0.00 ? 78 ILE D O 10 12
ATOM 11298 C CB . ILE D 1 12 ? -4.500 -1.056 0.793 1.00 0.00 ? 78 ILE D CB 10 12
ATOM 11299 C CG1 . ILE D 1 12 ? -4.355 0.434 0.988 1.00 0.00 ? 78 ILE D CG1 10 12
ATOM 11300 C CG2 . ILE D 1 12 ? -3.772 -1.585 -0.423 1.00 0.00 ? 78 ILE D CG2 10 12
ATOM 11301 C CD1 . ILE D 1 12 ? -2.946 0.990 0.990 1.00 0.00 ? 78 ILE D CD1 10 12
ATOM 11302 H H . ILE D 1 12 ? -5.618 -3.229 1.717 1.00 0.00 ? 78 ILE D H 10 12
ATOM 11303 H HA . ILE D 1 12 ? -6.492 -0.536 1.252 1.00 0.00 ? 78 ILE D HA 10 12
ATOM 11304 H HB . ILE D 1 12 ? -4.085 -1.544 1.661 1.00 0.00 ? 78 ILE D HB 10 12
ATOM 11305 H HG12 . ILE D 1 12 ? -4.919 0.944 0.207 1.00 0.00 ? 78 ILE D HG12 10 12
ATOM 11306 H HG13 . ILE D 1 12 ? -4.834 0.642 1.920 1.00 0.00 ? 78 ILE D HG13 10 12
ATOM 11307 H HG21 . ILE D 1 12 ? -4.126 -1.068 -1.295 1.00 0.00 ? 78 ILE D HG21 10 12
ATOM 11308 H HG22 . ILE D 1 12 ? -2.711 -1.415 -0.328 1.00 0.00 ? 78 ILE D HG22 10 12
ATOM 11309 H HG23 . ILE D 1 12 ? -4.005 -2.623 -0.548 1.00 0.00 ? 78 ILE D HG23 10 12
ATOM 11310 H HD11 . ILE D 1 12 ? -3.011 2.014 1.253 1.00 0.00 ? 78 ILE D HD11 10 12
ATOM 11311 H HD12 . ILE D 1 12 ? -2.352 0.490 1.699 1.00 0.00 ? 78 ILE D HD12 10 12
ATOM 11312 H HD13 . ILE D 1 12 ? -2.500 0.946 0.029 1.00 0.00 ? 78 ILE D HD13 10 12
ATOM 11313 N N . ALA D 1 13 ? -6.727 -2.519 -1.282 1.00 0.00 ? 79 ALA D N 10 13
ATOM 11314 C CA . ALA D 1 13 ? -7.407 -2.583 -2.553 1.00 0.00 ? 79 ALA D CA 10 13
ATOM 11315 C C . ALA D 1 13 ? -8.901 -2.332 -2.498 1.00 0.00 ? 79 ALA D C 10 13
ATOM 11316 O O . ALA D 1 13 ? -9.500 -1.964 -3.493 1.00 0.00 ? 79 ALA D O 10 13
ATOM 11317 C CB . ALA D 1 13 ? -7.130 -3.933 -3.193 1.00 0.00 ? 79 ALA D CB 10 13
ATOM 11318 H H . ALA D 1 13 ? -6.323 -3.334 -0.852 1.00 0.00 ? 79 ALA D H 10 13
ATOM 11319 H HA . ALA D 1 13 ? -6.995 -1.805 -3.184 1.00 0.00 ? 79 ALA D HA 10 13
ATOM 11320 H HB1 . ALA D 1 13 ? -7.553 -3.935 -4.163 1.00 0.00 ? 79 ALA D HB1 10 13
ATOM 11321 H HB2 . ALA D 1 13 ? -6.091 -4.078 -3.277 1.00 0.00 ? 79 ALA D HB2 10 13
ATOM 11322 H HB3 . ALA D 1 13 ? -7.589 -4.691 -2.608 1.00 0.00 ? 79 ALA D HB3 10 13
ATOM 11323 N N . ALA D 1 14 ? -9.515 -2.532 -1.339 1.00 0.00 ? 80 ALA D N 10 14
ATOM 11324 C CA . ALA D 1 14 ? -10.912 -2.266 -1.082 1.00 0.00 ? 80 ALA D CA 10 14
ATOM 11325 C C . ALA D 1 14 ? -11.134 -0.839 -0.623 1.00 0.00 ? 80 ALA D C 10 14
ATOM 11326 O O . ALA D 1 14 ? -12.076 -0.178 -1.038 1.00 0.00 ? 80 ALA D O 10 14
ATOM 11327 C CB . ALA D 1 14 ? -11.447 -3.281 -0.086 1.00 0.00 ? 80 ALA D CB 10 14
ATOM 11328 H H . ALA D 1 14 ? -8.914 -2.743 -0.571 1.00 0.00 ? 80 ALA D H 10 14
ATOM 11329 H HA . ALA D 1 14 ? -11.478 -2.350 -2.004 1.00 0.00 ? 80 ALA D HA 10 14
ATOM 11330 H HB1 . ALA D 1 14 ? -11.300 -4.260 -0.500 1.00 0.00 ? 80 ALA D HB1 10 14
ATOM 11331 H HB2 . ALA D 1 14 ? -10.923 -3.227 0.850 1.00 0.00 ? 80 ALA D HB2 10 14
ATOM 11332 H HB3 . ALA D 1 14 ? -12.472 -3.086 0.128 1.00 0.00 ? 80 ALA D HB3 10 14
ATOM 11333 N N . ILE D 1 15 ? -10.198 -0.323 0.169 1.00 0.00 ? 81 ILE D N 10 15
ATOM 11334 C CA . ILE D 1 15 ? -10.131 1.058 0.591 1.00 0.00 ? 81 ILE D CA 10 15
ATOM 11335 C C . ILE D 1 15 ? -9.873 1.983 -0.583 1.00 0.00 ? 81 ILE D C 10 15
ATOM 11336 O O . ILE D 1 15 ? -10.447 3.062 -0.643 1.00 0.00 ? 81 ILE D O 10 15
ATOM 11337 C CB . ILE D 1 15 ? -9.138 1.186 1.734 1.00 0.00 ? 81 ILE D CB 10 15
ATOM 11338 C CG1 . ILE D 1 15 ? -9.632 0.489 2.976 1.00 0.00 ? 81 ILE D CG1 10 15
ATOM 11339 C CG2 . ILE D 1 15 ? -8.813 2.621 2.075 1.00 0.00 ? 81 ILE D CG2 10 15
ATOM 11340 C CD1 . ILE D 1 15 ? -8.534 0.127 3.955 1.00 0.00 ? 81 ILE D CD1 10 15
ATOM 11341 H H . ILE D 1 15 ? -9.451 -0.946 0.417 1.00 0.00 ? 81 ILE D H 10 15
ATOM 11342 H HA . ILE D 1 15 ? -11.122 1.293 0.973 1.00 0.00 ? 81 ILE D HA 10 15
ATOM 11343 H HB . ILE D 1 15 ? -8.217 0.721 1.419 1.00 0.00 ? 81 ILE D HB 10 15
ATOM 11344 H HG12 . ILE D 1 15 ? -10.370 1.120 3.471 1.00 0.00 ? 81 ILE D HG12 10 15
ATOM 11345 H HG13 . ILE D 1 15 ? -10.108 -0.441 2.713 1.00 0.00 ? 81 ILE D HG13 10 15
ATOM 11346 H HG21 . ILE D 1 15 ? -9.694 3.147 2.369 1.00 0.00 ? 81 ILE D HG21 10 15
ATOM 11347 H HG22 . ILE D 1 15 ? -8.096 2.649 2.875 1.00 0.00 ? 81 ILE D HG22 10 15
ATOM 11348 H HG23 . ILE D 1 15 ? -8.363 3.140 1.251 1.00 0.00 ? 81 ILE D HG23 10 15
ATOM 11349 H HD11 . ILE D 1 15 ? -8.927 -0.399 4.709 1.00 0.00 ? 81 ILE D HD11 10 15
ATOM 11350 H HD12 . ILE D 1 15 ? -7.813 -0.438 3.534 1.00 0.00 ? 81 ILE D HD12 10 15
ATOM 11351 H HD13 . ILE D 1 15 ? -8.081 0.915 4.340 1.00 0.00 ? 81 ILE D HD13 10 15
ATOM 11352 N N . ILE D 1 16 ? -9.054 1.578 -1.547 1.00 0.00 ? 82 ILE D N 10 16
ATOM 11353 C CA . ILE D 1 16 ? -8.787 2.273 -2.784 1.00 0.00 ? 82 ILE D CA 10 16
ATOM 11354 C C . ILE D 1 16 ? -10.050 2.467 -3.601 1.00 0.00 ? 82 ILE D C 10 16
ATOM 11355 O O . ILE D 1 16 ? -10.363 3.572 -4.000 1.00 0.00 ? 82 ILE D O 10 16
ATOM 11356 C CB . ILE D 1 16 ? -7.717 1.560 -3.597 1.00 0.00 ? 82 ILE D CB 10 16
ATOM 11357 C CG1 . ILE D 1 16 ? -6.378 1.841 -2.935 1.00 0.00 ? 82 ILE D CG1 10 16
ATOM 11358 C CG2 . ILE D 1 16 ? -7.644 2.046 -5.035 1.00 0.00 ? 82 ILE D CG2 10 16
ATOM 11359 C CD1 . ILE D 1 16 ? -5.175 1.104 -3.494 1.00 0.00 ? 82 ILE D CD1 10 16
ATOM 11360 H H . ILE D 1 16 ? -8.544 0.727 -1.380 1.00 0.00 ? 82 ILE D H 10 16
ATOM 11361 H HA . ILE D 1 16 ? -8.459 3.268 -2.530 1.00 0.00 ? 82 ILE D HA 10 16
ATOM 11362 H HB . ILE D 1 16 ? -7.959 0.502 -3.559 1.00 0.00 ? 82 ILE D HB 10 16
ATOM 11363 H HG12 . ILE D 1 16 ? -6.184 2.911 -2.999 1.00 0.00 ? 82 ILE D HG12 10 16
ATOM 11364 H HG13 . ILE D 1 16 ? -6.451 1.593 -1.884 1.00 0.00 ? 82 ILE D HG13 10 16
ATOM 11365 H HG21 . ILE D 1 16 ? -7.532 3.102 -5.066 1.00 0.00 ? 82 ILE D HG21 10 16
ATOM 11366 H HG22 . ILE D 1 16 ? -6.818 1.621 -5.570 1.00 0.00 ? 82 ILE D HG22 10 16
ATOM 11367 H HG23 . ILE D 1 16 ? -8.516 1.778 -5.578 1.00 0.00 ? 82 ILE D HG23 10 16
ATOM 11368 H HD11 . ILE D 1 16 ? -4.923 1.517 -4.456 1.00 0.00 ? 82 ILE D HD11 10 16
ATOM 11369 H HD12 . ILE D 1 16 ? -4.359 1.304 -2.818 1.00 0.00 ? 82 ILE D HD12 10 16
ATOM 11370 H HD13 . ILE D 1 16 ? -5.364 0.050 -3.538 1.00 0.00 ? 82 ILE D HD13 10 16
ATOM 11371 N N . LYS D 1 17 ? -10.793 1.386 -3.802 1.00 0.00 ? 83 LYS D N 10 17
ATOM 11372 C CA . LYS D 1 17 ? -12.061 1.352 -4.492 1.00 0.00 ? 83 LYS D CA 10 17
ATOM 11373 C C . LYS D 1 17 ? -13.169 2.166 -3.872 1.00 0.00 ? 83 LYS D C 10 17
ATOM 11374 O O . LYS D 1 17 ? -13.969 2.740 -4.566 1.00 0.00 ? 83 LYS D O 10 17
ATOM 11375 C CB . LYS D 1 17 ? -12.444 -0.098 -4.650 1.00 0.00 ? 83 LYS D CB 10 17
ATOM 11376 C CG . LYS D 1 17 ? -11.608 -0.796 -5.702 1.00 0.00 ? 83 LYS D CG 10 17
ATOM 11377 C CD . LYS D 1 17 ? -11.995 -2.244 -5.821 1.00 0.00 ? 83 LYS D CD 10 17
ATOM 11378 C CE . LYS D 1 17 ? -11.039 -3.022 -6.696 1.00 0.00 ? 83 LYS D CE 10 17
ATOM 11379 N NZ . LYS D 1 17 ? -9.849 -3.411 -5.992 1.00 0.00 ? 83 LYS D NZ 10 17
ATOM 11380 H H . LYS D 1 17 ? -10.408 0.550 -3.433 1.00 0.00 ? 83 LYS D H 10 17
ATOM 11381 H HA . LYS D 1 17 ? -11.947 1.797 -5.462 1.00 0.00 ? 83 LYS D HA 10 17
ATOM 11382 H HB2 . LYS D 1 17 ? -12.308 -0.607 -3.696 1.00 0.00 ? 83 LYS D HB2 10 17
ATOM 11383 H HB3 . LYS D 1 17 ? -13.494 -0.183 -4.877 1.00 0.00 ? 83 LYS D HB3 10 17
ATOM 11384 H HG2 . LYS D 1 17 ? -11.742 -0.300 -6.663 1.00 0.00 ? 83 LYS D HG2 10 17
ATOM 11385 H HG3 . LYS D 1 17 ? -10.571 -0.719 -5.456 1.00 0.00 ? 83 LYS D HG3 10 17
ATOM 11386 H HD2 . LYS D 1 17 ? -12.046 -2.699 -4.831 1.00 0.00 ? 83 LYS D HD2 10 17
ATOM 11387 H HD3 . LYS D 1 17 ? -12.967 -2.283 -6.262 1.00 0.00 ? 83 LYS D HD3 10 17
ATOM 11388 H HE2 . LYS D 1 17 ? -11.539 -3.914 -7.075 1.00 0.00 ? 83 LYS D HE2 10 17
ATOM 11389 H HE3 . LYS D 1 17 ? -10.794 -2.436 -7.523 1.00 0.00 ? 83 LYS D HE3 10 17
ATOM 11390 H HZ1 . LYS D 1 17 ? -9.389 -2.651 -5.696 1.00 0.00 ? 83 LYS D HZ1 10 17
ATOM 11391 H HZ2 . LYS D 1 17 ? -10.083 -3.924 -5.255 1.00 0.00 ? 83 LYS D HZ2 10 17
ATOM 11392 H HZ3 . LYS D 1 17 ? -9.207 -3.916 -6.532 1.00 0.00 ? 83 LYS D HZ3 10 17
ATOM 11393 N N . ALA D 1 18 ? -13.142 2.313 -2.567 1.00 0.00 ? 84 ALA D N 10 18
ATOM 11394 C CA . ALA D 1 18 ? -13.963 3.216 -1.803 1.00 0.00 ? 84 ALA D CA 10 18
ATOM 11395 C C . ALA D 1 18 ? -13.452 4.637 -1.732 1.00 0.00 ? 84 ALA D C 10 18
ATOM 11396 O O . ALA D 1 18 ? -14.190 5.549 -1.441 1.00 0.00 ? 84 ALA D O 10 18
ATOM 11397 C CB . ALA D 1 18 ? -14.197 2.661 -0.419 1.00 0.00 ? 84 ALA D CB 10 18
ATOM 11398 H H . ALA D 1 18 ? -12.473 1.732 -2.098 1.00 0.00 ? 84 ALA D H 10 18
ATOM 11399 H HA . ALA D 1 18 ? -14.919 3.237 -2.313 1.00 0.00 ? 84 ALA D HA 10 18
ATOM 11400 H HB1 . ALA D 1 18 ? -14.788 3.340 0.153 1.00 0.00 ? 84 ALA D HB1 10 18
ATOM 11401 H HB2 . ALA D 1 18 ? -14.735 1.741 -0.485 1.00 0.00 ? 84 ALA D HB2 10 18
ATOM 11402 H HB3 . ALA D 1 18 ? -13.293 2.544 0.111 1.00 0.00 ? 84 ALA D HB3 10 18
ATOM 11403 N N . GLY D 1 19 ? -12.166 4.835 -1.931 1.00 0.00 ? 85 GLY D N 10 19
ATOM 11404 C CA . GLY D 1 19 ? -11.383 5.988 -1.609 1.00 0.00 ? 85 GLY D CA 10 19
ATOM 11405 C C . GLY D 1 19 ? -11.243 7.008 -2.713 1.00 0.00 ? 85 GLY D C 10 19
ATOM 11406 O O . GLY D 1 19 ? -10.989 8.127 -2.441 1.00 0.00 ? 85 GLY D O 10 19
ATOM 11407 H H . GLY D 1 19 ? -11.640 4.020 -2.112 1.00 0.00 ? 85 GLY D H 10 19
ATOM 11408 H HA2 . GLY D 1 19 ? -11.785 6.479 -0.736 1.00 0.00 ? 85 GLY D HA2 10 19
ATOM 11409 H HA3 . GLY D 1 19 ? -10.392 5.683 -1.329 1.00 0.00 ? 85 GLY D HA3 10 19
ATOM 11410 N N . GLY D 1 20 ? -11.413 6.639 -3.943 1.00 0.00 ? 86 GLY D N 10 20
ATOM 11411 C CA . GLY D 1 20 ? -11.267 7.520 -5.069 1.00 0.00 ? 86 GLY D CA 10 20
ATOM 11412 C C . GLY D 1 20 ? -9.869 8.014 -5.342 1.00 0.00 ? 86 GLY D C 10 20
ATOM 11413 O O . GLY D 1 20 ? -9.675 9.146 -5.674 1.00 0.00 ? 86 GLY D O 10 20
ATOM 11414 H H . GLY D 1 20 ? -11.660 5.710 -4.093 1.00 0.00 ? 86 GLY D H 10 20
ATOM 11415 H HA2 . GLY D 1 20 ? -11.648 7.036 -5.923 1.00 0.00 ? 86 GLY D HA2 10 20
ATOM 11416 H HA3 . GLY D 1 20 ? -11.887 8.362 -4.905 1.00 0.00 ? 86 GLY D HA3 10 20
ATOM 11417 N N . TYR D 1 21 ? -8.857 7.200 -5.151 1.00 0.00 ? 87 TYR D N 10 21
ATOM 11418 C CA . TYR D 1 21 ? -7.484 7.504 -5.421 1.00 0.00 ? 87 TYR D CA 10 21
ATOM 11419 C C . TYR D 1 21 ? -7.157 7.681 -6.883 1.00 0.00 ? 87 TYR D C 10 21
ATOM 11420 O O . TYR D 1 21 ? -6.170 8.246 -7.242 1.00 0.00 ? 87 TYR D O 10 21
ATOM 11421 C CB . TYR D 1 21 ? -6.665 6.369 -4.836 1.00 0.00 ? 87 TYR D CB 10 21
ATOM 11422 C CG . TYR D 1 21 ? -6.268 6.469 -3.389 1.00 0.00 ? 87 TYR D CG 10 21
ATOM 11423 C CD1 . TYR D 1 21 ? -5.311 7.352 -2.902 1.00 0.00 ? 87 TYR D CD1 10 21
ATOM 11424 C CD2 . TYR D 1 21 ? -6.692 5.413 -2.595 1.00 0.00 ? 87 TYR D CD2 10 21
ATOM 11425 C CE1 . TYR D 1 21 ? -4.794 7.166 -1.620 1.00 0.00 ? 87 TYR D CE1 10 21
ATOM 11426 C CE2 . TYR D 1 21 ? -6.163 5.191 -1.322 1.00 0.00 ? 87 TYR D CE2 10 21
ATOM 11427 C CZ . TYR D 1 21 ? -5.203 6.082 -0.838 1.00 0.00 ? 87 TYR D CZ 10 21
ATOM 11428 O OH . TYR D 1 21 ? -4.700 5.911 0.409 1.00 0.00 ? 87 TYR D OH 10 21
ATOM 11429 H H . TYR D 1 21 ? -9.053 6.274 -4.853 1.00 0.00 ? 87 TYR D H 10 21
ATOM 11430 H HA . TYR D 1 21 ? -7.176 8.391 -4.894 1.00 0.00 ? 87 TYR D HA 10 21
ATOM 11431 H HB2 . TYR D 1 21 ? -7.258 5.461 -4.951 1.00 0.00 ? 87 TYR D HB2 10 21
ATOM 11432 H HB3 . TYR D 1 21 ? -5.761 6.179 -5.388 1.00 0.00 ? 87 TYR D HB3 10 21
ATOM 11433 H HD1 . TYR D 1 21 ? -4.908 8.148 -3.483 1.00 0.00 ? 87 TYR D HD1 10 21
ATOM 11434 H HD2 . TYR D 1 21 ? -7.398 4.730 -3.021 1.00 0.00 ? 87 TYR D HD2 10 21
ATOM 11435 H HE1 . TYR D 1 21 ? -4.050 7.818 -1.231 1.00 0.00 ? 87 TYR D HE1 10 21
ATOM 11436 H HE2 . TYR D 1 21 ? -6.495 4.339 -0.761 1.00 0.00 ? 87 TYR D HE2 10 21
ATOM 11437 H HH . TYR D 1 21 ? -5.386 6.005 1.049 1.00 0.00 ? 87 TYR D HH 10 21
HETATM 11438 N N . NH2 D 1 22 ? -7.965 7.255 -7.780 1.00 0.00 ? 88 NH2 D N 10 22
HETATM 11439 H HN1 . NH2 D 1 22 ? -7.779 7.439 -8.738 1.00 0.00 ? 88 NH2 D HN1 10 22
HETATM 11440 H HN2 . NH2 D 1 22 ? -8.780 6.805 -7.492 1.00 0.00 ? 88 NH2 D HN2 10 22
#
loop_
_pdbx_poly_seq_scheme.asym_id
_pdbx_poly_seq_scheme.entity_id
_pdbx_poly_seq_scheme.seq_id
_pdbx_poly_seq_scheme.mon_id
_pdbx_poly_seq_scheme.ndb_seq_num
_pdbx_poly_seq_scheme.pdb_seq_num
_pdbx_poly_seq_scheme.auth_seq_num
_pdbx_poly_seq_scheme.pdb_mon_id
_pdbx_poly_seq_scheme.auth_mon_id
_pdbx_poly_seq_scheme.pdb_strand_id
_pdbx_poly_seq_scheme.pdb_ins_code
_pdbx_poly_seq_scheme.hetero
A 1 1 ACE 1 1 1 ACE ACE A . n
A 1 2 ALA 2 2 2 ALA ALA A . n
A 1 3 LYS 3 3 3 LYS LYS A . n
A 1 4 ALA 4 4 4 ALA ALA A . n
A 1 5 ALA 5 5 5 ALA ALA A . n
A 1 6 ALA 6 6 6 ALA ALA A . n
A 1 7 ALA 7 7 7 ALA ALA A . n
A 1 8 ALA 8 8 8 ALA ALA A . n
A 1 9 ILE 9 9 9 ILE ILE A . n
A 1 10 LYS 10 10 10 LYS LYS A . n
A 1 11 ALA 11 11 11 ALA ALA A . n
A 1 12 ILE 12 12 12 ILE ILE A . n
A 1 13 ALA 13 13 13 ALA ALA A . n
A 1 14 ALA 14 14 14 ALA ALA A . n
A 1 15 ILE 15 15 15 ILE ILE A . n
A 1 16 ILE 16 16 16 ILE ILE A . n
A 1 17 LYS 17 17 17 LYS LYS A . n
A 1 18 ALA 18 18 18 ALA ALA A . n
A 1 19 GLY 19 19 19 GLY GLY A . n
A 1 20 GLY 20 20 20 GLY GLY A . n
A 1 21 TYR 21 21 21 TYR TYR A . n
A 1 22 NH2 22 22 22 NH2 NH2 A . n
B 1 1 ACE 1 23 23 ACE ACE B . n
B 1 2 ALA 2 24 24 ALA ALA B . n
B 1 3 LYS 3 25 25 LYS LYS B . n
B 1 4 ALA 4 26 26 ALA ALA B . n
B 1 5 ALA 5 27 27 ALA ALA B . n
B 1 6 ALA 6 28 28 ALA ALA B . n
B 1 7 ALA 7 29 29 ALA ALA B . n
B 1 8 ALA 8 30 30 ALA ALA B . n
B 1 9 ILE 9 31 31 ILE ILE B . n
B 1 10 LYS 10 32 32 LYS LYS B . n
B 1 11 ALA 11 33 33 ALA ALA B . n
B 1 12 ILE 12 34 34 ILE ILE B . n
B 1 13 ALA 13 35 35 ALA ALA B . n
B 1 14 ALA 14 36 36 ALA ALA B . n
B 1 15 ILE 15 37 37 ILE ILE B . n
B 1 16 ILE 16 38 38 ILE ILE B . n
B 1 17 LYS 17 39 39 LYS LYS B . n
B 1 18 ALA 18 40 40 ALA ALA B . n
B 1 19 GLY 19 41 41 GLY GLY B . n
B 1 20 GLY 20 42 42 GLY GLY B . n
B 1 21 TYR 21 43 43 TYR TYR B . n
B 1 22 NH2 22 44 44 NH2 NH2 B . n
C 1 1 ACE 1 45 45 ACE ACE C . n
C 1 2 ALA 2 46 46 ALA ALA C . n
C 1 3 LYS 3 47 47 LYS LYS C . n
C 1 4 ALA 4 48 48 ALA ALA C . n
C 1 5 ALA 5 49 49 ALA ALA C . n
C 1 6 ALA 6 50 50 ALA ALA C . n
C 1 7 ALA 7 51 51 ALA ALA C . n
C 1 8 ALA 8 52 52 ALA ALA C . n
C 1 9 ILE 9 53 53 ILE ILE C . n
C 1 10 LYS 10 54 54 LYS LYS C . n
C 1 11 ALA 11 55 55 ALA ALA C . n
C 1 12 ILE 12 56 56 ILE ILE C . n
C 1 13 ALA 13 57 57 ALA ALA C . n
C 1 14 ALA 14 58 58 ALA ALA C . n
C 1 15 ILE 15 59 59 ILE ILE C . n
C 1 16 ILE 16 60 60 ILE ILE C . n
C 1 17 LYS 17 61 61 LYS LYS C . n
C 1 18 ALA 18 62 62 ALA ALA C . n
C 1 19 GLY 19 63 63 GLY GLY C . n
C 1 20 GLY 20 64 64 GLY GLY C . n
C 1 21 TYR 21 65 65 TYR TYR C . n
C 1 22 NH2 22 66 66 NH2 NH2 C . n
D 1 1 ACE 1 67 67 ACE ACE D . n
D 1 2 ALA 2 68 68 ALA ALA D . n
D 1 3 LYS 3 69 69 LYS LYS D . n
D 1 4 ALA 4 70 70 ALA ALA D . n
D 1 5 ALA 5 71 71 ALA ALA D . n
D 1 6 ALA 6 72 72 ALA ALA D . n
D 1 7 ALA 7 73 73 ALA ALA D . n
D 1 8 ALA 8 74 74 ALA ALA D . n
D 1 9 ILE 9 75 75 ILE ILE D . n
D 1 10 LYS 10 76 76 LYS LYS D . n
D 1 11 ALA 11 77 77 ALA ALA D . n
D 1 12 ILE 12 78 78 ILE ILE D . n
D 1 13 ALA 13 79 79 ALA ALA D . n
D 1 14 ALA 14 80 80 ALA ALA D . n
D 1 15 ILE 15 81 81 ILE ILE D . n
D 1 16 ILE 16 82 82 ILE ILE D . n
D 1 17 LYS 17 83 83 LYS LYS D . n
D 1 18 ALA 18 84 84 ALA ALA D . n
D 1 19 GLY 19 85 85 GLY GLY D . n
D 1 20 GLY 20 86 86 GLY GLY D . n
D 1 21 TYR 21 87 87 TYR TYR D . n
D 1 22 NH2 22 88 88 NH2 NH2 D . n
#
loop_
_pdbx_nmr_exptl_sample.component
_pdbx_nmr_exptl_sample.concentration
_pdbx_nmr_exptl_sample.concentration_units
_pdbx_nmr_exptl_sample.isotopic_labeling
_pdbx_nmr_exptl_sample.solution_id
'sodium acetate' 10 mM ? 1
'sodium chloride' 200 mM ? 1
DSS 0.005 mM ? 1
#
loop_
_pdbx_validate_close_contact.id
_pdbx_validate_close_contact.PDB_model_num
_pdbx_validate_close_contact.auth_atom_id_1
_pdbx_validate_close_contact.auth_asym_id_1
_pdbx_validate_close_contact.auth_comp_id_1
_pdbx_validate_close_contact.auth_seq_id_1
_pdbx_validate_close_contact.PDB_ins_code_1
_pdbx_validate_close_contact.label_alt_id_1
_pdbx_validate_close_contact.auth_atom_id_2
_pdbx_validate_close_contact.auth_asym_id_2
_pdbx_validate_close_contact.auth_comp_id_2
_pdbx_validate_close_contact.auth_seq_id_2
_pdbx_validate_close_contact.PDB_ins_code_2
_pdbx_validate_close_contact.label_alt_id_2
_pdbx_validate_close_contact.dist
1 9 O B TYR 43 ? ? N B NH2 44 ? ? 1.06
2 9 C B TYR 43 ? ? HN1 B NH2 44 ? ? 1.07
3 9 O B TYR 43 ? ? HN1 B NH2 44 ? ? 1.43
#
loop_
_pdbx_validate_rmsd_bond.id
_pdbx_validate_rmsd_bond.PDB_model_num
_pdbx_validate_rmsd_bond.auth_atom_id_1
_pdbx_validate_rmsd_bond.auth_asym_id_1
_pdbx_validate_rmsd_bond.auth_comp_id_1
_pdbx_validate_rmsd_bond.auth_seq_id_1
_pdbx_validate_rmsd_bond.PDB_ins_code_1
_pdbx_validate_rmsd_bond.label_alt_id_1
_pdbx_validate_rmsd_bond.auth_atom_id_2
_pdbx_validate_rmsd_bond.auth_asym_id_2
_pdbx_validate_rmsd_bond.auth_comp_id_2
_pdbx_validate_rmsd_bond.auth_seq_id_2
_pdbx_validate_rmsd_bond.PDB_ins_code_2
_pdbx_validate_rmsd_bond.label_alt_id_2
_pdbx_validate_rmsd_bond.bond_value
_pdbx_validate_rmsd_bond.bond_target_value
_pdbx_validate_rmsd_bond.bond_deviation
_pdbx_validate_rmsd_bond.bond_standard_deviation
_pdbx_validate_rmsd_bond.linker_flag
1 1 CD C LYS 47 ? ? CE C LYS 47 ? ? 1.332 1.508 -0.176 0.025 N
2 1 CE C LYS 47 ? ? NZ C LYS 47 ? ? 1.334 1.486 -0.152 0.025 N
3 1 CE D LYS 83 ? ? NZ D LYS 83 ? ? 1.164 1.486 -0.322 0.025 N
4 2 CD A LYS 3 ? ? CE A LYS 3 ? ? 1.142 1.508 -0.366 0.025 N
5 2 CE B LYS 25 ? ? NZ B LYS 25 ? ? 1.313 1.486 -0.173 0.025 N
6 2 CD D LYS 83 ? ? CE D LYS 83 ? ? 1.334 1.508 -0.174 0.025 N
7 3 CE C LYS 54 ? ? NZ C LYS 54 ? ? 1.299 1.486 -0.187 0.025 N
8 4 CE A LYS 3 ? ? NZ A LYS 3 ? ? 1.152 1.486 -0.334 0.025 N
9 4 CE B LYS 25 ? ? NZ B LYS 25 ? ? 1.202 1.486 -0.284 0.025 N
10 5 CE D LYS 83 ? ? NZ D LYS 83 ? ? 1.326 1.486 -0.160 0.025 N
11 6 CE A LYS 10 ? ? NZ A LYS 10 ? ? 1.316 1.486 -0.170 0.025 N
12 6 CD B LYS 25 ? ? CE B LYS 25 ? ? 1.214 1.508 -0.294 0.025 N
13 6 CD C LYS 47 ? ? CE C LYS 47 ? ? 1.263 1.508 -0.245 0.025 N
14 6 CB C LYS 61 ? ? CG C LYS 61 ? ? 1.285 1.521 -0.236 0.027 N
15 7 CD A LYS 10 ? ? CE A LYS 10 ? ? 1.057 1.508 -0.451 0.025 N
16 7 CE C LYS 54 ? ? NZ C LYS 54 ? ? 1.336 1.486 -0.150 0.025 N
17 7 CB D LYS 83 ? ? CG D LYS 83 ? ? 1.302 1.521 -0.219 0.027 N
18 7 CD D LYS 83 ? ? CE D LYS 83 ? ? 1.325 1.508 -0.183 0.025 N
19 7 CE D LYS 83 ? ? NZ D LYS 83 ? ? 1.108 1.486 -0.378 0.025 N
20 8 CG A LYS 17 ? ? CD A LYS 17 ? ? 1.239 1.520 -0.281 0.034 N
21 8 CD A LYS 17 ? ? CE A LYS 17 ? ? 1.118 1.508 -0.390 0.025 N
22 8 CE A LYS 17 ? ? NZ A LYS 17 ? ? 1.191 1.486 -0.295 0.025 N
23 8 CD C LYS 54 ? ? CE C LYS 54 ? ? 1.305 1.508 -0.203 0.025 N
24 9 CD B LYS 25 ? ? CE B LYS 25 ? ? 1.116 1.508 -0.392 0.025 N
25 9 CE B LYS 25 ? ? NZ B LYS 25 ? ? 1.232 1.486 -0.254 0.025 N
26 9 C B TYR 43 ? ? O B TYR 43 ? ? 0.645 1.229 -0.584 0.019 N
27 9 C B TYR 43 ? ? N B NH2 44 ? ? 0.973 1.336 -0.363 0.023 Y
28 9 CE C LYS 54 ? ? NZ C LYS 54 ? ? 1.146 1.486 -0.340 0.025 N
29 9 CG D LYS 69 ? ? CD D LYS 69 ? ? 1.066 1.520 -0.454 0.034 N
30 9 CE D LYS 69 ? ? NZ D LYS 69 ? ? 1.113 1.486 -0.373 0.025 N
31 10 CE A LYS 10 ? ? NZ A LYS 10 ? ? 1.300 1.486 -0.186 0.025 N
32 10 CE A LYS 17 ? ? NZ A LYS 17 ? ? 0.961 1.486 -0.525 0.025 N
33 10 CD B LYS 25 ? ? CE B LYS 25 ? ? 1.251 1.508 -0.257 0.025 N
34 10 CD B LYS 32 ? ? CE B LYS 32 ? ? 1.136 1.508 -0.372 0.025 N
#
loop_
_pdbx_validate_rmsd_angle.id
_pdbx_validate_rmsd_angle.PDB_model_num
_pdbx_validate_rmsd_angle.auth_atom_id_1
_pdbx_validate_rmsd_angle.auth_asym_id_1
_pdbx_validate_rmsd_angle.auth_comp_id_1
_pdbx_validate_rmsd_angle.auth_seq_id_1
_pdbx_validate_rmsd_angle.PDB_ins_code_1
_pdbx_validate_rmsd_angle.label_alt_id_1
_pdbx_validate_rmsd_angle.auth_atom_id_2
_pdbx_validate_rmsd_angle.auth_asym_id_2
_pdbx_validate_rmsd_angle.auth_comp_id_2
_pdbx_validate_rmsd_angle.auth_seq_id_2
_pdbx_validate_rmsd_angle.PDB_ins_code_2
_pdbx_validate_rmsd_angle.label_alt_id_2
_pdbx_validate_rmsd_angle.auth_atom_id_3
_pdbx_validate_rmsd_angle.auth_asym_id_3
_pdbx_validate_rmsd_angle.auth_comp_id_3
_pdbx_validate_rmsd_angle.auth_seq_id_3
_pdbx_validate_rmsd_angle.PDB_ins_code_3
_pdbx_validate_rmsd_angle.label_alt_id_3
_pdbx_validate_rmsd_angle.angle_value
_pdbx_validate_rmsd_angle.angle_target_value
_pdbx_validate_rmsd_angle.angle_deviation
_pdbx_validate_rmsd_angle.angle_standard_deviation
_pdbx_validate_rmsd_angle.linker_flag
1 1 CB A TYR 21 ? ? CG A TYR 21 ? ? CD2 A TYR 21 ? ? 115.50 121.00 -5.50 0.60 N
2 1 CB B TYR 43 ? ? CG B TYR 43 ? ? CD2 B TYR 43 ? ? 115.03 121.00 -5.97 0.60 N
3 1 CB D TYR 87 ? ? CG D TYR 87 ? ? CD2 D TYR 87 ? ? 116.24 121.00 -4.76 0.60 N
4 2 CB A TYR 21 ? ? CG A TYR 21 ? ? CD2 A TYR 21 ? ? 117.04 121.00 -3.96 0.60 N
5 2 CB C TYR 65 ? ? CG C TYR 65 ? ? CD2 C TYR 65 ? ? 116.82 121.00 -4.18 0.60 N
6 2 CB D TYR 87 ? ? CG D TYR 87 ? ? CD2 D TYR 87 ? ? 115.97 121.00 -5.03 0.60 N
7 3 CB A TYR 21 ? ? CG A TYR 21 ? ? CD2 A TYR 21 ? ? 117.32 121.00 -3.68 0.60 N
8 3 CB B ILE 34 ? ? CG1 B ILE 34 ? ? CD1 B ILE 34 ? ? 150.05 113.90 36.15 2.80 N
9 3 CB B TYR 43 ? ? CG B TYR 43 ? ? CD2 B TYR 43 ? ? 116.01 121.00 -4.99 0.60 N
10 3 CB C TYR 65 ? ? CG C TYR 65 ? ? CD2 C TYR 65 ? ? 117.00 121.00 -4.00 0.60 N
11 3 CB D TYR 87 ? ? CG D TYR 87 ? ? CD2 D TYR 87 ? ? 116.44 121.00 -4.56 0.60 N
12 4 CB A TYR 21 ? ? CG A TYR 21 ? ? CD2 A TYR 21 ? ? 116.48 121.00 -4.52 0.60 N
13 4 CB B TYR 43 ? ? CG B TYR 43 ? ? CD2 B TYR 43 ? ? 116.65 121.00 -4.35 0.60 N
14 4 CB C TYR 65 ? ? CG C TYR 65 ? ? CD2 C TYR 65 ? ? 115.82 121.00 -5.18 0.60 N
15 4 CB C TYR 65 ? ? CG C TYR 65 ? ? CD1 C TYR 65 ? ? 125.27 121.00 4.27 0.60 N
16 4 CB D TYR 87 ? ? CG D TYR 87 ? ? CD2 D TYR 87 ? ? 116.84 121.00 -4.16 0.60 N
17 5 CB A TYR 21 ? ? CG A TYR 21 ? ? CD2 A TYR 21 ? ? 115.89 121.00 -5.11 0.60 N
18 5 CB A TYR 21 ? ? CG A TYR 21 ? ? CD1 A TYR 21 ? ? 125.76 121.00 4.76 0.60 N
19 5 CB B TYR 43 ? ? CG B TYR 43 ? ? CD2 B TYR 43 ? ? 116.60 121.00 -4.40 0.60 N
20 5 CB C TYR 65 ? ? CG C TYR 65 ? ? CD2 C TYR 65 ? ? 116.45 121.00 -4.55 0.60 N
21 5 CB D TYR 87 ? ? CG D TYR 87 ? ? CD2 D TYR 87 ? ? 116.41 121.00 -4.59 0.60 N
22 6 CB A TYR 21 ? ? CG A TYR 21 ? ? CD2 A TYR 21 ? ? 116.92 121.00 -4.08 0.60 N
23 6 CB C TYR 65 ? ? CG C TYR 65 ? ? CD2 C TYR 65 ? ? 116.16 121.00 -4.84 0.60 N
24 6 CB D TYR 87 ? ? CG D TYR 87 ? ? CD2 D TYR 87 ? ? 116.54 121.00 -4.46 0.60 N
25 7 CB A TYR 21 ? ? CG A TYR 21 ? ? CD2 A TYR 21 ? ? 116.11 121.00 -4.89 0.60 N
26 7 CB A TYR 21 ? ? CG A TYR 21 ? ? CD1 A TYR 21 ? ? 124.65 121.00 3.65 0.60 N
27 7 CB C TYR 65 ? ? CG C TYR 65 ? ? CD2 C TYR 65 ? ? 114.43 121.00 -6.57 0.60 N
28 7 CB D TYR 87 ? ? CG D TYR 87 ? ? CD2 D TYR 87 ? ? 116.10 121.00 -4.90 0.60 N
29 8 CB A TYR 21 ? ? CG A TYR 21 ? ? CD2 A TYR 21 ? ? 115.55 121.00 -5.45 0.60 N
30 8 CB D TYR 87 ? ? CG D TYR 87 ? ? CD2 D TYR 87 ? ? 115.04 121.00 -5.96 0.60 N
31 8 CB D TYR 87 ? ? CG D TYR 87 ? ? CD1 D TYR 87 ? ? 125.75 121.00 4.75 0.60 N
32 9 CB A TYR 21 ? ? CG A TYR 21 ? ? CD2 A TYR 21 ? ? 115.81 121.00 -5.19 0.60 N
33 9 CB A TYR 21 ? ? CG A TYR 21 ? ? CD1 A TYR 21 ? ? 125.12 121.00 4.12 0.60 N
34 9 CD B LYS 25 ? ? CE B LYS 25 ? ? NZ B LYS 25 ? ? 139.69 111.70 27.99 2.30 N
35 9 CB B TYR 43 ? ? CG B TYR 43 ? ? CD2 B TYR 43 ? ? 116.56 121.00 -4.44 0.60 N
36 9 CA B TYR 43 ? ? C B TYR 43 ? ? O B TYR 43 ? ? 134.44 120.10 14.34 2.10 N
37 9 CA B TYR 43 ? ? C B TYR 43 ? ? N B NH2 44 ? ? 146.13 117.20 28.93 2.20 Y
38 9 O B TYR 43 ? ? C B TYR 43 ? ? N B NH2 44 ? ? 79.36 122.70 -43.34 1.60 Y
39 9 CB D LYS 69 ? ? CG D LYS 69 ? ? CD D LYS 69 ? ? 129.96 111.60 18.36 2.60 N
40 9 CB D TYR 87 ? ? CG D TYR 87 ? ? CD2 D TYR 87 ? ? 114.36 121.00 -6.64 0.60 N
41 10 CB A TYR 21 ? ? CG A TYR 21 ? ? CD2 A TYR 21 ? ? 117.04 121.00 -3.96 0.60 N
42 10 CD B LYS 32 ? ? CE B LYS 32 ? ? NZ B LYS 32 ? ? 128.06 111.70 16.36 2.30 N
43 10 CB B TYR 43 ? ? CG B TYR 43 ? ? CD2 B TYR 43 ? ? 115.01 121.00 -5.99 0.60 N
44 10 CB C TYR 65 ? ? CG C TYR 65 ? ? CD2 C TYR 65 ? ? 115.15 121.00 -5.85 0.60 N
45 10 CB D TYR 87 ? ? CG D TYR 87 ? ? CD2 D TYR 87 ? ? 114.79 121.00 -6.21 0.60 N
#
loop_
_pdbx_validate_torsion.id
_pdbx_validate_torsion.PDB_model_num
_pdbx_validate_torsion.auth_comp_id
_pdbx_validate_torsion.auth_asym_id
_pdbx_validate_torsion.auth_seq_id
_pdbx_validate_torsion.PDB_ins_code
_pdbx_validate_torsion.label_alt_id
_pdbx_validate_torsion.phi
_pdbx_validate_torsion.psi
1 1 ALA A 5 ? ? -63.64 -81.08
2 1 ALA A 6 ? ? -69.22 2.85
3 1 ALA B 26 ? ? -55.18 -7.85
4 1 ALA B 27 ? ? -65.54 -80.94
5 1 ALA C 49 ? ? -65.91 -85.71
6 1 ALA C 50 ? ? -76.67 32.90
7 1 ALA C 55 ? ? -64.45 12.47
8 1 ILE C 56 ? ? -122.18 -50.07
9 1 ALA D 72 ? ? -103.39 -62.24
10 2 ALA A 4 ? ? -59.33 1.03
11 2 ALA B 27 ? ? -60.30 -92.99
12 2 ALA B 28 ? ? -77.62 33.07
13 2 ALA C 48 ? ? -59.14 -4.58
14 2 ALA C 49 ? ? -74.76 -71.17
15 3 ALA A 5 ? ? -63.57 -87.19
16 3 ALA A 6 ? ? -69.31 5.44
17 3 ALA A 11 ? ? -68.33 6.46
18 3 ILE A 12 ? ? -109.64 -61.99
19 3 ALA B 27 ? ? -59.77 -81.89
20 3 ALA B 30 ? ? -104.53 -69.22
21 3 ALA C 49 ? ? -66.79 -87.79
22 3 ALA C 52 ? ? -103.48 -61.48
23 4 ALA A 5 ? ? -63.80 -85.69
24 4 ALA A 8 ? ? -101.82 -65.49
25 4 ALA B 26 ? ? -49.39 -18.60
26 4 ALA B 27 ? ? -66.39 -86.98
27 4 ALA C 49 ? ? -61.72 -79.44
28 4 ALA D 70 ? ? -58.54 -1.85
29 5 ALA A 5 ? ? -65.59 -82.34
30 5 ALA B 26 ? ? -58.34 -9.78
31 5 ALA B 27 ? ? -68.95 -88.51
32 5 ALA B 28 ? ? -74.21 23.06
33 5 ALA B 33 ? ? -67.71 11.53
34 5 ILE B 34 ? ? -120.69 -53.30
35 5 ALA C 49 ? ? -64.60 -87.86
36 5 ALA C 52 ? ? -122.21 -57.59
37 6 ALA A 5 ? ? -71.89 -85.40
38 6 ALA A 6 ? ? -68.98 9.68
39 6 ALA B 26 ? ? -58.59 -4.99
40 6 ALA B 27 ? ? -57.29 -84.45
41 6 ALA B 30 ? ? -131.40 -43.06
42 6 ALA C 48 ? ? -53.89 -9.13
43 6 ALA C 49 ? ? -55.03 -87.35
44 6 ALA C 52 ? ? -109.19 -61.14
45 6 ALA D 70 ? ? -57.16 -3.84
46 7 ALA A 4 ? ? -56.73 -5.23
47 7 ALA A 5 ? ? -57.35 -84.12
48 7 ALA A 8 ? ? -103.30 -63.16
49 7 ALA B 26 ? ? -57.77 -8.64
50 7 ALA B 27 ? ? -62.85 -85.16
51 7 ALA B 33 ? ? -68.45 13.39
52 7 ILE B 34 ? ? -122.03 -60.22
53 7 LYS C 47 ? ? -149.37 -60.26
54 7 ALA C 49 ? ? -65.15 -83.82
55 7 ALA C 50 ? ? -69.43 6.52
56 8 ALA A 5 ? ? -66.11 -83.67
57 8 ALA A 8 ? ? -105.55 -64.85
58 8 ALA B 26 ? ? -58.03 -4.70
59 8 ALA B 27 ? ? -60.88 -80.95
60 8 ALA B 28 ? ? -69.09 0.79
61 8 ALA B 33 ? ? -68.11 5.01
62 8 ALA C 48 ? ? -54.87 -1.48
63 8 ALA C 49 ? ? -60.96 -93.54
64 8 ALA C 52 ? ? -106.23 -61.61
65 9 ALA A 11 ? ? -68.00 11.73
66 9 ALA B 26 ? ? -56.87 0.98
67 9 ALA B 27 ? ? -72.56 -81.29
68 9 ILE B 34 ? ? -127.15 -51.41
69 9 ALA C 48 ? ? -53.72 -4.61
70 9 ALA C 49 ? ? -59.89 -93.18
71 9 ALA C 52 ? ? -97.85 -62.06
72 9 ALA D 70 ? ? -56.51 -0.99
73 10 ALA A 4 ? ? -56.99 -7.48
74 10 ALA A 5 ? ? -54.32 -89.25
75 10 ALA A 6 ? ? -80.80 36.29
76 10 ALA B 26 ? ? -47.75 -17.25
77 10 ALA B 27 ? ? -63.32 -89.96
78 10 ALA B 28 ? ? -81.14 35.41
79 10 ALA C 48 ? ? -57.68 -3.55
80 10 ALA C 49 ? ? -67.81 -80.15
81 10 ALA D 70 ? ? -57.78 1.05
#
loop_
_pdbx_validate_peptide_omega.id
_pdbx_validate_peptide_omega.PDB_model_num
_pdbx_validate_peptide_omega.auth_comp_id_1
_pdbx_validate_peptide_omega.auth_asym_id_1
_pdbx_validate_peptide_omega.auth_seq_id_1
_pdbx_validate_peptide_omega.PDB_ins_code_1
_pdbx_validate_peptide_omega.label_alt_id_1
_pdbx_validate_peptide_omega.auth_comp_id_2
_pdbx_validate_peptide_omega.auth_asym_id_2
_pdbx_validate_peptide_omega.auth_seq_id_2
_pdbx_validate_peptide_omega.PDB_ins_code_2
_pdbx_validate_peptide_omega.label_alt_id_2
_pdbx_validate_peptide_omega.omega
1 2 ALA D 71 ? ? ALA D 72 ? ? 149.66
2 5 ALA D 71 ? ? ALA D 72 ? ? 147.41
3 9 ALA A 5 ? ? ALA A 6 ? ? 149.56
#
loop_
_pdbx_validate_planes.id
_pdbx_validate_planes.PDB_model_num
_pdbx_validate_planes.auth_comp_id
_pdbx_validate_planes.auth_asym_id
_pdbx_validate_planes.auth_seq_id
_pdbx_validate_planes.PDB_ins_code
_pdbx_validate_planes.label_alt_id
_pdbx_validate_planes.rmsd
_pdbx_validate_planes.type
1 1 TYR A 21 ? ? 0.067 'SIDE CHAIN'
2 1 TYR D 87 ? ? 0.073 'SIDE CHAIN'
3 2 TYR A 21 ? ? 0.074 'SIDE CHAIN'
4 2 TYR B 43 ? ? 0.067 'SIDE CHAIN'
5 2 TYR C 65 ? ? 0.073 'SIDE CHAIN'
6 3 TYR B 43 ? ? 0.080 'SIDE CHAIN'
7 4 TYR D 87 ? ? 0.095 'SIDE CHAIN'
8 5 TYR B 43 ? ? 0.092 'SIDE CHAIN'
9 5 TYR C 65 ? ? 0.072 'SIDE CHAIN'
10 7 TYR A 21 ? ? 0.079 'SIDE CHAIN'
11 7 TYR B 43 ? ? 0.067 'SIDE CHAIN'
12 8 TYR A 21 ? ? 0.100 'SIDE CHAIN'
13 8 TYR C 65 ? ? 0.069 'SIDE CHAIN'
14 9 TYR C 65 ? ? 0.069 'SIDE CHAIN'
15 10 TYR B 43 ? ? 0.099 'SIDE CHAIN'
16 10 TYR C 65 ? ? 0.067 'SIDE CHAIN'
17 10 TYR D 87 ? ? 0.082 'SIDE CHAIN'
#
_pdbx_validate_polymer_linkage.id 1
_pdbx_validate_polymer_linkage.PDB_model_num 9
_pdbx_validate_polymer_linkage.auth_atom_id_1 C
_pdbx_validate_polymer_linkage.auth_asym_id_1 B
_pdbx_validate_polymer_linkage.auth_comp_id_1 TYR
_pdbx_validate_polymer_linkage.auth_seq_id_1 43
_pdbx_validate_polymer_linkage.PDB_ins_code_1 ?
_pdbx_validate_polymer_linkage.label_alt_id_1 ?
_pdbx_validate_polymer_linkage.auth_atom_id_2 N
_pdbx_validate_polymer_linkage.auth_asym_id_2 B
_pdbx_validate_polymer_linkage.auth_comp_id_2 NH2
_pdbx_validate_polymer_linkage.auth_seq_id_2 44
_pdbx_validate_polymer_linkage.PDB_ins_code_2 ?
_pdbx_validate_polymer_linkage.label_alt_id_2 ?
_pdbx_validate_polymer_linkage.dist 0.97
#
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.value_order
_chem_comp_bond.pdbx_aromatic_flag
_chem_comp_bond.pdbx_stereo_config
_chem_comp_bond.pdbx_ordinal
ACE C O DOUB N N 1
ACE C CH3 SING N N 2
ACE C H SING N N 3
ACE CH3 H1 SING N N 4
ACE CH3 H2 SING N N 5
ACE CH3 H3 SING N N 6
ALA N CA SING N N 1
ALA N H SING N N 2
ALA N H2 SING N N 3
ALA CA C SING N N 4
ALA CA CB SING N N 5
ALA CA HA SING N N 6
ALA C O DOUB N N 7
ALA C OXT SING N N 8
ALA CB HB1 SING N N 9
ALA CB HB2 SING N N 10
ALA CB HB3 SING N N 11
ALA OXT HXT SING N N 12
GLY N CA SING N N 1
GLY N H SING N N 2
GLY N H2 SING N N 3
GLY CA C SING N N 4
GLY CA HA2 SING N N 5
GLY CA HA3 SING N N 6
GLY C O DOUB N N 7
GLY C OXT SING N N 8
GLY OXT HXT SING N N 9
ILE N CA SING N N 1
ILE N H SING N N 2
ILE N H2 SING N N 3
ILE CA C SING N N 4
ILE CA CB SING N N 5
ILE CA HA SING N N 6
ILE C O DOUB N N 7
ILE C OXT SING N N 8
ILE CB CG1 SING N N 9
ILE CB CG2 SING N N 10
ILE CB HB SING N N 11
ILE CG1 CD1 SING N N 12
ILE CG1 HG12 SING N N 13
ILE CG1 HG13 SING N N 14
ILE CG2 HG21 SING N N 15
ILE CG2 HG22 SING N N 16
ILE CG2 HG23 SING N N 17
ILE CD1 HD11 SING N N 18
ILE CD1 HD12 SING N N 19
ILE CD1 HD13 SING N N 20
ILE OXT HXT SING N N 21
LYS N CA SING N N 1
LYS N H SING N N 2
LYS N H2 SING N N 3
LYS CA C SING N N 4
LYS CA CB SING N N 5
LYS CA HA SING N N 6
LYS C O DOUB N N 7
LYS C OXT SING N N 8
LYS CB CG SING N N 9
LYS CB HB2 SING N N 10
LYS CB HB3 SING N N 11
LYS CG CD SING N N 12
LYS CG HG2 SING N N 13
LYS CG HG3 SING N N 14
LYS CD CE SING N N 15
LYS CD HD2 SING N N 16
LYS CD HD3 SING N N 17
LYS CE NZ SING N N 18
LYS CE HE2 SING N N 19
LYS CE HE3 SING N N 20
LYS NZ HZ1 SING N N 21
LYS NZ HZ2 SING N N 22
LYS NZ HZ3 SING N N 23
LYS OXT HXT SING N N 24
NH2 N HN1 SING N N 1
NH2 N HN2 SING N N 2
TYR N CA SING N N 1
TYR N H SING N N 2
TYR N H2 SING N N 3
TYR CA C SING N N 4
TYR CA CB SING N N 5
TYR CA HA SING N N 6
TYR C O DOUB N N 7
TYR C OXT SING N N 8
TYR CB CG SING N N 9
TYR CB HB2 SING N N 10
TYR CB HB3 SING N N 11
TYR CG CD1 DOUB Y N 12
TYR CG CD2 SING Y N 13
TYR CD1 CE1 SING Y N 14
TYR CD1 HD1 SING N N 15
TYR CD2 CE2 DOUB Y N 16
TYR CD2 HD2 SING N N 17
TYR CE1 CZ DOUB Y N 18
TYR CE1 HE1 SING N N 19
TYR CE2 CZ SING Y N 20
TYR CE2 HE2 SING N N 21
TYR CZ OH SING N N 22
TYR OH HH SING N N 23
TYR OXT HXT SING N N 24
#
