data_3ztz_qFit
_cell.length_a                    53.506
_cell.length_b                    53.506
_cell.length_c                    181.574
_cell.angle_alpha                 90.000
_cell.angle_beta                  90.000
_cell.angle_gamma                 120.000
_cell.volume                      450183.200
_space_group.crystal_system       hexagonal
_space_group.IT_number            179
_space_group.name_H-M_alt         'P 65 2 2'
_space_group.name_Hall            ' P 65 2 (x,y,z+1/12)'
_symmetry.space_group_name_H-M    'P 65 2 2'
_symmetry.space_group_name_Hall   ' P 65 2 (x,y,z+1/12)'
_symmetry.Int_Tables_number       179
_reflns.B_iso_Wilson_estimate     7.90
_refine.pdbx_refine_id            'X-RAY DIFFRACTION'
_refine.ls_d_res_low              46.34
_refine.ls_d_res_high             1.04
_refine.pdbx_ls_sigma_F           1.35
_refine.ls_percent_reflns_obs     98.94
_refine.ls_number_reflns_obs      74102
_refine.ls_number_reflns_R_work   72108
_refine.ls_number_reflns_R_free   1994
_refine.ls_R_factor_obs           0.1800
_refine.ls_R_factor_R_work        0.1794
_refine.ls_R_factor_R_free        0.2028
_refine.ls_percent_reflns_R_free  2.69
_refine.solvent_model_details     'FLAT BULK SOLVENT MODEL'
_refine.pdbx_solvent_vdw_probe_radii 1.1000
_refine.pdbx_solvent_shrinkage_radii 0.9000
_refine.overall_SU_ML             0.0885
_refine.pdbx_overall_phase_error  20.7297
_refine.pdbx_stereochemistry_target_values 'GeoStd + Monomer Library + CDL v1.2'
_refine.B_iso_mean                10.74
_refine.pdbx_ls_cross_valid_method 'FREE R-VALUE'
_exptl.method                     'X-RAY DIFFRACTION'
loop_
  _space_group_symop.id
  _space_group_symop.operation_xyz
   1 x,y,z
   2 x-y,x,z+5/6
   3 y,-x+y,z+1/6
   4 -y,x-y,z+2/3
   5 -x+y,-x,z+1/3
   6 x-y,-y,-z
   7 -x,-x+y,-z+1/3
   8 -x,-y,z+1/2
   9 y,x,-z+2/3
   10 -y,-x,-z+1/6
   11 -x+y,y,-z+1/2
   12 x,x-y,-z+5/6

loop_
  _software.pdbx_ordinal
  _software.name
  _software.version
  _software.type
  _software.contact_author
  _software.contact_author_email
  _software.location
  _software.classification
  _software.language
   1 Phenix 2.0_5824 program 'Paul D. Adams' pdadams@lbl.gov https://www.phenix-online.org/ refinement Python/C++

loop_
  _em_software.id
  _em_software.name
  _em_software.version
  _em_software.category
  _em_software.details
   1 Phenix 2.0_5824 'MODEL REFINEMENT' .

loop_
  _citation.id
  _citation.title
  _citation.journal_abbrev
  _citation.journal_volume
  _citation.page_first
  _citation.page_last
  _citation.year
  _citation.journal_id_ASTM
  _citation.journal_id_ISSN
  _citation.journal_id_CSD
  _citation.pdbx_database_id_PubMed
  _citation.pdbx_database_id_DOI
   1 'Macromolecular structure determination using X-rays, neutrons and electrons: recent developments in Phenix' 'Acta Crystallogr., Sect. D: Biol. Crystallogr.' 75 861 877 2019 ABCRE6 0907-4449 0766 31588918 10.1107/S2059798319011471

loop_
  _citation_author.citation_id
  _citation_author.name
  _citation_author.ordinal
  _citation_author.identifier_ORCID
   1 'Liebschner, D.' 1 0000-0003-3921-3209
   1 'Afonine, P.V.' 2 0000-0002-5052-991X
   1 'Baker, M.L.' 3 ?
   1 'Bunkoczi, G.' 4 ?
   1 'Chen, V.B.' 5 0000-0003-2492-979X
   1 'Croll, T.I.' 6 ?
   1 'Hintze, B.' 7 0000-0002-4871-2096
   1 'Hung, L.W.' 8 0000-0001-6690-8458
   1 'Jain, S.' 9 ?
   1 'McCoy, A.J.' 10 ?
   1 'Moriarty, N.W.' 11 0000-0001-8857-9464
   1 'Oeffner, R.D.' 12 0000-0003-3107-2202
   1 'Poon, B.K.' 13 0000-0001-9633-6067
   1 'Prisant, M.G.' 14 ?
   1 'Read, R.J.' 15 0000-0001-8273-0047
   1 'Richardson, J.S.' 16 0000-0002-3311-2944
   1 'Richardson, D.C.' 17 ?
   1 'Sammito, M.D.' 18 0000-0002-8346-9247
   1 'Sobolev, O.V.' 19 0000-0002-0623-3214
   1 'Stockwell, D.H.' 20 ?
   1 'Terwilliger, T.C.' 21 0000-0001-6384-0320
   1 'Urzhumtsev, A.G.' 22 ?
   1 'Videau, L.L.' 23 ?
   1 'Williams, C.J.' 24 ?
   1 'Adams, P.D.' 25 0000-0001-9333-8219

loop_
  _refine_ls_restr.pdbx_refine_id
  _refine_ls_restr.type
  _refine_ls_restr.number
  _refine_ls_restr.dev_ideal
  _refine_ls_restr.weight
  _refine_ls_restr.pdbx_restraint_function
   'X-RAY DIFFRACTION' f_bond_d 2156 0.0097 ? ?
   'X-RAY DIFFRACTION' f_angle_d 2949 1.1187 ? ?
   'X-RAY DIFFRACTION' f_chiral_restr 312 0.0839 ? ?
   'X-RAY DIFFRACTION' f_plane_restr 406 0.0101 ? ?
   'X-RAY DIFFRACTION' f_dihedral_angle_d 790 14.5417 ? ?

loop_
  _refine_ls_shell.pdbx_refine_id
  _refine_ls_shell.d_res_high
  _refine_ls_shell.d_res_low
  _refine_ls_shell.number_reflns_R_work
  _refine_ls_shell.R_factor_R_work
  _refine_ls_shell.percent_reflns_obs
  _refine_ls_shell.R_factor_R_free
  _refine_ls_shell.number_reflns_R_free
   'X-RAY DIFFRACTION' 2.51 46.34 5671 0.1747 99.59 0.1986 157
   'X-RAY DIFFRACTION' 1.99 2.51 5340 0.1712 100.00 0.2083 148
   'X-RAY DIFFRACTION' 1.74 1.99 5278 0.1787 99.87 0.1934 146
   'X-RAY DIFFRACTION' 1.58 1.74 5193 0.1682 99.50 0.1688 143
   'X-RAY DIFFRACTION' 1.47 1.58 5148 0.1629 98.90 0.1928 144
   'X-RAY DIFFRACTION' 1.38 1.47 5114 0.1770 99.13 0.1991 141
   'X-RAY DIFFRACTION' 1.31 1.38 5115 0.1803 99.02 0.2167 142
   'X-RAY DIFFRACTION' 1.25 1.31 5127 0.1790 99.85 0.1952 142
   'X-RAY DIFFRACTION' 1.21 1.25 5129 0.1804 99.70 0.2183 142
   'X-RAY DIFFRACTION' 1.16 1.21 5053 0.1848 99.33 0.1972 140
   'X-RAY DIFFRACTION' 1.13 1.16 5086 0.2041 98.88 0.2355 141
   'X-RAY DIFFRACTION' 1.09 1.13 5006 0.2211 98.24 0.2337 136
   'X-RAY DIFFRACTION' 1.07 1.09 5003 0.2316 98.02 0.2296 139
   'X-RAY DIFFRACTION' 1.04 1.07 4845 0.2415 95.07 0.2839 133

loop_
  _struct_asym.id
   A
   B
   C
   D
   E
   F
   G
   H
   I

loop_
  _struct_conn.id
  _struct_conn.conn_type_id
  _struct_conn.ptnr1_auth_comp_id
  _struct_conn.ptnr1_auth_asym_id
  _struct_conn.ptnr1_auth_seq_id
  _struct_conn.ptnr1_auth_atom_id
  _struct_conn.ptnr1_label_comp_id
  _struct_conn.ptnr1_label_asym_id
  _struct_conn.ptnr1_label_seq_id
  _struct_conn.ptnr1_label_atom_id
  _struct_conn.ptnr1_role
  _struct_conn.ptnr2_auth_comp_id
  _struct_conn.ptnr2_auth_asym_id
  _struct_conn.ptnr2_auth_seq_id
  _struct_conn.ptnr2_auth_atom_id
  _struct_conn.ptnr2_label_comp_id
  _struct_conn.ptnr2_label_asym_id
  _struct_conn.ptnr2_label_seq_id
  _struct_conn.ptnr2_label_atom_id
  _struct_conn.ptnr2_role
  _struct_conn.details
   C00001 covale PHE A 2 N PHE A 1 N . PCA A 1 C PCA A 125 C . 'Bond created based on atom type and distance.'
   C00002 covale CYS A 116 SG CYS A 115 SG . HEC A 1126 CAB HEC B . CAB . 'Bond created based on atom type and distance.'
   C00003 covale CYS A 116 SG CYS A 115 SG . HEC A 1126 CAB HEC B . CAB . 'Bond created based on atom type and distance.'
   C00004 covale CYS A 116 SG CYS A 115 SG . HEC A 1126 CAB HEC B . CAB . 'Bond created based on atom type and distance.'
   C00005 covale CYS A 119 SG CYS A 118 SG . HEC A 1126 CAC HEC B . CAC . 'Bond created based on atom type and distance.'
   C00006 covale CYS A 119 SG CYS A 118 SG . HEC A 1126 CAC HEC B . CAC . 'Bond created based on atom type and distance.'
   C00007 covale CYS A 119 SG CYS A 118 SG . HEC A 1126 CAC HEC B . CAC . 'Bond created based on atom type and distance.'
   C00008 covale HIS A 120 NE2 HIS A 119 NE2 . HEC A 1126 FE HEC B . FE . 'Bond created based on atom type and distance.'

loop_
  _atom_type.symbol
  _atom_type.scat_dispersion_real
  _atom_type.scat_dispersion_imag
  _atom_type.scat_Cromer_Mann_a1
  _atom_type.scat_Cromer_Mann_a2
  _atom_type.scat_Cromer_Mann_a3
  _atom_type.scat_Cromer_Mann_a4
  _atom_type.scat_Cromer_Mann_b1
  _atom_type.scat_Cromer_Mann_b2
  _atom_type.scat_Cromer_Mann_b3
  _atom_type.scat_Cromer_Mann_b4
  _atom_type.scat_Cromer_Mann_c
  _atom_type.scat_source
  _atom_type.scat_dispersion_source
   C . . 3.54356 2.42580 . . 25.62398 1.50364 . . 0.0 
;
2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD:
Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
 .
   Fe . . 13.53868 8.76290 3.62829 . 5.59997 0.29039 49.61845 . 0.0 
;
3-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD:
Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
 .
   N . . 4.01032 2.96436 . . 19.97189 1.75589 . . 0.0 
;
2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD:
Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
 .
   O . . 4.49882 3.47563 . . 15.80542 1.70748 . . 0.0 
;
2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD:
Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
 .
   S . . 9.55732 6.39887 . . 1.23737 29.19336 . . 0.0 
;
2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD:
Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
 .

loop_
  _chem_comp.id
   ALA
   ARG
   ASN
   ASP
   CMO
   CYS
   GLN
   GLU
   GLY
   HEC
   HIS
   HOH
   ILE
   LEU
   LYS
   MET
   PCA
   PHE
   PRO
   SER
   THR
   TRP
   TYR
   VAL

loop_
  _atom_site.group_PDB
  _atom_site.id
  _atom_site.label_atom_id
  _atom_site.label_alt_id
  _atom_site.label_comp_id
  _atom_site.auth_asym_id
  _atom_site.auth_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.type_symbol
  _atom_site.pdbx_formal_charge
  _atom_site.label_asym_id
  _atom_site.label_entity_id
  _atom_site.label_seq_id
  _atom_site.auth_atom_id
  _atom_site.pdbx_PDB_model_num
   ATOM 1 N . PHE A 2 ? 32.29904 -8.42173 2.73916 1.000 7.52284 N ? A ? 1 N 1
   ATOM 2 CA . PHE A 2 ? 33.37400 -9.29871 3.15742 1.000 8.22772 C ? A ? 1 CA 1
   ATOM 3 C . PHE A 2 ? 34.61797 -8.96211 2.37552 1.000 9.34372 C ? A ? 1 C 1
   ATOM 4 O . PHE A 2 ? 34.61286 -8.94866 1.14709 1.000 10.47087 O ? A ? 1 O 1
   ATOM 5 CB . PHE A 2 ? 32.93084 -10.73556 2.94947 1.000 9.18803 C ? A ? 1 CB 1
   ATOM 6 CG . PHE A 2 ? 31.66416 -11.05215 3.72706 1.000 7.63752 C ? A ? 1 CG 1
   ATOM 7 CD1 . PHE A 2 ? 31.63407 -10.93373 5.10088 1.000 8.12359 C ? A ? 1 CD1 1
   ATOM 8 CD2 . PHE A 2 ? 30.49933 -11.43375 3.08090 1.000 8.80172 C ? A ? 1 CD2 1
   ATOM 9 CE1 . PHE A 2 ? 30.47117 -11.17495 5.81376 1.000 8.20600 C ? A ? 1 CE1 1
   ATOM 10 CE2 . PHE A 2 ? 29.33803 -11.68237 3.81163 1.000 8.93792 C ? A ? 1 CE2 1
   ATOM 11 CZ . PHE A 2 ? 29.33571 -11.56115 5.19307 1.000 8.65696 C ? A ? 1 CZ 1
   ATOM 12 N . ALA A 3 ? 35.69263 -8.65788 3.09170 1.000 10.17299 N ? A ? 2 N 1
   ATOM 13 CA . ALA A 3 ? 36.92600 -8.24701 2.42960 1.000 13.82740 C ? A ? 2 CA 1
   ATOM 14 C . ALA A 3 ? 37.53783 -9.38703 1.63584 1.000 12.44777 C ? A ? 2 C 1
   ATOM 15 O . ALA A 3 ? 38.11771 -9.14416 0.56222 1.000 13.83484 O ? A ? 2 O 1
   ATOM 16 CB . ALA A 3 ? 37.91595 -7.71199 3.46244 1.000 14.58149 C ? A ? 2 CB 1
   ATOM 17 N . LYS A 4 ? 37.40815 -10.62307 2.11679 1.000 12.24231 N ? A ? 3 N 1
   ATOM 18 CA . LYS A 4 ? 37.94665 -11.82654 1.50047 1.000 12.00240 C ? A ? 3 CA 1
   ATOM 19 C . LYS A 4 ? 36.90030 -12.91609 1.65107 1.000 11.10464 C ? A ? 3 C 1
   ATOM 20 O . LYS A 4 ? 36.05644 -12.84427 2.55120 1.000 10.93767 O ? A ? 3 O 1
   ATOM 21 CB . LYS A 4 ? 39.23118 -12.27868 2.20889 1.000 14.74816 C ? A ? 3 CB 1
   ATOM 22 CG . LYS A 4 ? 40.40031 -11.32581 2.05790 1.000 18.88748 C ? A ? 3 CG 1
   ATOM 23 CD . LYS A 4 ? 41.62750 -11.88698 2.77343 1.000 34.16672 C ? A ? 3 CD 1
   ATOM 24 CE . LYS A 4 ? 42.81668 -10.94321 2.66030 1.000 44.06889 C ? A ? 3 CE 1
   ATOM 25 NZ . LYS A 4 ? 42.97832 -10.43642 1.26921 1.000 47.92320 N ? A ? 3 NZ 1
   ATOM 26 N A PRO A 5 ? 36.94734 -13.94847 0.80804 0.488 11.38355 N ? A ? 4 N 1
   ATOM 27 CA A PRO A 5 ? 35.99114 -15.06132 0.93950 0.488 11.50228 C ? A ? 4 CA 1
   ATOM 28 C A PRO A 5 ? 35.96973 -15.67451 2.32226 0.488 9.38885 C ? A ? 4 C 1
   ATOM 29 O A PRO A 5 ? 34.88833 -16.01304 2.82214 0.488 8.50424 O ? A ? 4 O 1
   ATOM 30 CB A PRO A 5 ? 36.47338 -16.06347 -0.11610 0.488 13.22523 C ? A ? 4 CB 1
   ATOM 31 CG A PRO A 5 ? 37.23047 -15.23564 -1.10163 0.488 11.43780 C ? A ? 4 CG 1
   ATOM 32 CD A PRO A 5 ? 37.82819 -14.09039 -0.36717 0.488 12.38180 C ? A ? 4 CD 1
   ATOM 33 N B PRO A 5 ? 36.93327 -13.94342 0.79719 0.087 11.40617 N ? A ? 4 N 1
   ATOM 34 CA B PRO A 5 ? 35.93678 -15.02247 0.92417 0.087 11.36599 C ? A ? 4 CA 1
   ATOM 35 C B PRO A 5 ? 35.93605 -15.70324 2.28250 0.087 9.47089 C ? A ? 4 C 1
   ATOM 36 O B PRO A 5 ? 34.88495 -16.18961 2.72159 0.087 10.02046 O ? A ? 4 O 1
   ATOM 37 CB B PRO A 5 ? 36.31075 -15.98904 -0.20876 0.087 13.30952 C ? A ? 4 CB 1
   ATOM 38 CG B PRO A 5 ? 37.71970 -15.61805 -0.59277 0.087 13.36451 C ? A ? 4 CG 1
   ATOM 39 CD B PRO A 5 ? 37.82263 -14.14734 -0.35808 0.087 12.30614 C ? A ? 4 CD 1
   ATOM 40 N C PRO A 5 ? 36.93007 -13.94379 0.80227 0.425 11.41584 N ? A ? 4 N 1
   ATOM 41 CA C PRO A 5 ? 35.97954 -15.06297 0.98172 0.425 11.42057 C ? A ? 4 CA 1
   ATOM 42 C C PRO A 5 ? 36.03777 -15.68653 2.37101 0.425 9.35576 C ? A ? 4 C 1
   ATOM 43 O C PRO A 5 ? 35.01042 -16.14055 2.90487 0.425 10.15940 O ? A ? 4 O 1
   ATOM 44 CB C PRO A 5 ? 36.38084 -16.04809 -0.12772 0.425 13.37588 C ? A ? 4 CB 1
   ATOM 45 CG C PRO A 5 ? 37.73121 -15.53409 -0.65321 0.425 12.57968 C ? A ? 4 CG 1
   ATOM 46 CD C PRO A 5 ? 37.72021 -14.06983 -0.43442 0.425 12.54869 C ? A ? 4 CD 1
   ATOM 47 N A GLU A 6 ? 37.13953 -15.81205 2.95741 0.488 9.19226 N ? A ? 5 N 1
   ATOM 48 CA A GLU A 6 ? 37.21931 -16.37128 4.31082 0.488 9.42381 C ? A ? 5 CA 1
   ATOM 49 C A GLU A 6 ? 36.35385 -15.60099 5.29388 0.488 8.07604 C ? A ? 5 C 1
   ATOM 50 O A GLU A 6 ? 35.89661 -16.16763 6.29117 0.488 8.83693 O ? A ? 5 O 1
   ATOM 51 CB A GLU A 6 ? 38.66993 -16.38287 4.80726 0.488 9.90855 C ? A ? 5 CB 1
   ATOM 52 CG A GLU A 6 ? 39.52807 -17.48864 4.20526 0.488 11.12698 C ? A ? 5 CG 1
   ATOM 53 CD A GLU A 6 ? 40.27174 -17.08910 2.93548 0.488 7.34024 C ? A ? 5 CD 1
   ATOM 54 OE1 A GLU A 6 ? 39.87543 -16.12581 2.24333 0.488 10.14976 O ? A ? 5 OE1 1
   ATOM 55 OE2 A GLU A 6 ? 41.25097 -17.78706 2.59569 0.488 8.12979 O ? A ? 5 OE2 1
   ATOM 56 N B GLU A 6 ? 37.07977 -15.74460 2.96787 0.087 9.28361 N ? A ? 5 N 1
   ATOM 57 CA B GLU A 6 ? 37.12597 -16.34010 4.29990 0.087 9.67364 C ? A ? 5 CA 1
   ATOM 58 C B GLU A 6 ? 36.30614 -15.54478 5.30665 0.087 8.49818 C ? A ? 5 C 1
   ATOM 59 O B GLU A 6 ? 35.82504 -16.11242 6.29273 0.087 9.05331 O ? A ? 5 O 1
   ATOM 60 CB B GLU A 6 ? 38.57061 -16.43850 4.76676 0.087 10.21618 C ? A ? 5 CB 1
   ATOM 61 CG B GLU A 6 ? 39.40597 -15.26533 4.32744 0.087 11.91085 C ? A ? 5 CG 1
   ATOM 62 CD B GLU A 6 ? 40.82802 -15.40838 4.77161 0.087 13.73178 C ? A ? 5 CD 1
   ATOM 63 OE1 B GLU A 6 ? 41.01878 -15.84341 5.92328 0.087 16.71307 O ? A ? 5 OE1 1
   ATOM 64 OE2 B GLU A 6 ? 41.74415 -15.09210 3.98118 0.087 14.37068 O ? A ? 5 OE2 1
   ATOM 65 N C GLU A 6 ? 37.21382 -15.67823 2.99030 0.425 9.44198 N ? A ? 5 N 1
   ATOM 66 CA C GLU A 6 ? 37.36234 -16.20047 4.34825 0.425 9.72202 C ? A ? 5 CA 1
   ATOM 67 C C GLU A 6 ? 36.41773 -15.50634 5.32407 0.425 8.69972 C ? A ? 5 C 1
   ATOM 68 O C GLU A 6 ? 35.91365 -16.13131 6.26300 0.425 8.95818 O ? A ? 5 O 1
   ATOM 69 CB C GLU A 6 ? 38.81548 -16.01289 4.79174 0.425 8.53046 C ? A ? 5 CB 1
   ATOM 70 CG C GLU A 6 ? 39.81177 -16.98096 4.11890 0.425 10.09714 C ? A ? 5 CG 1
   ATOM 71 CD C GLU A 6 ? 40.29847 -16.58403 2.70708 0.425 8.10460 C ? A ? 5 CD 1
   ATOM 72 OE1 C GLU A 6 ? 39.86695 -15.56330 2.11386 0.425 8.76297 O ? A ? 5 OE1 1
   ATOM 73 OE2 C GLU A 6 ? 41.14674 -17.34691 2.16291 0.425 7.93660 O ? A ? 5 OE2 1
   ATOM 74 N A ASP A 7 ? 36.13891 -14.30317 5.04488 0.488 8.44191 N ? A ? 6 N 1
   ATOM 75 CA A ASP A 7 ? 35.27055 -13.54182 5.93254 0.488 8.51708 C ? A ? 6 CA 1
   ATOM 76 C A ASP A 7 ? 33.80477 -13.92055 5.74378 0.488 8.01972 C ? A ? 6 C 1
   ATOM 77 O A ASP A 7 ? 33.02631 -13.83743 6.69867 0.488 8.47077 O ? A ? 6 O 1
   ATOM 78 CB A ASP A 7 ? 35.49139 -12.03532 5.76515 0.488 10.20049 C ? A ? 6 CB 1
   ATOM 79 CG A ASP A 7 ? 36.90353 -11.60464 6.12412 0.488 10.95787 C ? A ? 6 CG 1
   ATOM 80 OD1 A ASP A 7 ? 37.45800 -12.11761 7.10251 0.488 12.78068 O ? A ? 6 OD1 1
   ATOM 81 OD2 A ASP A 7 ? 37.46515 -10.74751 5.42750 0.488 11.57586 O ? A ? 6 OD2 1
   ATOM 82 N B ASP A 7 ? 36.15082 -14.23717 5.08967 0.087 8.33356 N ? A ? 6 N 1
   ATOM 83 CA B ASP A 7 ? 35.29333 -13.44460 5.96547 0.087 8.33159 C ? A ? 6 CA 1
   ATOM 84 C B ASP A 7 ? 33.83983 -13.88280 5.84860 0.087 7.71486 C ? A ? 6 C 1
   ATOM 85 O B ASP A 7 ? 33.11421 -13.92781 6.84890 0.087 7.11319 O ? A ? 6 O 1
   ATOM 86 CB B ASP A 7 ? 35.43586 -11.96086 5.63008 0.087 10.33574 C ? A ? 6 CB 1
   ATOM 87 CG B ASP A 7 ? 36.84844 -11.45704 5.81890 0.087 9.34728 C ? A ? 6 CG 1
   ATOM 88 OD1 B ASP A 7 ? 37.48660 -11.86464 6.80859 0.087 11.25862 O ? A ? 6 OD1 1
   ATOM 89 OD2 B ASP A 7 ? 37.32253 -10.66736 4.97344 0.087 11.46545 O ? A ? 6 OD2 1
   ATOM 90 N C ASP A 7 ? 36.17826 -14.20726 5.12099 0.425 8.01408 N ? A ? 6 N 1
   ATOM 91 CA C ASP A 7 ? 35.31692 -13.44952 6.02299 0.425 7.98148 C ? A ? 6 CA 1
   ATOM 92 C C ASP A 7 ? 33.85720 -13.84527 5.85453 0.425 7.47187 C ? A ? 6 C 1
   ATOM 93 O C ASP A 7 ? 33.11269 -13.94467 6.83941 0.425 6.73106 O ? A ? 6 O 1
   ATOM 94 CB C ASP A 7 ? 35.49283 -11.95991 5.73481 0.425 10.39053 C ? A ? 6 CB 1
   ATOM 95 CG C ASP A 7 ? 36.92816 -11.51770 5.87157 0.425 8.44372 C ? A ? 6 CG 1
   ATOM 96 OD1 C ASP A 7 ? 37.44421 -11.68065 6.99453 0.425 11.46572 O ? A ? 6 OD1 1
   ATOM 97 OD2 C ASP A 7 ? 37.52821 -11.05262 4.86606 0.425 8.00958 O ? A ? 6 OD2 1
   ATOM 98 N A ALA A 8 ? 33.40635 -14.32651 4.52419 0.488 7.06778 N ? A ? 7 N 1
   ATOM 99 CA A ALA A 8 ? 32.05306 -14.85305 4.31052 0.488 6.51273 C ? A ? 7 CA 1
   ATOM 100 C A ALA A 8 ? 31.86776 -16.19616 5.01345 0.488 6.90344 C ? A ? 7 C 1
   ATOM 101 O A ALA A 8 ? 30.81285 -16.44942 5.62726 0.488 6.44406 O ? A ? 7 O 1
   ATOM 102 CB A ALA A 8 ? 31.74987 -14.97246 2.81611 0.488 6.21980 C ? A ? 7 CB 1
   ATOM 103 N B ALA A 8 ? 33.39747 -14.21027 4.63225 0.087 7.56302 N ? A ? 7 N 1
   ATOM 104 CA B ALA A 8 ? 32.03773 -14.70698 4.45021 0.087 7.10214 C ? A ? 7 CA 1
   ATOM 105 C B ALA A 8 ? 31.86802 -16.08841 5.06858 0.087 6.66700 C ? A ? 7 C 1
   ATOM 106 O B ALA A 8 ? 30.80463 -16.40249 5.61964 0.087 6.48215 O ? A ? 7 O 1
   ATOM 107 CB B ALA A 8 ? 31.68595 -14.73549 2.96430 0.087 7.65670 C ? A ? 7 CB 1
   ATOM 108 N C ALA A 8 ? 33.41857 -14.03723 4.60485 0.425 7.48329 N ? A ? 7 N 1
   ATOM 109 CA C ALA A 8 ? 32.05578 -14.50636 4.35353 0.425 6.95927 C ? A ? 7 CA 1
   ATOM 110 C C ALA A 8 ? 31.84310 -15.89137 4.94648 0.425 6.32443 C ? A ? 7 C 1
   ATOM 111 O C ALA A 8 ? 30.78006 -16.17747 5.52693 0.425 6.07701 O ? A ? 7 O 1
   ATOM 112 CB C ALA A 8 ? 31.78776 -14.54101 2.85002 0.425 7.86893 C ? A ? 7 CB 1
   ATOM 113 N A VAL A 9 ? 32.86798 -17.07722 4.91183 0.488 6.62606 N ? A ? 8 N 1
   ATOM 114 CA A VAL A 9 ? 32.82307 -18.36434 5.59979 0.488 7.03044 C ? A ? 8 CA 1
   ATOM 115 C A VAL A 9 ? 32.62808 -18.16283 7.09224 0.488 6.83818 C ? A ? 8 C 1
   ATOM 116 O A VAL A 9 ? 31.75832 -18.78122 7.71602 0.488 6.01310 O ? A ? 8 O 1
   ATOM 117 CB A VAL A 9 ? 34.10759 -19.16448 5.31182 0.488 6.58286 C ? A ? 8 CB 1
   ATOM 118 CG1 A VAL A 9 ? 34.13508 -20.42813 6.15190 0.488 7.36600 C ? A ? 8 CG1 1
   ATOM 119 CG2 A VAL A 9 ? 34.20945 -19.51658 3.81782 0.488 6.66269 C ? A ? 8 CG2 1
   ATOM 120 N B VAL A 9 ? 32.90272 -16.92816 4.98429 0.087 7.02171 N ? A ? 8 N 1
   ATOM 121 CA B VAL A 9 ? 32.83858 -18.25080 5.59854 0.087 6.85912 C ? A ? 8 CA 1
   ATOM 122 C B VAL A 9 ? 32.71495 -18.13167 7.11151 0.087 6.93709 C ? A ? 8 C 1
   ATOM 123 O B VAL A 9 ? 31.90887 -18.82755 7.74194 0.087 6.72476 O ? A ? 8 O 1
   ATOM 124 CB B VAL A 9 ? 34.05513 -19.09811 5.17905 0.087 7.39098 C ? A ? 8 CB 1
   ATOM 125 CG1 B VAL A 9 ? 33.99989 -20.45974 5.84491 0.087 8.34133 C ? A ? 8 CG1 1
   ATOM 126 CG2 B VAL A 9 ? 34.11341 -19.24522 3.65952 0.087 7.67907 C ? A ? 8 CG2 1
   ATOM 127 N C VAL A 9 ? 32.84778 -16.76372 4.81328 0.425 6.21294 N ? A ? 8 N 1
   ATOM 128 CA C VAL A 9 ? 32.78860 -18.08591 5.42278 0.425 5.72876 C ? A ? 8 CA 1
   ATOM 129 C C VAL A 9 ? 32.66108 -17.98044 6.94507 0.425 6.97666 C ? A ? 8 C 1
   ATOM 130 O C VAL A 9 ? 31.81693 -18.64963 7.56284 0.425 8.02799 O ? A ? 8 O 1
   ATOM 131 CB C VAL A 9 ? 34.00414 -18.92714 4.98630 0.425 6.57472 C ? A ? 8 CB 1
   ATOM 132 CG1 C VAL A 9 ? 33.98729 -20.26353 5.70729 0.425 8.54051 C ? A ? 8 CG1 1
   ATOM 133 CG2 C VAL A 9 ? 34.04435 -19.11593 3.45038 0.425 6.42837 C ? A ? 8 CG2 1
   ATOM 134 N A LYS A 10 ? 33.46557 -17.32287 7.69056 0.488 6.65805 N ? A ? 9 N 1
   ATOM 135 CA A LYS A 10 ? 33.38049 -17.05859 9.12270 0.488 7.79414 C ? A ? 9 CA 1
   ATOM 136 C A LYS A 10 ? 32.01001 -16.50472 9.51141 0.488 6.75549 C ? A ? 9 C 1
   ATOM 137 O A LYS A 10 ? 31.44161 -16.89381 10.54504 0.488 6.79973 O ? A ? 9 O 1
   ATOM 138 CB A LYS A 10 ? 34.50099 -16.09280 9.51572 0.488 8.49609 C ? A ? 9 CB 1
   ATOM 139 CG A LYS A 10 ? 34.59866 -15.70614 10.98864 0.488 10.87607 C ? A ? 9 CG 1
   ATOM 140 CD A LYS A 10 ? 35.97144 -15.07796 11.31987 0.488 14.10786 C ? A ? 9 CD 1
   ATOM 141 CE A LYS A 10 ? 36.00907 -14.22649 12.60478 0.488 8.82059 C ? A ? 9 CE 1
   ATOM 142 NZ A LYS A 10 ? 37.42915 -14.12119 13.09189 0.488 22.32064 N ? A ? 9 NZ 1
   ATOM 143 N B LYS A 10 ? 33.50921 -17.24977 7.71910 0.087 6.85284 N ? A ? 9 N 1
   ATOM 144 CA B LYS A 10 ? 33.39044 -17.02573 9.15498 0.087 7.71775 C ? A ? 9 CA 1
   ATOM 145 C B LYS A 10 ? 32.01415 -16.49563 9.51994 0.087 6.74612 C ? A ? 9 C 1
   ATOM 146 O B LYS A 10 ? 31.43614 -16.90076 10.53454 0.087 6.90336 O ? A ? 9 O 1
   ATOM 147 CB B LYS A 10 ? 34.48250 -16.07476 9.63543 0.087 7.97885 C ? A ? 9 CB 1
   ATOM 148 CG B LYS A 10 ? 35.82326 -16.74702 9.83129 0.087 8.63667 C ? A ? 9 CG 1
   ATOM 149 CD B LYS A 10 ? 36.97849 -15.77710 9.73611 0.087 13.52315 C ? A ? 9 CD 1
   ATOM 150 CE B LYS A 10 ? 38.27151 -16.53967 9.47721 0.087 13.89428 C ? A ? 9 CE 1
   ATOM 151 NZ B LYS A 10 ? 39.44989 -15.65053 9.34433 0.087 14.28253 N ? A ? 9 NZ 1
   ATOM 152 N C LYS A 10 ? 33.49782 -17.14757 7.57613 0.425 7.07849 N ? A ? 9 N 1
   ATOM 153 CA C LYS A 10 ? 33.41037 -17.00771 9.03129 0.425 7.10017 C ? A ? 9 CA 1
   ATOM 154 C C LYS A 10 ? 32.02273 -16.53599 9.45169 0.425 6.64532 C ? A ? 9 C 1
   ATOM 155 O C LYS A 10 ? 31.45637 -17.02455 10.44386 0.425 7.18817 O ? A ? 9 O 1
   ATOM 156 CB C LYS A 10 ? 34.46714 -16.03306 9.55493 0.425 7.99246 C ? A ? 9 CB 1
   ATOM 157 CG C LYS A 10 ? 35.90690 -16.54461 9.49254 0.425 10.00322 C ? A ? 9 CG 1
   ATOM 158 CD C LYS A 10 ? 36.92592 -15.41941 9.63873 0.425 11.64932 C ? A ? 9 CD 1
   ATOM 159 CE C LYS A 10 ? 38.34257 -15.93490 9.39871 0.425 20.30355 C ? A ? 9 CE 1
   ATOM 160 NZ C LYS A 10 ? 39.35476 -14.93425 9.82317 0.425 21.04519 N ? A ? 9 NZ 1
   ATOM 161 N . TYR A 11 ? 31.46537 -15.59092 8.70303 1.000 6.82698 N ? A ? 10 N 1
   ATOM 162 CA . TYR A 11 ? 30.15501 -15.03627 9.00316 1.000 6.73856 C ? A ? 10 CA 1
   ATOM 163 C . TYR A 11 ? 29.07280 -16.11408 8.96994 1.000 5.77416 C ? A ? 10 C 1
   ATOM 164 O . TYR A 11 ? 28.28597 -16.24943 9.92586 1.000 6.16932 O ? A ? 10 O 1
   ATOM 165 CB . TYR A 11 ? 29.85597 -13.89465 8.02512 1.000 7.30501 C ? A ? 10 CB 1
   ATOM 166 CG . TYR A 11 ? 28.50527 -13.26818 8.21075 1.000 6.38168 C ? A ? 10 CG 1
   ATOM 167 CD1 . TYR A 11 ? 27.35022 -13.88750 7.73197 1.000 6.36471 C ? A ? 10 CD1 1
   ATOM 168 CD2 . TYR A 11 ? 28.37014 -12.03472 8.83499 1.000 6.72871 C ? A ? 10 CD2 1
   ATOM 169 CE1 . TYR A 11 ? 26.08915 -13.30625 7.89909 1.000 6.75854 C ? A ? 10 CE1 1
   ATOM 170 CE2 . TYR A 11 ? 27.11485 -11.43265 8.98041 1.000 6.24893 C ? A ? 10 CE2 1
   ATOM 171 CZ . TYR A 11 ? 25.97988 -12.07489 8.52601 1.000 6.17728 C ? A ? 10 CZ 1
   ATOM 172 OH . TYR A 11 ? 24.71796 -11.54390 8.66781 1.000 7.27532 O ? A ? 10 OH 1
   ATOM 173 N A ARG A 12 ? 28.99292 -16.85628 7.86001 0.554 6.52368 N ? A ? 11 N 1
   ATOM 174 CA A ARG A 12 ? 27.88024 -17.78374 7.69623 0.554 5.93272 C ? A ? 11 CA 1
   ATOM 175 C A ARG A 12 ? 27.96445 -18.92185 8.70047 0.554 5.97765 C ? A ? 11 C 1
   ATOM 176 O A ARG A 12 ? 26.92902 -19.37771 9.21833 0.554 6.48950 O ? A ? 11 O 1
   ATOM 177 CB A ARG A 12 ? 27.78048 -18.27513 6.25138 0.554 6.44445 C ? A ? 11 CB 1
   ATOM 178 CG A ARG A 12 ? 28.83037 -19.32354 5.79822 0.554 6.01722 C ? A ? 11 CG 1
   ATOM 179 CD A ARG A 12 ? 29.00520 -19.25276 4.32052 0.554 6.26769 C ? A ? 11 CD 1
   ATOM 180 NE A ARG A 12 ? 29.98595 -20.19922 3.81424 0.554 6.21429 N ? A ? 11 NE 1
   ATOM 181 CZ A ARG A 12 ? 30.58026 -20.07565 2.63396 0.554 5.51384 C ? A ? 11 CZ 1
   ATOM 182 NH1 A ARG A 12 ? 30.37864 -19.00725 1.87194 0.554 6.67570 N ? A ? 11 NH1 1
   ATOM 183 NH2 A ARG A 12 ? 31.39929 -21.04048 2.20639 0.554 5.81658 N ? A ? 11 NH2 1
   ATOM 184 N B ARG A 12 ? 29.02705 -16.91194 7.89461 0.446 6.02823 N ? A ? 11 N 1
   ATOM 185 CA B ARG A 12 ? 27.94024 -17.88333 7.78751 0.446 7.65118 C ? A ? 11 CA 1
   ATOM 186 C B ARG A 12 ? 28.07657 -18.99983 8.81510 0.446 5.38591 C ? A ? 11 C 1
   ATOM 187 O B ARG A 12 ? 27.06111 -19.50234 9.32269 0.446 6.07100 O ? A ? 11 O 1
   ATOM 188 CB B ARG A 12 ? 27.76743 -18.41498 6.35805 0.446 5.54085 C ? A ? 11 CB 1
   ATOM 189 CG B ARG A 12 ? 28.94917 -19.15140 5.76571 0.446 7.53146 C ? A ? 11 CG 1
   ATOM 190 CD B ARG A 12 ? 29.02926 -18.88107 4.26999 0.446 4.95358 C ? A ? 11 CD 1
   ATOM 191 NE B ARG A 12 ? 29.92091 -19.83166 3.61734 0.446 5.08711 N ? A ? 11 NE 1
   ATOM 192 CZ B ARG A 12 ? 30.50758 -19.62569 2.44753 0.446 4.49773 C ? A ? 11 CZ 1
   ATOM 193 NH1 B ARG A 12 ? 30.31564 -18.51385 1.77147 0.446 5.53269 N ? A ? 11 NH1 1
   ATOM 194 NH2 B ARG A 12 ? 31.27736 -20.58312 1.92078 0.446 5.59226 N ? A ? 11 NH2 1
   ATOM 195 N A GLN A 13 ? 29.17986 -19.36967 9.03429 0.554 6.33115 N ? A ? 12 N 1
   ATOM 196 CA A GLN A 13 ? 29.33990 -20.40131 10.05140 0.554 5.76766 C ? A ? 12 CA 1
   ATOM 197 C A GLN A 13 ? 28.87045 -19.89546 11.41780 0.554 7.11459 C ? A ? 12 C 1
   ATOM 198 O A GLN A 13 ? 28.18376 -20.61564 12.15400 0.554 5.62266 O ? A ? 12 O 1
   ATOM 199 CB A GLN A 13 ? 30.79804 -20.87555 10.11287 0.554 7.70597 C ? A ? 12 CB 1
   ATOM 200 CG A GLN A 13 ? 31.24180 -21.59675 8.87186 0.554 6.97688 C ? A ? 12 CG 1
   ATOM 201 CD A GLN A 13 ? 32.68800 -22.07894 8.93777 0.554 9.12609 C ? A ? 12 CD 1
   ATOM 202 OE1 A GLN A 13 ? 33.52054 -21.48972 9.63651 0.554 8.19113 O ? A ? 12 OE1 1
   ATOM 203 NE2 A GLN A 13 ? 32.99273 -23.16139 8.21056 0.554 7.84143 N ? A ? 12 NE2 1
   ATOM 204 N B GLN A 13 ? 29.30874 -19.35959 9.18286 0.446 7.02985 N ? A ? 12 N 1
   ATOM 205 CA B GLN A 13 ? 29.48934 -20.33041 10.25464 0.446 7.46171 C ? A ? 12 CA 1
   ATOM 206 C B GLN A 13 ? 29.03777 -19.76627 11.59498 0.446 5.31369 C ? A ? 12 C 1
   ATOM 207 O B GLN A 13 ? 28.43866 -20.48607 12.41010 0.446 7.45050 O ? A ? 12 O 1
   ATOM 208 CB B GLN A 13 ? 30.93394 -20.83522 10.29364 0.446 6.45282 C ? A ? 12 CB 1
   ATOM 209 CG B GLN A 13 ? 31.24616 -21.68836 9.08050 0.446 6.16584 C ? A ? 12 CG 1
   ATOM 210 CD B GLN A 13 ? 32.66113 -22.23570 9.04787 0.446 8.69410 C ? A ? 12 CD 1
   ATOM 211 OE1 B GLN A 13 ? 33.42819 -22.09563 10.01394 0.446 8.47629 O ? A ? 12 OE1 1
   ATOM 212 NE2 B GLN A 13 ? 33.03054 -22.84139 7.90251 0.446 7.69366 N ? A ? 12 NE2 1
   ATOM 213 N A SER A 14 ? 29.22531 -18.64812 11.76481 0.554 6.09732 N ? A ? 13 N 1
   ATOM 214 CA A SER A 14 ? 28.77487 -18.05761 13.02525 0.554 6.60088 C ? A ? 13 CA 1
   ATOM 215 C A SER A 14 ? 27.26068 -17.91873 13.06336 0.554 6.34440 C ? A ? 13 C 1
   ATOM 216 O A SER A 14 ? 26.62404 -18.14280 14.10595 0.554 5.98045 O ? A ? 13 O 1
   ATOM 217 CB A SER A 14 ? 29.40587 -16.67529 13.21600 0.554 6.83437 C ? A ? 13 CB 1
   ATOM 218 OG A SER A 14 ? 30.78979 -16.71303 13.48449 0.554 10.54831 O ? A ? 13 OG 1
   ATOM 219 N B SER A 14 ? 29.30852 -18.48038 11.83926 0.446 6.01147 N ? A ? 13 N 1
   ATOM 220 CA B SER A 14 ? 28.81941 -17.89370 13.07742 0.446 6.32298 C ? A ? 13 CA 1
   ATOM 221 C B SER A 14 ? 27.29932 -17.75338 13.09661 0.446 6.15048 C ? A ? 13 C 1
   ATOM 222 O B SER A 14 ? 26.69412 -17.87816 14.16951 0.446 6.34431 O ? A ? 13 O 1
   ATOM 223 CB B SER A 14 ? 29.55525 -16.59775 13.41185 0.446 7.02269 C ? A ? 13 CB 1
   ATOM 224 OG B SER A 14 ? 30.77750 -16.88007 14.07973 0.446 7.37883 O ? A ? 13 OG 1
   ATOM 225 N . ALA A 15 ? 26.66291 -17.51835 11.92760 1.000 6.48337 N ? A ? 14 N 1
   ATOM 226 CA . ALA A 15 ? 25.20118 -17.46368 11.88116 1.000 6.82334 C ? A ? 14 CA 1
   ATOM 227 C . ALA A 15 ? 24.62191 -18.85102 12.14922 1.000 6.19491 C ? A ? 14 C 1
   ATOM 228 O . ALA A 15 ? 23.63475 -18.98912 12.89085 1.000 6.73538 O ? A ? 14 O 1
   ATOM 229 CB . ALA A 15 ? 24.72128 -16.86532 10.55061 1.000 6.49837 C ? A ? 14 CB 1
   ATOM 230 N A GLY A 16 ? 25.25160 -19.88217 11.57960 0.254 6.32012 N ? A ? 15 N 1
   ATOM 231 CA A GLY A 16 ? 24.89876 -21.24096 11.93251 0.254 7.43431 C ? A ? 15 CA 1
   ATOM 232 C A GLY A 16 ? 25.04362 -21.51656 13.42007 0.254 5.93294 C ? A ? 15 C 1
   ATOM 233 O A GLY A 16 ? 24.18820 -22.17439 14.02383 0.254 6.68877 O ? A ? 15 O 1
   ATOM 234 N B GLY A 16 ? 25.19548 -19.88942 11.53645 0.597 6.33985 N ? A ? 15 N 1
   ATOM 235 CA B GLY A 16 ? 24.72080 -21.23518 11.80606 0.597 6.56277 C ? A ? 15 CA 1
   ATOM 236 C B GLY A 16 ? 24.85469 -21.61617 13.28233 0.597 7.41352 C ? A ? 15 C 1
   ATOM 237 O B GLY A 16 ? 23.93394 -22.17552 13.88808 0.597 6.51539 O ? A ? 15 O 1
   ATOM 238 N C GLY A 16 ? 25.22347 -19.88829 11.56512 0.149 6.33327 N ? A ? 15 N 1
   ATOM 239 CA C GLY A 16 ? 24.69025 -21.22892 11.74940 0.149 6.33774 C ? A ? 15 CA 1
   ATOM 240 C C GLY A 16 ? 24.76721 -21.70946 13.18677 0.149 6.78354 C ? A ? 15 C 1
   ATOM 241 O C GLY A 16 ? 23.83430 -22.33714 13.69499 0.149 8.34565 O ? A ? 15 O 1
   ATOM 242 N A THR A 17 ? 26.10842 -20.99123 14.03951 0.254 5.18362 N ? A ? 16 N 1
   ATOM 243 CA A THR A 17 ? 26.28719 -21.19248 15.47841 0.254 4.44757 C ? A ? 16 CA 1
   ATOM 244 C A THR A 17 ? 25.16414 -20.53155 16.26496 0.254 5.60183 C ? A ? 16 C 1
   ATOM 245 O A THR A 17 ? 24.59033 -21.14201 17.17500 0.254 4.50408 O ? A ? 16 O 1
   ATOM 246 CB A THR A 17 ? 27.64432 -20.64666 15.93422 0.254 3.49158 C ? A ? 16 CB 1
   ATOM 247 OG1 A THR A 17 ? 28.69577 -21.34784 15.25307 0.254 6.31943 O ? A ? 16 OG1 1
   ATOM 248 CG2 A THR A 17 ? 27.81569 -20.78780 17.44851 0.254 6.98430 C ? A ? 16 CG2 1
   ATOM 249 N B THR A 17 ? 25.99538 -21.28805 13.88719 0.597 7.72285 N ? A ? 16 N 1
   ATOM 250 CA B THR A 17 ? 26.20176 -21.56822 15.31232 0.597 7.34333 C ? A ? 16 CA 1
   ATOM 251 C B THR A 17 ? 25.10120 -20.94774 16.15370 0.597 5.83008 C ? A ? 16 C 1
   ATOM 252 O B THR A 17 ? 24.56607 -21.58901 17.07344 0.597 7.23435 O ? A ? 16 O 1
   ATOM 253 CB B THR A 17 ? 27.58164 -21.04473 15.71530 0.597 7.66031 C ? A ? 16 CB 1
   ATOM 254 OG1 B THR A 17 ? 28.57781 -21.80018 15.01649 0.597 7.88779 O ? A ? 16 OG1 1
   ATOM 255 CG2 B THR A 17 ? 27.84327 -21.15980 17.22374 0.597 8.74776 C ? A ? 16 CG2 1
   ATOM 256 N C THR A 17 ? 25.88142 -21.42437 13.85938 0.149 5.86622 N ? A ? 16 N 1
   ATOM 257 CA C THR A 17 ? 26.02483 -21.81107 15.25989 0.149 5.72512 C ? A ? 16 CA 1
   ATOM 258 C C THR A 17 ? 24.98495 -21.12124 16.13293 0.149 4.96932 C ? A ? 16 C 1
   ATOM 259 O C THR A 17 ? 24.42191 -21.74214 17.04632 0.149 5.17179 O ? A ? 16 O 1
   ATOM 260 CB C THR A 17 ? 27.44438 -21.50196 15.73664 0.149 6.86507 C ? A ? 16 CB 1
   ATOM 261 OG1 C THR A 17 ? 27.54438 -21.71294 17.15192 0.149 9.58191 O ? A ? 16 OG1 1
   ATOM 262 CG2 C THR A 17 ? 27.82198 -20.06382 15.40255 0.149 7.97931 C ? A ? 16 CG2 1
   ATOM 263 N A LEU A 18 ? 24.84755 -19.27009 15.95434 0.254 2.92530 N ? A ? 17 N 1
   ATOM 264 CA A LEU A 18 ? 23.79762 -18.60220 16.71705 0.254 3.84601 C ? A ? 17 CA 1
   ATOM 265 C A LEU A 18 ? 22.43349 -19.21272 16.44264 0.254 2.76052 C ? A ? 17 C 1
   ATOM 266 O A LEU A 18 ? 21.63802 -19.38174 17.36963 0.254 3.63551 O ? A ? 17 O 1
   ATOM 267 CB A LEU A 18 ? 23.79749 -17.10647 16.43910 0.254 3.70617 C ? A ? 17 CB 1
   ATOM 268 CG A LEU A 18 ? 25.02281 -16.37684 16.96686 0.254 5.99808 C ? A ? 17 CG 1
   ATOM 269 CD1 A LEU A 18 ? 24.63161 -14.93723 17.14128 0.254 6.34656 C ? A ? 17 CD1 1
   ATOM 270 CD2 A LEU A 18 ? 25.54997 -17.00208 18.25631 0.254 5.75087 C ? A ? 17 CD2 1
   ATOM 271 N B LEU A 18 ? 24.74217 -19.69975 15.86499 0.597 6.95595 N ? A ? 17 N 1
   ATOM 272 CA B LEU A 18 ? 23.69623 -19.06714 16.66386 0.597 5.98825 C ? A ? 17 CA 1
   ATOM 273 C B LEU A 18 ? 22.32947 -19.67847 16.38650 0.597 5.97286 C ? A ? 17 C 1
   ATOM 274 O B LEU A 18 ? 21.54197 -19.85718 17.33167 0.597 6.39734 O ? A ? 17 O 1
   ATOM 275 CB B LEU A 18 ? 23.72084 -17.54404 16.48234 0.597 7.49543 C ? A ? 17 CB 1
   ATOM 276 CG B LEU A 18 ? 25.01270 -16.78736 16.85812 0.597 8.47517 C ? A ? 17 CG 1
   ATOM 277 CD1 B LEU A 18 ? 24.99815 -15.35710 16.32122 0.597 12.61946 C ? A ? 17 CD1 1
   ATOM 278 CD2 B LEU A 18 ? 25.30912 -16.76688 18.35226 0.597 9.97385 C ? A ? 17 CD2 1
   ATOM 279 N C LEU A 18 ? 24.71295 -19.83952 15.86918 0.149 5.88998 N ? A ? 17 N 1
   ATOM 280 CA C LEU A 18 ? 23.72609 -19.12433 16.67268 0.149 5.81839 C ? A ? 17 CA 1
   ATOM 281 C C LEU A 18 ? 22.31583 -19.61659 16.38603 0.149 5.79730 C ? A ? 17 C 1
   ATOM 282 O C LEU A 18 ? 21.47314 -19.66051 17.28987 0.149 7.00309 O ? A ? 17 O 1
   ATOM 283 CB C LEU A 18 ? 23.83666 -17.61492 16.44178 0.149 6.78932 C ? A ? 17 CB 1
   ATOM 284 CG C LEU A 18 ? 25.10520 -16.91527 16.92419 0.149 7.67435 C ? A ? 17 CG 1
   ATOM 285 CD1 C LEU A 18 ? 24.84939 -15.42145 17.08452 0.149 6.27135 C ? A ? 17 CD1 1
   ATOM 286 CD2 C LEU A 18 ? 25.63295 -17.52113 18.22117 0.149 3.47286 C ? A ? 17 CD2 1
   ATOM 287 N A MET A 19 ? 22.12841 -19.51621 15.17136 0.254 3.73744 N ? A ? 18 N 1
   ATOM 288 CA A MET A 19 ? 20.86258 -20.17761 14.84536 0.254 4.15562 C ? A ? 18 CA 1
   ATOM 289 C A MET A 19 ? 20.70957 -21.49342 15.59960 0.254 3.16100 C ? A ? 18 C 1
   ATOM 290 O A MET A 19 ? 19.63161 -21.79826 16.13171 0.254 4.15656 O ? A ? 18 O 1
   ATOM 291 CB A MET A 19 ? 20.80029 -20.48076 13.35291 0.254 5.99655 C ? A ? 18 CB 1
   ATOM 292 CG A MET A 19 ? 20.56159 -19.31701 12.43894 0.254 5.39131 C ? A ? 18 CG 1
   ATOM 293 SD A MET A 19 ? 21.02782 -19.69070 10.72594 0.254 6.42977 S ? A ? 18 SD 1
   ATOM 294 CE A MET A 19 ? 19.86670 -20.97544 10.28787 0.254 6.35817 C ? A ? 18 CE 1
   ATOM 295 N B MET A 19 ? 22.03110 -20.01315 15.11341 0.597 6.09569 N ? A ? 18 N 1
   ATOM 296 CA B MET A 19 ? 20.76078 -20.68361 14.84432 0.597 6.38909 C ? A ? 18 CA 1
   ATOM 297 C B MET A 19 ? 20.66012 -21.99878 15.60843 0.597 5.59568 C ? A ? 18 C 1
   ATOM 298 O B MET A 19 ? 19.59980 -22.32984 16.15069 0.597 6.49152 O ? A ? 18 O 1
   ATOM 299 CB B MET A 19 ? 20.55347 -20.92598 13.35118 0.597 6.34413 C ? A ? 18 CB 1
   ATOM 300 CG B MET A 19 ? 20.29123 -19.68061 12.51433 0.597 6.71504 C ? A ? 18 CG 1
   ATOM 301 SD B MET A 19 ? 19.57705 -20.06946 10.90045 0.597 7.39523 S ? A ? 18 SD 1
   ATOM 302 CE B MET A 19 ? 20.92226 -21.03858 10.21654 0.597 8.19006 C ? A ? 18 CE 1
   ATOM 303 N C MET A 19 ? 22.03510 -19.98485 15.13185 0.149 6.19728 N ? A ? 18 N 1
   ATOM 304 CA C MET A 19 ? 20.77503 -20.65569 14.83954 0.149 6.45548 C ? A ? 18 CA 1
   ATOM 305 C C MET A 19 ? 20.67467 -21.96936 15.59627 0.149 5.70643 C ? A ? 18 C 1
   ATOM 306 O C MET A 19 ? 19.61001 -22.31316 16.12198 0.149 6.41421 O ? A ? 18 O 1
   ATOM 307 CB C MET A 19 ? 20.65346 -20.92209 13.34201 0.149 6.68959 C ? A ? 18 CB 1
   ATOM 308 CG C MET A 19 ? 20.00858 -19.81353 12.54977 0.149 8.13995 C ? A ? 18 CG 1
   ATOM 309 SD C MET A 19 ? 19.33724 -20.49780 11.03128 0.149 4.11320 S ? A ? 18 SD 1
   ATOM 310 CE C MET A 19 ? 20.81572 -21.19587 10.30158 0.149 7.80197 C ? A ? 18 CE 1
   ATOM 311 N A ALA A 20 ? 21.76940 -22.30947 15.61843 0.254 5.00576 N ? A ? 19 N 1
   ATOM 312 CA A ALA A 20 ? 21.68004 -23.61692 16.26216 0.254 6.14146 C ? A ? 19 CA 1
   ATOM 313 C A ALA A 20 ? 21.39334 -23.48302 17.75451 0.254 4.44660 C ? A ? 19 C 1
   ATOM 314 O A ALA A 20 ? 20.61429 -24.25894 18.31708 0.254 4.92292 O ? A ? 19 O 1
   ATOM 315 CB A ALA A 20 ? 22.95755 -24.42587 16.02052 0.254 7.82713 C ? A ? 19 CB 1
   ATOM 316 N B ALA A 20 ? 21.73596 -22.78821 15.61434 0.597 6.50165 N ? A ? 19 N 1
   ATOM 317 CA B ALA A 20 ? 21.70626 -24.05929 16.31469 0.597 6.55012 C ? A ? 19 CA 1
   ATOM 318 C B ALA A 20 ? 21.37757 -23.84950 17.78176 0.597 6.71007 C ? A ? 19 C 1
   ATOM 319 O B ALA A 20 ? 20.64207 -24.64255 18.36911 0.597 7.29030 O ? A ? 19 O 1
   ATOM 320 CB B ALA A 20 ? 23.05381 -24.76609 16.16855 0.597 8.92771 C ? A ? 19 CB 1
   ATOM 321 N C ALA A 20 ? 21.77096 -22.72738 15.64156 0.149 6.58312 N ? A ? 19 N 1
   ATOM 322 CA C ALA A 20 ? 21.76989 -23.98284 16.37739 0.149 7.09102 C ? A ? 19 CA 1
   ATOM 323 C C ALA A 20 ? 21.45048 -23.75267 17.84580 0.149 6.54705 C ? A ? 19 C 1
   ATOM 324 O C ALA A 20 ? 20.73794 -24.54965 18.46348 0.149 7.52699 O ? A ? 19 O 1
   ATOM 325 CB C ALA A 20 ? 23.12199 -24.67930 16.22312 0.149 8.86155 C ? A ? 19 CB 1
   ATOM 326 N A SER A 21 ? 22.01488 -22.50354 18.41217 0.254 4.39622 N ? A ? 20 N 1
   ATOM 327 CA A SER A 21 ? 21.73975 -22.31475 19.82946 0.254 6.50572 C ? A ? 20 CA 1
   ATOM 328 C A SER A 21 ? 20.28463 -21.92386 20.06406 0.254 5.73556 C ? A ? 20 C 1
   ATOM 329 O A SER A 21 ? 19.65192 -22.39086 21.01433 0.254 6.34159 O ? A ? 20 O 1
   ATOM 330 CB A SER A 21 ? 22.67535 -21.25552 20.39285 0.254 5.80546 C ? A ? 20 CB 1
   ATOM 331 OG A SER A 21 ? 22.38275 -21.02210 21.75728 0.254 6.93709 O ? A ? 20 OG 1
   ATOM 332 N B SER A 21 ? 21.94114 -22.80688 18.39529 0.597 6.89131 N ? A ? 20 N 1
   ATOM 333 CA B SER A 21 ? 21.64008 -22.53556 19.79560 0.597 6.20365 C ? A ? 20 CA 1
   ATOM 334 C B SER A 21 ? 20.19610 -22.06125 19.99818 0.597 6.13167 C ? A ? 20 C 1
   ATOM 335 O B SER A 21 ? 19.50248 -22.55086 20.90473 0.597 6.68456 O ? A ? 20 O 1
   ATOM 336 CB B SER A 21 ? 22.61967 -21.52526 20.37384 0.597 6.36463 C ? A ? 20 CB 1
   ATOM 337 OG B SER A 21 ? 22.29321 -21.26716 21.73522 0.597 6.64135 O ? A ? 20 OG 1
   ATOM 338 N C SER A 21 ? 21.97105 -22.66558 18.42278 0.149 6.09480 N ? A ? 20 N 1
   ATOM 339 CA C SER A 21 ? 21.70896 -22.38189 19.83026 0.149 6.48082 C ? A ? 20 CA 1
   ATOM 340 C C SER A 21 ? 20.26002 -21.95920 20.05510 0.149 5.90279 C ? A ? 20 C 1
   ATOM 341 O C SER A 21 ? 19.61188 -22.42759 20.99636 0.149 6.40013 O ? A ? 20 O 1
   ATOM 342 CB C SER A 21 ? 22.66977 -21.31242 20.34156 0.149 6.05620 C ? A ? 20 CB 1
   ATOM 343 OG C SER A 21 ? 22.43379 -21.03173 21.71276 0.149 6.99469 O ? A ? 20 OG 1
   ATOM 344 N . HIS A 22 ? 19.73242 -21.07644 19.20584 1.000 6.05638 N ? A ? 21 N 1
   ATOM 345 CA . HIS A 22 ? 18.36801 -20.58391 19.40632 1.000 6.45383 C ? A ? 21 CA 1
   ATOM 346 C . HIS A 22 ? 17.30574 -21.60129 19.02501 1.000 6.69203 C ? A ? 21 C 1
   ATOM 347 O . HIS A 22 ? 16.20505 -21.57202 19.59233 1.000 7.24567 O ? A ? 21 O 1
   ATOM 348 CB . HIS A 22 ? 18.17686 -19.21509 18.74216 1.000 7.25967 C ? A ? 21 CB 1
   ATOM 349 CG . HIS A 22 ? 18.83128 -18.12587 19.53605 1.000 6.50130 C ? A ? 21 CG 1
   ATOM 350 ND1 . HIS A 22 ? 18.22275 -17.55550 20.63672 1.000 7.13084 N ? A ? 21 ND1 1
   ATOM 351 CD2 . HIS A 22 ? 20.09076 -17.62444 19.50139 1.000 6.29730 C ? A ? 21 CD2 1
   ATOM 352 CE1 . HIS A 22 ? 19.07543 -16.69866 21.18240 1.000 7.34940 C ? A ? 21 CE1 1
   ATOM 353 NE2 . HIS A 22 ? 20.21655 -16.72516 20.52649 1.000 7.49530 N ? A ? 21 NE2 1
   ATOM 354 N . PHE A 23 ? 17.58970 -22.46841 18.05166 1.000 6.40154 N ? A ? 22 N 1
   ATOM 355 CA . PHE A 23 ? 16.67404 -23.55101 17.71178 1.000 6.78228 C ? A ? 22 CA 1
   ATOM 356 C . PHE A 23 ? 16.76820 -24.66808 18.74927 1.000 6.65738 C ? A ? 22 C 1
   ATOM 357 O . PHE A 23 ? 15.77249 -25.02077 19.40466 1.000 6.66046 O ? A ? 22 O 1
   ATOM 358 CB . PHE A 23 ? 17.01636 -24.07066 16.29635 1.000 6.87661 C ? A ? 22 CB 1
   ATOM 359 CG . PHE A 23 ? 16.12268 -25.19719 15.86394 1.000 6.61835 C ? A ? 22 CG 1
   ATOM 360 CD1 . PHE A 23 ? 14.80098 -24.96445 15.50499 1.000 8.62659 C ? A ? 22 CD1 1
   ATOM 361 CD2 . PHE A 23 ? 16.57920 -26.48356 15.83277 1.000 9.64489 C ? A ? 22 CD2 1
   ATOM 362 CE1 . PHE A 23 ? 13.95222 -26.01351 15.11188 1.000 8.32764 C ? A ? 22 CE1 1
   ATOM 363 CE2 . PHE A 23 ? 15.71934 -27.53741 15.46158 1.000 12.98919 C ? A ? 22 CE2 1
   ATOM 364 CZ . PHE A 23 ? 14.40832 -27.27741 15.10096 1.000 8.95158 C ? A ? 22 CZ 1
   ATOM 365 N . GLY A 24 ? 17.98405 -25.18686 18.96857 1.000 7.27218 N ? A ? 23 N 1
   ATOM 366 CA . GLY A 24 ? 18.18869 -26.33905 19.81928 1.000 8.62593 C ? A ? 23 CA 1
   ATOM 367 C . GLY A 24 ? 17.82897 -26.11055 21.27605 1.000 7.78512 C ? A ? 23 C 1
   ATOM 368 O . GLY A 24 ? 17.43495 -27.05930 21.95999 1.000 8.99242 O ? A ? 23 O 1
   ATOM 369 N . ARG A 25 ? 17.93063 -24.87404 21.75214 1.000 6.75128 N ? A ? 24 N 1
   ATOM 370 CA . ARG A 25 ? 17.60668 -24.64634 23.16200 1.000 7.51577 C ? A ? 24 CA 1
   ATOM 371 C . ARG A 25 ? 16.12255 -24.86473 23.43465 1.000 7.15625 C ? A ? 24 C 1
   ATOM 372 O . ARG A 25 ? 15.73787 -24.96520 24.62112 1.000 7.68183 O ? A ? 24 O 1
   ATOM 373 CB . ARG A 25 ? 18.01579 -23.24000 23.61693 1.000 7.89155 C ? A ? 24 CB 1
   ATOM 374 CG . ARG A 25 ? 17.15483 -22.13786 23.01262 1.000 7.15611 C ? A ? 24 CG 1
   ATOM 375 CD . ARG A 25 ? 17.61422 -20.74691 23.46066 1.000 7.90560 C ? A ? 24 CD 1
   ATOM 376 NE . ARG A 25 ? 18.99414 -20.43863 23.11920 1.000 6.88536 N ? A ? 24 NE 1
   ATOM 377 CZ . ARG A 25 ? 19.65769 -19.42992 23.65290 1.000 7.19123 C ? A ? 24 CZ 1
   ATOM 378 NH1 . ARG A 25 ? 19.08620 -18.61782 24.52613 1.000 8.24099 N ? A ? 24 NH1 1
   ATOM 379 NH2 . ARG A 25 ? 20.93874 -19.25434 23.34416 1.000 7.27754 N ? A ? 24 NH2 1
   ATOM 380 N A MET A 26 ? 15.28182 -24.86840 22.39776 0.504 6.82586 N ? A ? 25 N 1
   ATOM 381 CA A MET A 26 ? 13.86359 -25.09629 22.61519 0.504 7.98928 C ? A ? 25 CA 1
   ATOM 382 C A MET A 26 ? 13.48547 -26.57087 22.62969 0.504 8.24210 C ? A ? 25 C 1
   ATOM 383 O A MET A 26 ? 12.32898 -26.87956 22.94854 0.504 7.40332 O ? A ? 25 O 1
   ATOM 384 CB A MET A 26 ? 13.01745 -24.31680 21.59815 0.504 6.78808 C ? A ? 25 CB 1
   ATOM 385 CG A MET A 26 ? 13.20034 -22.80367 21.68331 0.504 6.84801 C ? A ? 25 CG 1
   ATOM 386 SD A MET A 26 ? 12.07830 -21.89183 20.56746 0.504 6.07435 S ? A ? 25 SD 1
   ATOM 387 CE A MET A 26 ? 12.88770 -22.23636 18.98896 0.504 7.12833 C ? A ? 25 CE 1
   ATOM 388 N C MET A 26 ? 15.27896 -25.00265 22.39040 0.496 7.32523 N ? A ? 25 N 1
   ATOM 389 CA C MET A 26 ? 13.85970 -25.31792 22.57961 0.496 5.93753 C ? A ? 25 CA 1
   ATOM 390 C C MET A 26 ? 13.56107 -26.80926 22.61198 0.496 7.25125 C ? A ? 25 C 1
   ATOM 391 O C MET A 26 ? 12.43430 -27.19065 22.97095 0.496 7.53919 O ? A ? 25 O 1
   ATOM 392 CB C MET A 26 ? 12.99425 -24.64166 21.51649 0.496 7.14409 C ? A ? 25 CB 1
   ATOM 393 CG C MET A 26 ? 13.06881 -23.13584 21.57358 0.496 6.83529 C ? A ? 25 CG 1
   ATOM 394 SD C MET A 26 ? 11.97137 -22.32778 20.39156 0.496 6.80744 S ? A ? 25 SD 1
   ATOM 395 CE C MET A 26 ? 12.82134 -22.73523 18.88790 0.496 5.34309 C ? A ? 25 CE 1
   ATOM 396 N A THR A 27 ? 14.41846 -27.48459 22.33006 0.504 8.47367 N ? A ? 26 N 1
   ATOM 397 CA A THR A 27 ? 14.09095 -28.91085 22.28973 0.504 7.50989 C ? A ? 26 CA 1
   ATOM 398 C A THR A 27 ? 13.47972 -29.44520 23.58241 0.504 5.97425 C ? A ? 26 C 1
   ATOM 399 O A THR A 27 ? 12.42208 -30.08968 23.52198 0.504 8.69818 O ? A ? 26 O 1
   ATOM 400 CB A THR A 27 ? 15.32818 -29.72438 21.88340 0.504 7.42770 C ? A ? 26 CB 1
   ATOM 401 OG1 A THR A 27 ? 15.91058 -29.19522 20.68415 0.504 7.69754 O ? A ? 26 OG1 1
   ATOM 402 CG2 A THR A 27 ? 14.96404 -31.18887 21.70932 0.504 11.32859 C ? A ? 26 CG2 1
   ATOM 403 N C THR A 27 ? 14.52352 -27.65926 22.27267 0.496 6.64190 N ? A ? 26 N 1
   ATOM 404 CA C THR A 27 ? 14.29177 -29.09773 22.34643 0.496 7.26416 C ? A ? 26 CA 1
   ATOM 405 C C THR A 27 ? 13.67452 -29.51725 23.66375 0.496 8.02444 C ? A ? 26 C 1
   ATOM 406 O C THR A 27 ? 12.68997 -30.26178 23.63361 0.496 7.36641 O ? A ? 26 O 1
   ATOM 407 CB C THR A 27 ? 15.56557 -29.87284 21.99944 0.496 9.13115 C ? A ? 26 CB 1
   ATOM 408 OG1 C THR A 27 ? 15.85246 -29.65917 20.62153 0.496 7.97836 O ? A ? 26 OG1 1
   ATOM 409 CG2 C THR A 27 ? 15.37378 -31.35173 22.22558 0.496 11.01597 C ? A ? 26 CG2 1
   ATOM 410 N A PRO A 28 ? 14.06808 -29.22499 24.77021 0.504 7.88961 N ? A ? 27 N 1
   ATOM 411 CA A PRO A 28 ? 13.45225 -29.76105 25.99251 0.504 6.42061 C ? A ? 27 CA 1
   ATOM 412 C A PRO A 28 ? 12.06988 -29.21780 26.21936 0.504 6.69810 C ? A ? 27 C 1
   ATOM 413 O A PRO A 28 ? 11.23471 -29.90244 26.82299 0.504 6.82500 O ? A ? 27 O 1
   ATOM 414 CB A PRO A 28 ? 14.41012 -29.31162 27.10484 0.504 10.02002 C ? A ? 27 CB 1
   ATOM 415 CG A PRO A 28 ? 15.70424 -29.05656 26.43308 0.504 8.59426 C ? A ? 27 CG 1
   ATOM 416 CD A PRO A 28 ? 15.33072 -28.52355 25.06645 0.504 7.68317 C ? A ? 27 CD 1
   ATOM 417 N C PRO A 28 ? 14.12692 -29.02663 24.83656 0.496 7.05173 N ? A ? 27 N 1
   ATOM 418 CA C PRO A 28 ? 13.47816 -29.46098 26.08378 0.496 6.78657 C ? A ? 27 CA 1
   ATOM 419 C C PRO A 28 ? 12.03631 -28.97803 26.22891 0.496 7.56397 C ? A ? 27 C 1
   ATOM 420 O C PRO A 28 ? 11.22964 -29.67253 26.86434 0.496 8.94279 O ? A ? 27 O 1
   ATOM 421 CB C PRO A 28 ? 14.39530 -28.91318 27.19488 0.496 7.85912 C ? A ? 27 CB 1
   ATOM 422 CG C PRO A 28 ? 15.70795 -28.65983 26.52052 0.496 9.85736 C ? A ? 27 CG 1
   ATOM 423 CD C PRO A 28 ? 15.34505 -28.23256 25.11209 0.496 8.03136 C ? A ? 27 CD 1
   ATOM 424 N A VAL A 29 ? 11.80458 -27.99061 25.77582 0.504 7.47697 N ? A ? 28 N 1
   ATOM 425 CA A VAL A 29 ? 10.44978 -27.45634 25.84651 0.504 7.51218 C ? A ? 28 CA 1
   ATOM 426 C A VAL A 29 ? 9.52028 -28.25707 24.94477 0.504 5.81251 C ? A ? 28 C 1
   ATOM 427 O A VAL A 29 ? 8.41943 -28.66382 25.34362 0.504 7.25627 O ? A ? 28 O 1
   ATOM 428 CB A VAL A 29 ? 10.44671 -25.94787 25.52403 0.504 7.75902 C ? A ? 28 CB 1
   ATOM 429 CG1 A VAL A 29 ? 9.01828 -25.39048 25.51455 0.504 8.82166 C ? A ? 28 CG1 1
   ATOM 430 CG2 A VAL A 29 ? 11.34248 -25.18756 26.52551 0.504 8.70214 C ? A ? 28 CG2 1
   ATOM 431 N C VAL A 29 ? 11.69409 -27.81656 25.66156 0.496 7.10813 N ? A ? 28 N 1
   ATOM 432 CA C VAL A 29 ? 10.35091 -27.26368 25.79874 0.496 9.05608 C ? A ? 28 CA 1
   ATOM 433 C C VAL A 29 ? 9.35511 -28.00812 24.92091 0.496 7.69168 C ? A ? 28 C 1
   ATOM 434 O C VAL A 29 ? 8.26045 -28.38014 25.36696 0.496 7.48212 O ? A ? 28 O 1
   ATOM 435 CB C VAL A 29 ? 10.36033 -25.75303 25.49323 0.496 7.73001 C ? A ? 28 CB 1
   ATOM 436 CG1 C VAL A 29 ? 8.93637 -25.18412 25.48393 0.496 8.42521 C ? A ? 28 CG1 1
   ATOM 437 CG2 C VAL A 29 ? 11.24849 -25.00606 26.48449 0.496 8.27850 C ? A ? 28 CG2 1
   ATOM 438 N A VAL A 30 ? 9.96842 -28.52194 23.71638 0.504 7.11227 N ? A ? 29 N 1
   ATOM 439 CA A VAL A 30 ? 9.13223 -29.23184 22.75669 0.504 8.32455 C ? A ? 29 CA 1
   ATOM 440 C A VAL A 30 ? 8.81201 -30.62656 23.25660 0.504 9.53516 C ? A ? 29 C 1
   ATOM 441 O A VAL A 30 ? 7.70377 -31.12725 23.04961 0.504 12.35990 O ? A ? 29 O 1
   ATOM 442 CB A VAL A 30 ? 9.80997 -29.25449 21.37879 0.504 8.96474 C ? A ? 29 CB 1
   ATOM 443 CG1 A VAL A 30 ? 9.19052 -30.31310 20.45254 0.504 9.43618 C ? A ? 29 CG1 1
   ATOM 444 CG2 A VAL A 30 ? 9.71874 -27.90116 20.76882 0.504 10.01603 C ? A ? 29 CG2 1
   ATOM 445 N C VAL A 30 ? 9.70204 -28.21191 23.64579 0.496 6.82282 N ? A ? 29 N 1
   ATOM 446 CA C VAL A 30 ? 8.80932 -28.98260 22.78360 0.496 6.64739 C ? A ? 29 CA 1
   ATOM 447 C C VAL A 30 ? 8.70244 -30.43888 23.22891 0.496 9.55291 C ? A ? 29 C 1
   ATOM 448 O C VAL A 30 ? 7.69703 -31.09011 22.93366 0.496 11.22705 O ? A ? 29 O 1
   ATOM 449 CB C VAL A 30 ? 9.16815 -28.87475 21.29032 0.496 7.97048 C ? A ? 29 CB 1
   ATOM 450 CG1 C VAL A 30 ? 9.02684 -27.43192 20.80656 0.496 8.39182 C ? A ? 29 CG1 1
   ATOM 451 CG2 C VAL A 30 ? 10.56739 -29.44722 21.00564 0.496 11.83903 C ? A ? 29 CG2 1
   ATOM 452 N A LYS A 31 ? 9.76905 -31.26691 23.92257 0.504 6.35718 N ? A ? 30 N 1
   ATOM 453 CA A LYS A 31 ? 9.59929 -32.57165 24.54822 0.504 9.83725 C ? A ? 30 CA 1
   ATOM 454 C A LYS A 31 ? 8.85450 -32.51936 25.86979 0.504 9.38715 C ? A ? 30 C 1
   ATOM 455 O A LYS A 31 ? 8.39387 -33.56548 26.33002 0.504 9.17214 O ? A ? 30 O 1
   ATOM 456 CB A LYS A 31 ? 10.95193 -33.26712 24.71559 0.504 10.35996 C ? A ? 30 CB 1
   ATOM 457 CG A LYS A 31 ? 11.57318 -33.57535 23.38255 0.504 14.13596 C ? A ? 30 CG 1
   ATOM 458 CD A LYS A 31 ? 12.71606 -34.56757 23.50968 0.504 22.78401 C ? A ? 30 CD 1
   ATOM 459 CE A LYS A 31 ? 13.94625 -33.94679 24.15122 0.504 27.18578 C ? A ? 30 CE 1
   ATOM 460 NZ A LYS A 31 ? 15.17679 -34.76279 23.90076 0.504 31.99847 N ? A ? 30 NZ 1
   ATOM 461 N C LYS A 31 ? 9.69872 -30.97150 23.93710 0.496 9.95030 N ? A ? 30 N 1
   ATOM 462 CA C LYS A 31 ? 9.66280 -32.33833 24.46536 0.496 10.47117 C ? A ? 30 CA 1
   ATOM 463 C C LYS A 31 ? 9.01279 -32.45986 25.83426 0.496 9.60187 C ? A ? 30 C 1
   ATOM 464 O C LYS A 31 ? 8.84859 -33.58125 26.32669 0.496 11.92189 O ? A ? 30 O 1
   ATOM 465 CB C LYS A 31 ? 11.06615 -32.91985 24.55787 0.496 11.94493 C ? A ? 30 CB 1
   ATOM 466 CG C LYS A 31 ? 11.65109 -33.25891 23.22702 0.496 12.50552 C ? A ? 30 CG 1
   ATOM 467 CD C LYS A 31 ? 12.90287 -34.08378 23.39913 0.496 19.76778 C ? A ? 30 CD 1
   ATOM 468 CE C LYS A 31 ? 13.36732 -34.62949 22.07242 0.496 13.99964 C ? A ? 30 CE 1
   ATOM 469 NZ C LYS A 31 ? 14.63039 -35.41444 22.16729 0.496 23.52793 N ? A ? 30 NZ 1
   ATOM 470 N . GLY A 32 ? 8.61938 -31.34173 26.43779 1.000 8.77156 N ? A ? 31 N 1
   ATOM 471 CA . GLY A 32 ? 7.92905 -31.29610 27.71494 1.000 8.66726 C ? A ? 31 CA 1
   ATOM 472 C . GLY A 32 ? 8.82284 -31.48415 28.91634 1.000 7.39934 C ? A ? 31 C 1
   ATOM 473 O . GLY A 32 ? 8.32800 -31.49412 30.06465 1.000 7.33921 O ? A ? 31 O 1
   ATOM 474 N A GLN A 33 ? 10.12368 -31.63362 28.71077 0.372 7.90902 N ? A ? 32 N 1
   ATOM 475 CA A GLN A 33 ? 11.07676 -31.81244 29.79523 0.372 8.62788 C ? A ? 32 CA 1
   ATOM 476 C A GLN A 33 ? 11.45957 -30.50644 30.48973 0.372 7.17600 C ? A ? 32 C 1
   ATOM 477 O A GLN A 33 ? 12.03560 -30.54988 31.58826 0.372 10.09296 O ? A ? 32 O 1
   ATOM 478 CB A GLN A 33 ? 12.30276 -32.56428 29.27379 0.372 10.28716 C ? A ? 32 CB 1
   ATOM 479 CG A GLN A 33 ? 11.97130 -33.98084 28.80396 0.372 10.86882 C ? A ? 32 CG 1
   ATOM 480 CD A GLN A 33 ? 13.05831 -34.58374 27.94867 0.372 18.59795 C ? A ? 32 CD 1
   ATOM 481 OE1 A GLN A 33 ? 14.13576 -34.00121 27.78555 0.372 15.00533 O ? A ? 32 OE1 1
   ATOM 482 NE2 A GLN A 33 ? 12.78039 -35.75829 27.38589 0.372 20.38869 N ? A ? 32 NE2 1
   ATOM 483 N B GLN A 33 ? 10.12763 -31.60879 28.68827 0.262 8.00358 N ? A ? 32 N 1
   ATOM 484 CA B GLN A 33 ? 11.07480 -31.80584 29.77847 0.262 8.51327 C ? A ? 32 CA 1
   ATOM 485 C B GLN A 33 ? 11.45472 -30.50714 30.48671 0.262 7.20065 C ? A ? 32 C 1
   ATOM 486 O B GLN A 33 ? 12.03114 -30.55438 31.58409 0.262 9.94484 O ? A ? 32 O 1
   ATOM 487 CB B GLN A 33 ? 12.31204 -32.53711 29.26103 0.262 10.26306 C ? A ? 32 CB 1
   ATOM 488 CG B GLN A 33 ? 11.99442 -33.90657 28.67587 0.262 10.59160 C ? A ? 32 CG 1
   ATOM 489 CD B GLN A 33 ? 13.21883 -34.58769 28.11005 0.262 18.70075 C ? A ? 32 CD 1
   ATOM 490 OE1 B GLN A 33 ? 14.31066 -34.49637 28.67443 0.262 17.49153 O ? A ? 32 OE1 1
   ATOM 491 NE2 B GLN A 33 ? 13.04901 -35.26723 26.98171 0.262 22.95868 N ? A ? 32 NE2 1
   ATOM 492 N C GLN A 33 ? 10.12695 -31.63912 28.68498 0.366 7.93452 N ? A ? 32 N 1
   ATOM 493 CA C GLN A 33 ? 11.10337 -31.80364 29.74845 0.366 8.27909 C ? A ? 32 CA 1
   ATOM 494 C C GLN A 33 ? 11.31159 -30.51609 30.53408 0.366 7.28991 C ? A ? 32 C 1
   ATOM 495 O C GLN A 33 ? 11.63989 -30.56987 31.72540 0.366 6.00837 O ? A ? 32 O 1
   ATOM 496 CB C GLN A 33 ? 12.43842 -32.25612 29.15306 0.366 8.82060 C ? A ? 32 CB 1
   ATOM 497 CG C GLN A 33 ? 12.38647 -33.56127 28.39218 0.366 15.49576 C ? A ? 32 CG 1
   ATOM 498 CD C GLN A 33 ? 13.62171 -33.78420 27.52717 0.366 13.60385 C ? A ? 32 CD 1
   ATOM 499 OE1 C GLN A 33 ? 14.26528 -32.83238 27.07539 0.366 17.12112 O ? A ? 32 OE1 1
   ATOM 500 NE2 C GLN A 33 ? 13.95903 -35.04445 27.29789 0.366 19.51821 N ? A ? 32 NE2 1
   ATOM 501 N . ALA A 34 ? 11.15237 -29.36258 29.88377 1.000 6.99953 N ? A ? 33 N 1
   ATOM 502 CA . ALA A 34 ? 11.24888 -28.03886 30.47074 1.000 8.03571 C ? A ? 33 CA 1
   ATOM 503 C . ALA A 34 ? 9.89910 -27.35416 30.29899 1.000 7.32969 C ? A ? 33 C 1
   ATOM 504 O . ALA A 34 ? 9.13441 -27.68197 29.38329 1.000 7.89324 O ? A ? 33 O 1
   ATOM 505 CB . ALA A 34 ? 12.34995 -27.23653 29.75794 1.000 7.76547 C ? A ? 33 CB 1
   ATOM 506 N . PRO A 35 ? 9.55246 -26.42302 31.19589 1.000 7.68109 N ? A ? 34 N 1
   ATOM 507 CA . PRO A 35 ? 8.22103 -25.79265 31.12838 1.000 7.96063 C ? A ? 34 CA 1
   ATOM 508 C . PRO A 35 ? 8.07087 -24.89434 29.90982 1.000 7.54850 C ? A ? 34 C 1
   ATOM 509 O . PRO A 35 ? 9.06245 -24.37690 29.36045 1.000 7.95257 O ? A ? 34 O 1
   ATOM 510 CB . PRO A 35 ? 8.12715 -24.99624 32.44367 1.000 9.25076 C ? A ? 34 CB 1
   ATOM 511 CG . PRO A 35 ? 9.51550 -24.78844 32.83933 1.000 11.41482 C ? A ? 34 CG 1
   ATOM 512 CD . PRO A 35 ? 10.32458 -25.94624 32.34955 1.000 7.95236 C ? A ? 34 CD 1
   ATOM 513 N . TYR A 36 ? 6.83029 -24.72458 29.48630 1.000 9.17864 N ? A ? 35 N 1
   ATOM 514 CA . TYR A 36 ? 6.46201 -23.88760 28.34231 1.000 9.49855 C ? A ? 35 CA 1
   ATOM 515 C . TYR A 36 ? 5.96159 -22.54046 28.86108 1.000 8.29881 C ? A ? 35 C 1
   ATOM 516 O . TYR A 36 ? 4.88275 -22.46250 29.48352 1.000 9.93074 O ? A ? 35 O 1
   ATOM 517 CB . TYR A 36 ? 5.39631 -24.55844 27.46582 1.000 10.37997 C ? A ? 35 CB 1
   ATOM 518 CG . TYR A 36 ? 4.90091 -23.65021 26.35990 1.000 8.92686 C ? A ? 35 CG 1
   ATOM 519 CD1 . TYR A 36 ? 5.79622 -23.01815 25.49684 1.000 8.88329 C ? A ? 35 CD1 1
   ATOM 520 CD2 . TYR A 36 ? 3.53921 -23.40189 26.15992 1.000 10.35677 C ? A ? 35 CD2 1
   ATOM 521 CE1 . TYR A 36 ? 5.35827 -22.18944 24.49126 1.000 8.70815 C ? A ? 35 CE1 1
   ATOM 522 CE2 . TYR A 36 ? 3.09150 -22.55284 25.17710 1.000 11.03004 C ? A ? 35 CE2 1
   ATOM 523 CZ . TYR A 36 ? 4.01230 -21.95771 24.33594 1.000 9.17476 C ? A ? 35 CZ 1
   ATOM 524 OH . TYR A 36 ? 3.54326 -21.13790 23.33652 1.000 10.73146 O ? A ? 35 OH 1
   ATOM 525 N A ASP A 37 ? 6.63975 -21.47425 28.48934 0.323 7.39201 N ? A ? 36 N 1
   ATOM 526 CA A ASP A 37 ? 6.16956 -20.12698 28.78702 0.323 8.09506 C ? A ? 36 CA 1
   ATOM 527 C A ASP A 37 ? 6.01906 -19.42019 27.44645 0.323 5.79444 C ? A ? 36 C 1
   ATOM 528 O A ASP A 37 ? 7.01269 -19.20360 26.73733 0.323 5.77294 O ? A ? 36 O 1
   ATOM 529 CB A ASP A 37 ? 7.17483 -19.41828 29.68668 0.323 7.48117 C ? A ? 36 CB 1
   ATOM 530 CG A ASP A 37 ? 6.81651 -17.97431 29.95345 0.323 6.78009 C ? A ? 36 CG 1
   ATOM 531 OD1 A ASP A 37 ? 5.85546 -17.73080 30.72664 0.323 8.77817 O ? A ? 36 OD1 1
   ATOM 532 OD2 A ASP A 37 ? 7.53860 -17.08605 29.43273 0.323 6.37275 O ? A ? 36 OD2 1
   ATOM 533 N B ASP A 37 ? 6.81165 -21.50789 28.74766 0.435 9.32531 N ? A ? 36 N 1
   ATOM 534 CA B ASP A 37 ? 6.45772 -20.11455 29.02482 0.435 8.16532 C ? A ? 36 CA 1
   ATOM 535 C B ASP A 37 ? 6.30888 -19.45907 27.66221 0.435 6.56352 C ? A ? 36 C 1
   ATOM 536 O B ASP A 37 ? 7.30608 -19.24016 26.95615 0.435 8.07182 O ? A ? 36 O 1
   ATOM 537 CB B ASP A 37 ? 7.52720 -19.40206 29.85311 0.435 9.36129 C ? A ? 36 CB 1
   ATOM 538 CG B ASP A 37 ? 7.18616 -17.93829 30.12908 0.435 9.87912 C ? A ? 36 CG 1
   ATOM 539 OD1 B ASP A 37 ? 7.10114 -17.12370 29.18151 0.435 9.95849 O ? A ? 36 OD1 1
   ATOM 540 OD2 B ASP A 37 ? 6.96354 -17.61802 31.32033 0.435 12.29933 O ? A ? 36 OD2 1
   ATOM 541 N C ASP A 37 ? 6.75282 -21.49772 28.62869 0.242 9.04101 N ? A ? 36 N 1
   ATOM 542 CA C ASP A 37 ? 6.40951 -20.10960 28.92149 0.242 8.81657 C ? A ? 36 CA 1
   ATOM 543 C C ASP A 37 ? 6.17948 -19.46672 27.55874 0.242 7.13591 C ? A ? 36 C 1
   ATOM 544 O C ASP A 37 ? 7.10853 -19.37396 26.74828 0.242 6.58377 O ? A ? 36 O 1
   ATOM 545 CB C ASP A 37 ? 7.57497 -19.45323 29.66838 0.242 10.85643 C ? A ? 36 CB 1
   ATOM 546 CG C ASP A 37 ? 7.37223 -17.96278 29.93916 0.242 7.73716 C ? A ? 36 CG 1
   ATOM 547 OD1 C ASP A 37 ? 6.61346 -17.29104 29.21064 0.242 10.63265 O ? A ? 36 OD1 1
   ATOM 548 OD2 C ASP A 37 ? 8.00443 -17.45791 30.88893 0.242 14.75657 O ? A ? 36 OD2 1
   ATOM 549 N A ALA A 38 ? 4.77650 -19.09511 27.07719 0.323 6.82761 N ? A ? 37 N 1
   ATOM 550 CA A ALA A 38 ? 4.54225 -18.54335 25.74346 0.323 6.28492 C ? A ? 37 CA 1
   ATOM 551 C A ALA A 38 ? 5.38763 -17.29939 25.47332 0.323 7.37857 C ? A ? 37 C 1
   ATOM 552 O A ALA A 38 ? 5.85380 -17.10833 24.33869 0.323 8.07371 O ? A ? 37 O 1
   ATOM 553 CB A ALA A 38 ? 3.05215 -18.25758 25.53013 0.323 7.67719 C ? A ? 37 CB 1
   ATOM 554 N B ALA A 38 ? 5.05852 -19.16338 27.29690 0.435 6.93018 N ? A ? 37 N 1
   ATOM 555 CA B ALA A 38 ? 4.75010 -18.76436 25.92642 0.435 7.66804 C ? A ? 37 CA 1
   ATOM 556 C B ALA A 38 ? 5.45799 -17.47090 25.54175 0.435 7.51368 C ? A ? 37 C 1
   ATOM 557 O B ALA A 38 ? 6.03018 -17.37040 24.44893 0.435 5.80081 O ? A ? 37 O 1
   ATOM 558 CB B ALA A 38 ? 3.23025 -18.65379 25.74000 0.435 8.17258 C ? A ? 37 CB 1
   ATOM 559 N C ALA A 38 ? 4.94089 -19.03962 27.30152 0.242 7.66144 N ? A ? 37 N 1
   ATOM 560 CA C ALA A 38 ? 4.59659 -18.51225 25.98387 0.242 9.10597 C ? A ? 37 CA 1
   ATOM 561 C C ALA A 38 ? 5.44286 -17.29581 25.62492 0.242 7.07328 C ? A ? 37 C 1
   ATOM 562 O C ALA A 38 ? 5.89139 -17.16001 24.47704 0.242 8.60688 O ? A ? 37 O 1
   ATOM 563 CB C ALA A 38 ? 3.10536 -18.16847 25.93546 0.242 9.55446 C ? A ? 37 CB 1
   ATOM 564 N A ALA A 39 ? 5.63305 -16.46646 26.49220 0.323 8.65417 N ? A ? 38 N 1
   ATOM 565 CA A ALA A 39 ? 6.39494 -15.23712 26.26961 0.323 7.71384 C ? A ? 38 CA 1
   ATOM 566 C A ALA A 39 ? 7.87736 -15.51439 26.02940 0.323 6.91167 C ? A ? 38 C 1
   ATOM 567 O A ALA A 39 ? 8.49428 -14.89947 25.14575 0.323 6.69664 O ? A ? 38 O 1
   ATOM 568 CB A ALA A 39 ? 6.21493 -14.27282 27.43960 0.323 8.23772 C ? A ? 38 CB 1
   ATOM 569 N B ALA A 39 ? 5.43734 -16.46821 26.42542 0.435 7.73678 N ? A ? 38 N 1
   ATOM 570 CA B ALA A 39 ? 6.10152 -15.20448 26.11054 0.435 7.16431 C ? A ? 38 CA 1
   ATOM 571 C B ALA A 39 ? 7.59689 -15.39557 25.86907 0.435 6.40766 C ? A ? 38 C 1
   ATOM 572 O B ALA A 39 ? 8.16092 -14.80119 24.94509 0.435 6.69563 O ? A ? 38 O 1
   ATOM 573 CB B ALA A 39 ? 5.84538 -14.16731 27.20283 0.435 7.08832 C ? A ? 38 CB 1
   ATOM 574 N C ALA A 39 ? 5.68430 -16.40517 26.59277 0.242 8.00246 N ? A ? 38 N 1
   ATOM 575 CA C ALA A 39 ? 6.47948 -15.21644 26.30349 0.242 7.65817 C ? A ? 38 CA 1
   ATOM 576 C C ALA A 39 ? 7.93781 -15.57454 26.05488 0.242 6.79883 C ? A ? 38 C 1
   ATOM 577 O C ALA A 39 ? 8.58591 -14.98859 25.17699 0.242 6.66089 O ? A ? 38 O 1
   ATOM 578 CB C ALA A 39 ? 6.36055 -14.20403 27.44015 0.242 7.33631 C ? A ? 38 CB 1
   ATOM 579 N A GLN A 40 ? 8.47319 -16.41466 26.81923 0.323 8.50598 N ? A ? 39 N 1
   ATOM 580 CA A GLN A 40 ? 9.87322 -16.77761 26.61773 0.323 7.35831 C ? A ? 39 CA 1
   ATOM 581 C A GLN A 40 ? 10.09804 -17.32951 25.20777 0.323 6.71114 C ? A ? 39 C 1
   ATOM 582 O A GLN A 40 ? 11.06320 -16.94863 24.51660 0.323 5.72183 O ? A ? 39 O 1
   ATOM 583 CB A GLN A 40 ? 10.30417 -17.80214 27.66715 0.323 8.44697 C ? A ? 39 CB 1
   ATOM 584 CG A GLN A 40 ? 11.64550 -18.44212 27.34406 0.323 9.34281 C ? A ? 39 CG 1
   ATOM 585 CD A GLN A 40 ? 12.01700 -19.56012 28.29753 0.323 8.81907 C ? A ? 39 CD 1
   ATOM 586 OE1 A GLN A 40 ? 11.26991 -20.52080 28.47151 0.323 14.49175 O ? A ? 39 OE1 1
   ATOM 587 NE2 A GLN A 40 ? 13.17818 -19.43257 28.93996 0.323 11.30362 N ? A ? 39 NE2 1
   ATOM 588 N B GLN A 40 ? 8.25498 -16.21829 26.68724 0.435 5.45030 N ? A ? 39 N 1
   ATOM 589 CA B GLN A 40 ? 9.69159 -16.45880 26.55235 0.435 7.73594 C ? A ? 39 CA 1
   ATOM 590 C B GLN A 40 ? 9.99594 -17.07712 25.19000 0.435 6.49018 C ? A ? 39 C 1
   ATOM 591 O B GLN A 40 ? 10.87407 -16.61159 24.44153 0.435 7.03698 O ? A ? 39 O 1
   ATOM 592 CB B GLN A 40 ? 10.16284 -17.38673 27.68783 0.435 8.19372 C ? A ? 39 CB 1
   ATOM 593 CG B GLN A 40 ? 11.63013 -17.83726 27.59409 0.435 8.49633 C ? A ? 39 CG 1
   ATOM 594 CD B GLN A 40 ? 11.94939 -19.07436 28.44430 0.435 9.91556 C ? A ? 39 CD 1
   ATOM 595 OE1 B GLN A 40 ? 11.05600 -19.81378 28.87794 0.435 12.62655 O ? A ? 39 OE1 1
   ATOM 596 NE2 B GLN A 40 ? 13.24004 -19.29931 28.68290 0.435 13.93202 N ? A ? 39 NE2 1
   ATOM 597 N C GLN A 40 ? 8.46718 -16.53953 26.81321 0.242 8.50502 N ? A ? 39 N 1
   ATOM 598 CA C GLN A 40 ? 9.83797 -16.99083 26.60220 0.242 7.27556 C ? A ? 39 CA 1
   ATOM 599 C C GLN A 40 ? 10.03371 -17.51199 25.17840 0.242 6.61684 C ? A ? 39 C 1
   ATOM 600 O C GLN A 40 ? 11.02190 -17.17081 24.50775 0.242 6.63198 O ? A ? 39 O 1
   ATOM 601 CB C GLN A 40 ? 10.18284 -18.07176 27.62202 0.242 6.28595 C ? A ? 39 CB 1
   ATOM 602 CG C GLN A 40 ? 11.63027 -18.54614 27.53954 0.242 10.74397 C ? A ? 39 CG 1
   ATOM 603 CD C GLN A 40 ? 11.91650 -19.67869 28.50547 0.242 11.63144 C ? A ? 39 CD 1
   ATOM 604 OE1 C GLN A 40 ? 11.02827 -20.46320 28.81384 0.242 9.55443 O ? A ? 39 OE1 1
   ATOM 605 NE2 C GLN A 40 ? 13.15127 -19.75999 29.00857 0.242 7.09404 N ? A ? 39 NE2 1
   ATOM 606 N A ILE A 41 ? 9.19120 -18.19781 24.74341 0.323 6.99685 N ? A ? 40 N 1
   ATOM 607 CA A ILE A 41 ? 9.36337 -18.84339 23.44039 0.323 6.78179 C ? A ? 40 CA 1
   ATOM 608 C A ILE A 41 ? 9.04468 -17.88002 22.30029 0.323 5.78103 C ? A ? 40 C 1
   ATOM 609 O A ILE A 41 ? 9.67521 -17.93546 21.23778 0.323 6.60838 O ? A ? 40 O 1
   ATOM 610 CB A ILE A 41 ? 8.52997 -20.14218 23.37935 0.323 7.76587 C ? A ? 40 CB 1
   ATOM 611 CG1 A ILE A 41 ? 9.07108 -21.18930 24.37256 0.323 7.10794 C ? A ? 40 CG1 1
   ATOM 612 CG2 A ILE A 41 ? 8.46342 -20.69963 21.94290 0.323 6.87310 C ? A ? 40 CG2 1
   ATOM 613 CD1 A ILE A 41 ? 10.45469 -21.72733 24.00941 0.323 6.94482 C ? A ? 40 CD1 1
   ATOM 614 N B ILE A 41 ? 9.23681 -18.11065 24.82775 0.435 6.28838 N ? A ? 40 N 1
   ATOM 615 CA B ILE A 41 ? 9.41923 -18.74033 23.52295 0.435 6.77025 C ? A ? 40 CA 1
   ATOM 616 C B ILE A 41 ? 9.15622 -17.74569 22.40189 0.435 7.34901 C ? A ? 40 C 1
   ATOM 617 O B ILE A 41 ? 9.91202 -17.70302 21.42578 0.435 5.73783 O ? A ? 40 O 1
   ATOM 618 CB B ILE A 41 ? 8.54620 -20.00620 23.41575 0.435 6.84160 C ? A ? 40 CB 1
   ATOM 619 CG1 B ILE A 41 ? 9.05098 -21.08628 24.39220 0.435 7.63675 C ? A ? 40 CG1 1
   ATOM 620 CG2 B ILE A 41 ? 8.49772 -20.51296 21.95979 0.435 7.13620 C ? A ? 40 CG2 1
   ATOM 621 CD1 B ILE A 41 ? 10.52030 -21.46334 24.19278 0.435 8.46289 C ? A ? 40 CD1 1
   ATOM 622 N C ILE A 41 ? 9.08749 -18.31770 24.68728 0.242 6.98153 N ? A ? 40 N 1
   ATOM 623 CA C ILE A 41 ? 9.22232 -18.91333 23.35892 0.242 6.78394 C ? A ? 40 CA 1
   ATOM 624 C C ILE A 41 ? 8.97747 -17.87956 22.26801 0.242 5.42891 C ? A ? 40 C 1
   ATOM 625 O C ILE A 41 ? 9.67825 -17.85632 21.24949 0.242 6.68356 O ? A ? 40 O 1
   ATOM 626 CB C ILE A 41 ? 8.28592 -20.12979 23.23847 0.242 7.20245 C ? A ? 40 CB 1
   ATOM 627 CG1 C ILE A 41 ? 8.77068 -21.25803 24.15740 0.242 5.62314 C ? A ? 40 CG1 1
   ATOM 628 CG2 C ILE A 41 ? 8.17154 -20.59243 21.78422 0.242 5.82728 C ? A ? 40 CG2 1
   ATOM 629 CD1 C ILE A 41 ? 10.13575 -21.82404 23.74674 0.242 6.82486 C ? A ? 40 CD1 1
   ATOM 630 N A LYS A 42 ? 8.07089 -16.98659 22.49439 0.323 7.31467 N ? A ? 41 N 1
   ATOM 631 CA A LYS A 42 ? 7.77884 -16.00260 21.45583 0.323 7.61071 C ? A ? 41 CA 1
   ATOM 632 C A LYS A 42 ? 8.99961 -15.12747 21.17913 0.323 6.09825 C ? A ? 41 C 1
   ATOM 633 O A LYS A 42 ? 9.42210 -14.95782 20.02371 0.323 5.73851 O ? A ? 41 O 1
   ATOM 634 CB A LYS A 42 ? 6.56662 -15.15533 21.85576 0.323 7.61756 C ? A ? 41 CB 1
   ATOM 635 CG A LYS A 42 ? 6.21777 -14.07005 20.84442 0.323 9.77076 C ? A ? 41 CG 1
   ATOM 636 CD A LYS A 42 ? 4.98336 -13.28878 21.22698 0.323 9.84107 C ? A ? 41 CD 1
   ATOM 637 CE A LYS A 42 ? 4.77547 -12.15968 20.23552 0.323 13.54519 C ? A ? 41 CE 1
   ATOM 638 NZ A LYS A 42 ? 3.57845 -11.33891 20.54109 0.323 22.18802 N ? A ? 41 NZ 1
   ATOM 639 N B LYS A 42 ? 8.10523 -16.91499 22.53596 0.435 6.96052 N ? A ? 41 N 1
   ATOM 640 CA B LYS A 42 ? 7.85655 -15.87444 21.53629 0.435 6.51327 C ? A ? 41 CA 1
   ATOM 641 C B LYS A 42 ? 9.09672 -15.01037 21.32930 0.435 6.86073 C ? A ? 41 C 1
   ATOM 642 O B LYS A 42 ? 9.48178 -14.69603 20.18517 0.435 7.47873 O ? A ? 41 O 1
   ATOM 643 CB B LYS A 42 ? 6.64687 -15.01002 21.93204 0.435 8.91218 C ? A ? 41 CB 1
   ATOM 644 CG B LYS A 42 ? 6.28608 -13.91047 20.92163 0.435 8.96860 C ? A ? 41 CG 1
   ATOM 645 CD B LYS A 42 ? 5.10997 -13.07942 21.37987 0.435 9.78142 C ? A ? 41 CD 1
   ATOM 646 CE B LYS A 42 ? 4.79597 -12.02618 20.33763 0.435 13.42737 C ? A ? 41 CE 1
   ATOM 647 NZ B LYS A 42 ? 3.59829 -11.22016 20.68446 0.435 23.78367 N ? A ? 41 NZ 1
   ATOM 648 N C LYS A 42 ? 7.98144 -17.01686 22.45937 0.242 7.31890 N ? A ? 41 N 1
   ATOM 649 CA C LYS A 42 ? 7.68046 -16.01486 21.44604 0.242 7.65334 C ? A ? 41 CA 1
   ATOM 650 C C LYS A 42 ? 8.86559 -15.08009 21.22541 0.242 6.80362 C ? A ? 41 C 1
   ATOM 651 O C LYS A 42 ? 9.22066 -14.76193 20.07840 0.242 7.49779 O ? A ? 41 O 1
   ATOM 652 CB C LYS A 42 ? 6.43228 -15.24105 21.86313 0.242 6.99901 C ? A ? 41 CB 1
   ATOM 653 CG C LYS A 42 ? 6.08510 -14.10489 20.93313 0.242 8.97593 C ? A ? 41 CG 1
   ATOM 654 CD C LYS A 42 ? 4.84059 -13.36999 21.37682 0.242 7.92905 C ? A ? 41 CD 1
   ATOM 655 CE C LYS A 42 ? 4.69569 -12.09656 20.55806 0.242 16.43662 C ? A ? 41 CE 1
   ATOM 656 NZ C LYS A 42 ? 3.47161 -11.31563 20.87694 0.242 21.71460 N ? A ? 41 NZ 1
   ATOM 657 N A ALA A 43 ? 9.59656 -14.58584 22.24447 0.323 6.85282 N ? A ? 42 N 1
   ATOM 658 CA A ALA A 43 ? 10.76033 -13.71976 22.09590 0.323 7.19685 C ? A ? 42 CA 1
   ATOM 659 C A ALA A 43 ? 11.95008 -14.48187 21.52922 0.323 5.85418 C ? A ? 42 C 1
   ATOM 660 O A ALA A 43 ? 12.68590 -13.95356 20.68587 0.323 6.45367 O ? A ? 42 O 1
   ATOM 661 CB A ALA A 43 ? 11.13052 -13.09452 23.44597 0.323 9.03806 C ? A ? 42 CB 1
   ATOM 662 N B ALA A 43 ? 9.76173 -14.65521 22.43518 0.435 6.76049 N ? A ? 42 N 1
   ATOM 663 CA B ALA A 43 ? 11.00214 -13.89664 22.34149 0.435 5.14099 C ? A ? 42 CA 1
   ATOM 664 C B ALA A 43 ? 12.12013 -14.70896 21.68524 0.435 6.26294 C ? A ? 42 C 1
   ATOM 665 O B ALA A 43 ? 12.84665 -14.17364 20.83861 0.435 7.03793 O ? A ? 42 O 1
   ATOM 666 CB B ALA A 43 ? 11.40725 -13.35262 23.71231 0.435 6.47753 C ? A ? 42 CB 1
   ATOM 667 N C ALA A 43 ? 9.50060 -14.64545 22.31791 0.242 7.22551 N ? A ? 42 N 1
   ATOM 668 CA C ALA A 43 ? 10.64335 -13.74712 22.22000 0.242 8.41271 C ? A ? 42 CA 1
   ATOM 669 C C ALA A 43 ? 11.83784 -14.44918 21.59529 0.242 4.92807 C ? A ? 42 C 1
   ATOM 670 O C ALA A 43 ? 12.55498 -13.86137 20.77230 0.242 6.88278 O ? A ? 42 O 1
   ATOM 671 CB C ALA A 43 ? 11.00779 -13.23470 23.61537 0.242 7.90821 C ? A ? 42 CB 1
   ATOM 672 N A ASN A 44 ? 12.16025 -15.72524 21.96693 0.323 6.40563 N ? A ? 43 N 1
   ATOM 673 CA A ASN A 44 ? 13.28168 -16.48230 21.41519 0.323 6.01089 C ? A ? 43 CA 1
   ATOM 674 C A ASN A 44 ? 13.09194 -16.79532 19.93773 0.323 5.98313 C ? A ? 43 C 1
   ATOM 675 O A ASN A 44 ? 14.05503 -16.73534 19.15880 0.323 6.71781 O ? A ? 43 O 1
   ATOM 676 CB A ASN A 44 ? 13.50224 -17.78347 22.17743 0.323 6.16057 C ? A ? 43 CB 1
   ATOM 677 CG A ASN A 44 ? 14.67852 -18.52792 21.63589 0.323 4.98101 C ? A ? 43 CG 1
   ATOM 678 OD1 A ASN A 44 ? 15.80304 -18.06079 21.79522 0.323 6.13369 O ? A ? 43 OD1 1
   ATOM 679 ND2 A ASN A 44 ? 14.42964 -19.60961 20.86939 0.323 6.47592 N ? A ? 43 ND2 1
   ATOM 680 N B ASN A 44 ? 12.26704 -15.99247 22.03907 0.435 5.59681 N ? A ? 43 N 1
   ATOM 681 CA B ASN A 44 ? 13.32617 -16.79893 21.42975 0.435 5.64919 C ? A ? 43 CA 1
   ATOM 682 C B ASN A 44 ? 13.11746 -16.98366 19.92620 0.435 5.42811 C ? A ? 43 C 1
   ATOM 683 O B ASN A 44 ? 14.08058 -16.94681 19.13911 0.435 5.23471 O ? A ? 43 O 1
   ATOM 684 CB B ASN A 44 ? 13.42694 -18.15466 22.13996 0.435 5.50937 C ? A ? 43 CB 1
   ATOM 685 CG B ASN A 44 ? 14.63169 -18.94314 21.66039 0.435 4.92932 C ? A ? 43 CG 1
   ATOM 686 OD1 B ASN A 44 ? 15.77243 -18.49179 21.87427 0.435 6.83868 O ? A ? 43 OD1 1
   ATOM 687 ND2 B ASN A 44 ? 14.39657 -20.06837 20.96465 0.435 6.81226 N ? A ? 43 ND2 1
   ATOM 688 N C ASN A 44 ? 12.07133 -15.70599 21.97254 0.242 5.92460 N ? A ? 43 N 1
   ATOM 689 CA C ASN A 44 ? 13.19962 -16.43084 21.40459 0.242 6.17922 C ? A ? 43 CA 1
   ATOM 690 C C ASN A 44 ? 13.02133 -16.65976 19.91330 0.242 5.78267 C ? A ? 43 C 1
   ATOM 691 O C ASN A 44 ? 13.96277 -16.46598 19.13437 0.242 6.29219 O ? A ? 43 O 1
   ATOM 692 CB C ASN A 44 ? 13.40545 -17.76281 22.11621 0.242 6.30134 C ? A ? 43 CB 1
   ATOM 693 CG C ASN A 44 ? 14.65069 -18.45643 21.63693 0.242 4.93694 C ? A ? 43 CG 1
   ATOM 694 OD1 C ASN A 44 ? 15.73626 -17.89248 21.73783 0.242 6.79490 O ? A ? 43 OD1 1
   ATOM 695 ND2 C ASN A 44 ? 14.49656 -19.65107 21.05114 0.242 5.18864 N ? A ? 43 ND2 1
   ATOM 696 N A VAL A 45 ? 11.86746 -17.15416 19.53759 0.323 6.61546 N ? A ? 44 N 1
   ATOM 697 CA A VAL A 45 ? 11.58601 -17.39107 18.12589 0.323 6.35187 C ? A ? 44 CA 1
   ATOM 698 C A VAL A 45 ? 11.81971 -16.13202 17.30980 0.323 7.24257 C ? A ? 44 C 1
   ATOM 699 O A VAL A 45 ? 12.31100 -16.20824 16.17479 0.323 6.38711 O ? A ? 44 O 1
   ATOM 700 CB A VAL A 45 ? 10.17526 -17.97349 17.93893 0.323 7.13475 C ? A ? 44 CB 1
   ATOM 701 CG1 A VAL A 45 ? 9.77699 -17.94153 16.46105 0.323 7.25548 C ? A ? 44 CG1 1
   ATOM 702 CG2 A VAL A 45 ? 10.13259 -19.39099 18.45508 0.323 7.82804 C ? A ? 44 CG2 1
   ATOM 703 N B VAL A 45 ? 11.87210 -17.20950 19.50640 0.435 6.69208 N ? A ? 44 N 1
   ATOM 704 CA B VAL A 45 ? 11.62232 -17.39509 18.08150 0.435 6.24327 C ? A ? 44 CA 1
   ATOM 705 C B VAL A 45 ? 11.81315 -16.08260 17.31324 0.435 7.23030 C ? A ? 44 C 1
   ATOM 706 O B VAL A 45 ? 12.28775 -16.10463 16.17013 0.435 6.24581 O ? A ? 44 O 1
   ATOM 707 CB B VAL A 45 ? 10.28520 -18.13590 17.84760 0.435 6.31732 C ? A ? 44 CB 1
   ATOM 708 CG1 B VAL A 45 ? 9.97690 -18.31044 16.35476 0.435 6.73322 C ? A ? 44 CG1 1
   ATOM 709 CG2 B VAL A 45 ? 10.34915 -19.49819 18.51179 0.435 6.13901 C ? A ? 44 CG2 1
   ATOM 710 N C VAL A 45 ? 11.82375 -17.09195 19.50103 0.242 6.70486 N ? A ? 44 N 1
   ATOM 711 CA C VAL A 45 ? 11.55688 -17.34047 18.08616 0.242 6.18941 C ? A ? 44 CA 1
   ATOM 712 C C VAL A 45 ? 11.73622 -16.06682 17.27241 0.242 7.09187 C ? A ? 44 C 1
   ATOM 713 O C VAL A 45 ? 12.09763 -16.12225 16.08940 0.242 8.21768 O ? A ? 44 O 1
   ATOM 714 CB C VAL A 45 ? 10.17419 -18.00162 17.89754 0.242 7.12370 C ? A ? 44 CB 1
   ATOM 715 CG1 C VAL A 45 ? 9.81817 -18.14093 16.41751 0.242 7.01073 C ? A ? 44 CG1 1
   ATOM 716 CG2 C VAL A 45 ? 10.17023 -19.36595 18.54386 0.242 7.50213 C ? A ? 44 CG2 1
   ATOM 717 N A GLU A 46 ? 11.50134 -14.95943 17.86678 0.323 7.04095 N ? A ? 45 N 1
   ATOM 718 CA A GLU A 46 ? 11.83746 -13.70802 17.19357 0.323 8.35328 C ? A ? 45 CA 1
   ATOM 719 C A GLU A 46 ? 13.33322 -13.60770 16.91650 0.323 6.93786 C ? A ? 45 C 1
   ATOM 720 O A GLU A 46 ? 13.74038 -13.29507 15.78499 0.323 6.61184 O ? A ? 45 O 1
   ATOM 721 CB A GLU A 46 ? 11.30205 -12.50920 17.97665 0.323 10.07154 C ? A ? 45 CB 1
   ATOM 722 CG A GLU A 46 ? 9.93709 -12.07935 17.48480 0.323 24.20804 C ? A ? 45 CG 1
   ATOM 723 CD A GLU A 46 ? 10.02415 -11.25936 16.19541 0.323 23.87966 C ? A ? 45 CD 1
   ATOM 724 OE1 A GLU A 46 ? 10.75875 -10.23425 16.18133 0.323 25.13284 O ? A ? 45 OE1 1
   ATOM 725 OE2 A GLU A 46 ? 9.36822 -11.61289 15.17688 0.323 28.85216 O ? A ? 45 OE2 1
   ATOM 726 N B GLU A 46 ? 11.54279 -14.92308 17.92510 0.435 7.50131 N ? A ? 45 N 1
   ATOM 727 CA B GLU A 46 ? 11.82380 -13.65387 17.25513 0.435 7.92451 C ? A ? 45 CA 1
   ATOM 728 C B GLU A 46 ? 13.31929 -13.45632 16.99423 0.435 7.27326 C ? A ? 45 C 1
   ATOM 729 O B GLU A 46 ? 13.71222 -12.91162 15.94339 0.435 7.68055 O ? A ? 45 O 1
   ATOM 730 CB B GLU A 46 ? 11.19744 -12.49874 18.03901 0.435 9.81683 C ? A ? 45 CB 1
   ATOM 731 CG B GLU A 46 ? 9.72418 -12.29236 17.70877 0.435 18.83644 C ? A ? 45 CG 1
   ATOM 732 CD B GLU A 46 ? 9.57891 -11.35520 16.46872 0.435 30.02092 C ? A ? 45 CD 1
   ATOM 733 OE1 B GLU A 46 ? 10.57184 -11.16699 15.71906 0.435 26.16372 O ? A ? 45 OE1 1
   ATOM 734 OE2 B GLU A 46 ? 8.48639 -10.74731 16.33514 0.435 33.20289 O ? A ? 45 OE2 1
   ATOM 735 N C GLU A 46 ? 11.53413 -14.90381 17.88801 0.242 7.19222 N ? A ? 45 N 1
   ATOM 736 CA C GLU A 46 ? 11.84185 -13.66152 17.19425 0.242 8.24429 C ? A ? 45 CA 1
   ATOM 737 C C GLU A 46 ? 13.34050 -13.52404 16.94113 0.242 7.19095 C ? A ? 45 C 1
   ATOM 738 O C GLU A 46 ? 13.75627 -13.09041 15.85274 0.242 7.88074 O ? A ? 45 O 1
   ATOM 739 CB C GLU A 46 ? 11.28710 -12.48635 17.98996 0.242 10.01111 C ? A ? 45 CB 1
   ATOM 740 CG C GLU A 46 ? 9.79734 -12.34548 17.86053 0.242 11.41401 C ? A ? 45 CG 1
   ATOM 741 CD C GLU A 46 ? 9.43359 -11.35808 16.76601 0.242 26.60678 C ? A ? 45 CD 1
   ATOM 742 OE1 C GLU A 46 ? 9.50520 -11.65210 15.53720 0.242 24.53335 O ? A ? 45 OE1 1
   ATOM 743 OE2 C GLU A 46 ? 9.09817 -10.24047 17.17610 0.242 27.45501 O ? A ? 45 OE2 1
   ATOM 744 N . VAL A 47 ? 14.17284 -13.89947 17.91904 1.000 7.02705 N ? A ? 46 N 1
   ATOM 745 CA . VAL A 47 ? 15.61630 -13.90995 17.67829 1.000 7.09547 C ? A ? 46 CA 1
   ATOM 746 C . VAL A 47 ? 15.95494 -14.87061 16.53640 1.000 7.11230 C ? A ? 46 C 1
   ATOM 747 O . VAL A 47 ? 16.70720 -14.52460 15.60301 1.000 6.98314 O ? A ? 46 O 1
   ATOM 748 CB . VAL A 47 ? 16.38966 -14.25755 18.95757 1.000 7.23327 C ? A ? 46 CB 1
   ATOM 749 CG1 . VAL A 47 ? 17.86097 -14.38664 18.60790 1.000 8.48821 C ? A ? 46 CG1 1
   ATOM 750 CG2 . VAL A 47 ? 16.16969 -13.19136 20.02111 1.000 9.12679 C ? A ? 46 CG2 1
   ATOM 751 N C LEU A 48 ? 15.43081 -16.09533 16.61039 0.735 6.70872 N ? A ? 47 N 1
   ATOM 752 CA C LEU A 48 ? 15.72533 -17.09927 15.58953 0.735 6.28620 C ? A ? 47 CA 1
   ATOM 753 C C LEU A 48 ? 15.29658 -16.62429 14.20305 0.735 6.38560 C ? A ? 47 C 1
   ATOM 754 O C LEU A 48 ? 16.00844 -16.83318 13.21251 0.735 6.78765 O ? A ? 47 O 1
   ATOM 755 CB C LEU A 48 ? 15.06333 -18.43508 15.94782 0.735 7.18916 C ? A ? 47 CB 1
   ATOM 756 CG C LEU A 48 ? 15.29157 -19.57393 14.94006 0.735 7.59040 C ? A ? 47 CG 1
   ATOM 757 CD1 C LEU A 48 ? 16.77582 -19.86720 14.70673 0.735 8.49288 C ? A ? 47 CD1 1
   ATOM 758 CD2 C LEU A 48 ? 14.54531 -20.81070 15.39603 0.735 8.22570 C ? A ? 47 CD2 1
   ATOM 759 N D LEU A 48 ? 15.37024 -16.06142 16.60072 0.265 6.83191 N ? A ? 47 N 1
   ATOM 760 CA D LEU A 48 ? 15.58185 -17.04679 15.54758 0.265 6.87809 C ? A ? 47 CA 1
   ATOM 761 C D LEU A 48 ? 15.10592 -16.52201 14.19178 0.265 5.13946 C ? A ? 47 C 1
   ATOM 762 O D LEU A 48 ? 15.73309 -16.79438 13.15520 0.265 5.82983 O ? A ? 47 O 1
   ATOM 763 CB D LEU A 48 ? 14.88507 -18.35504 15.92314 0.265 5.75027 C ? A ? 47 CB 1
   ATOM 764 CG D LEU A 48 ? 15.10055 -19.54461 14.98340 0.265 7.92317 C ? A ? 47 CG 1
   ATOM 765 CD1 D LEU A 48 ? 16.56083 -20.02195 14.96822 0.265 10.17938 C ? A ? 47 CD1 1
   ATOM 766 CD2 D LEU A 48 ? 14.15342 -20.66324 15.37165 0.265 8.24143 C ? A ? 47 CD2 1
   ATOM 767 N C LYS A 49 ? 14.13985 -15.96792 14.10607 0.735 6.60585 N ? A ? 48 N 1
   ATOM 768 CA C LYS A 49 ? 13.67717 -15.43774 12.82133 0.735 7.59364 C ? A ? 48 CA 1
   ATOM 769 C C LYS A 49 ? 14.65586 -14.41084 12.25591 0.735 6.29577 C ? A ? 48 C 1
   ATOM 770 O C LYS A 49 ? 14.93670 -14.41245 11.05361 0.735 7.07686 O ? A ? 48 O 1
   ATOM 771 CB C LYS A 49 ? 12.28535 -14.82472 12.98680 0.735 8.89751 C ? A ? 48 CB 1
   ATOM 772 CG C LYS A 49 ? 11.73915 -14.10300 11.73419 0.735 10.81316 C ? A ? 48 CG 1
   ATOM 773 CD C LYS A 49 ? 10.58522 -13.15077 12.11491 0.735 17.60499 C ? A ? 48 CD 1
   ATOM 774 CE C LYS A 49 ? 10.20450 -12.20549 10.96157 0.735 27.98791 C ? A ? 48 CE 1
   ATOM 775 NZ C LYS A 49 ? 9.13391 -11.20339 11.27229 0.735 30.29788 N ? A ? 48 NZ 1
   ATOM 776 N D LYS A 49 ? 14.00839 -15.76019 14.17700 0.265 6.23155 N ? A ? 48 N 1
   ATOM 777 CA D LYS A 49 ? 13.53291 -15.15937 12.93670 0.265 5.02623 C ? A ? 48 CA 1
   ATOM 778 C D LYS A 49 ? 14.65136 -14.36293 12.27966 0.265 6.24885 C ? A ? 48 C 1
   ATOM 779 O D LYS A 49 ? 15.10886 -14.68410 11.17243 0.265 4.40390 O ? A ? 48 O 1
   ATOM 780 CB D LYS A 49 ? 12.32090 -14.27256 13.24305 0.265 5.03112 C ? A ? 48 CB 1
   ATOM 781 CG D LYS A 49 ? 11.84214 -13.42176 12.06689 0.265 4.87593 C ? A ? 48 CG 1
   ATOM 782 CD D LYS A 49 ? 10.54271 -12.71138 12.39140 0.265 6.29180 C ? A ? 48 CD 1
   ATOM 783 CE D LYS A 49 ? 10.21384 -11.67743 11.32857 0.265 24.21825 C ? A ? 48 CE 1
   ATOM 784 NZ D LYS A 49 ? 9.12499 -10.75981 11.76867 0.265 16.27597 N ? A ? 48 NZ 1
   ATOM 785 N C THR A 50 ? 15.17995 -13.50439 13.07839 0.735 6.57283 N ? A ? 49 N 1
   ATOM 786 CA C THR A 50 ? 16.20839 -12.58098 12.59583 0.735 6.72690 C ? A ? 49 CA 1
   ATOM 787 C C THR A 50 ? 17.43372 -13.33699 12.09980 0.735 5.69784 C ? A ? 49 C 1
   ATOM 788 O C THR A 50 ? 17.92827 -13.08773 10.99060 0.735 6.55821 O ? A ? 49 O 1
   ATOM 789 CB C THR A 50 ? 16.60737 -11.61272 13.70800 0.735 8.21165 C ? A ? 49 CB 1
   ATOM 790 OG1 C THR A 50 ? 15.45167 -10.83931 14.08418 0.735 11.05072 O ? A ? 49 OG1 1
   ATOM 791 CG2 C THR A 50 ? 17.74989 -10.68904 13.25745 0.735 9.56103 C ? A ? 49 CG2 1
   ATOM 792 N D THR A 50 ? 15.14221 -13.35258 12.99982 0.265 6.73509 N ? A ? 49 N 1
   ATOM 793 CA D THR A 50 ? 16.18563 -12.47549 12.48507 0.265 7.10500 C ? A ? 49 CA 1
   ATOM 794 C D THR A 50 ? 17.43773 -13.24630 12.09500 0.265 5.68777 C ? A ? 49 C 1
   ATOM 795 O D THR A 50 ? 18.02739 -12.99232 11.03742 0.265 7.14620 O ? A ? 49 O 1
   ATOM 796 CB D THR A 50 ? 16.52070 -11.43474 13.54987 0.265 8.42245 C ? A ? 49 CB 1
   ATOM 797 OG1 D THR A 50 ? 15.37221 -10.60765 13.77639 0.265 11.76024 O ? A ? 49 OG1 1
   ATOM 798 CG2 D THR A 50 ? 17.71115 -10.58202 13.12004 0.265 10.17308 C ? A ? 49 CG2 1
   ATOM 799 N C LEU A 51 ? 17.92882 -14.28516 12.90681 0.735 6.37257 N ? A ? 50 N 1
   ATOM 800 CA C LEU A 51 ? 19.12215 -15.04215 12.50966 0.735 6.79481 C ? A ? 50 CA 1
   ATOM 801 C C LEU A 51 ? 18.89911 -15.81956 11.21439 0.735 6.84100 C ? A ? 50 C 1
   ATOM 802 O C LEU A 51 ? 19.80047 -15.92861 10.36903 0.735 7.71301 O ? A ? 50 O 1
   ATOM 803 CB C LEU A 51 ? 19.50279 -16.00999 13.63183 0.735 6.80394 C ? A ? 50 CB 1
   ATOM 804 CG C LEU A 51 ? 19.94452 -15.37604 14.93712 0.735 7.18720 C ? A ? 50 CG 1
   ATOM 805 CD1 C LEU A 51 ? 20.06931 -16.46389 15.99209 0.735 7.77003 C ? A ? 50 CD1 1
   ATOM 806 CD2 C LEU A 51 ? 21.28884 -14.65076 14.76136 0.735 8.16792 C ? A ? 50 CD2 1
   ATOM 807 N D LEU A 51 ? 17.85989 -14.19193 12.93203 0.265 5.59720 N ? A ? 50 N 1
   ATOM 808 CA D LEU A 51 ? 19.11938 -14.88711 12.67648 0.265 7.19697 C ? A ? 50 CA 1
   ATOM 809 C D LEU A 51 ? 19.03764 -15.80544 11.45989 0.265 6.87314 C ? A ? 50 C 1
   ATOM 810 O D LEU A 51 ? 20.01799 -15.94145 10.71244 0.265 4.79859 O ? A ? 50 O 1
   ATOM 811 CB D LEU A 51 ? 19.50591 -15.69671 13.90970 0.265 6.71221 C ? A ? 50 CB 1
   ATOM 812 CG D LEU A 51 ? 19.91332 -14.93662 15.17260 0.265 3.76263 C ? A ? 50 CG 1
   ATOM 813 CD1 D LEU A 51 ? 20.06149 -15.92348 16.35196 0.265 5.30660 C ? A ? 50 CD1 1
   ATOM 814 CD2 D LEU A 51 ? 21.23247 -14.21210 14.94007 0.265 7.06529 C ? A ? 50 CD2 1
   ATOM 815 N C SER A 52 ? 17.68884 -16.35896 11.04089 0.735 6.64924 N ? A ? 51 N 1
   ATOM 816 CA C SER A 52 ? 17.38161 -17.27399 9.94212 0.735 7.70227 C ? A ? 51 CA 1
   ATOM 817 C C SER A 52 ? 17.44985 -16.61299 8.57910 0.735 5.93082 C ? A ? 51 C 1
   ATOM 818 O C SER A 52 ? 17.53282 -17.31878 7.56604 0.735 7.58046 O ? A ? 51 O 1
   ATOM 819 CB C SER A 52 ? 15.98637 -17.85785 10.15000 0.735 6.99921 C ? A ? 51 CB 1
   ATOM 820 OG C SER A 52 ? 14.97599 -16.90129 9.91821 0.735 8.63362 O ? A ? 51 OG 1
   ATOM 821 N D SER A 52 ? 17.88708 -16.46033 11.25716 0.265 7.38712 N ? A ? 51 N 1
   ATOM 822 CA D SER A 52 ? 17.72537 -17.45213 10.20117 0.265 5.84242 C ? A ? 51 CA 1
   ATOM 823 C D SER A 52 ? 17.74404 -16.84921 8.80887 0.265 6.53676 C ? A ? 51 C 1
   ATOM 824 O D SER A 52 ? 17.85420 -17.60014 7.84279 0.265 4.52017 O ? A ? 51 O 1
   ATOM 825 CB D SER A 52 ? 16.42505 -18.22915 10.39029 0.265 5.01611 C ? A ? 51 CB 1
   ATOM 826 OG D SER A 52 ? 16.53885 -19.14424 11.44931 0.265 7.09796 O ? A ? 51 OG 1
   ATOM 827 N C ALA A 53 ? 17.39855 -15.28987 8.51754 0.735 6.49529 N ? A ? 52 N 1
   ATOM 828 CA C ALA A 53 ? 17.51859 -14.54043 7.28304 0.735 6.61744 C ? A ? 52 CA 1
   ATOM 829 C C ALA A 53 ? 18.95593 -14.20263 6.93615 0.735 6.90568 C ? A ? 52 C 1
   ATOM 830 O C ALA A 53 ? 19.19724 -13.64991 5.86602 0.735 9.34848 O ? A ? 52 O 1
   ATOM 831 CB C ALA A 53 ? 16.69998 -13.24850 7.40170 0.735 8.54434 C ? A ? 52 CB 1
   ATOM 832 N D ALA A 53 ? 17.62995 -15.53249 8.67862 0.265 5.91303 N ? A ? 52 N 1
   ATOM 833 CA D ALA A 53 ? 17.74272 -14.88055 7.38091 0.265 7.55958 C ? A ? 52 CA 1
   ATOM 834 C D ALA A 53 ? 19.18092 -14.52216 7.01955 0.265 4.92422 C ? A ? 52 C 1
   ATOM 835 O D ALA A 53 ? 19.47495 -14.31265 5.82950 0.265 4.96058 O ? A ? 52 O 1
   ATOM 836 CB D ALA A 53 ? 16.86453 -13.62346 7.35012 0.265 6.90023 C ? A ? 52 CB 1
   ATOM 837 N C LEU A 54 ? 19.91201 -14.51149 7.79222 0.735 6.24712 N ? A ? 53 N 1
   ATOM 838 CA C LEU A 54 ? 21.26459 -13.98875 7.64408 0.735 6.32915 C ? A ? 53 CA 1
   ATOM 839 C C LEU A 54 ? 22.23340 -14.84261 6.83295 0.735 6.09995 C ? A ? 53 C 1
   ATOM 840 O C LEU A 54 ? 23.05038 -14.26406 6.10209 0.735 7.46982 O ? A ? 53 O 1
   ATOM 841 CB C LEU A 54 ? 21.89826 -13.66187 8.99901 0.735 7.61794 C ? A ? 53 CB 1
   ATOM 842 CG C LEU A 54 ? 21.14641 -12.64231 9.83921 0.735 7.36001 C ? A ? 53 CG 1
   ATOM 843 CD1 C LEU A 54 ? 21.94072 -12.40675 11.11786 0.735 8.07784 C ? A ? 53 CD1 1
   ATOM 844 CD2 C LEU A 54 ? 20.93924 -11.32249 9.09050 0.735 9.19254 C ? A ? 53 CD2 1
   ATOM 845 N D LEU A 54 ? 20.08701 -14.48136 8.01306 0.265 7.68800 N ? A ? 53 N 1
   ATOM 846 CA D LEU A 54 ? 21.47152 -14.02386 7.87682 0.265 5.50164 C ? A ? 53 CA 1
   ATOM 847 C D LEU A 54 ? 22.39866 -14.87904 7.00858 0.265 6.47391 C ? A ? 53 C 1
   ATOM 848 O D LEU A 54 ? 23.26802 -14.31406 6.33586 0.265 3.83973 O ? A ? 53 O 1
   ATOM 849 CB D LEU A 54 ? 22.11182 -13.77940 9.24769 0.265 5.51993 C ? A ? 53 CB 1
   ATOM 850 CG D LEU A 54 ? 21.39710 -12.80764 10.17986 0.265 5.14407 C ? A ? 53 CG 1
   ATOM 851 CD1 D LEU A 54 ? 22.25560 -12.54759 11.40818 0.265 7.02080 C ? A ? 53 CD1 1
   ATOM 852 CD2 D LEU A 54 ? 21.09572 -11.50260 9.45041 0.265 5.37743 C ? A ? 53 CD2 1
   ATOM 853 N C PRO A 55 ? 22.23515 -16.18056 6.90484 0.735 5.69030 N ? A ? 54 N 1
   ATOM 854 CA C PRO A 55 ? 23.36223 -16.88146 6.26758 0.735 6.40144 C ? A ? 54 CA 1
   ATOM 855 C C PRO A 55 ? 23.40587 -16.67420 4.77958 0.735 6.78190 C ? A ? 54 C 1
   ATOM 856 O C PRO A 55 ? 24.49959 -16.68857 4.18366 0.735 7.52297 O ? A ? 54 O 1
   ATOM 857 CB C PRO A 55 ? 23.10795 -18.35143 6.61799 0.735 7.09739 C ? A ? 54 CB 1
   ATOM 858 CG C PRO A 55 ? 22.29959 -18.33219 7.87053 0.735 7.20521 C ? A ? 54 CG 1
   ATOM 859 CD C PRO A 55 ? 21.43045 -17.09639 7.74108 0.735 7.51769 C ? A ? 54 CD 1
   ATOM 860 N D PRO A 55 ? 22.28457 -16.21698 6.99108 0.265 6.58072 N ? A ? 54 N 1
   ATOM 861 CA D PRO A 55 ? 23.30051 -17.00847 6.27078 0.265 7.18318 C ? A ? 54 CA 1
   ATOM 862 C D PRO A 55 ? 23.38515 -16.73384 4.78713 0.265 6.94124 C ? A ? 54 C 1
   ATOM 863 O D PRO A 55 ? 24.48426 -16.77214 4.21368 0.265 7.89169 O ? A ? 54 O 1
   ATOM 864 CB D PRO A 55 ? 22.83640 -18.44642 6.50444 0.265 6.80689 C ? A ? 54 CB 1
   ATOM 865 CG D PRO A 55 ? 22.14019 -18.39502 7.81987 0.265 7.74443 C ? A ? 54 CG 1
   ATOM 866 CD D PRO A 55 ? 21.41816 -17.08254 7.81417 0.265 7.67955 C ? A ? 54 CD 1
   ATOM 867 N . TRP A 56 ? 22.25294 -16.49678 4.14175 1.000 6.69066 N ? A ? 55 N 1
   ATOM 868 CA . TRP A 56 ? 22.16270 -16.70277 2.68611 1.000 8.09936 C ? A ? 55 CA 1
   ATOM 869 C . TRP A 56 ? 22.99044 -15.67254 1.91564 1.000 8.15537 C ? A ? 55 C 1
   ATOM 870 O . TRP A 56 ? 23.63244 -16.00799 0.88349 1.000 9.22955 O ? A ? 55 O 1
   ATOM 871 CB . TRP A 56 ? 20.67266 -16.90336 2.23549 1.000 8.66762 C ? A ? 55 CB 1
   ATOM 872 CG . TRP A 56 ? 19.96541 -17.63455 3.30792 1.000 8.21106 C ? A ? 55 CG 1
   ATOM 873 CD1 . TRP A 56 ? 18.95790 -17.15143 4.08696 1.000 9.00794 C ? A ? 55 CD1 1
   ATOM 874 CD2 . TRP A 56 ? 20.34489 -18.90176 3.85301 1.000 6.98894 C ? A ? 55 CD2 1
   ATOM 875 NE1 . TRP A 56 ? 18.67626 -18.05271 5.07338 1.000 8.77795 N ? A ? 55 NE1 1
   ATOM 876 CE2 . TRP A 56 ? 19.53663 -19.11998 4.98267 1.000 7.51093 C ? A ? 55 CE2 1
   ATOM 877 CE3 . TRP A 56 ? 21.34066 -19.84551 3.54864 1.000 7.63177 C ? A ? 55 CE3 1
   ATOM 878 CZ2 . TRP A 56 ? 19.69373 -20.23562 5.80835 1.000 7.80266 C ? A ? 55 CZ2 1
   ATOM 879 CZ3 . TRP A 56 ? 21.49211 -20.95813 4.36320 1.000 8.23868 C ? A ? 55 CZ3 1
   ATOM 880 CH2 . TRP A 56 ? 20.67478 -21.14183 5.48189 1.000 8.85697 C ? A ? 55 CH2 1
   ATOM 881 N A ALA A 57 ? 22.98368 -14.43728 2.42796 0.548 8.59662 N ? A ? 56 N 1
   ATOM 882 CA A ALA A 57 ? 23.71527 -13.30239 1.87490 0.548 8.52062 C ? A ? 56 CA 1
   ATOM 883 C A ALA A 57 ? 25.22136 -13.45932 1.99193 0.548 7.28536 C ? A ? 56 C 1
   ATOM 884 O A ALA A 57 ? 25.94737 -12.63836 1.41094 0.548 10.08984 O ? A ? 56 O 1
   ATOM 885 CB A ALA A 57 ? 23.27000 -11.99427 2.54361 0.548 12.16103 C ? A ? 56 CB 1
   ATOM 886 N B ALA A 57 ? 23.00597 -14.43356 2.37280 0.452 8.18547 N ? A ? 56 N 1
   ATOM 887 CA B ALA A 57 ? 23.78084 -13.43903 1.64614 0.452 9.28659 C ? A ? 56 CA 1
   ATOM 888 C B ALA A 57 ? 25.27707 -13.64910 1.78076 0.452 7.35504 C ? A ? 56 C 1
   ATOM 889 O B ALA A 57 ? 26.05223 -13.02497 1.04433 0.452 6.11207 O ? A ? 56 O 1
   ATOM 890 CB B ALA A 57 ? 23.40076 -12.04370 2.12678 0.452 9.30439 C ? A ? 56 CB 1
   ATOM 891 N . ALA A 58 ? 25.69904 -14.48600 2.71042 1.000 6.79011 N ? A ? 57 N 1
   ATOM 892 CA . ALA A 58 ? 27.10875 -14.77507 2.88380 1.000 7.18991 C ? A ? 57 CA 1
   ATOM 893 C . ALA A 58 ? 27.57154 -15.95599 2.03685 1.000 7.56793 C ? A ? 57 C 1
   ATOM 894 O . ALA A 58 ? 28.67859 -16.45838 2.28406 1.000 7.56695 O ? A ? 57 O 1
   ATOM 895 CB . ALA A 58 ? 27.43102 -14.97554 4.36768 1.000 7.77477 C ? A ? 57 CB 1
   ATOM 896 N B PHE A 59 ? 26.76082 -16.39059 1.07139 0.282 8.07272 N ? A ? 58 N 1
   ATOM 897 CA B PHE A 59 ? 27.16581 -17.33191 0.03384 0.282 8.45737 C ? A ? 58 CA 1
   ATOM 898 C B PHE A 59 ? 27.16041 -16.65682 -1.34320 0.282 8.39518 C ? A ? 58 C 1
   ATOM 899 O B PHE A 59 ? 26.78768 -17.26639 -2.34743 0.282 9.25827 O ? A ? 58 O 1
   ATOM 900 CB B PHE A 59 ? 26.25838 -18.56499 0.01805 0.282 7.26753 C ? A ? 58 CB 1
   ATOM 901 CG B PHE A 59 ? 26.35919 -19.45310 1.24779 0.282 7.65076 C ? A ? 58 CG 1
   ATOM 902 CD1 B PHE A 59 ? 25.56443 -19.23241 2.37121 0.282 8.38523 C ? A ? 58 CD1 1
   ATOM 903 CD2 B PHE A 59 ? 27.20878 -20.54621 1.24976 0.282 9.84913 C ? A ? 58 CD2 1
   ATOM 904 CE1 B PHE A 59 ? 25.64726 -20.07566 3.47807 0.282 10.53889 C ? A ? 58 CE1 1
   ATOM 905 CE2 B PHE A 59 ? 27.29100 -21.38588 2.34464 0.282 9.53645 C ? A ? 58 CE2 1
   ATOM 906 CZ B PHE A 59 ? 26.51426 -21.15008 3.46218 0.282 11.90800 C ? A ? 58 CZ 1
   ATOM 907 N C PHE A 59 ? 26.72413 -16.50552 1.15715 0.408 7.85927 N ? A ? 58 N 1
   ATOM 908 CA C PHE A 59 ? 27.15608 -17.50877 0.18473 0.408 7.37249 C ? A ? 58 CA 1
   ATOM 909 C C PHE A 59 ? 27.19776 -16.91183 -1.22514 0.408 11.08126 C ? A ? 58 C 1
   ATOM 910 O C PHE A 59 ? 26.77445 -17.55054 -2.20049 0.408 9.51172 O ? A ? 58 O 1
   ATOM 911 CB C PHE A 59 ? 26.23854 -18.73816 0.14673 0.408 7.48630 C ? A ? 58 CB 1
   ATOM 912 CG C PHE A 59 ? 26.23120 -19.59758 1.40021 0.408 6.78282 C ? A ? 58 CG 1
   ATOM 913 CD1 C PHE A 59 ? 27.04066 -20.73196 1.49151 0.408 5.28410 C ? A ? 58 CD1 1
   ATOM 914 CD2 C PHE A 59 ? 25.36280 -19.30857 2.45939 0.408 7.50998 C ? A ? 58 CD2 1
   ATOM 915 CE1 C PHE A 59 ? 27.00214 -21.54773 2.60419 0.408 6.36811 C ? A ? 58 CE1 1
   ATOM 916 CE2 C PHE A 59 ? 25.31969 -20.11940 3.58928 0.408 6.02607 C ? A ? 58 CE2 1
   ATOM 917 CZ C PHE A 59 ? 26.13210 -21.24448 3.66273 0.408 6.34263 C ? A ? 58 CZ 1
   ATOM 918 N D PHE A 59 ? 26.77702 -16.27425 1.01092 0.310 7.38644 N ? A ? 58 N 1
   ATOM 919 CA D PHE A 59 ? 27.16258 -17.16153 -0.07857 0.310 7.19082 C ? A ? 58 CA 1
   ATOM 920 C D PHE A 59 ? 27.23325 -16.39181 -1.40356 0.310 4.85397 C ? A ? 58 C 1
   ATOM 921 O D PHE A 59 ? 26.79483 -16.88540 -2.45590 0.310 5.70798 O ? A ? 58 O 1
   ATOM 922 CB D PHE A 59 ? 26.20880 -18.35210 -0.18447 0.310 7.86992 C ? A ? 58 CB 1
   ATOM 923 CG D PHE A 59 ? 26.15432 -19.22089 1.04840 0.310 6.00743 C ? A ? 58 CG 1
   ATOM 924 CD1 D PHE A 59 ? 26.97217 -20.33301 1.15899 0.310 6.10846 C ? A ? 58 CD1 1
   ATOM 925 CD2 D PHE A 59 ? 25.25137 -18.95912 2.06926 0.310 5.84655 C ? A ? 58 CD2 1
   ATOM 926 CE1 D PHE A 59 ? 26.91792 -21.16386 2.26963 0.310 5.45154 C ? A ? 58 CE1 1
   ATOM 927 CE2 D PHE A 59 ? 25.19236 -19.77880 3.20035 0.310 4.41276 C ? A ? 58 CE2 1
   ATOM 928 CZ D PHE A 59 ? 26.02026 -20.88607 3.30083 0.310 3.62367 C ? A ? 58 CZ 1
   ATOM 929 N B GLY A 60 ? 27.55155 -15.37155 -1.40003 0.282 9.40531 N ? A ? 59 N 1
   ATOM 930 CA B GLY A 60 ? 27.52886 -14.63022 -2.63432 0.282 10.20554 C ? A ? 59 CA 1
   ATOM 931 C B GLY A 60 ? 28.65024 -15.05718 -3.56492 0.282 9.65445 C ? A ? 59 C 1
   ATOM 932 O B GLY A 60 ? 29.38338 -16.01241 -3.28895 0.282 9.91796 O ? A ? 59 O 1
   ATOM 933 N C GLY A 60 ? 27.68724 -15.67254 -1.34965 0.408 8.59725 N ? A ? 59 N 1
   ATOM 934 CA C GLY A 60 ? 27.65301 -14.98719 -2.61624 0.408 10.04016 C ? A ? 59 CA 1
   ATOM 935 C C GLY A 60 ? 28.70244 -15.52088 -3.56569 0.408 8.99974 C ? A ? 59 C 1
   ATOM 936 O C GLY A 60 ? 29.50354 -16.40284 -3.20655 0.408 11.56895 O ? A ? 59 O 1
   ATOM 937 N D GLY A 60 ? 27.73791 -15.15206 -1.32617 0.310 7.68546 N ? A ? 59 N 1
   ATOM 938 CA D GLY A 60 ? 27.85126 -14.29169 -2.47867 0.310 6.22223 C ? A ? 59 CA 1
   ATOM 939 C D GLY A 60 ? 28.95866 -14.70987 -3.39417 0.310 5.59158 C ? A ? 59 C 1
   ATOM 940 O D GLY A 60 ? 29.61522 -15.73519 -3.20729 0.310 6.26682 O ? A ? 59 O 1
   ATOM 941 N B PRO A 61 ? 28.80253 -14.35019 -4.68038 0.282 12.24357 N ? A ? 60 N 1
   ATOM 942 CA B PRO A 61 ? 29.86051 -14.71965 -5.63063 0.282 13.18891 C ? A ? 60 CA 1
   ATOM 943 C B PRO A 61 ? 31.24872 -14.56494 -5.01815 0.282 15.16714 C ? A ? 60 C 1
   ATOM 944 O B PRO A 61 ? 31.52524 -13.61536 -4.29008 0.282 14.88028 O ? A ? 60 O 1
   ATOM 945 CB B PRO A 61 ? 29.65601 -13.73597 -6.78828 0.282 11.62545 C ? A ? 60 CB 1
   ATOM 946 CG B PRO A 61 ? 28.28712 -13.14128 -6.58340 0.282 16.06278 C ? A ? 60 CG 1
   ATOM 947 CD B PRO A 61 ? 28.06139 -13.15330 -5.12023 0.282 15.48983 C ? A ? 60 CD 1
   ATOM 948 N C PRO A 61 ? 28.72731 -14.97823 -4.78483 0.408 11.31443 N ? A ? 60 N 1
   ATOM 949 CA C PRO A 61 ? 29.70615 -15.45578 -5.75308 0.408 10.76811 C ? A ? 60 CA 1
   ATOM 950 C C PRO A 61 ? 31.10279 -15.15872 -5.24578 0.408 8.77546 C ? A ? 60 C 1
   ATOM 951 O C PRO A 61 ? 31.36782 -14.09322 -4.67769 0.408 9.97361 O ? A ? 60 O 1
   ATOM 952 CB C PRO A 61 ? 29.40214 -14.64320 -7.02657 0.408 13.98918 C ? A ? 60 CB 1
   ATOM 953 CG C PRO A 61 ? 28.13090 -13.92918 -6.77583 0.408 12.22165 C ? A ? 60 CG 1
   ATOM 954 CD C PRO A 61 ? 28.05285 -13.77053 -5.29521 0.408 14.11119 C ? A ? 60 CD 1
   ATOM 955 N D PRO A 61 ? 29.15928 -13.92340 -4.39802 0.310 11.87980 N ? A ? 60 N 1
   ATOM 956 CA D PRO A 61 ? 30.08800 -14.29770 -5.45883 0.310 12.41747 C ? A ? 60 CA 1
   ATOM 957 C D PRO A 61 ? 31.43044 -14.88639 -5.02860 0.310 13.81895 C ? A ? 60 C 1
   ATOM 958 O D PRO A 61 ? 32.15233 -14.30775 -4.22895 0.310 20.82389 O ? A ? 60 O 1
   ATOM 959 CB D PRO A 61 ? 30.17773 -13.00926 -6.33110 0.310 14.48310 C ? A ? 60 CB 1
   ATOM 960 CG D PRO A 61 ? 28.91879 -12.23046 -6.10488 0.310 17.70457 C ? A ? 60 CG 1
   ATOM 961 CD D PRO A 61 ? 28.15035 -12.98398 -4.88276 0.310 16.69506 C ? A ? 60 CD 1
   ATOM 962 N B GLY A 62 ? 32.13543 -15.50717 -5.33691 0.282 7.90543 N ? A ? 61 N 1
   ATOM 963 CA B GLY A 62 ? 33.49684 -15.49150 -4.85254 0.282 13.18654 C ? A ? 61 CA 1
   ATOM 964 C B GLY A 62 ? 33.69098 -16.03738 -3.45771 0.282 8.92926 C ? A ? 61 C 1
   ATOM 965 O B GLY A 62 ? 34.83620 -16.25927 -3.05267 0.282 11.28637 O ? A ? 61 O 1
   ATOM 966 N C GLY A 62 ? 31.99231 -16.12013 -5.41614 0.408 17.76052 N ? A ? 61 N 1
   ATOM 967 CA C GLY A 62 ? 33.36077 -15.94069 -4.98468 0.408 13.14558 C ? A ? 61 CA 1
   ATOM 968 C C GLY A 62 ? 33.63809 -16.24664 -3.52584 0.408 10.58723 C ? A ? 61 C 1
   ATOM 969 O C GLY A 62 ? 34.79041 -16.14345 -3.10490 0.408 11.67992 O ? A ? 61 O 1
   ATOM 970 N D GLY A 62 ? 31.68086 -16.11345 -5.48545 0.310 11.86863 N ? A ? 61 N 1
   ATOM 971 CA D GLY A 62 ? 32.97639 -16.80350 -5.32539 0.310 10.24148 C ? A ? 61 CA 1
   ATOM 972 C D GLY A 62 ? 33.35459 -17.15210 -3.90066 0.310 8.90636 C ? A ? 61 C 1
   ATOM 973 O D GLY A 62 ? 34.54391 -17.17909 -3.58874 0.310 12.35857 O ? A ? 61 O 1
   ATOM 974 N B THR A 63 ? 32.61424 -16.29593 -2.71672 0.282 9.61165 N ? A ? 62 N 1
   ATOM 975 CA B THR A 63 ? 32.70993 -16.71162 -1.32406 0.282 8.07477 C ? A ? 62 CA 1
   ATOM 976 C B THR A 63 ? 32.79922 -18.21987 -1.15527 0.282 6.14788 C ? A ? 62 C 1
   ATOM 977 O B THR A 63 ? 32.47098 -18.72600 -0.07682 0.282 6.69585 O ? A ? 62 O 1
   ATOM 978 CB B THR A 63 ? 31.54071 -16.16722 -0.50014 0.282 7.24219 C ? A ? 62 CB 1
   ATOM 979 OG1 B THR A 63 ? 30.31228 -16.74764 -0.95034 0.282 7.71195 O ? A ? 62 OG1 1
   ATOM 980 CG2 B THR A 63 ? 31.46333 -14.65677 -0.58741 0.282 9.94871 C ? A ? 62 CG2 1
   ATOM 981 N C THR A 63 ? 32.63141 -16.64169 -2.73820 0.408 8.86097 N ? A ? 62 N 1
   ATOM 982 CA C THR A 63 ? 32.80970 -16.96082 -1.31859 0.408 9.55211 C ? A ? 62 CA 1
   ATOM 983 C C THR A 63 ? 32.88019 -18.46387 -1.04617 0.408 9.40014 C ? A ? 62 C 1
   ATOM 984 O C THR A 63 ? 32.56354 -18.91333 0.06792 0.408 8.89622 O ? A ? 62 O 1
   ATOM 985 CB C THR A 63 ? 31.73391 -16.30965 -0.45441 0.408 9.02398 C ? A ? 62 CB 1
   ATOM 986 OG1 C THR A 63 ? 30.47392 -16.90802 -0.74849 0.408 6.92682 O ? A ? 62 OG1 1
   ATOM 987 CG2 C THR A 63 ? 31.66625 -14.81704 -0.69603 0.408 10.58384 C ? A ? 62 CG2 1
   ATOM 988 N D THR A 63 ? 32.38413 -17.42413 -3.02356 0.310 6.77578 N ? A ? 62 N 1
   ATOM 989 CA D THR A 63 ? 32.65877 -17.60045 -1.59079 0.310 9.21227 C ? A ? 62 CA 1
   ATOM 990 C D THR A 63 ? 32.80310 -19.06385 -1.16462 0.310 6.67518 C ? A ? 62 C 1
   ATOM 991 O D THR A 63 ? 32.49524 -19.42339 -0.00978 0.310 6.17035 O ? A ? 62 O 1
   ATOM 992 CB D THR A 63 ? 31.67144 -16.88323 -0.66132 0.310 9.81769 C ? A ? 62 CB 1
   ATOM 993 OG1 D THR A 63 ? 30.37763 -17.47117 -0.78781 0.310 6.03732 O ? A ? 62 OG1 1
   ATOM 994 CG2 D THR A 63 ? 31.61940 -15.39134 -0.94039 0.310 9.40783 C ? A ? 62 CG2 1
   ATOM 995 N B GLU A 64 ? 33.26182 -18.94380 -2.17280 0.282 6.34353 N ? A ? 63 N 1
   ATOM 996 CA B GLU A 64 ? 33.43943 -20.38296 -2.04740 0.282 3.98671 C ? A ? 63 CA 1
   ATOM 997 C B GLU A 64 ? 34.43950 -20.68806 -0.93894 0.282 5.88558 C ? A ? 63 C 1
   ATOM 998 O B GLU A 64 ? 35.36083 -19.91167 -0.67050 0.282 7.32596 O ? A ? 63 O 1
   ATOM 999 CB B GLU A 64 ? 33.98636 -20.95657 -3.35182 0.282 5.81657 C ? A ? 63 CB 1
   ATOM 1000 CG B GLU A 64 ? 32.95237 -21.14109 -4.45259 0.282 9.96723 C ? A ? 63 CG 1
   ATOM 1001 CD B GLU A 64 ? 32.57227 -19.86359 -5.16863 0.282 6.89057 C ? A ? 63 CD 1
   ATOM 1002 OE1 B GLU A 64 ? 33.24604 -18.84019 -4.98951 0.282 5.72267 O ? A ? 63 OE1 1
   ATOM 1003 OE2 B GLU A 64 ? 31.58062 -19.91438 -5.91888 0.282 8.61232 O ? A ? 63 OE2 1
   ATOM 1004 N C GLU A 64 ? 33.32094 -19.24104 -2.03687 0.408 8.95012 N ? A ? 63 N 1
   ATOM 1005 CA C GLU A 64 ? 33.50285 -20.67688 -1.86204 0.408 9.22040 C ? A ? 63 CA 1
   ATOM 1006 C C GLU A 64 ? 34.48660 -20.95037 -0.72360 0.408 9.76485 C ? A ? 63 C 1
   ATOM 1007 O C GLU A 64 ? 35.45642 -20.21550 -0.53632 0.408 10.39919 O ? A ? 63 O 1
   ATOM 1008 CB C GLU A 64 ? 34.02747 -21.27255 -3.17406 0.408 7.60938 C ? A ? 63 CB 1
   ATOM 1009 CG C GLU A 64 ? 33.00816 -21.32162 -4.30946 0.408 13.48722 C ? A ? 63 CG 1
   ATOM 1010 CD C GLU A 64 ? 32.79343 -19.99083 -5.01917 0.408 9.39300 C ? A ? 63 CD 1
   ATOM 1011 OE1 C GLU A 64 ? 33.60663 -19.05757 -4.84123 0.408 12.17035 O ? A ? 63 OE1 1
   ATOM 1012 OE2 C GLU A 64 ? 31.79842 -19.89116 -5.76929 0.408 11.70509 O ? A ? 63 OE2 1
   ATOM 1013 N D GLU A 64 ? 33.28811 -19.89660 -2.08038 0.310 9.81278 N ? A ? 63 N 1
   ATOM 1014 CA D GLU A 64 ? 33.64458 -21.26744 -1.75120 0.310 7.74343 C ? A ? 63 CA 1
   ATOM 1015 C D GLU A 64 ? 34.58351 -21.29116 -0.55659 0.310 8.26820 C ? A ? 63 C 1
   ATOM 1016 O D GLU A 64 ? 35.42825 -20.41257 -0.39549 0.310 8.37137 O ? A ? 63 O 1
   ATOM 1017 CB D GLU A 64 ? 34.31786 -21.94451 -2.95299 0.310 6.62955 C ? A ? 63 CB 1
   ATOM 1018 CG D GLU A 64 ? 33.35313 -22.40129 -4.04829 0.310 11.69598 C ? A ? 63 CG 1
   ATOM 1019 CD D GLU A 64 ? 32.85918 -21.28036 -4.94980 0.310 9.95931 C ? A ? 63 CD 1
   ATOM 1020 OE1 D GLU A 64 ? 33.28503 -20.13067 -4.76356 0.310 8.53277 O ? A ? 63 OE1 1
   ATOM 1021 OE2 D GLU A 64 ? 32.08600 -21.56286 -5.89353 0.310 13.32827 O ? A ? 63 OE2 1
   ATOM 1022 N B GLY A 65 ? 34.23664 -21.82698 -0.27502 0.282 6.35040 N ? A ? 64 N 1
   ATOM 1023 CA B GLY A 65 ? 35.10762 -22.34156 0.75884 0.282 7.38313 C ? A ? 64 CA 1
   ATOM 1024 C B GLY A 65 ? 34.32113 -22.81946 1.95089 0.282 3.99277 C ? A ? 64 C 1
   ATOM 1025 O B GLY A 65 ? 33.08980 -22.90069 1.92457 0.282 5.21286 O ? A ? 64 O 1
   ATOM 1026 N C GLY A 65 ? 34.20962 -21.97912 0.07310 0.408 8.68274 N ? A ? 64 N 1
   ATOM 1027 CA C GLY A 65 ? 35.09085 -22.35327 1.16295 0.408 9.43377 C ? A ? 64 CA 1
   ATOM 1028 C C GLY A 65 ? 34.32834 -22.99695 2.30860 0.408 9.65339 C ? A ? 64 C 1
   ATOM 1029 O C GLY A 65 ? 33.13855 -23.29285 2.20411 0.408 8.76058 O ? A ? 64 O 1
   ATOM 1030 N D GLY A 65 ? 34.42063 -22.29485 0.28060 0.310 8.15114 N ? A ? 64 N 1
   ATOM 1031 CA D GLY A 65 ? 35.21516 -22.38815 1.48827 0.310 10.39745 C ? A ? 64 CA 1
   ATOM 1032 C D GLY A 65 ? 34.44237 -23.08846 2.58247 0.310 7.11850 C ? A ? 64 C 1
   ATOM 1033 O D GLY A 65 ? 33.24706 -23.36191 2.46292 0.310 8.21636 O ? A ? 64 O 1
   ATOM 1034 N B GLY A 66 ? 35.03687 -23.14311 3.02506 0.282 6.03752 N ? A ? 65 N 1
   ATOM 1035 CA B GLY A 66 ? 34.37871 -23.69583 4.19322 0.282 6.67972 C ? A ? 65 CA 1
   ATOM 1036 C B GLY A 66 ? 33.90767 -25.12219 3.94007 0.282 5.77141 C ? A ? 65 C 1
   ATOM 1037 O B GLY A 66 ? 34.40963 -25.82964 3.06522 0.282 5.40809 O ? A ? 65 O 1
   ATOM 1038 N C GLY A 66 ? 35.03673 -23.20477 3.41458 0.408 11.80838 N ? A ? 65 N 1
   ATOM 1039 CA C GLY A 66 ? 34.42846 -23.80608 4.59354 0.408 11.81244 C ? A ? 65 CA 1
   ATOM 1040 C C GLY A 66 ? 33.94150 -25.21216 4.30795 0.408 14.86820 C ? A ? 65 C 1
   ATOM 1041 O C GLY A 66 ? 34.70008 -26.09844 3.89665 0.408 10.75828 O ? A ? 65 O 1
   ATOM 1042 N D GLY A 66 ? 35.14494 -23.35785 3.67549 0.310 9.38941 N ? A ? 65 N 1
   ATOM 1043 CA D GLY A 66 ? 34.52528 -24.12301 4.72646 0.310 12.90671 C ? A ? 65 CA 1
   ATOM 1044 C D GLY A 66 ? 33.88133 -25.37361 4.17032 0.310 12.40586 C ? A ? 65 C 1
   ATOM 1045 O D GLY A 66 ? 34.37884 -26.01679 3.23029 0.310 9.70961 O ? A ? 65 O 1
   ATOM 1046 N B ASP A 67 ? 33.00045 -25.57377 4.82539 0.282 12.14393 N ? A ? 66 N 1
   ATOM 1047 CA B ASP A 67 ? 32.32613 -26.86546 4.71532 0.282 11.37087 C ? A ? 66 CA 1
   ATOM 1048 C B ASP A 67 ? 31.14961 -26.82158 3.75388 0.282 7.12505 C ? A ? 66 C 1
   ATOM 1049 O B ASP A 67 ? 30.38245 -27.78200 3.65647 0.282 8.19102 O ? A ? 66 O 1
   ATOM 1050 CB B ASP A 67 ? 31.89409 -27.38128 6.09312 0.282 10.47980 C ? A ? 66 CB 1
   ATOM 1051 CG B ASP A 67 ? 33.01746 -28.08729 6.82218 0.282 15.67617 C ? A ? 66 CG 1
   ATOM 1052 OD1 B ASP A 67 ? 34.12175 -28.19986 6.25263 0.282 14.85278 O ? A ? 66 OD1 1
   ATOM 1053 OD2 B ASP A 67 ? 32.79800 -28.53228 7.96607 0.282 17.76330 O ? A ? 66 OD2 1
   ATOM 1054 N C ASP A 67 ? 32.65463 -25.43079 4.55379 0.408 9.72214 N ? A ? 66 N 1
   ATOM 1055 CA C ASP A 67 ? 32.00361 -26.69184 4.23102 0.408 6.76311 C ? A ? 66 CA 1
   ATOM 1056 C C ASP A 67 ? 30.85902 -26.48452 3.25132 0.408 6.68510 C ? A ? 66 C 1
   ATOM 1057 O C ASP A 67 ? 30.00028 -27.36316 3.12868 0.408 8.26240 O ? A ? 66 O 1
   ATOM 1058 CB C ASP A 67 ? 31.55440 -27.43093 5.49607 0.408 9.51647 C ? A ? 66 CB 1
   ATOM 1059 CG C ASP A 67 ? 32.68336 -28.23701 6.13745 0.408 16.13016 C ? A ? 66 CG 1
   ATOM 1060 OD1 C ASP A 67 ? 33.65533 -28.57511 5.42275 0.408 16.15594 O ? A ? 66 OD1 1
   ATOM 1061 OD2 C ASP A 67 ? 32.60000 -28.53900 7.35040 0.408 11.58769 O ? A ? 66 OD2 1
   ATOM 1062 N D ASP A 67 ? 32.73167 -25.71229 4.74981 0.310 9.57546 N ? A ? 66 N 1
   ATOM 1063 CA D ASP A 67 ? 31.98079 -26.90019 4.37713 0.310 10.04539 C ? A ? 66 CA 1
   ATOM 1064 C D ASP A 67 ? 30.79058 -26.58520 3.47702 0.310 9.09368 C ? A ? 66 C 1
   ATOM 1065 O D ASP A 67 ? 29.77707 -27.28450 3.53291 0.310 12.24881 O ? A ? 66 O 1
   ATOM 1066 CB D ASP A 67 ? 31.57014 -27.66336 5.63794 0.310 10.99081 C ? A ? 66 CB 1
   ATOM 1067 CG D ASP A 67 ? 32.77158 -28.07489 6.47258 0.310 14.53983 C ? A ? 66 CG 1
   ATOM 1068 OD1 D ASP A 67 ? 33.82423 -28.38768 5.87303 0.310 15.59054 O ? A ? 66 OD1 1
   ATOM 1069 OD2 D ASP A 67 ? 32.67739 -28.07505 7.71951 0.310 20.80114 O ? A ? 66 OD2 1
   ATOM 1070 N B ALA A 68 ? 31.00288 -25.72363 3.03271 0.282 6.95955 N ? A ? 67 N 1
   ATOM 1071 CA B ALA A 68 ? 29.98601 -25.59142 1.99973 0.282 6.31934 C ? A ? 67 CA 1
   ATOM 1072 C B ALA A 68 ? 30.36250 -26.35651 0.73129 0.282 6.59124 C ? A ? 67 C 1
   ATOM 1073 O B ALA A 68 ? 31.53849 -26.51782 0.39364 0.282 6.16487 O ? A ? 67 O 1
   ATOM 1074 CB B ALA A 68 ? 29.85739 -24.13263 1.59156 0.282 6.10065 C ? A ? 67 CB 1
   ATOM 1075 N C ALA A 68 ? 30.83707 -25.35687 2.53867 0.408 7.26016 N ? A ? 67 N 1
   ATOM 1076 CA C ALA A 68 ? 29.81244 -25.08189 1.53754 0.408 6.97132 C ? A ? 67 CA 1
   ATOM 1077 C C ALA A 68 ? 30.13045 -25.89846 0.28899 0.408 5.71943 C ? A ? 67 C 1
   ATOM 1078 O C ALA A 68 ? 31.21054 -25.74287 -0.28948 0.408 8.67817 O ? A ? 67 O 1
   ATOM 1079 CB C ALA A 68 ? 29.82117 -23.59478 1.19078 0.408 8.06101 C ? A ? 67 CB 1
   ATOM 1080 N D ALA A 68 ? 30.89758 -25.56040 2.63151 0.310 10.26918 N ? A ? 67 N 1
   ATOM 1081 CA D ALA A 68 ? 29.87894 -25.25578 1.63512 0.310 8.94341 C ? A ? 67 CA 1
   ATOM 1082 C D ALA A 68 ? 30.18358 -26.04715 0.36774 0.310 8.82082 C ? A ? 67 C 1
   ATOM 1083 O D ALA A 68 ? 31.31293 -26.01115 -0.13429 0.310 5.95374 O ? A ? 67 O 1
   ATOM 1084 CB D ALA A 68 ? 29.90244 -23.76425 1.30960 0.310 8.33736 C ? A ? 67 CB 1
   ATOM 1085 N B ARG A 69 ? 29.26009 -26.75723 -0.10460 0.282 10.48071 N ? A ? 68 N 1
   ATOM 1086 CA B ARG A 69 ? 29.47004 -27.47558 -1.36227 0.282 11.52498 C ? A ? 68 CA 1
   ATOM 1087 C B ARG A 69 ? 29.34263 -26.55060 -2.57398 0.282 10.74521 C ? A ? 68 C 1
   ATOM 1088 O B ARG A 69 ? 28.53751 -25.61503 -2.58100 0.282 10.61005 O ? A ? 68 O 1
   ATOM 1089 CB B ARG A 69 ? 28.47521 -28.63420 -1.49813 0.282 11.63242 C ? A ? 68 CB 1
   ATOM 1090 CG B ARG A 69 ? 28.82413 -29.79958 -0.58925 0.282 12.90828 C ? A ? 68 CG 1
   ATOM 1091 CD B ARG A 69 ? 27.78751 -30.92277 -0.57914 0.282 14.37019 C ? A ? 68 CD 1
   ATOM 1092 NE B ARG A 69 ? 27.68795 -31.60398 -1.86373 0.282 14.82286 N ? A ? 68 NE 1
   ATOM 1093 CZ B ARG A 69 ? 27.00851 -32.72515 -2.06537 0.282 16.76657 C ? A ? 68 CZ 1
   ATOM 1094 NH1 B ARG A 69 ? 26.38252 -33.34137 -1.07590 0.282 18.22840 N ? A ? 68 NH1 1
   ATOM 1095 NH2 B ARG A 69 ? 26.95994 -33.24411 -3.28960 0.282 15.73632 N ? A ? 68 NH2 1
   ATOM 1096 N C ARG A 69 ? 29.23836 -26.80167 -0.11089 0.408 10.51590 N ? A ? 68 N 1
   ATOM 1097 CA C ARG A 69 ? 29.48179 -27.54447 -1.34418 0.408 11.45524 C ? A ? 68 CA 1
   ATOM 1098 C C ARG A 69 ? 29.34029 -26.60909 -2.54211 0.408 10.65943 C ? A ? 68 C 1
   ATOM 1099 O C ARG A 69 ? 28.51862 -25.69407 -2.52985 0.408 11.05281 O ? A ? 68 O 1
   ATOM 1100 CB C ARG A 69 ? 28.48814 -28.69305 -1.48627 0.408 11.81709 C ? A ? 68 CB 1
   ATOM 1101 CG C ARG A 69 ? 28.78334 -29.84877 -0.56251 0.408 13.42236 C ? A ? 68 CG 1
   ATOM 1102 CD C ARG A 69 ? 27.85844 -31.03752 -0.80658 0.408 15.45217 C ? A ? 68 CD 1
   ATOM 1103 NE C ARG A 69 ? 28.16436 -32.15412 0.07960 0.408 18.25021 N ? A ? 68 NE 1
   ATOM 1104 CZ C ARG A 69 ? 29.12614 -33.04199 -0.12820 0.408 26.50458 C ? A ? 68 CZ 1
   ATOM 1105 NH1 C ARG A 69 ? 29.90046 -32.98371 -1.20078 0.408 26.63914 N ? A ? 68 NH1 1
   ATOM 1106 NH2 C ARG A 69 ? 29.31242 -34.01843 0.75967 0.408 30.49436 N ? A ? 68 NH2 1
   ATOM 1107 N D ARG A 69 ? 29.19082 -26.78321 -0.13954 0.310 10.38786 N ? A ? 68 N 1
   ATOM 1108 CA D ARG A 69 ? 29.42946 -27.51716 -1.37514 0.310 11.46710 C ? A ? 68 CA 1
   ATOM 1109 C D ARG A 69 ? 29.33320 -26.57910 -2.57005 0.310 10.77168 C ? A ? 68 C 1
   ATOM 1110 O D ARG A 69 ? 28.53489 -25.63996 -2.57257 0.310 10.76840 O ? A ? 68 O 1
   ATOM 1111 CB D ARG A 69 ? 28.40613 -28.63208 -1.54275 0.310 11.08535 C ? A ? 68 CB 1
   ATOM 1112 CG D ARG A 69 ? 28.67737 -29.79029 -0.62391 0.310 12.03056 C ? A ? 68 CG 1
   ATOM 1113 CD D ARG A 69 ? 27.74050 -30.97247 -0.83686 0.310 15.09818 C ? A ? 68 CD 1
   ATOM 1114 NE D ARG A 69 ? 28.13845 -32.11356 -0.02067 0.310 18.04428 N ? A ? 68 NE 1
   ATOM 1115 CZ D ARG A 69 ? 27.84780 -33.37637 -0.30120 0.310 18.32463 C ? A ? 68 CZ 1
   ATOM 1116 NH1 D ARG A 69 ? 27.15783 -33.70203 -1.38035 0.310 23.65097 N ? A ? 68 NH1 1
   ATOM 1117 NH2 D ARG A 69 ? 28.26046 -34.33646 0.52369 0.310 20.04530 N ? A ? 68 NH2 1
   ATOM 1118 N . PRO A 70 ? 30.13388 -26.82442 -3.61967 1.000 11.33157 N ? A ? 69 N 1
   ATOM 1119 CA . PRO A 70 ? 30.10395 -25.98589 -4.84277 1.000 10.60546 C ? A ? 69 CA 1
   ATOM 1120 C . PRO A 70 ? 28.75733 -25.87514 -5.54573 1.000 7.95920 C ? A ? 69 C 1
   ATOM 1121 O . PRO A 70 ? 28.46471 -24.87678 -6.19757 1.000 10.71151 O ? A ? 69 O 1
   ATOM 1122 CB . PRO A 70 ? 31.15829 -26.65705 -5.73846 1.000 11.17358 C ? A ? 69 CB 1
   ATOM 1123 CG . PRO A 70 ? 31.47733 -27.92853 -5.13507 1.000 13.66416 C ? A ? 69 CG 1
   ATOM 1124 CD . PRO A 70 ? 31.19200 -27.85057 -3.69072 1.000 11.92770 C ? A ? 69 CD 1
   ATOM 1125 N A GLU A 71 ? 27.99096 -26.94277 -5.29373 0.575 10.36408 N ? A ? 70 N 1
   ATOM 1126 CA A GLU A 71 ? 26.64251 -27.06355 -5.82042 0.575 14.11239 C ? A ? 70 CA 1
   ATOM 1127 C A GLU A 71 ? 25.74482 -25.95028 -5.32192 0.575 10.48355 C ? A ? 70 C 1
   ATOM 1128 O A GLU A 71 ? 24.72537 -25.67898 -5.94910 0.575 11.30107 O ? A ? 70 O 1
   ATOM 1129 CB A GLU A 71 ? 26.02802 -28.42081 -5.46012 0.575 19.32073 C ? A ? 70 CB 1
   ATOM 1130 CG A GLU A 71 ? 26.60811 -29.60899 -6.20303 0.575 21.34268 C ? A ? 70 CG 1
   ATOM 1131 CD A GLU A 71 ? 27.60646 -30.37024 -5.37364 0.575 21.08358 C ? A ? 70 CD 1
   ATOM 1132 OE1 A GLU A 71 ? 28.25995 -29.74986 -4.50875 0.575 23.12479 O ? A ? 70 OE1 1
   ATOM 1133 OE2 A GLU A 71 ? 27.73361 -31.59503 -5.57259 0.575 26.27596 O ? A ? 70 OE2 1
   ATOM 1134 N B GLU A 71 ? 27.87557 -26.86600 -5.40016 0.425 10.52029 N ? A ? 70 N 1
   ATOM 1135 CA B GLU A 71 ? 26.58394 -26.82074 -6.08797 0.425 8.22441 C ? A ? 70 CA 1
   ATOM 1136 C B GLU A 71 ? 25.66898 -25.72921 -5.53103 0.425 6.89285 C ? A ? 70 C 1
   ATOM 1137 O B GLU A 71 ? 24.71120 -25.31394 -6.20060 0.425 8.00722 O ? A ? 70 O 1
   ATOM 1138 CB B GLU A 71 ? 25.92770 -28.19764 -5.98285 0.425 12.48931 C ? A ? 70 CB 1
   ATOM 1139 CG B GLU A 71 ? 26.64600 -29.30530 -6.78764 0.425 9.24988 C ? A ? 70 CG 1
   ATOM 1140 CD B GLU A 71 ? 27.92499 -29.85043 -6.14527 0.425 11.62045 C ? A ? 70 CD 1
   ATOM 1141 OE1 B GLU A 71 ? 28.20861 -29.54795 -4.96776 0.425 10.84055 O ? A ? 70 OE1 1
   ATOM 1142 OE2 B GLU A 71 ? 28.65267 -30.60267 -6.83219 0.425 14.27206 O ? A ? 70 OE2 1
   ATOM 1143 N A ILE A 72 ? 26.08294 -25.30504 -4.20108 0.575 9.02979 N ? A ? 71 N 1
   ATOM 1144 CA A ILE A 72 ? 25.34218 -24.10879 -3.79320 0.575 9.86997 C ? A ? 71 CA 1
   ATOM 1145 C A ILE A 72 ? 25.28723 -23.07639 -4.91840 0.575 8.96895 C ? A ? 71 C 1
   ATOM 1146 O A ILE A 72 ? 24.25707 -22.43319 -5.14453 0.575 10.97549 O ? A ? 71 O 1
   ATOM 1147 CB A ILE A 72 ? 25.97908 -23.51976 -2.52315 0.575 9.35783 C ? A ? 71 CB 1
   ATOM 1148 CG1 A ILE A 72 ? 25.72608 -24.44605 -1.34274 0.575 7.74810 C ? A ? 71 CG1 1
   ATOM 1149 CG2 A ILE A 72 ? 25.48715 -22.09020 -2.24879 0.575 8.57460 C ? A ? 71 CG2 1
   ATOM 1150 CD1 A ILE A 72 ? 26.43108 -24.03432 -0.08054 0.575 9.58688 C ? A ? 71 CD1 1
   ATOM 1151 N B ILE A 72 ? 25.93773 -25.26107 -4.31239 0.425 10.66815 N ? A ? 71 N 1
   ATOM 1152 CA B ILE A 72 ? 25.26815 -24.06637 -3.81459 0.425 9.66661 C ? A ? 71 CA 1
   ATOM 1153 C B ILE A 72 ? 25.29419 -22.97194 -4.88233 0.425 9.01588 C ? A ? 71 C 1
   ATOM 1154 O B ILE A 72 ? 24.31123 -22.24338 -5.08779 0.425 9.36598 O ? A ? 71 O 1
   ATOM 1155 CB B ILE A 72 ? 25.94873 -23.62114 -2.50493 0.425 9.29602 C ? A ? 71 CB 1
   ATOM 1156 CG1 B ILE A 72 ? 25.74270 -24.65788 -1.38479 0.425 9.58191 C ? A ? 71 CG1 1
   ATOM 1157 CG2 B ILE A 72 ? 25.44188 -22.28841 -2.08152 0.425 8.66543 C ? A ? 71 CG2 1
   ATOM 1158 CD1 B ILE A 72 ? 26.42395 -24.30002 -0.05296 0.425 9.55976 C ? A ? 71 CD1 1
   ATOM 1159 N . TRP A 73 ? 26.42194 -22.84785 -5.58317 1.000 9.64475 N ? A ? 72 N 1
   ATOM 1160 CA . TRP A 73 ? 26.58049 -21.81851 -6.60657 1.000 10.00030 C ? A ? 72 CA 1
   ATOM 1161 C . TRP A 73 ? 26.18785 -22.28686 -7.99162 1.000 11.59830 C ? A ? 72 C 1
   ATOM 1162 O . TRP A 73 ? 25.61936 -21.50950 -8.76750 1.000 14.46198 O ? A ? 72 O 1
   ATOM 1163 CB . TRP A 73 ? 28.03969 -21.34616 -6.63890 1.000 10.33843 C ? A ? 72 CB 1
   ATOM 1164 CG . TRP A 73 ? 28.39075 -20.54017 -5.41397 1.000 9.89253 C ? A ? 72 CG 1
   ATOM 1165 CD1 . TRP A 73 ? 28.30377 -19.17513 -5.27551 1.000 11.71768 C ? A ? 72 CD1 1
   ATOM 1166 CD2 . TRP A 73 ? 28.89542 -21.03235 -4.15766 1.000 10.15199 C ? A ? 72 CD2 1
   ATOM 1167 NE1 . TRP A 73 ? 28.70667 -18.80550 -4.01072 1.000 11.98677 N ? A ? 72 NE1 1
   ATOM 1168 CE2 . TRP A 73 ? 29.07506 -19.92235 -3.31470 1.000 9.11506 C ? A ? 72 CE2 1
   ATOM 1169 CE3 . TRP A 73 ? 29.22437 -22.28775 -3.67302 1.000 9.43864 C ? A ? 72 CE3 1
   ATOM 1170 CZ2 . TRP A 73 ? 29.54998 -20.03779 -2.00432 1.000 10.82662 C ? A ? 72 CZ2 1
   ATOM 1171 CZ3 . TRP A 73 ? 29.70635 -22.40590 -2.35610 1.000 9.60237 C ? A ? 72 CZ3 1
   ATOM 1172 CH2 . TRP A 73 ? 29.84271 -21.28417 -1.54302 1.000 8.87728 C ? A ? 72 CH2 1
   ATOM 1173 N A SER A 74 ? 26.45462 -23.57758 -8.27510 0.463 9.85745 N ? A ? 73 N 1
   ATOM 1174 CA A SER A 74 ? 26.21578 -24.23374 -9.56935 0.463 10.68884 C ? A ? 73 CA 1
   ATOM 1175 C A SER A 74 ? 24.83632 -24.87788 -9.69587 0.463 8.79501 C ? A ? 73 C 1
   ATOM 1176 O A SER A 74 ? 24.39983 -25.13017 -10.82672 0.463 13.47920 O ? A ? 73 O 1
   ATOM 1177 CB A SER A 74 ? 27.27664 -25.31030 -9.82157 0.463 12.58490 C ? A ? 73 CB 1
   ATOM 1178 OG A SER A 74 ? 26.99291 -26.51466 -9.11493 0.463 15.40254 O ? A ? 73 OG 1
   ATOM 1179 N B SER A 74 ? 26.48790 -23.50752 -8.37860 0.537 10.80642 N ? A ? 73 N 1
   ATOM 1180 CA B SER A 74 ? 26.13647 -23.84569 -9.76024 0.537 10.74750 C ? A ? 73 CA 1
   ATOM 1181 C B SER A 74 ? 24.65638 -24.17037 -9.92522 0.537 7.17337 C ? A ? 73 C 1
   ATOM 1182 O B SER A 74 ? 24.15437 -24.14082 -11.05122 0.537 9.32417 O ? A ? 73 O 1
   ATOM 1183 CB B SER A 74 ? 27.01222 -24.97617 -10.26723 0.537 11.14422 C ? A ? 73 CB 1
   ATOM 1184 OG B SER A 74 ? 26.87306 -26.09477 -9.43040 0.537 9.91747 O ? A ? 73 OG 1
   ATOM 1185 N A ASP A 75 ? 24.16615 -25.17903 -8.57844 0.463 8.42473 N ? A ? 74 N 1
   ATOM 1186 CA A ASP A 75 ? 22.74169 -25.49093 -8.58892 0.463 8.85653 C ? A ? 74 CA 1
   ATOM 1187 C A ASP A 75 ? 22.03324 -24.44446 -7.74911 0.463 7.14264 C ? A ? 74 C 1
   ATOM 1188 O A ASP A 75 ? 21.37413 -24.76959 -6.74183 0.463 9.38334 O ? A ? 74 O 1
   ATOM 1189 CB A ASP A 75 ? 22.49842 -26.85407 -7.95944 0.463 9.37365 C ? A ? 74 CB 1
   ATOM 1190 CG A ASP A 75 ? 23.18545 -27.97513 -8.70624 0.463 15.40492 C ? A ? 74 CG 1
   ATOM 1191 OD1 A ASP A 75 ? 23.18935 -27.96376 -9.95659 0.463 25.41372 O ? A ? 74 OD1 1
   ATOM 1192 OD2 A ASP A 75 ? 23.72800 -28.87643 -8.03570 0.463 24.01035 O ? A ? 74 OD2 1
   ATOM 1193 N B ASP A 75 ? 23.95793 -24.47402 -8.82983 0.537 6.93789 N ? A ? 74 N 1
   ATOM 1194 CA B ASP A 75 ? 22.52109 -24.72484 -8.82759 0.537 9.46100 C ? A ? 74 CA 1
   ATOM 1195 C B ASP A 75 ? 21.85560 -23.65293 -7.96245 0.537 9.01917 C ? A ? 74 C 1
   ATOM 1196 O B ASP A 75 ? 21.21620 -23.94748 -6.94153 0.537 7.72665 O ? A ? 74 O 1
   ATOM 1197 CB B ASP A 75 ? 22.20164 -26.13040 -8.28132 0.537 10.38523 C ? A ? 74 CB 1
   ATOM 1198 CG B ASP A 75 ? 22.82469 -27.26577 -9.09833 0.537 9.11654 C ? A ? 74 CG 1
   ATOM 1199 OD1 B ASP A 75 ? 23.00959 -27.13997 -10.33778 0.537 11.52365 O ? A ? 74 OD1 1
   ATOM 1200 OD2 B ASP A 75 ? 23.12035 -28.32497 -8.50672 0.537 12.85237 O ? A ? 74 OD2 1
   ATOM 1201 N A ALA A 76 ? 22.17859 -23.17977 -8.15579 0.463 11.02104 N ? A ? 75 N 1
   ATOM 1202 CA A ALA A 76 ? 21.75250 -22.06300 -7.32778 0.463 12.74958 C ? A ? 75 CA 1
   ATOM 1203 C A ALA A 76 ? 20.24786 -22.06843 -7.10994 0.463 9.49367 C ? A ? 75 C 1
   ATOM 1204 O A ALA A 76 ? 19.78519 -21.77405 -6.00325 0.463 9.18350 O ? A ? 75 O 1
   ATOM 1205 CB A ALA A 76 ? 22.21695 -20.74019 -7.93775 0.463 12.99788 C ? A ? 75 CB 1
   ATOM 1206 N B ALA A 76 ? 21.98086 -22.39208 -8.37346 0.537 9.69645 N ? A ? 75 N 1
   ATOM 1207 CA B ALA A 76 ? 21.58294 -21.29491 -7.50320 0.537 8.98032 C ? A ? 75 CA 1
   ATOM 1208 C B ALA A 76 ? 20.08734 -21.29544 -7.21847 0.537 8.96613 C ? A ? 75 C 1
   ATOM 1209 O B ALA A 76 ? 19.66085 -20.98530 -6.10037 0.537 9.23318 O ? A ? 75 O 1
   ATOM 1210 CB B ALA A 76 ? 22.00464 -19.95588 -8.10540 0.537 11.76761 C ? A ? 75 CB 1
   ATOM 1211 N A ALA A 77 ? 19.46917 -22.39814 -8.14485 0.463 11.54127 N ? A ? 76 N 1
   ATOM 1212 CA A ALA A 77 ? 18.01298 -22.38936 -8.01206 0.463 11.19014 C ? A ? 76 CA 1
   ATOM 1213 C A ALA A 77 ? 17.55707 -23.42557 -7.00071 0.463 10.21682 C ? A ? 76 C 1
   ATOM 1214 O A ALA A 77 ? 16.67991 -23.16399 -6.16747 0.463 13.19621 O ? A ? 76 O 1
   ATOM 1215 CB A ALA A 77 ? 17.34947 -22.63143 -9.37379 0.463 10.78832 C ? A ? 76 CB 1
   ATOM 1216 N B ALA A 77 ? 19.26691 -21.59003 -8.21872 0.537 9.94530 N ? A ? 76 N 1
   ATOM 1217 CA B ALA A 77 ? 17.82691 -21.60031 -7.98511 0.537 10.86590 C ? A ? 76 CA 1
   ATOM 1218 C B ALA A 77 ? 17.42530 -22.68919 -7.00106 0.537 9.27341 C ? A ? 76 C 1
   ATOM 1219 O B ALA A 77 ? 16.53763 -22.47220 -6.17401 0.537 8.96658 O ? A ? 76 O 1
   ATOM 1220 CB B ALA A 77 ? 17.07215 -21.75447 -9.31166 0.537 10.19403 C ? A ? 76 CB 1
   ATOM 1221 N A SER A 78 ? 18.15348 -24.60422 -7.03669 0.463 10.56364 N ? A ? 77 N 1
   ATOM 1222 CA A SER A 78 ? 17.85679 -25.53474 -5.97295 0.463 13.75253 C ? A ? 77 CA 1
   ATOM 1223 C A SER A 78 ? 18.27115 -25.00648 -4.59669 0.463 14.55328 C ? A ? 77 C 1
   ATOM 1224 O A SER A 78 ? 17.67735 -25.44495 -3.60365 0.463 11.11108 O ? A ? 77 O 1
   ATOM 1225 CB A SER A 78 ? 18.48601 -26.88004 -6.26543 0.463 11.53820 C ? A ? 77 CB 1
   ATOM 1226 OG A SER A 78 ? 18.15252 -27.79508 -5.24944 0.463 35.58999 O ? A ? 77 OG 1
   ATOM 1227 N B SER A 78 ? 18.07974 -23.85119 -7.06347 0.537 10.30012 N ? A ? 77 N 1
   ATOM 1228 CA B SER A 78 ? 17.74179 -24.97473 -6.19146 0.537 9.16144 C ? A ? 77 CA 1
   ATOM 1229 C B SER A 78 ? 18.13814 -24.72456 -4.73812 0.537 9.13220 C ? A ? 77 C 1
   ATOM 1230 O B SER A 78 ? 17.32566 -24.88844 -3.82532 0.537 9.79578 O ? A ? 77 O 1
   ATOM 1231 CB B SER A 78 ? 18.45980 -26.22353 -6.67954 0.537 8.95610 C ? A ? 77 CB 1
   ATOM 1232 OG B SER A 78 ? 17.72335 -26.92442 -7.65707 0.537 11.57452 O ? A ? 77 OG 1
   ATOM 1233 N A PHE A 79 ? 19.23643 -24.05069 -4.51668 0.463 8.91126 N ? A ? 78 N 1
   ATOM 1234 CA A PHE A 79 ? 19.68899 -23.51193 -3.23073 0.463 6.50740 C ? A ? 78 CA 1
   ATOM 1235 C A PHE A 79 ? 18.76529 -22.42063 -2.69684 0.463 7.77958 C ? A ? 78 C 1
   ATOM 1236 O A PHE A 79 ? 18.38876 -22.43028 -1.51686 0.463 6.99112 O ? A ? 78 O 1
   ATOM 1237 CB A PHE A 79 ? 21.12269 -22.97753 -3.31304 0.463 6.47261 C ? A ? 78 CB 1
   ATOM 1238 CG A PHE A 79 ? 21.66403 -22.60831 -1.95250 0.463 7.87350 C ? A ? 78 CG 1
   ATOM 1239 CD1 A PHE A 79 ? 22.04734 -23.60752 -1.08337 0.463 6.52030 C ? A ? 78 CD1 1
   ATOM 1240 CD2 A PHE A 79 ? 21.75987 -21.28266 -1.54973 0.463 8.40703 C ? A ? 78 CD2 1
   ATOM 1241 CE1 A PHE A 79 ? 22.50768 -23.29677 0.19705 0.463 6.00590 C ? A ? 78 CE1 1
   ATOM 1242 CE2 A PHE A 79 ? 22.23202 -20.95954 -0.27118 0.463 8.50986 C ? A ? 78 CE2 1
   ATOM 1243 CZ A PHE A 79 ? 22.61398 -21.96697 0.58947 0.463 7.40605 C ? A ? 78 CZ 1
   ATOM 1244 N B PHE A 79 ? 19.42785 -24.47651 -4.47544 0.537 12.56678 N ? A ? 78 N 1
   ATOM 1245 CA B PHE A 79 ? 19.80724 -24.10084 -3.11787 0.537 10.19661 C ? A ? 78 CA 1
   ATOM 1246 C B PHE A 79 ? 18.83752 -23.05729 -2.57718 0.537 10.20709 C ? A ? 78 C 1
   ATOM 1247 O B PHE A 79 ? 18.41284 -23.12886 -1.41619 0.537 8.94198 O ? A ? 78 O 1
   ATOM 1248 CB B PHE A 79 ? 21.24308 -23.56374 -3.12698 0.537 10.25766 C ? A ? 78 CB 1
   ATOM 1249 CG B PHE A 79 ? 21.74447 -23.16851 -1.76718 0.537 7.81369 C ? A ? 78 CG 1
   ATOM 1250 CD1 B PHE A 79 ? 22.12847 -24.13218 -0.85251 0.537 8.91533 C ? A ? 78 CD1 1
   ATOM 1251 CD2 B PHE A 79 ? 21.85061 -21.84095 -1.42947 0.537 8.44610 C ? A ? 78 CD2 1
   ATOM 1252 CE1 B PHE A 79 ? 22.58948 -23.77914 0.40770 0.537 8.82029 C ? A ? 78 CE1 1
   ATOM 1253 CE2 B PHE A 79 ? 22.32707 -21.47031 -0.17004 0.537 10.19891 C ? A ? 78 CE2 1
   ATOM 1254 CZ B PHE A 79 ? 22.70101 -22.45291 0.74027 0.537 8.16732 C ? A ? 78 CZ 1
   ATOM 1255 N A LYS A 80 ? 18.41033 -21.45697 -3.54464 0.463 7.29692 N ? A ? 79 N 1
   ATOM 1256 CA A LYS A 80 ? 17.48647 -20.41649 -3.11379 0.463 6.32249 C ? A ? 79 CA 1
   ATOM 1257 C A LYS A 80 ? 16.14135 -21.00781 -2.69908 0.463 6.98002 C ? A ? 79 C 1
   ATOM 1258 O A LYS A 80 ? 15.54694 -20.55787 -1.71837 0.463 5.96802 O ? A ? 79 O 1
   ATOM 1259 CB A LYS A 80 ? 17.32645 -19.36136 -4.20704 0.463 8.79117 C ? A ? 79 CB 1
   ATOM 1260 CG A LYS A 80 ? 16.53261 -18.13690 -3.78758 0.463 9.45635 C ? A ? 79 CG 1
   ATOM 1261 CD A LYS A 80 ? 16.52714 -17.07237 -4.87610 0.463 15.61151 C ? A ? 79 CD 1
   ATOM 1262 CE A LYS A 80 ? 15.73142 -15.86420 -4.42233 0.463 21.44335 C ? A ? 79 CE 1
   ATOM 1263 NZ A LYS A 80 ? 15.61958 -14.84100 -5.49020 0.463 21.19200 N ? A ? 79 NZ 1
   ATOM 1264 N B LYS A 80 ? 18.41008 -22.13700 -3.44978 0.537 9.74995 N ? A ? 79 N 1
   ATOM 1265 CA B LYS A 80 ? 17.40363 -21.14383 -3.09446 0.537 10.12478 C ? A ? 79 CA 1
   ATOM 1266 C B LYS A 80 ? 16.08991 -21.78786 -2.65043 0.537 10.55977 C ? A ? 79 C 1
   ATOM 1267 O B LYS A 80 ? 15.41357 -21.26451 -1.76360 0.537 11.30058 O ? A ? 79 O 1
   ATOM 1268 CB B LYS A 80 ? 17.18888 -20.14667 -4.24627 0.537 14.97695 C ? A ? 79 CB 1
   ATOM 1269 CG B LYS A 80 ? 16.31094 -18.95191 -3.87692 0.537 18.21720 C ? A ? 79 CG 1
   ATOM 1270 CD B LYS A 80 ? 16.42904 -17.79574 -4.86413 0.537 27.64021 C ? A ? 79 CD 1
   ATOM 1271 CE B LYS A 80 ? 15.54237 -16.63576 -4.43324 0.537 34.48242 C ? A ? 79 CE 1
   ATOM 1272 NZ B LYS A 80 ? 15.59836 -16.44235 -2.95392 0.537 39.36228 N ? A ? 79 NZ 1
   ATOM 1273 N A GLN A 81 ? 15.64882 -22.02028 -3.42811 0.463 5.83011 N ? A ? 80 N 1
   ATOM 1274 CA A GLN A 81 ? 14.39914 -22.66942 -3.03790 0.463 6.05348 C ? A ? 80 CA 1
   ATOM 1275 C A GLN A 81 ? 14.50186 -23.25930 -1.64112 0.463 6.05642 C ? A ? 80 C 1
   ATOM 1276 O A GLN A 81 ? 13.56498 -23.12863 -0.85116 0.463 5.91634 O ? A ? 80 O 1
   ATOM 1277 CB A GLN A 81 ? 13.98937 -23.76380 -4.01682 0.463 5.83972 C ? A ? 80 CB 1
   ATOM 1278 CG A GLN A 81 ? 13.48312 -23.27613 -5.36096 0.463 18.12357 C ? A ? 80 CG 1
   ATOM 1279 CD A GLN A 81 ? 12.10592 -22.63498 -5.28903 0.463 23.85659 C ? A ? 80 CD 1
   ATOM 1280 OE1 A GLN A 81 ? 11.21493 -23.11466 -4.58373 0.463 25.29192 O ? A ? 80 OE1 1
   ATOM 1281 NE2 A GLN A 81 ? 11.92607 -21.54350 -6.02632 0.463 19.00051 N ? A ? 80 NE2 1
   ATOM 1282 N B GLN A 81 ? 15.69441 -22.90767 -3.26102 0.537 10.22211 N ? A ? 80 N 1
   ATOM 1283 CA B GLN A 81 ? 14.48329 -23.60153 -2.81719 0.537 9.94824 C ? A ? 80 CA 1
   ATOM 1284 C B GLN A 81 ? 14.67802 -24.26079 -1.45553 0.537 10.50519 C ? A ? 80 C 1
   ATOM 1285 O B GLN A 81 ? 13.74494 -24.30110 -0.64326 0.537 11.12674 O ? A ? 80 O 1
   ATOM 1286 CB B GLN A 81 ? 14.01467 -24.63561 -3.84211 0.537 10.14413 C ? A ? 80 CB 1
   ATOM 1287 CG B GLN A 81 ? 13.28884 -24.03773 -5.03261 0.537 17.65753 C ? A ? 80 CG 1
   ATOM 1288 CD B GLN A 81 ? 12.09302 -23.20157 -4.61014 0.537 32.86205 C ? A ? 80 CD 1
   ATOM 1289 OE1 B GLN A 81 ? 11.18091 -23.68423 -3.93461 0.537 26.37930 O ? A ? 80 OE1 1
   ATOM 1290 NE2 B GLN A 81 ? 12.10048 -21.93353 -4.99578 0.537 26.86464 N ? A ? 80 NE2 1
   ATOM 1291 N A LYS A 82 ? 15.62074 -23.91621 -1.31833 0.463 6.52337 N ? A ? 81 N 1
   ATOM 1292 CA A LYS A 82 ? 15.73704 -24.50617 0.01242 0.463 5.77820 C ? A ? 81 CA 1
   ATOM 1293 C A LYS A 82 ? 15.78200 -23.45579 1.12398 0.463 5.71663 C ? A ? 81 C 1
   ATOM 1294 O A LYS A 82 ? 15.13742 -23.63807 2.15844 0.463 6.35008 O ? A ? 81 O 1
   ATOM 1295 CB A LYS A 82 ? 16.91745 -25.47048 0.12360 0.463 7.80159 C ? A ? 81 CB 1
   ATOM 1296 CG A LYS A 82 ? 16.65545 -26.83076 -0.53006 0.463 16.12680 C ? A ? 81 CG 1
   ATOM 1297 CD A LYS A 82 ? 17.68325 -27.85357 -0.05669 0.463 10.52567 C ? A ? 81 CD 1
   ATOM 1298 CE A LYS A 82 ? 17.20040 -29.29822 -0.22174 0.463 17.64722 C ? A ? 81 CE 1
   ATOM 1299 NZ A LYS A 82 ? 16.85220 -29.72495 -1.61710 0.463 15.17432 N ? A ? 81 NZ 1
   ATOM 1300 N B LYS A 82 ? 15.86657 -24.79860 -1.17212 0.537 10.14612 N ? A ? 81 N 1
   ATOM 1301 CA B LYS A 82 ? 16.10573 -25.26655 0.18961 0.537 8.64356 C ? A ? 81 CA 1
   ATOM 1302 C B LYS A 82 ? 16.07868 -24.11039 1.17369 0.537 8.58149 C ? A ? 81 C 1
   ATOM 1303 O B LYS A 82 ? 15.55898 -24.25671 2.28841 0.537 8.60764 O ? A ? 81 O 1
   ATOM 1304 CB B LYS A 82 ? 17.39148 -26.08091 0.29506 0.537 11.61429 C ? A ? 81 CB 1
   ATOM 1305 CG B LYS A 82 ? 17.23854 -27.40516 -0.42643 0.537 26.87875 C ? A ? 81 CG 1
   ATOM 1306 CD B LYS A 82 ? 18.17422 -28.46393 0.09385 0.537 26.30534 C ? A ? 81 CD 1
   ATOM 1307 CE B LYS A 82 ? 17.52433 -29.83347 -0.01764 0.537 19.00933 C ? A ? 81 CE 1
   ATOM 1308 NZ B LYS A 82 ? 16.76096 -29.98512 -1.29453 0.537 15.56472 N ? A ? 81 NZ 1
   ATOM 1309 N A GLN A 83 ? 16.55261 -22.36342 0.96572 0.463 6.42154 N ? A ? 82 N 1
   ATOM 1310 CA A GLN A 83 ? 16.58746 -21.35740 2.03379 0.463 5.42155 C ? A ? 82 CA 1
   ATOM 1311 C A GLN A 83 ? 15.26645 -20.60844 2.12448 0.463 5.51037 C ? A ? 82 C 1
   ATOM 1312 O A GLN A 83 ? 14.85699 -20.23072 3.22013 0.463 6.07297 O ? A ? 82 O 1
   ATOM 1313 CB A GLN A 83 ? 17.76906 -20.38389 1.91949 0.463 6.47857 C ? A ? 82 CB 1
   ATOM 1314 CG A GLN A 83 ? 17.33079 -19.00144 1.51384 0.463 15.65370 C ? A ? 82 CG 1
   ATOM 1315 CD A GLN A 83 ? 18.15858 -18.48536 0.35770 0.463 17.65131 C ? A ? 82 CD 1
   ATOM 1316 OE1 A GLN A 83 ? 19.22481 -19.02119 0.08813 0.463 17.54788 O ? A ? 82 OE1 1
   ATOM 1317 NE2 A GLN A 83 ? 17.67455 -17.44926 -0.34805 0.463 10.51873 N ? A ? 82 NE2 1
   ATOM 1318 N B GLN A 83 ? 16.61010 -22.94739 0.77531 0.537 9.81021 N ? A ? 82 N 1
   ATOM 1319 CA B GLN A 83 ? 16.61587 -21.80428 1.68439 0.537 10.69911 C ? A ? 82 CA 1
   ATOM 1320 C B GLN A 83 ? 15.22092 -21.23679 1.88185 0.537 8.86348 C ? A ? 82 C 1
   ATOM 1321 O B GLN A 83 ? 14.84209 -20.92059 3.01373 0.537 10.13298 O ? A ? 82 O 1
   ATOM 1322 CB B GLN A 83 ? 17.70046 -20.73709 1.36316 0.537 17.90896 C ? A ? 82 CB 1
   ATOM 1323 CG B GLN A 83 ? 17.49847 -19.68830 0.24141 0.537 17.63364 C ? A ? 82 CG 1
   ATOM 1324 CD B GLN A 83 ? 17.32673 -18.22824 0.71389 0.537 6.32091 C ? A ? 82 CD 1
   ATOM 1325 OE1 B GLN A 83 ? 16.42340 -17.94435 1.49560 0.537 8.37766 O ? A ? 82 OE1 1
   ATOM 1326 NE2 B GLN A 83 ? 18.13128 -17.31240 0.18483 0.537 24.09633 N ? A ? 82 NE2 1
   ATOM 1327 N A GLN A 84 ? 14.56468 -20.41372 1.00789 0.463 5.98745 N ? A ? 83 N 1
   ATOM 1328 CA A GLN A 84 ? 13.26837 -19.74599 1.06861 0.463 5.55303 C ? A ? 83 CA 1
   ATOM 1329 C A GLN A 84 ? 12.22779 -20.62745 1.73460 0.463 5.19329 C ? A ? 83 C 1
   ATOM 1330 O A GLN A 84 ? 11.38796 -20.11910 2.47235 0.463 6.45036 O ? A ? 83 O 1
   ATOM 1331 CB A GLN A 84 ? 12.80522 -19.30898 -0.32585 0.463 7.86345 C ? A ? 83 CB 1
   ATOM 1332 CG A GLN A 84 ? 13.61393 -18.16033 -0.90813 0.463 7.91491 C ? A ? 83 CG 1
   ATOM 1333 CD A GLN A 84 ? 13.29251 -16.79223 -0.30861 0.463 24.48164 C ? A ? 83 CD 1
   ATOM 1334 OE1 A GLN A 84 ? 12.34569 -16.12407 -0.73315 0.463 26.71322 O ? A ? 83 OE1 1
   ATOM 1335 NE2 A GLN A 84 ? 14.09854 -16.35875 0.66358 0.463 10.12039 N ? A ? 83 NE2 1
   ATOM 1336 N B GLN A 84 ? 14.41350 -21.15966 0.82190 0.537 11.93199 N ? A ? 83 N 1
   ATOM 1337 CA B GLN A 84 ? 13.10622 -20.52844 0.99900 0.537 10.51821 C ? A ? 83 CA 1
   ATOM 1338 C B GLN A 84 ? 12.11566 -21.42772 1.73554 0.537 13.21114 C ? A ? 83 C 1
   ATOM 1339 O B GLN A 84 ? 11.33065 -20.93896 2.54417 0.537 11.71318 O ? A ? 83 O 1
   ATOM 1340 CB B GLN A 84 ? 12.59783 -19.92454 -0.31753 0.537 15.75164 C ? A ? 83 CB 1
   ATOM 1341 CG B GLN A 84 ? 13.41588 -18.71547 -0.82032 0.537 23.93617 C ? A ? 83 CG 1
   ATOM 1342 CD B GLN A 84 ? 13.11853 -17.40107 -0.08828 0.537 32.96282 C ? A ? 83 CD 1
   ATOM 1343 OE1 B GLN A 84 ? 12.02363 -16.84494 -0.19850 0.537 31.23416 O ? A ? 83 OE1 1
   ATOM 1344 NE2 B GLN A 84 ? 14.10612 -16.88984 0.64195 0.537 27.20068 N ? A ? 83 NE2 1
   ATOM 1345 N A ALA A 85 ? 12.27080 -21.94203 1.47526 0.463 4.76223 N ? A ? 84 N 1
   ATOM 1346 CA A ALA A 85 ? 11.38621 -22.90428 2.11448 0.463 7.14216 C ? A ? 84 CA 1
   ATOM 1347 C A ALA A 85 ? 11.67088 -23.01548 3.62396 0.463 7.19132 C ? A ? 84 C 1
   ATOM 1348 O A ALA A 85 ? 10.72548 -23.01284 4.41989 0.463 6.51110 O ? A ? 84 O 1
   ATOM 1349 CB A ALA A 85 ? 11.52316 -24.26170 1.42029 0.463 9.76688 C ? A ? 84 CB 1
   ATOM 1350 N B ALA A 85 ? 12.15487 -22.74062 1.53343 0.537 8.23688 N ? A ? 84 N 1
   ATOM 1351 CA B ALA A 85 ? 11.29668 -23.60660 2.33130 0.537 13.29837 C ? A ? 84 CA 1
   ATOM 1352 C B ALA A 85 ? 11.69291 -23.53164 3.78588 0.537 7.68107 C ? A ? 84 C 1
   ATOM 1353 O B ALA A 85 ? 10.85159 -23.65847 4.68115 0.537 9.17043 O ? A ? 84 O 1
   ATOM 1354 CB B ALA A 85 ? 11.42058 -25.03418 1.85071 0.537 14.60333 C ? A ? 84 CB 1
   ATOM 1355 N . PHE A 86 ? 12.95587 -23.20788 4.02969 1.000 9.07736 N ? A ? 85 N 1
   ATOM 1356 CA . PHE A 86 ? 13.37736 -23.07477 5.42207 1.000 7.05631 C ? A ? 85 CA 1
   ATOM 1357 C . PHE A 86 ? 12.80518 -21.81099 6.03793 1.000 7.17243 C ? A ? 85 C 1
   ATOM 1358 O . PHE A 86 ? 12.21228 -21.86271 7.11026 1.000 6.90186 O ? A ? 85 O 1
   ATOM 1359 CB . PHE A 86 ? 14.90376 -23.09058 5.49688 1.000 8.48268 C ? A ? 85 CB 1
   ATOM 1360 CG . PHE A 86 ? 15.42996 -22.58456 6.82317 1.000 6.61436 C ? A ? 85 CG 1
   ATOM 1361 CD1 . PHE A 86 ? 15.20247 -23.27125 8.02276 1.000 8.50348 C ? A ? 85 CD1 1
   ATOM 1362 CD2 . PHE A 86 ? 16.17083 -21.40847 6.85820 1.000 6.46158 C ? A ? 85 CD2 1
   ATOM 1363 CE1 . PHE A 86 ? 15.67591 -22.77631 9.22385 1.000 8.30624 C ? A ? 85 CE1 1
   ATOM 1364 CE2 . PHE A 86 ? 16.63394 -20.89684 8.06671 1.000 8.26862 C ? A ? 85 CE2 1
   ATOM 1365 CZ . PHE A 86 ? 16.38517 -21.60169 9.25270 1.000 7.28886 C ? A ? 85 CZ 1
   ATOM 1366 N A GLN A 87 ? 12.97070 -20.66621 5.34318 0.739 7.72674 N ? A ? 86 N 1
   ATOM 1367 CA A GLN A 87 ? 12.42753 -19.43015 5.90139 0.739 10.20676 C ? A ? 86 CA 1
   ATOM 1368 C A GLN A 87 ? 10.90776 -19.45913 5.94894 0.739 10.02206 C ? A ? 86 C 1
   ATOM 1369 O A GLN A 87 ? 10.33622 -18.85096 6.83605 0.739 9.26447 O ? A ? 86 O 1
   ATOM 1370 CB A GLN A 87 ? 12.97510 -18.16189 5.23607 0.739 11.70036 C ? A ? 86 CB 1
   ATOM 1371 CG A GLN A 87 ? 14.45858 -17.91823 5.54189 0.739 10.62431 C ? A ? 86 CG 1
   ATOM 1372 CD A GLN A 87 ? 14.96094 -16.60903 4.98132 0.739 9.80792 C ? A ? 86 CD 1
   ATOM 1373 OE1 A GLN A 87 ? 15.51267 -16.59082 3.89497 0.739 16.75554 O ? A ? 86 OE1 1
   ATOM 1374 NE2 A GLN A 87 ? 14.73372 -15.51965 5.69823 0.739 13.04484 N ? A ? 86 NE2 1
   ATOM 1375 N B GLN A 87 ? 12.91555 -20.66251 5.35784 0.261 7.80180 N ? A ? 86 N 1
   ATOM 1376 CA B GLN A 87 ? 12.43433 -19.40605 5.95054 0.261 10.02673 C ? A ? 86 CA 1
   ATOM 1377 C B GLN A 87 ? 10.91964 -19.42594 6.19353 0.261 4.44081 C ? A ? 86 C 1
   ATOM 1378 O B GLN A 87 ? 10.42721 -18.92963 7.21856 0.261 6.64654 O ? A ? 86 O 1
   ATOM 1379 CB B GLN A 87 ? 12.84163 -18.24398 5.04769 0.261 12.57616 C ? A ? 86 CB 1
   ATOM 1380 CG B GLN A 87 ? 14.34745 -18.03381 4.95948 0.261 8.87570 C ? A ? 86 CG 1
   ATOM 1381 CD B GLN A 87 ? 14.66545 -16.60759 4.56378 0.261 18.48208 C ? A ? 86 CD 1
   ATOM 1382 OE1 B GLN A 87 ? 13.82015 -15.72106 4.67192 0.261 23.83661 O ? A ? 86 OE1 1
   ATOM 1383 NE2 B GLN A 87 ? 15.87396 -16.38160 4.09496 0.261 13.31983 N ? A ? 86 NE2 1
   ATOM 1384 N A ASP A 88 ? 10.24179 -20.16258 5.01801 0.739 9.43243 N ? A ? 87 N 1
   ATOM 1385 CA A ASP A 88 ? 8.79196 -20.35576 5.12948 0.739 7.82611 C ? A ? 87 CA 1
   ATOM 1386 C A ASP A 88 ? 8.44150 -21.12444 6.41383 0.739 7.07386 C ? A ? 87 C 1
   ATOM 1387 O A ASP A 88 ? 7.48417 -20.76760 7.11684 0.739 8.46516 O ? A ? 87 O 1
   ATOM 1388 CB A ASP A 88 ? 8.25180 -21.11549 3.92124 0.739 8.22407 C ? A ? 87 CB 1
   ATOM 1389 CG A ASP A 88 ? 8.32554 -20.31490 2.62362 0.739 9.43520 C ? A ? 87 CG 1
   ATOM 1390 OD1 A ASP A 88 ? 8.46237 -19.07409 2.68025 0.739 10.76093 O ? A ? 87 OD1 1
   ATOM 1391 OD2 A ASP A 88 ? 8.21593 -20.95582 1.56012 0.739 10.09012 O ? A ? 87 OD2 1
   ATOM 1392 N B ASP A 88 ? 10.16992 -20.01165 5.25814 0.261 5.15504 N ? A ? 87 N 1
   ATOM 1393 CA B ASP A 88 ? 8.72662 -20.15846 5.42448 0.261 7.46128 C ? A ? 87 CA 1
   ATOM 1394 C B ASP A 88 ? 8.37734 -21.16806 6.50547 0.261 6.60171 C ? A ? 87 C 1
   ATOM 1395 O B ASP A 88 ? 7.35565 -21.01564 7.18124 0.261 6.61685 O ? A ? 87 O 1
   ATOM 1396 CB B ASP A 88 ? 8.06755 -20.50354 4.09196 0.261 4.59797 C ? A ? 87 CB 1
   ATOM 1397 CG B ASP A 88 ? 7.99843 -19.30633 3.17296 0.261 8.94038 C ? A ? 87 CG 1
   ATOM 1398 OD1 B ASP A 88 ? 8.13159 -18.17017 3.68179 0.261 10.25321 O ? A ? 87 OD1 1
   ATOM 1399 OD2 B ASP A 88 ? 7.81727 -19.51660 1.96017 0.261 10.21656 O ? A ? 87 OD2 1
   ATOM 1400 N . ASN A 89 ? 9.19927 -22.19297 6.71686 1.000 7.53572 N ? A ? 88 N 1
   ATOM 1401 CA . ASN A 89 ? 8.98227 -22.95836 7.94484 1.000 8.38299 C ? A ? 88 CA 1
   ATOM 1402 C . ASN A 89 ? 9.25791 -22.11457 9.18872 1.000 6.61544 C ? A ? 88 C 1
   ATOM 1403 O . ASN A 89 ? 8.58618 -22.28283 10.21210 1.000 8.16739 O ? A ? 88 O 1
   ATOM 1404 CB . ASN A 89 ? 9.73763 -24.26627 7.90830 1.000 8.84451 C ? A ? 88 CB 1
   ATOM 1405 CG . ASN A 89 ? 8.91959 -25.34097 7.22505 1.000 10.29427 C ? A ? 88 CG 1
   ATOM 1406 OD1 . ASN A 89 ? 7.68710 -25.32657 7.28501 1.000 11.71163 O ? A ? 88 OD1 1
   ATOM 1407 ND2 . ASN A 89 ? 9.57567 -26.25064 6.58807 1.000 12.95659 N ? A ? 88 ND2 1
   ATOM 1408 N A ILE A 90 ? 10.21760 -21.19285 9.11954 0.270 7.11154 N ? A ? 89 N 1
   ATOM 1409 CA A ILE A 90 ? 10.42438 -20.28411 10.24474 0.270 7.63303 C ? A ? 89 CA 1
   ATOM 1410 C A ILE A 90 ? 9.18558 -19.42105 10.47135 0.270 8.06811 C ? A ? 89 C 1
   ATOM 1411 O A ILE A 90 ? 8.81939 -19.12597 11.61565 0.270 8.06133 O ? A ? 89 O 1
   ATOM 1412 CB A ILE A 90 ? 11.70357 -19.44493 10.05751 0.270 8.83030 C ? A ? 89 CB 1
   ATOM 1413 CG1 A ILE A 90 ? 12.95227 -20.33892 10.08087 0.270 8.11474 C ? A ? 89 CG1 1
   ATOM 1414 CG2 A ILE A 90 ? 11.80947 -18.38905 11.15036 0.270 9.82965 C ? A ? 89 CG2 1
   ATOM 1415 CD1 A ILE A 90 ? 13.33272 -20.83652 11.47711 0.270 8.79614 C ? A ? 89 CD1 1
   ATOM 1416 N B ILE A 90 ? 10.22864 -21.20192 9.13020 0.353 7.06086 N ? A ? 89 N 1
   ATOM 1417 CA B ILE A 90 ? 10.42831 -20.28293 10.25157 0.353 7.60844 C ? A ? 89 CA 1
   ATOM 1418 C B ILE A 90 ? 9.14616 -19.49928 10.52541 0.353 7.90957 C ? A ? 89 C 1
   ATOM 1419 O B ILE A 90 ? 8.72506 -19.34202 11.68099 0.353 6.57160 O ? A ? 89 O 1
   ATOM 1420 CB B ILE A 90 ? 11.63615 -19.35291 10.00504 0.353 8.48862 C ? A ? 89 CB 1
   ATOM 1421 CG1 B ILE A 90 ? 12.96831 -20.11979 10.06611 0.353 7.47665 C ? A ? 89 CG1 1
   ATOM 1422 CG2 B ILE A 90 ? 11.65167 -18.20903 11.01247 0.353 9.89646 C ? A ? 89 CG2 1
   ATOM 1423 CD1 B ILE A 90 ? 13.40548 -20.47695 11.48838 0.353 7.20341 C ? A ? 89 CD1 1
   ATOM 1424 N C ILE A 90 ? 10.18820 -21.16557 9.07580 0.377 7.20485 N ? A ? 89 N 1
   ATOM 1425 CA C ILE A 90 ? 10.42742 -20.22610 10.16842 0.377 7.58848 C ? A ? 89 CA 1
   ATOM 1426 C C ILE A 90 ? 9.26938 -19.23678 10.31096 0.377 6.86920 C ? A ? 89 C 1
   ATOM 1427 O C ILE A 90 ? 8.89793 -18.86494 11.43007 0.377 7.72817 O ? A ? 89 O 1
   ATOM 1428 CB C ILE A 90 ? 11.79196 -19.52913 10.00441 0.377 9.31552 C ? A ? 89 CB 1
   ATOM 1429 CG1 C ILE A 90 ? 12.94669 -20.53234 10.23995 0.377 7.33488 C ? A ? 89 CG1 1
   ATOM 1430 CG2 C ILE A 90 ? 11.87138 -18.24127 10.85849 0.377 11.54898 C ? A ? 89 CG2 1
   ATOM 1431 CD1 C ILE A 90 ? 13.10120 -21.08086 11.67919 0.377 7.71898 C ? A ? 89 CD1 1
   ATOM 1432 N A VAL A 91 ? 8.50855 -19.01786 9.38816 0.270 8.61977 N ? A ? 90 N 1
   ATOM 1433 CA A VAL A 91 ? 7.26881 -18.25575 9.53731 0.270 8.67963 C ? A ? 90 CA 1
   ATOM 1434 C A VAL A 91 ? 6.22122 -19.07195 10.29039 0.270 7.79088 C ? A ? 90 C 1
   ATOM 1435 O A VAL A 91 ? 5.51645 -18.55271 11.16838 0.270 7.58828 O ? A ? 90 O 1
   ATOM 1436 CB A VAL A 91 ? 6.75014 -17.75824 8.17112 0.270 8.68390 C ? A ? 90 CB 1
   ATOM 1437 CG1 A VAL A 91 ? 5.40772 -17.05681 8.34558 0.270 8.52197 C ? A ? 90 CG1 1
   ATOM 1438 CG2 A VAL A 91 ? 7.74920 -16.80892 7.52955 0.270 9.18101 C ? A ? 90 CG2 1
   ATOM 1439 N B VAL A 91 ? 8.49329 -19.01742 9.45566 0.353 8.55276 N ? A ? 90 N 1
   ATOM 1440 CA B VAL A 91 ? 7.24166 -18.27148 9.59687 0.353 8.73772 C ? A ? 90 CA 1
   ATOM 1441 C B VAL A 91 ? 6.18864 -19.10539 10.32518 0.353 7.81960 C ? A ? 90 C 1
   ATOM 1442 O B VAL A 91 ? 5.48681 -18.60568 11.21792 0.353 6.93879 O ? A ? 90 O 1
   ATOM 1443 CB B VAL A 91 ? 6.73637 -17.76029 8.22805 0.353 8.94674 C ? A ? 90 CB 1
   ATOM 1444 CG1 B VAL A 91 ? 5.33621 -17.17763 8.37769 0.353 8.44012 C ? A ? 90 CG1 1
   ATOM 1445 CG2 B VAL A 91 ? 7.67707 -16.70110 7.64945 0.353 9.11807 C ? A ? 90 CG2 1
   ATOM 1446 N C VAL A 91 ? 8.67459 -18.79206 9.19587 0.377 7.68362 N ? A ? 90 N 1
   ATOM 1447 CA C VAL A 91 ? 7.49052 -17.94183 9.31526 0.377 6.98929 C ? A ? 90 CA 1
   ATOM 1448 C C VAL A 91 ? 6.38868 -18.67347 10.06865 0.377 6.30175 C ? A ? 90 C 1
   ATOM 1449 O C VAL A 91 ? 5.70685 -18.09024 10.92593 0.377 6.71668 O ? A ? 90 O 1
   ATOM 1450 CB C VAL A 91 ? 7.01767 -17.45986 7.93080 0.377 7.18936 C ? A ? 90 CB 1
   ATOM 1451 CG1 C VAL A 91 ? 5.72870 -16.66070 8.05289 0.377 7.59766 C ? A ? 90 CG1 1
   ATOM 1452 CG2 C VAL A 91 ? 8.10345 -16.62592 7.27942 0.377 9.75542 C ? A ? 90 CG2 1
   ATOM 1453 N A LYS A 92 ? 6.11907 -20.36713 9.98072 0.270 7.66507 N ? A ? 91 N 1
   ATOM 1454 CA A LYS A 92 ? 5.13139 -21.21206 10.64635 0.270 8.65946 C ? A ? 91 CA 1
   ATOM 1455 C A LYS A 92 ? 5.45799 -21.39476 12.12449 0.270 7.23613 C ? A ? 91 C 1
   ATOM 1456 O A LYS A 92 ? 4.55929 -21.36755 12.97090 0.270 7.56277 O ? A ? 91 O 1
   ATOM 1457 CB A LYS A 92 ? 5.03522 -22.55763 9.93763 0.270 7.85520 C ? A ? 91 CB 1
   ATOM 1458 CG A LYS A 92 ? 3.89447 -23.44102 10.40301 0.270 8.39258 C ? A ? 91 CG 1
   ATOM 1459 CD A LYS A 92 ? 3.65224 -24.49642 9.34541 0.270 17.59770 C ? A ? 91 CD 1
   ATOM 1460 CE A LYS A 92 ? 4.94401 -25.24228 9.02997 0.270 19.69861 C ? A ? 91 CE 1
   ATOM 1461 NZ A LYS A 92 ? 4.91346 -25.87635 7.69040 0.270 22.69016 N ? A ? 91 NZ 1
   ATOM 1462 N B LYS A 92 ? 6.07028 -20.38948 9.97419 0.353 7.56323 N ? A ? 91 N 1
   ATOM 1463 CA B LYS A 92 ? 5.11706 -21.25303 10.66676 0.353 8.63435 C ? A ? 91 CA 1
   ATOM 1464 C B LYS A 92 ? 5.46318 -21.37658 12.14412 0.353 7.25384 C ? A ? 91 C 1
   ATOM 1465 O B LYS A 92 ? 4.57463 -21.44270 12.99653 0.353 7.17510 O ? A ? 91 O 1
   ATOM 1466 CB B LYS A 92 ? 5.06071 -22.62906 10.00500 0.353 7.69301 C ? A ? 91 CB 1
   ATOM 1467 CG B LYS A 92 ? 4.24090 -22.66466 8.72615 0.353 7.73531 C ? A ? 91 CG 1
   ATOM 1468 CD B LYS A 92 ? 4.54893 -23.94282 7.96111 0.353 8.01466 C ? A ? 91 CD 1
   ATOM 1469 CE B LYS A 92 ? 4.51356 -25.18568 8.81924 0.353 15.48181 C ? A ? 91 CE 1
   ATOM 1470 NZ B LYS A 92 ? 3.14413 -25.31365 9.33489 0.353 25.24289 N ? A ? 91 NZ 1
   ATOM 1471 N C LYS A 92 ? 6.20407 -19.95998 9.75186 0.377 6.84512 N ? A ? 91 N 1
   ATOM 1472 CA C LYS A 92 ? 5.20988 -20.79101 10.42062 0.377 4.94635 C ? A ? 91 CA 1
   ATOM 1473 C C LYS A 92 ? 5.53559 -20.97097 11.90097 0.377 7.32482 C ? A ? 91 C 1
   ATOM 1474 O C LYS A 92 ? 4.63451 -20.97779 12.74280 0.377 7.01440 O ? A ? 91 O 1
   ATOM 1475 CB C LYS A 92 ? 5.09161 -22.13835 9.68648 0.377 5.45759 C ? A ? 91 CB 1
   ATOM 1476 CG C LYS A 92 ? 4.13527 -23.12753 10.34584 0.377 9.44425 C ? A ? 91 CG 1
   ATOM 1477 CD C LYS A 92 ? 3.41166 -24.10171 9.40418 0.377 15.96973 C ? A ? 91 CD 1
   ATOM 1478 CE C LYS A 92 ? 4.32665 -24.88483 8.45842 0.377 7.11860 C ? A ? 91 CE 1
   ATOM 1479 NZ C LYS A 92 ? 5.49279 -25.58325 9.07012 0.377 7.54875 N ? A ? 91 NZ 1
   ATOM 1480 N A LEU A 93 ? 6.73677 -21.58513 12.45261 0.270 7.70751 N ? A ? 92 N 1
   ATOM 1481 CA A LEU A 93 ? 7.15133 -21.65436 13.85076 0.270 6.59362 C ? A ? 92 CA 1
   ATOM 1482 C A LEU A 93 ? 6.85470 -20.34387 14.57822 0.270 7.86585 C ? A ? 92 C 1
   ATOM 1483 O A LEU A 93 ? 6.38616 -20.34824 15.72337 0.270 7.63078 O ? A ? 92 O 1
   ATOM 1484 CB A LEU A 93 ? 8.64020 -21.99719 13.89424 0.270 6.13999 C ? A ? 92 CB 1
   ATOM 1485 CG A LEU A 93 ? 9.28204 -21.99825 15.27933 0.270 8.06579 C ? A ? 92 CG 1
   ATOM 1486 CD1 A LEU A 93 ? 8.80849 -23.21257 16.04282 0.270 9.85960 C ? A ? 92 CD1 1
   ATOM 1487 CD2 A LEU A 93 ? 10.80227 -21.96147 15.14275 0.270 8.74186 C ? A ? 92 CD2 1
   ATOM 1488 N B LEU A 93 ? 6.75650 -21.42630 12.46228 0.353 8.45483 N ? A ? 92 N 1
   ATOM 1489 CA B LEU A 93 ? 7.19263 -21.49966 13.85357 0.353 5.93139 C ? A ? 92 CA 1
   ATOM 1490 C B LEU A 93 ? 6.83104 -20.22833 14.62259 0.353 7.38413 C ? A ? 92 C 1
   ATOM 1491 O B LEU A 93 ? 6.31911 -20.29682 15.74707 0.353 7.27147 O ? A ? 92 O 1
   ATOM 1492 CB B LEU A 93 ? 8.69536 -21.76340 13.86911 0.353 8.36027 C ? A ? 92 CB 1
   ATOM 1493 CG B LEU A 93 ? 9.31466 -21.96775 15.24959 0.353 8.12767 C ? A ? 92 CG 1
   ATOM 1494 CD1 B LEU A 93 ? 8.82423 -23.27833 15.87069 0.353 9.20914 C ? A ? 92 CD1 1
   ATOM 1495 CD2 B LEU A 93 ? 10.83801 -21.92437 15.10555 0.353 8.46830 C ? A ? 92 CD2 1
   ATOM 1496 N C LEU A 93 ? 6.83048 -21.07499 12.24496 0.377 6.45607 N ? A ? 92 N 1
   ATOM 1497 CA C LEU A 93 ? 7.21757 -21.17264 13.65682 0.377 7.28697 C ? A ? 92 CA 1
   ATOM 1498 C C LEU A 93 ? 6.96439 -19.85883 14.39971 0.377 4.89184 C ? A ? 92 C 1
   ATOM 1499 O C LEU A 93 ? 6.50895 -19.86352 15.54980 0.377 6.71064 O ? A ? 92 O 1
   ATOM 1500 CB C LEU A 93 ? 8.68073 -21.63614 13.76902 0.377 7.53760 C ? A ? 92 CB 1
   ATOM 1501 CG C LEU A 93 ? 9.21719 -21.95098 15.18487 0.377 8.19285 C ? A ? 92 CG 1
   ATOM 1502 CD1 C LEU A 93 ? 8.42805 -23.03995 15.90456 0.377 9.89275 C ? A ? 92 CD1 1
   ATOM 1503 CD2 C LEU A 93 ? 10.68906 -22.34246 15.12819 0.377 8.28684 C ? A ? 92 CD2 1
   ATOM 1504 N A SER A 94 ? 7.08368 -19.21327 13.90262 0.270 7.24726 N ? A ? 93 N 1
   ATOM 1505 CA A SER A 94 ? 6.75215 -17.90933 14.46598 0.270 8.36257 C ? A ? 93 CA 1
   ATOM 1506 C A SER A 94 ? 5.25702 -17.78138 14.73191 0.270 6.95518 C ? A ? 93 C 1
   ATOM 1507 O A SER A 94 ? 4.84635 -17.16276 15.71767 0.270 7.50776 O ? A ? 93 O 1
   ATOM 1508 CB A SER A 94 ? 7.22243 -16.80414 13.52059 0.270 7.13806 C ? A ? 93 CB 1
   ATOM 1509 OG A SER A 94 ? 6.86354 -15.52731 14.01190 0.270 13.34493 O ? A ? 93 OG 1
   ATOM 1510 N B SER A 94 ? 7.06274 -19.06709 14.00686 0.353 6.44629 N ? A ? 93 N 1
   ATOM 1511 CA B SER A 94 ? 6.68334 -17.79420 14.60640 0.353 9.44407 C ? A ? 93 CA 1
   ATOM 1512 C B SER A 94 ? 5.18226 -17.73521 14.86081 0.353 5.89330 C ? A ? 93 C 1
   ATOM 1513 O B SER A 94 ? 4.73969 -17.29887 15.92462 0.353 6.47631 O ? A ? 93 O 1
   ATOM 1514 CB B SER A 94 ? 7.11913 -16.64765 13.69012 0.353 7.79236 C ? A ? 93 CB 1
   ATOM 1515 OG B SER A 94 ? 8.51973 -16.66515 13.46738 0.353 7.04938 O ? A ? 93 OG 1
   ATOM 1516 N C SER A 94 ? 7.22998 -18.72810 13.73790 0.377 7.51443 N ? A ? 93 N 1
   ATOM 1517 CA C SER A 94 ? 6.86774 -17.44111 14.31002 0.377 4.78150 C ? A ? 93 CA 1
   ATOM 1518 C C SER A 94 ? 5.36699 -17.35723 14.54909 0.377 6.63598 C ? A ? 93 C 1
   ATOM 1519 O C SER A 94 ? 4.93278 -16.87243 15.60065 0.377 6.88145 O ? A ? 93 O 1
   ATOM 1520 CB C SER A 94 ? 7.32294 -16.30524 13.40519 0.377 7.70615 C ? A ? 93 CB 1
   ATOM 1521 OG C SER A 94 ? 8.73798 -16.22050 13.36209 0.377 6.37480 O ? A ? 93 OG 1
   ATOM 1522 N A ALA A 95 ? 4.42562 -18.33958 13.84962 0.270 8.17490 N ? A ? 94 N 1
   ATOM 1523 CA A ALA A 95 ? 2.98187 -18.31045 14.06312 0.270 6.45150 C ? A ? 94 CA 1
   ATOM 1524 C A ALA A 95 ? 2.59185 -19.14673 15.27109 0.270 7.04737 C ? A ? 94 C 1
   ATOM 1525 O A ALA A 95 ? 1.71993 -18.75434 16.05191 0.270 7.58184 O ? A ? 94 O 1
   ATOM 1526 CB A ALA A 95 ? 2.25050 -18.79336 12.80792 0.270 8.32421 C ? A ? 94 CB 1
   ATOM 1527 N B ALA A 95 ? 4.37783 -18.15327 13.88068 0.353 7.93934 N ? A ? 94 N 1
   ATOM 1528 CA B ALA A 95 ? 2.93049 -18.12349 14.06685 0.353 8.29450 C ? A ? 94 CA 1
   ATOM 1529 C B ALA A 95 ? 2.51630 -18.98300 15.25204 0.353 7.51763 C ? A ? 94 C 1
   ATOM 1530 O B ALA A 95 ? 1.68014 -18.58032 16.06615 0.353 9.22050 O ? A ? 94 O 1
   ATOM 1531 CB B ALA A 95 ? 2.21896 -18.56794 12.78642 0.353 8.72818 C ? A ? 94 CB 1
   ATOM 1532 N C ALA A 95 ? 4.55209 -17.81777 13.59220 0.377 5.33022 N ? A ? 94 N 1
   ATOM 1533 CA C ALA A 95 ? 3.10746 -17.76939 13.79758 0.377 5.34447 C ? A ? 94 CA 1
   ATOM 1534 C C ALA A 95 ? 2.69083 -18.59281 15.01314 0.377 6.22841 C ? A ? 94 C 1
   ATOM 1535 O C ALA A 95 ? 1.87849 -18.14144 15.82736 0.377 6.32406 O ? A ? 94 O 1
   ATOM 1536 CB C ALA A 95 ? 2.37301 -18.22083 12.53683 0.377 7.75593 C ? A ? 94 CB 1
   ATOM 1537 N A ALA A 96 ? 3.21651 -20.31019 15.43027 0.270 8.05342 N ? A ? 95 N 1
   ATOM 1538 CA A ALA A 96 ? 2.94913 -21.13108 16.60260 0.270 8.99341 C ? A ? 95 CA 1
   ATOM 1539 C A ALA A 96 ? 3.34701 -20.39938 17.87668 0.270 7.89424 C ? A ? 95 C 1
   ATOM 1540 O A ALA A 96 ? 2.62459 -20.43538 18.87794 0.270 8.87756 O ? A ? 95 O 1
   ATOM 1541 CB A ALA A 96 ? 3.71686 -22.44386 16.48645 0.270 6.95145 C ? A ? 95 CB 1
   ATOM 1542 N B ALA A 96 ? 3.10573 -20.16685 15.37388 0.353 7.17039 N ? A ? 95 N 1
   ATOM 1543 CA B ALA A 96 ? 2.75061 -21.05174 16.47393 0.353 8.35175 C ? A ? 95 CA 1
   ATOM 1544 C B ALA A 96 ? 3.18339 -20.46910 17.81200 0.353 7.77568 C ? A ? 95 C 1
   ATOM 1545 O B ALA A 96 ? 2.42737 -20.51241 18.78569 0.353 8.71478 O ? A ? 95 O 1
   ATOM 1546 CB B ALA A 96 ? 3.38234 -22.41671 16.25032 0.353 10.10477 C ? A ? 95 CB 1
   ATOM 1547 N C ALA A 96 ? 3.23699 -19.80536 15.15139 0.377 6.74489 N ? A ? 95 N 1
   ATOM 1548 CA C ALA A 96 ? 2.87678 -20.67045 16.27333 0.377 7.43146 C ? A ? 95 CA 1
   ATOM 1549 C C ALA A 96 ? 3.28571 -20.04028 17.60116 0.377 6.31173 C ? A ? 95 C 1
   ATOM 1550 O C ALA A 96 ? 2.52055 -20.04387 18.57767 0.377 7.23102 O ? A ? 95 O 1
   ATOM 1551 CB C ALA A 96 ? 3.56209 -22.02519 16.10679 0.377 8.57569 C ? A ? 95 CB 1
   ATOM 1552 N A ALA A 97 ? 4.48063 -19.69906 17.84039 0.270 7.22605 N ? A ? 96 N 1
   ATOM 1553 CA A ALA A 97 ? 4.97801 -19.00479 19.02236 0.270 8.32389 C ? A ? 96 CA 1
   ATOM 1554 C A ALA A 97 ? 4.16494 -17.74846 19.31842 0.270 7.86903 C ? A ? 96 C 1
   ATOM 1555 O A ALA A 97 ? 3.86112 -17.45438 20.48420 0.270 7.79156 O ? A ? 96 O 1
   ATOM 1556 CB A ALA A 97 ? 6.45223 -18.65666 18.82145 0.270 8.95930 C ? A ? 96 CB 1
   ATOM 1557 N B ALA A 97 ? 4.38834 -19.89740 17.86644 0.353 7.52907 N ? A ? 96 N 1
   ATOM 1558 CA B ALA A 97 ? 4.86856 -19.24964 19.07898 0.353 7.52118 C ? A ? 96 CA 1
   ATOM 1559 C B ALA A 97 ? 3.99443 -18.05589 19.44479 0.353 7.11807 C ? A ? 96 C 1
   ATOM 1560 O B ALA A 97 ? 3.66910 -17.85050 20.62248 0.353 8.40035 O ? A ? 96 O 1
   ATOM 1561 CB B ALA A 97 ? 6.31386 -18.80476 18.86732 0.353 8.36643 C ? A ? 96 CB 1
   ATOM 1562 N C ALA A 97 ? 4.51350 -19.51866 17.65558 0.377 6.52107 N ? A ? 96 N 1
   ATOM 1563 CA C ALA A 97 ? 5.02992 -18.93666 18.88693 0.377 6.69512 C ? A ? 96 CA 1
   ATOM 1564 C C ALA A 97 ? 4.25676 -17.67951 19.26339 0.377 7.87823 C ? A ? 96 C 1
   ATOM 1565 O C ALA A 97 ? 3.97492 -17.43776 20.44839 0.377 8.21624 O ? A ? 96 O 1
   ATOM 1566 CB C ALA A 97 ? 6.51743 -18.63336 18.71505 0.377 8.45140 C ? A ? 96 CB 1
   ATOM 1567 N A ASP A 98 ? 3.80035 -16.99413 18.27848 0.270 8.66898 N ? A ? 97 N 1
   ATOM 1568 CA A ASP A 98 ? 3.01187 -15.78256 18.47971 0.270 9.40603 C ? A ? 97 CA 1
   ATOM 1569 C A ASP A 98 ? 1.59001 -16.09974 18.92798 0.270 7.33271 C ? A ? 97 C 1
   ATOM 1570 O A ASP A 98 ? 0.94794 -15.27017 19.58613 0.270 8.12100 O ? A ? 97 O 1
   ATOM 1571 CB A ASP A 98 ? 2.99138 -14.95958 17.19120 0.270 8.39841 C ? A ? 97 CB 1
   ATOM 1572 CG A ASP A 98 ? 4.34095 -14.35572 16.85299 0.270 9.55455 C ? A ? 97 CG 1
   ATOM 1573 OD1 A ASP A 98 ? 5.23266 -14.36622 17.72394 0.270 9.96843 O ? A ? 97 OD1 1
   ATOM 1574 OD2 A ASP A 98 ? 4.50599 -13.86319 15.71837 0.270 10.91072 O ? A ? 97 OD2 1
   ATOM 1575 N B ASP A 98 ? 3.58131 -17.26610 18.44544 0.353 8.14695 N ? A ? 97 N 1
   ATOM 1576 CA B ASP A 98 ? 2.67844 -16.15079 18.71340 0.353 9.58726 C ? A ? 97 CA 1
   ATOM 1577 C B ASP A 98 ? 1.32283 -16.64963 19.18589 0.353 9.73268 C ? A ? 97 C 1
   ATOM 1578 O B ASP A 98 ? 0.63609 -15.95967 19.95507 0.353 12.30323 O ? A ? 97 O 1
   ATOM 1579 CB B ASP A 98 ? 2.50514 -15.27998 17.46916 0.353 10.88531 C ? A ? 97 CB 1
   ATOM 1580 CG B ASP A 98 ? 3.78711 -14.58447 17.05637 0.353 10.55139 C ? A ? 97 CG 1
   ATOM 1581 OD1 B ASP A 98 ? 4.76120 -14.62347 17.84483 0.353 11.88683 O ? A ? 97 OD1 1
   ATOM 1582 OD2 B ASP A 98 ? 3.82836 -14.00987 15.93921 0.353 15.27379 O ? A ? 97 OD2 1
   ATOM 1583 N C ASP A 98 ? 3.90564 -16.86800 18.26239 0.377 7.46648 N ? A ? 97 N 1
   ATOM 1584 CA C ASP A 98 ? 3.06620 -15.70787 18.51716 0.377 9.49862 C ? A ? 97 CA 1
   ATOM 1585 C C ASP A 98 ? 1.69849 -16.12354 19.05323 0.377 7.81234 C ? A ? 97 C 1
   ATOM 1586 O C ASP A 98 ? 1.14447 -15.45529 19.93455 0.377 10.21813 O ? A ? 97 O 1
   ATOM 1587 CB C ASP A 98 ? 2.92027 -14.89241 17.23233 0.377 8.90181 C ? A ? 97 CB 1
   ATOM 1588 CG C ASP A 98 ? 4.21198 -14.20562 16.80910 0.377 7.72872 C ? A ? 97 CG 1
   ATOM 1589 OD1 C ASP A 98 ? 5.20635 -14.24601 17.56692 0.377 8.60927 O ? A ? 97 OD1 1
   ATOM 1590 OD2 C ASP A 98 ? 4.21643 -13.60915 15.70938 0.377 9.30373 O ? A ? 97 OD2 1
   ATOM 1591 N A ALA A 99 ? 1.08121 -17.27989 18.59080 0.270 9.33176 N ? A ? 98 N 1
   ATOM 1592 CA A ALA A 99 ? -0.24885 -17.71312 19.00166 0.270 10.75155 C ? A ? 98 CA 1
   ATOM 1593 C A ALA A 99 ? -0.25672 -18.39737 20.36300 0.270 9.92830 C ? A ? 98 C 1
   ATOM 1594 O A ALA A 99 ? -1.33759 -18.70364 20.87938 0.270 6.89569 O ? A ? 98 O 1
   ATOM 1595 CB A ALA A 99 ? -0.85299 -18.65426 17.95005 0.270 12.73715 C ? A ? 98 CB 1
   ATOM 1596 N B ALA A 99 ? 0.92994 -17.84805 18.75744 0.353 10.65275 N ? A ? 98 N 1
   ATOM 1597 CA B ALA A 99 ? -0.32184 -18.41567 19.22957 0.353 12.46012 C ? A ? 98 CA 1
   ATOM 1598 C B ALA A 99 ? -0.22738 -18.89240 20.66709 0.353 9.89342 C ? A ? 98 C 1
   ATOM 1599 O B ALA A 99 ? -1.26459 -19.04515 21.32041 0.353 12.25283 O ? A ? 98 O 1
   ATOM 1600 CB B ALA A 99 ? -0.75796 -19.55881 18.32201 0.353 11.76380 C ? A ? 98 CB 1
   ATOM 1601 N C ALA A 99 ? 1.14704 -17.23236 18.54696 0.377 9.31263 N ? A ? 98 N 1
   ATOM 1602 CA C ALA A 99 ? -0.15807 -17.71600 18.99924 0.377 11.10816 C ? A ? 98 CA 1
   ATOM 1603 C C ALA A 99 ? -0.10872 -18.24179 20.43019 0.377 10.17724 C ? A ? 98 C 1
   ATOM 1604 O C ALA A 99 ? -1.12876 -18.22354 21.13044 0.377 11.75903 O ? A ? 98 O 1
   ATOM 1605 CB C ALA A 99 ? -0.67426 -18.79995 18.04520 0.377 13.28717 C ? A ? 98 CB 1
   ATOM 1606 N A GLY A 100 ? 0.91297 -18.62602 20.96437 0.270 9.33972 N ? A ? 99 N 1
   ATOM 1607 CA A GLY A 100 ? 0.97825 -19.36341 22.21388 0.270 10.98228 C ? A ? 99 CA 1
   ATOM 1608 C A GLY A 100 ? 0.45335 -20.77798 22.11565 0.270 10.80601 C ? A ? 99 C 1
   ATOM 1609 O A GLY A 100 ? -0.03409 -21.33050 23.10835 0.270 6.86498 O ? A ? 99 O 1
   ATOM 1610 N B GLY A 100 ? 0.97865 -19.10312 21.18096 0.353 10.24777 N ? A ? 99 N 1
   ATOM 1611 CA B GLY A 100 ? 1.11815 -19.59262 22.53721 0.353 10.45070 C ? A ? 99 CA 1
   ATOM 1612 C B GLY A 100 ? 0.62206 -21.00340 22.70837 0.353 11.48851 C ? A ? 99 C 1
   ATOM 1613 O B GLY A 100 ? 0.21411 -21.38371 23.80692 0.353 8.57011 O ? A ? 99 O 1
   ATOM 1614 N C GLY A 100 ? 1.05630 -18.69866 20.89215 0.377 9.22574 N ? A ? 99 N 1
   ATOM 1615 CA C GLY A 100 ? 1.19262 -19.29516 22.20693 0.377 10.73457 C ? A ? 99 CA 1
   ATOM 1616 C C GLY A 100 ? 0.54882 -20.66265 22.35978 0.377 9.50343 C ? A ? 99 C 1
   ATOM 1617 O C GLY A 100 ? -0.27116 -20.86513 23.25788 0.377 17.89557 O ? A ? 99 O 1
   ATOM 1618 N A ASP A 101 ? 0.56526 -21.39363 20.95008 0.270 6.43346 N ? A ? 100 N 1
   ATOM 1619 CA A ASP A 101 ? -0.02222 -22.70311 20.71402 0.270 8.49323 C ? A ? 100 CA 1
   ATOM 1620 C A ASP A 101 ? 1.09794 -23.73494 20.70283 0.270 10.21037 C ? A ? 100 C 1
   ATOM 1621 O A ASP A 101 ? 1.84372 -23.85908 19.72861 0.270 6.09924 O ? A ? 100 O 1
   ATOM 1622 CB A ASP A 101 ? -0.77505 -22.70518 19.38671 0.270 11.52495 C ? A ? 100 CB 1
   ATOM 1623 CG A ASP A 101 ? -1.60055 -23.96281 19.18499 0.270 8.87569 C ? A ? 100 CG 1
   ATOM 1624 OD1 A ASP A 101 ? -1.12602 -25.07068 19.49806 0.270 15.91292 O ? A ? 100 OD1 1
   ATOM 1625 OD2 A ASP A 101 ? -2.72985 -23.82987 18.67988 0.270 16.71983 O ? A ? 100 OD2 1
   ATOM 1626 N B ASP A 101 ? 0.66020 -21.80064 21.64603 0.353 13.44272 N ? A ? 100 N 1
   ATOM 1627 CA B ASP A 101 ? 0.05821 -23.12656 21.62653 0.353 14.61303 C ? A ? 100 CA 1
   ATOM 1628 C B ASP A 101 ? 1.15951 -24.15063 21.38388 0.353 13.24305 C ? A ? 100 C 1
   ATOM 1629 O B ASP A 101 ? 1.75860 -24.18588 20.30019 0.353 13.68911 O ? A ? 100 O 1
   ATOM 1630 CB B ASP A 101 ? -1.03360 -23.18865 20.55932 0.353 16.99164 C ? A ? 100 CB 1
   ATOM 1631 CG B ASP A 101 ? -1.60044 -24.57158 20.38087 0.353 18.08176 C ? A ? 100 CG 1
   ATOM 1632 OD1 B ASP A 101 ? -1.05338 -25.32799 19.55619 0.353 18.69252 O ? A ? 100 OD1 1
   ATOM 1633 OD2 B ASP A 101 ? -2.59310 -24.90184 21.06692 0.353 28.02173 O ? A ? 100 OD2 1
   ATOM 1634 N C ASP A 101 ? 0.92349 -21.62213 21.50940 0.377 10.96574 N ? A ? 100 N 1
   ATOM 1635 CA C ASP A 101 ? 0.31262 -22.95481 21.49142 0.377 13.03085 C ? A ? 100 CA 1
   ATOM 1636 C C ASP A 101 ? 1.42537 -24.00191 21.42446 0.377 13.56173 C ? A ? 100 C 1
   ATOM 1637 O C ASP A 101 ? 2.08299 -24.13854 20.38828 0.377 10.05786 O ? A ? 100 O 1
   ATOM 1638 CB C ASP A 101 ? -0.63120 -23.08468 20.28363 0.377 14.30989 C ? A ? 100 CB 1
   ATOM 1639 CG C ASP A 101 ? -1.44034 -24.39631 20.27259 0.377 16.76458 C ? A ? 100 CG 1
   ATOM 1640 OD1 C ASP A 101 ? -0.86759 -25.49067 20.47780 0.377 11.08432 O ? A ? 100 OD1 1
   ATOM 1641 OD2 C ASP A 101 ? -2.66925 -24.33627 20.01917 0.377 16.88114 O ? A ? 100 OD2 1
   ATOM 1642 N A LEU A 102 ? 1.17841 -24.50957 21.79189 0.270 6.54248 N ? A ? 101 N 1
   ATOM 1643 CA A LEU A 102 ? 2.26670 -25.46021 21.97487 0.270 7.99525 C ? A ? 101 CA 1
   ATOM 1644 C A LEU A 102 ? 2.17714 -26.61627 20.98638 0.270 10.85817 C ? A ? 101 C 1
   ATOM 1645 O A LEU A 102 ? 3.19822 -27.06637 20.45566 0.270 7.56573 O ? A ? 101 O 1
   ATOM 1646 CB A LEU A 102 ? 2.26801 -25.95894 23.42516 0.270 13.85351 C ? A ? 101 CB 1
   ATOM 1647 CG A LEU A 102 ? 3.35530 -26.93919 23.87423 0.270 11.78042 C ? A ? 101 CG 1
   ATOM 1648 CD1 A LEU A 102 ? 4.73151 -26.32484 23.71380 0.270 14.56619 C ? A ? 101 CD1 1
   ATOM 1649 CD2 A LEU A 102 ? 3.14385 -27.38421 25.31177 0.270 13.84893 C ? A ? 101 CD2 1
   ATOM 1650 N B LEU A 102 ? 1.42613 -24.98090 22.39253 0.353 14.61473 N ? A ? 101 N 1
   ATOM 1651 CA B LEU A 102 ? 2.54541 -25.91648 22.33792 0.353 12.66828 C ? A ? 101 CA 1
   ATOM 1652 C B LEU A 102 ? 2.37625 -26.98476 21.25841 0.353 13.78551 C ? A ? 101 C 1
   ATOM 1653 O B LEU A 102 ? 3.38647 -27.53236 20.79853 0.353 12.29609 O ? A ? 101 O 1
   ATOM 1654 CB B LEU A 102 ? 2.80071 -26.52990 23.72587 0.353 13.46664 C ? A ? 101 CB 1
   ATOM 1655 CG B LEU A 102 ? 4.11495 -27.28282 23.97099 0.353 11.51751 C ? A ? 101 CG 1
   ATOM 1656 CD1 B LEU A 102 ? 5.32005 -26.49683 23.47953 0.353 15.01575 C ? A ? 101 CD1 1
   ATOM 1657 CD2 B LEU A 102 ? 4.24955 -27.60643 25.45363 0.353 15.04224 C ? A ? 101 CD2 1
   ATOM 1658 N C LEU A 102 ? 1.62244 -24.76542 22.50572 0.377 11.56653 N ? A ? 101 N 1
   ATOM 1659 CA C LEU A 102 ? 2.72514 -25.73144 22.54505 0.377 12.15281 C ? A ? 101 CA 1
   ATOM 1660 C C LEU A 102 ? 2.55571 -26.84368 21.51475 0.377 9.36727 C ? A ? 101 C 1
   ATOM 1661 O C LEU A 102 ? 3.54188 -27.28967 20.91391 0.377 8.95660 O ? A ? 101 O 1
   ATOM 1662 CB C LEU A 102 ? 2.89269 -26.32004 23.94877 0.377 10.56836 C ? A ? 101 CB 1
   ATOM 1663 CG C LEU A 102 ? 4.00080 -27.36820 24.11568 0.377 13.60508 C ? A ? 101 CG 1
   ATOM 1664 CD1 C LEU A 102 ? 5.38089 -26.79086 23.82899 0.377 10.96751 C ? A ? 101 CD1 1
   ATOM 1665 CD2 C LEU A 102 ? 3.95390 -27.96182 25.50972 0.377 13.85595 C ? A ? 101 CD2 1
   ATOM 1666 N A ASP A 103 ? 0.97663 -27.12492 20.71861 0.270 13.73694 N ? A ? 102 N 1
   ATOM 1667 CA A ASP A 103 ? 0.88558 -28.23146 19.77317 0.270 13.73572 C ? A ? 102 CA 1
   ATOM 1668 C A ASP A 103 ? 1.32741 -27.79869 18.38556 0.270 15.29662 C ? A ? 102 C 1
   ATOM 1669 O A ASP A 103 ? 2.05965 -28.52232 17.70303 0.270 11.54499 O ? A ? 102 O 1
   ATOM 1670 CB A ASP A 103 ? -0.52008 -28.83021 19.76714 0.270 14.80518 C ? A ? 102 CB 1
   ATOM 1671 CG A ASP A 103 ? -0.74754 -29.77123 20.93134 0.270 16.14040 C ? A ? 102 CG 1
   ATOM 1672 OD1 A ASP A 103 ? -0.01167 -30.77179 21.05500 0.270 19.30291 O ? A ? 102 OD1 1
   ATOM 1673 OD2 A ASP A 103 ? -1.64763 -29.49528 21.74148 0.270 24.37833 O ? A ? 102 OD2 1
   ATOM 1674 N B ASP A 103 ? 1.14098 -27.28606 20.82912 0.353 15.52981 N ? A ? 102 N 1
   ATOM 1675 CA B ASP A 103 ? 0.93566 -28.28989 19.77985 0.353 13.31036 C ? A ? 102 CA 1
   ATOM 1676 C B ASP A 103 ? 1.36440 -27.76487 18.41525 0.353 15.16448 C ? A ? 102 C 1
   ATOM 1677 O B ASP A 103 ? 2.07298 -28.44731 17.66832 0.353 10.13656 O ? A ? 102 O 1
   ATOM 1678 CB B ASP A 103 ? -0.53128 -28.73512 19.71970 0.353 13.67260 C ? A ? 102 CB 1
   ATOM 1679 CG B ASP A 103 ? -0.93562 -29.60549 20.89154 0.353 17.85066 C ? A ? 102 CG 1
   ATOM 1680 OD1 B ASP A 103 ? -0.05679 -30.21852 21.52528 0.353 19.11187 O ? A ? 102 OD1 1
   ATOM 1681 OD2 B ASP A 103 ? -2.14997 -29.67318 21.17719 0.353 26.37928 O ? A ? 102 OD2 1
   ATOM 1682 N C ASP A 103 ? 1.32210 -27.33093 21.32861 0.377 10.43056 N ? A ? 102 N 1
   ATOM 1683 CA C ASP A 103 ? 1.07072 -28.35085 20.31412 0.377 13.58766 C ? A ? 102 CA 1
   ATOM 1684 C C ASP A 103 ? 1.43529 -27.84816 18.91950 0.377 10.31694 C ? A ? 102 C 1
   ATOM 1685 O C ASP A 103 ? 2.08165 -28.56505 18.14548 0.377 16.14787 O ? A ? 102 O 1
   ATOM 1686 CB C ASP A 103 ? -0.39758 -28.78658 20.36487 0.377 20.55801 C ? A ? 102 CB 1
   ATOM 1687 CG C ASP A 103 ? -0.59781 -30.23193 19.93808 0.377 24.36182 C ? A ? 102 CG 1
   ATOM 1688 OD1 C ASP A 103 ? 0.35448 -31.02988 20.06839 0.377 21.74552 O ? A ? 102 OD1 1
   ATOM 1689 OD2 C ASP A 103 ? -1.70546 -30.57273 19.46881 0.377 27.72111 O ? A ? 102 OD2 1
   ATOM 1690 N A LYS A 104 ? 0.92744 -26.60456 17.95869 0.270 13.62760 N ? A ? 103 N 1
   ATOM 1691 CA A LYS A 104 ? 1.47803 -26.08762 16.71465 0.270 14.25759 C ? A ? 103 CA 1
   ATOM 1692 C A LYS A 104 ? 2.96488 -25.78427 16.82906 0.270 11.17313 C ? A ? 103 C 1
   ATOM 1693 O A LYS A 104 ? 3.65270 -25.75030 15.80157 0.270 9.61634 O ? A ? 103 O 1
   ATOM 1694 CB A LYS A 104 ? 0.70188 -24.85482 16.26641 0.270 16.51614 C ? A ? 103 CB 1
   ATOM 1695 CG A LYS A 104 ? -0.76942 -25.12869 16.03721 0.270 18.13768 C ? A ? 103 CG 1
   ATOM 1696 CD A LYS A 104 ? -1.53346 -23.83701 15.88797 0.270 24.11094 C ? A ? 103 CD 1
   ATOM 1697 CE A LYS A 104 ? -2.98756 -24.09928 15.50227 0.270 27.83000 C ? A ? 103 CE 1
   ATOM 1698 NZ A LYS A 104 ? -3.08230 -25.19715 14.49264 0.270 27.51639 N ? A ? 103 NZ 1
   ATOM 1699 N B LYS A 104 ? 0.91143 -26.57055 18.04778 0.353 13.50127 N ? A ? 103 N 1
   ATOM 1700 CA B LYS A 104 ? 1.34693 -26.01817 16.77443 0.353 14.10179 C ? A ? 103 CA 1
   ATOM 1701 C B LYS A 104 ? 2.84839 -25.80028 16.77315 0.353 10.33354 C ? A ? 103 C 1
   ATOM 1702 O B LYS A 104 ? 3.54037 -26.17550 15.82185 0.353 10.50317 O ? A ? 103 O 1
   ATOM 1703 CB B LYS A 104 ? 0.61119 -24.71778 16.49776 0.353 16.95232 C ? A ? 103 CB 1
   ATOM 1704 CG B LYS A 104 ? -0.88158 -24.90040 16.36858 0.353 19.88046 C ? A ? 103 CG 1
   ATOM 1705 CD B LYS A 104 ? -1.53639 -23.55987 16.15685 0.353 24.31293 C ? A ? 103 CD 1
   ATOM 1706 CE B LYS A 104 ? -3.01881 -23.70313 15.84482 0.353 30.04665 C ? A ? 103 CE 1
   ATOM 1707 NZ B LYS A 104 ? -3.28422 -24.81496 14.86479 0.353 29.48403 N ? A ? 103 NZ 1
   ATOM 1708 N C LYS A 104 ? 1.01756 -26.62319 18.58111 0.377 8.24211 N ? A ? 103 N 1
   ATOM 1709 CA C LYS A 104 ? 1.42365 -26.01081 17.32096 0.377 8.77569 C ? A ? 103 CA 1
   ATOM 1710 C C LYS A 104 ? 2.92808 -25.79496 17.27722 0.377 8.31047 C ? A ? 103 C 1
   ATOM 1711 O C LYS A 104 ? 3.55169 -25.97480 16.22366 0.377 11.64221 O ? A ? 103 O 1
   ATOM 1712 CB C LYS A 104 ? 0.69858 -24.68053 17.12789 0.377 11.21675 C ? A ? 103 CB 1
   ATOM 1713 CG C LYS A 104 ? -0.78345 -24.81689 16.97372 0.377 15.67784 C ? A ? 103 CG 1
   ATOM 1714 CD C LYS A 104 ? -1.43368 -23.46617 16.80496 0.377 13.56800 C ? A ? 103 CD 1
   ATOM 1715 CE C LYS A 104 ? -2.91173 -23.66073 16.51745 0.377 23.86293 C ? A ? 103 CE 1
   ATOM 1716 NZ C LYS A 104 ? -3.32711 -23.56174 15.07305 0.377 25.50178 N ? A ? 103 NZ 1
   ATOM 1717 N A LEU A 105 ? 3.47337 -25.58287 18.04848 0.270 10.60077 N ? A ? 104 N 1
   ATOM 1718 CA A LEU A 105 ? 4.89341 -25.30059 18.24148 0.270 9.89182 C ? A ? 104 CA 1
   ATOM 1719 C A LEU A 105 ? 5.74443 -26.54773 18.02199 0.270 7.52013 C ? A ? 104 C 1
   ATOM 1720 O A LEU A 105 ? 6.67701 -26.53359 17.20977 0.270 8.63349 O ? A ? 104 O 1
   ATOM 1721 CB A LEU A 105 ? 5.13647 -24.69609 19.62785 0.270 8.77370 C ? A ? 104 CB 1
   ATOM 1722 CG A LEU A 105 ? 6.56437 -24.21848 19.90979 0.270 11.55187 C ? A ? 104 CG 1
   ATOM 1723 CD1 A LEU A 105 ? 6.84188 -22.88363 19.21763 0.270 10.64176 C ? A ? 104 CD1 1
   ATOM 1724 CD2 A LEU A 105 ? 6.80080 -24.12044 21.40685 0.270 11.80818 C ? A ? 104 CD2 1
   ATOM 1725 N B LEU A 105 ? 3.37031 -25.22890 17.85609 0.353 6.81389 N ? A ? 104 N 1
   ATOM 1726 CA B LEU A 105 ? 4.80079 -24.99928 17.96786 0.353 7.95873 C ? A ? 104 CA 1
   ATOM 1727 C B LEU A 105 ? 5.57525 -26.29087 17.80377 0.353 7.31986 C ? A ? 104 C 1
   ATOM 1728 O B LEU A 105 ? 6.58735 -26.31603 17.10217 0.353 7.57700 O ? A ? 104 O 1
   ATOM 1729 CB B LEU A 105 ? 5.12411 -24.38484 19.32934 0.353 8.11335 C ? A ? 104 CB 1
   ATOM 1730 CG B LEU A 105 ? 6.56376 -23.90120 19.50393 0.353 9.91703 C ? A ? 104 CG 1
   ATOM 1731 CD1 B LEU A 105 ? 6.65702 -22.41411 19.19266 0.353 11.29250 C ? A ? 104 CD1 1
   ATOM 1732 CD2 B LEU A 105 ? 7.11133 -24.20061 20.89556 0.353 13.13751 C ? A ? 104 CD2 1
   ATOM 1733 N C LEU A 105 ? 3.52915 -25.39339 18.40613 0.377 7.54338 N ? A ? 104 N 1
   ATOM 1734 CA C LEU A 105 ? 4.97667 -25.22620 18.43558 0.377 8.45697 C ? A ? 104 CA 1
   ATOM 1735 C C LEU A 105 ? 5.67048 -26.51964 18.02892 0.377 7.19486 C ? A ? 104 C 1
   ATOM 1736 O C LEU A 105 ? 6.64065 -26.49823 17.25538 0.377 8.74993 O ? A ? 104 O 1
   ATOM 1737 CB C LEU A 105 ? 5.42792 -24.76583 19.81896 0.377 8.07860 C ? A ? 104 CB 1
   ATOM 1738 CG C LEU A 105 ? 6.84645 -24.18871 19.84257 0.377 10.61548 C ? A ? 104 CG 1
   ATOM 1739 CD1 C LEU A 105 ? 6.89460 -22.79455 19.21576 0.377 10.39003 C ? A ? 104 CD1 1
   ATOM 1740 CD2 C LEU A 105 ? 7.36560 -24.16608 21.26200 0.377 12.38486 C ? A ? 104 CD2 1
   ATOM 1741 N A ARG A 106 ? 5.45585 -27.63694 18.74461 0.270 7.21275 N ? A ? 105 N 1
   ATOM 1742 CA A ARG A 106 ? 6.24196 -28.85417 18.54967 0.270 6.07537 C ? A ? 105 CA 1
   ATOM 1743 C A ARG A 106 ? 6.18465 -29.32798 17.09941 0.270 6.98860 C ? A ? 105 C 1
   ATOM 1744 O A ARG A 106 ? 7.18927 -29.79109 16.54516 0.270 5.47687 O ? A ? 105 O 1
   ATOM 1745 CB A ARG A 106 ? 5.77779 -29.95616 19.50863 0.270 5.07542 C ? A ? 105 CB 1
   ATOM 1746 CG A ARG A 106 ? 4.35469 -30.46039 19.31296 0.270 6.84673 C ? A ? 105 CG 1
   ATOM 1747 CD A ARG A 106 ? 3.94968 -31.43577 20.42352 0.270 10.43871 C ? A ? 105 CD 1
   ATOM 1748 NE A ARG A 106 ? 2.56095 -31.85294 20.26332 0.270 15.89648 N ? A ? 105 NE 1
   ATOM 1749 CZ A ARG A 106 ? 2.15788 -33.09731 20.03842 0.270 21.17163 C ? A ? 105 CZ 1
   ATOM 1750 NH1 A ARG A 106 ? 3.00668 -34.11190 20.03253 0.270 18.37749 N ? A ? 105 NH1 1
   ATOM 1751 NH2 A ARG A 106 ? 0.86642 -33.33100 19.82255 0.270 20.76293 N ? A ? 105 NH2 1
   ATOM 1752 N B ARG A 106 ? 5.11822 -27.37387 18.43438 0.353 8.37070 N ? A ? 105 N 1
   ATOM 1753 CA B ARG A 106 ? 5.85610 -28.63269 18.38990 0.353 8.82522 C ? A ? 105 CA 1
   ATOM 1754 C B ARG A 106 ? 5.95554 -29.15385 16.96632 0.353 7.83230 C ? A ? 105 C 1
   ATOM 1755 O B ARG A 106 ? 7.03712 -29.51652 16.48866 0.353 9.94637 O ? A ? 105 O 1
   ATOM 1756 CB B ARG A 106 ? 5.13805 -29.64025 19.29252 0.353 9.70294 C ? A ? 105 CB 1
   ATOM 1757 CG B ARG A 106 ? 5.63992 -31.08144 19.31521 0.353 19.93451 C ? A ? 105 CG 1
   ATOM 1758 CD B ARG A 106 ? 4.97709 -31.86615 20.48146 0.353 16.93620 C ? A ? 105 CD 1
   ATOM 1759 NE B ARG A 106 ? 3.61927 -32.34506 20.22479 0.353 14.71506 N ? A ? 105 NE 1
   ATOM 1760 CZ B ARG A 106 ? 3.24249 -33.61180 20.35616 0.353 10.48885 C ? A ? 105 CZ 1
   ATOM 1761 NH1 B ARG A 106 ? 4.08232 -34.53622 20.79125 0.353 14.21552 N ? A ? 105 NH1 1
   ATOM 1762 NH2 B ARG A 106 ? 1.99975 -33.96449 20.02794 0.353 9.38463 N ? A ? 105 NH2 1
   ATOM 1763 N C ARG A 106 ? 5.17015 -27.65383 18.52155 0.377 8.72658 N ? A ? 105 N 1
   ATOM 1764 CA C ARG A 106 ? 5.80713 -28.92853 18.22774 0.377 7.37948 C ? A ? 105 CA 1
   ATOM 1765 C C ARG A 106 ? 5.80956 -29.21326 16.74135 0.377 7.51555 C ? A ? 105 C 1
   ATOM 1766 O C ARG A 106 ? 6.82443 -29.64158 16.19160 0.377 7.87664 O ? A ? 105 O 1
   ATOM 1767 CB C ARG A 106 ? 5.12167 -30.06348 18.98278 0.377 9.25566 C ? A ? 105 CB 1
   ATOM 1768 CG C ARG A 106 ? 5.18363 -29.90893 20.47794 0.377 7.92002 C ? A ? 105 CG 1
   ATOM 1769 CD C ARG A 106 ? 4.61665 -31.14988 21.16916 0.377 10.42942 C ? A ? 105 CD 1
   ATOM 1770 NE C ARG A 106 ? 5.57203 -32.24666 21.26015 0.377 19.97584 N ? A ? 105 NE 1
   ATOM 1771 CZ C ARG A 106 ? 5.26500 -33.53348 21.14139 0.377 25.20180 C ? A ? 105 CZ 1
   ATOM 1772 NH1 C ARG A 106 ? 4.05729 -33.93224 20.76388 0.377 13.76709 N ? A ? 105 NH1 1
   ATOM 1773 NH2 C ARG A 106 ? 6.19616 -34.44577 21.40186 0.377 33.00143 N ? A ? 105 NH2 1
   ATOM 1774 N A ALA A 107 ? 5.02821 -29.18626 16.45582 0.270 7.77679 N ? A ? 106 N 1
   ATOM 1775 CA A ALA A 107 ? 4.89865 -29.60469 15.06153 0.270 9.36032 C ? A ? 106 CA 1
   ATOM 1776 C A ALA A 107 ? 5.74151 -28.72785 14.13173 0.270 7.58477 C ? A ? 106 C 1
   ATOM 1777 O A ALA A 107 ? 6.49641 -29.23481 13.28313 0.270 6.77315 O ? A ? 106 O 1
   ATOM 1778 CB A ALA A 107 ? 3.42301 -29.56449 14.65687 0.270 9.27046 C ? A ? 106 CB 1
   ATOM 1779 N B ALA A 107 ? 4.82483 -29.17868 16.26616 0.353 10.42956 N ? A ? 106 N 1
   ATOM 1780 CA B ALA A 107 ? 4.81839 -29.65868 14.89060 0.353 8.37976 C ? A ? 106 CA 1
   ATOM 1781 C B ALA A 107 ? 5.64844 -28.75044 13.98794 0.353 8.65795 C ? A ? 106 C 1
   ATOM 1782 O B ALA A 107 ? 6.35124 -29.23145 13.08731 0.353 9.06856 O ? A ? 106 O 1
   ATOM 1783 CB B ALA A 107 ? 3.37395 -29.74730 14.39974 0.353 11.86286 C ? A ? 106 CB 1
   ATOM 1784 N C ALA A 107 ? 4.68233 -28.96573 16.06420 0.377 7.67333 N ? A ? 106 N 1
   ATOM 1785 CA C ALA A 107 ? 4.63626 -29.26524 14.63853 0.377 7.83820 C ? A ? 106 CA 1
   ATOM 1786 C C ALA A 107 ? 5.55415 -28.33215 13.86264 0.377 8.99868 C ? A ? 106 C 1
   ATOM 1787 O C ALA A 107 ? 6.31141 -28.77649 12.98953 0.377 6.78856 O ? A ? 106 O 1
   ATOM 1788 CB C ALA A 107 ? 3.20037 -29.16863 14.12796 0.377 8.76892 C ? A ? 106 CB 1
   ATOM 1789 N A ALA A 108 ? 5.60510 -27.40409 14.25693 0.270 8.95634 N ? A ? 107 N 1
   ATOM 1790 CA A ALA A 108 ? 6.36162 -26.49983 13.39360 0.270 7.98319 C ? A ? 107 CA 1
   ATOM 1791 C A ALA A 108 ? 7.85361 -26.59737 13.66719 0.270 7.16379 C ? A ? 107 C 1
   ATOM 1792 O A ALA A 108 ? 8.67756 -26.45325 12.75045 0.270 7.73968 O ? A ? 107 O 1
   ATOM 1793 CB A ALA A 108 ? 5.87284 -25.05915 13.56671 0.270 9.57667 C ? A ? 107 CB 1
   ATOM 1794 N B ALA A 108 ? 5.58079 -27.43495 14.20912 0.353 8.90871 N ? A ? 107 N 1
   ATOM 1795 CA B ALA A 108 ? 6.36489 -26.51209 13.39134 0.353 7.84767 C ? A ? 107 CA 1
   ATOM 1796 C B ALA A 108 ? 7.85370 -26.66447 13.65696 0.353 6.85999 C ? A ? 107 C 1
   ATOM 1797 O B ALA A 108 ? 8.67781 -26.60914 12.72597 0.353 6.48318 O ? A ? 107 O 1
   ATOM 1798 CB B ALA A 108 ? 5.91447 -25.06951 13.63481 0.353 9.60452 C ? A ? 107 CB 1
   ATOM 1799 N C ALA A 108 ? 5.52214 -27.04403 14.18912 0.377 8.75155 N ? A ? 107 N 1
   ATOM 1800 CA C ALA A 108 ? 6.35724 -26.07889 13.48426 0.377 7.04124 C ? A ? 107 CA 1
   ATOM 1801 C C ALA A 108 ? 7.85016 -26.29235 13.73750 0.377 7.02699 C ? A ? 107 C 1
   ATOM 1802 O C ALA A 108 ? 8.66643 -26.01302 12.84329 0.377 5.93727 O ? A ? 107 O 1
   ATOM 1803 CB C ALA A 108 ? 5.91686 -24.65418 13.80908 0.377 8.88909 C ? A ? 107 CB 1
   ATOM 1804 N . PHE A 109 ? 8.21346 -26.80839 14.93405 1.000 7.80731 N ? A ? 108 N 1
   ATOM 1805 CA . PHE A 109 ? 9.61331 -27.04430 15.29381 1.000 7.65256 C ? A ? 108 CA 1
   ATOM 1806 C . PHE A 109 ? 10.16863 -28.22256 14.49150 1.000 7.65032 C ? A ? 108 C 1
   ATOM 1807 O . PHE A 109 ? 11.28113 -28.15180 13.93218 1.000 7.84162 O ? A ? 108 O 1
   ATOM 1808 CB . PHE A 109 ? 9.67480 -27.29174 16.80629 1.000 8.08404 C ? A ? 108 CB 1
   ATOM 1809 CG . PHE A 109 ? 11.06353 -27.51329 17.36108 1.000 7.15480 C ? A ? 108 CG 1
   ATOM 1810 CD1 . PHE A 109 ? 11.82572 -26.44776 17.78827 1.000 8.90164 C ? A ? 108 CD1 1
   ATOM 1811 CD2 . PHE A 109 ? 11.57206 -28.77465 17.47054 1.000 9.05847 C ? A ? 108 CD2 1
   ATOM 1812 CE1 . PHE A 109 ? 13.10819 -26.65804 18.32865 1.000 9.17295 C ? A ? 108 CE1 1
   ATOM 1813 CE2 . PHE A 109 ? 12.85605 -28.98497 18.01171 1.000 10.16418 C ? A ? 108 CE2 1
   ATOM 1814 CZ . PHE A 109 ? 13.59886 -27.90947 18.44096 1.000 9.82073 C ? A ? 108 CZ 1
   ATOM 1815 N . GLY A 110 ? 9.41692 -29.31831 14.43170 1.000 8.24692 N ? A ? 109 N 1
   ATOM 1816 CA . GLY A 110 ? 9.86238 -30.46654 13.66769 1.000 9.93961 C ? A ? 109 CA 1
   ATOM 1817 C . GLY A 110 ? 10.05188 -30.13444 12.19853 1.000 8.05089 C ? A ? 109 C 1
   ATOM 1818 O . GLY A 110 ? 11.01780 -30.58320 11.56393 1.000 9.07387 O ? A ? 109 O 1
   ATOM 1819 N . ASP A 111 ? 9.14408 -29.33352 11.64833 1.000 8.28120 N ? A ? 110 N 1
   ATOM 1820 CA . ASP A 111 ? 9.26931 -28.98268 10.23262 1.000 8.62861 C ? A ? 110 CA 1
   ATOM 1821 C . ASP A 111 ? 10.51177 -28.13596 9.97346 1.000 7.44419 C ? A ? 110 C 1
   ATOM 1822 O . ASP A 111 ? 11.21318 -28.33156 8.97081 1.000 7.40038 O ? A ? 110 O 1
   ATOM 1823 CB . ASP A 111 ? 8.02360 -28.23026 9.75621 1.000 9.58494 C ? A ? 110 CB 1
   ATOM 1824 CG . ASP A 111 ? 6.79379 -29.09219 9.63354 1.000 13.05150 C ? A ? 110 CG 1
   ATOM 1825 OD1 . ASP A 111 ? 6.90296 -30.32096 9.72510 1.000 14.64929 O ? A ? 110 OD1 1
   ATOM 1826 OD2 . ASP A 111 ? 5.69563 -28.49492 9.44136 1.000 13.52611 O ? A ? 110 OD2 1
   ATOM 1827 N A VAL A 112 ? 10.78773 -27.17173 10.86433 0.471 7.33127 N ? A ? 111 N 1
   ATOM 1828 CA A VAL A 112 ? 11.98298 -26.33001 10.73693 0.471 6.92302 C ? A ? 111 CA 1
   ATOM 1829 C A VAL A 112 ? 13.24922 -27.17449 10.80067 0.471 7.43793 C ? A ? 111 C 1
   ATOM 1830 O A VAL A 112 ? 14.15171 -27.04059 9.95715 0.471 7.23151 O ? A ? 111 O 1
   ATOM 1831 CB A VAL A 112 ? 12.00366 -25.22133 11.80961 0.471 6.68672 C ? A ? 111 CB 1
   ATOM 1832 CG1 A VAL A 112 ? 13.39121 -24.57649 11.91211 0.471 7.77690 C ? A ? 111 CG1 1
   ATOM 1833 CG2 A VAL A 112 ? 10.94977 -24.17197 11.52706 0.471 7.77013 C ? A ? 111 CG2 1
   ATOM 1834 N B VAL A 112 ? 10.83443 -27.24355 10.89896 0.417 7.41558 N ? A ? 111 N 1
   ATOM 1835 CA B VAL A 112 ? 12.09438 -26.51962 10.79278 0.417 7.02259 C ? A ? 111 CA 1
   ATOM 1836 C B VAL A 112 ? 13.27627 -27.48203 10.85566 0.417 6.06163 C ? A ? 111 C 1
   ATOM 1837 O B VAL A 112 ? 14.17514 -27.44667 10.00590 0.417 6.16412 O ? A ? 111 O 1
   ATOM 1838 CB B VAL A 112 ? 12.19196 -25.42555 11.86706 0.417 6.88867 C ? A ? 111 CB 1
   ATOM 1839 CG1 B VAL A 112 ? 13.59862 -24.86275 11.89002 0.417 7.13248 C ? A ? 111 CG1 1
   ATOM 1840 CG2 B VAL A 112 ? 11.16865 -24.32672 11.60680 0.417 7.45428 C ? A ? 111 CG2 1
   ATOM 1841 N D VAL A 112 ? 10.81279 -27.20903 10.88421 0.112 7.36956 N ? A ? 111 N 1
   ATOM 1842 CA D VAL A 112 ? 12.03064 -26.40827 10.76700 0.112 7.04517 C ? A ? 111 CA 1
   ATOM 1843 C D VAL A 112 ? 13.26329 -27.30210 10.81817 0.112 7.06699 C ? A ? 111 C 1
   ATOM 1844 O D VAL A 112 ? 14.19110 -27.15758 10.01257 0.112 7.33550 O ? A ? 111 O 1
   ATOM 1845 CB D VAL A 112 ? 12.06779 -25.31153 11.84778 0.112 6.94089 C ? A ? 111 CB 1
   ATOM 1846 CG1 D VAL A 112 ? 13.40314 -24.58171 11.83037 0.112 7.72302 C ? A ? 111 CG1 1
   ATOM 1847 CG2 D VAL A 112 ? 10.91720 -24.34231 11.64806 0.112 7.84740 C ? A ? 111 CG2 1
   ATOM 1848 N A GLY A 113 ? 13.34450 -28.04463 11.81588 0.471 7.30022 N ? A ? 112 N 1
   ATOM 1849 CA A GLY A 113 ? 14.52792 -28.88184 11.93822 0.471 6.68036 C ? A ? 112 CA 1
   ATOM 1850 C A GLY A 113 ? 14.74743 -29.74888 10.71160 0.471 7.05089 C ? A ? 112 C 1
   ATOM 1851 O A GLY A 113 ? 15.88709 -29.93669 10.26036 0.471 7.99459 O ? A ? 112 O 1
   ATOM 1852 N B GLY A 113 ? 13.29234 -28.36038 11.86321 0.417 7.34574 N ? A ? 112 N 1
   ATOM 1853 CA B GLY A 113 ? 14.40623 -29.28641 11.99804 0.417 8.06667 C ? A ? 112 CA 1
   ATOM 1854 C B GLY A 113 ? 14.65104 -30.10222 10.74471 0.417 8.65258 C ? A ? 112 C 1
   ATOM 1855 O B GLY A 113 ? 15.79816 -30.27802 10.31367 0.417 9.64416 O ? A ? 112 O 1
   ATOM 1856 N D GLY A 113 ? 13.28968 -28.24196 11.76787 0.112 7.14756 N ? A ? 112 N 1
   ATOM 1857 CA D GLY A 113 ? 14.38972 -29.19007 11.82782 0.112 8.18393 C ? A ? 112 CA 1
   ATOM 1858 C D GLY A 113 ? 14.54697 -29.99604 10.55366 0.112 7.55276 C ? A ? 112 C 1
   ATOM 1859 O D GLY A 113 ? 15.67008 -30.31228 10.14565 0.112 8.48075 O ? A ? 112 O 1
   ATOM 1860 N A ALA A 114 ? 13.65821 -30.28341 10.13980 0.471 7.58302 N ? A ? 113 N 1
   ATOM 1861 CA A ALA A 114 ? 13.76785 -31.08842 8.92585 0.471 9.17774 C ? A ? 113 CA 1
   ATOM 1862 C A ALA A 114 ? 14.29425 -30.26586 7.75043 0.471 7.06295 C ? A ? 113 C 1
   ATOM 1863 O A ALA A 114 ? 15.04038 -30.77541 6.90342 0.471 8.37363 O ? A ? 113 O 1
   ATOM 1864 CB A ALA A 114 ? 12.41164 -31.70801 8.58969 0.471 9.24769 C ? A ? 113 CB 1
   ATOM 1865 N B ALA A 114 ? 13.57549 -30.59003 10.12494 0.417 8.13501 N ? A ? 113 N 1
   ATOM 1866 CA B ALA A 114 ? 13.72462 -31.36404 8.90130 0.417 9.64914 C ? A ? 113 CA 1
   ATOM 1867 C B ALA A 114 ? 14.31494 -30.51506 7.77984 0.417 8.23933 C ? A ? 113 C 1
   ATOM 1868 O B ALA A 114 ? 15.13287 -30.99956 6.98883 0.417 7.84418 O ? A ? 113 O 1
   ATOM 1869 CB B ALA A 114 ? 12.37346 -31.95005 8.48991 0.417 9.42817 C ? A ? 113 CB 1
   ATOM 1870 N D ALA A 114 ? 13.43141 -30.32264 9.89700 0.112 6.62271 N ? A ? 113 N 1
   ATOM 1871 CA D ALA A 114 ? 13.50333 -31.03610 8.62550 0.112 7.70116 C ? A ? 113 CA 1
   ATOM 1872 C D ALA A 114 ? 14.10626 -30.16938 7.52477 0.112 6.11847 C ? A ? 113 C 1
   ATOM 1873 O D ALA A 114 ? 14.76617 -30.68889 6.61421 0.112 5.24225 O ? A ? 113 O 1
   ATOM 1874 CB D ALA A 114 ? 12.11377 -31.53583 8.22811 0.112 5.64508 C ? A ? 113 CB 1
   ATOM 1875 N A SER A 115 ? 13.91910 -28.98868 7.68095 0.471 8.34763 N ? A ? 114 N 1
   ATOM 1876 CA A SER A 115 ? 14.44624 -28.11805 6.63366 0.471 7.74647 C ? A ? 114 CA 1
   ATOM 1877 C A SER A 115 ? 15.93048 -27.83005 6.82070 0.471 7.16374 C ? A ? 114 C 1
   ATOM 1878 O A SER A 115 ? 16.68041 -27.79053 5.83541 0.471 8.87984 O ? A ? 114 O 1
   ATOM 1879 CB A SER A 115 ? 13.65399 -26.81729 6.58281 0.471 9.62525 C ? A ? 114 CB 1
   ATOM 1880 OG A SER A 115 ? 12.32087 -27.05175 6.16290 0.471 8.68206 O ? A ? 114 OG 1
   ATOM 1881 N B SER A 115 ? 13.93289 -29.24034 7.71384 0.417 6.75197 N ? A ? 114 N 1
   ATOM 1882 CA B SER A 115 ? 14.41286 -28.35742 6.65735 0.417 7.56221 C ? A ? 114 CA 1
   ATOM 1883 C B SER A 115 ? 15.89110 -28.00936 6.83963 0.417 7.23996 C ? A ? 114 C 1
   ATOM 1884 O B SER A 115 ? 16.63828 -27.92246 5.85455 0.417 8.89694 O ? A ? 114 O 1
   ATOM 1885 CB B SER A 115 ? 13.50874 -27.12381 6.61934 0.417 7.81983 C ? A ? 114 CB 1
   ATOM 1886 OG B SER A 115 ? 13.89735 -26.16835 5.67223 0.417 13.69768 O ? A ? 114 OG 1
   ATOM 1887 N D SER A 115 ? 13.90204 -28.85356 7.59467 0.112 8.01735 N ? A ? 114 N 1
   ATOM 1888 CA D SER A 115 ? 14.48373 -27.94841 6.60845 0.112 7.47997 C ? A ? 114 CA 1
   ATOM 1889 C D SER A 115 ? 15.98361 -27.75317 6.82560 0.112 7.26715 C ? A ? 114 C 1
   ATOM 1890 O D SER A 115 ? 16.73931 -27.65932 5.84932 0.112 8.62674 O ? A ? 114 O 1
   ATOM 1891 CB D SER A 115 ? 13.75450 -26.60514 6.63458 0.112 9.65560 C ? A ? 114 CB 1
   ATOM 1892 OG D SER A 115 ? 12.41896 -26.74382 6.17956 0.112 8.35567 O ? A ? 114 OG 1
   ATOM 1893 N A CYS A 116 ? 16.37972 -27.60487 8.06701 0.471 8.58337 N ? A ? 115 N 1
   ATOM 1894 CA A CYS A 116 ? 17.82251 -27.47594 8.28190 0.471 8.66400 C ? A ? 115 CA 1
   ATOM 1895 C A CYS A 116 ? 18.54349 -28.67936 7.68104 0.471 7.01595 C ? A ? 115 C 1
   ATOM 1896 O A CYS A 116 ? 19.50565 -28.54201 6.90614 0.471 7.60425 O ? A ? 115 O 1
   ATOM 1897 CB A CYS A 116 ? 18.18786 -27.41155 9.77911 0.471 8.29582 C ? A ? 115 CB 1
   ATOM 1898 SG A CYS A 116 ? 17.32818 -26.34540 10.96563 0.471 7.48472 S ? A ? 115 SG 1
   ATOM 1899 N B CYS A 116 ? 16.34248 -27.82057 8.09176 0.417 8.51945 N ? A ? 115 N 1
   ATOM 1900 CA B CYS A 116 ? 17.77824 -27.67234 8.34621 0.417 8.13746 C ? A ? 115 CA 1
   ATOM 1901 C B CYS A 116 ? 18.54703 -28.89981 7.86086 0.417 8.33718 C ? A ? 115 C 1
   ATOM 1902 O B CYS A 116 ? 19.50415 -28.80113 7.07446 0.417 9.81807 O ? A ? 115 O 1
   ATOM 1903 CB B CYS A 116 ? 18.06479 -27.52020 9.84705 0.417 9.82691 C ? A ? 115 CB 1
   ATOM 1904 SG B CYS A 116 ? 17.23063 -26.27326 10.88418 0.417 10.63313 S ? A ? 115 SG 1
   ATOM 1905 N D CYS A 116 ? 16.43466 -27.68138 8.08612 0.112 8.68079 N ? A ? 115 N 1
   ATOM 1906 CA D CYS A 116 ? 17.86818 -27.55549 8.34442 0.112 8.65763 C ? A ? 115 CA 1
   ATOM 1907 C D CYS A 116 ? 18.61653 -28.81644 7.92610 0.112 8.18637 C ? A ? 115 C 1
   ATOM 1908 O D CYS A 116 ? 19.76377 -28.74984 7.46399 0.112 5.97977 O ? A ? 115 O 1
   ATOM 1909 CB D CYS A 116 ? 18.13818 -27.28209 9.83205 0.112 7.86324 C ? A ? 115 CB 1
   ATOM 1910 SG D CYS A 116 ? 17.04399 -26.13688 10.72411 0.112 3.55489 S ? A ? 115 SG 1
   ATOM 1911 N A LYS A 117 ? 18.06070 -29.88080 8.02510 0.471 7.52564 N ? A ? 116 N 1
   ATOM 1912 CA A LYS A 117 ? 18.70734 -31.12080 7.60974 0.471 9.14262 C ? A ? 116 CA 1
   ATOM 1913 C A LYS A 117 ? 18.63595 -31.32071 6.10104 0.471 7.19515 C ? A ? 116 C 1
   ATOM 1914 O A LYS A 117 ? 19.59767 -31.80951 5.49782 0.471 7.84144 O ? A ? 116 O 1
   ATOM 1915 CB A LYS A 117 ? 18.08786 -32.31399 8.35339 0.471 9.68857 C ? A ? 116 CB 1
   ATOM 1916 CG A LYS A 117 ? 18.76502 -33.64813 8.01473 0.471 13.67213 C ? A ? 116 CG 1
   ATOM 1917 CD A LYS A 117 ? 18.19637 -34.80671 8.82922 0.471 15.30800 C ? A ? 116 CD 1
   ATOM 1918 CE A LYS A 117 ? 18.63720 -36.15444 8.25973 0.471 22.18477 C ? A ? 116 CE 1
   ATOM 1919 NZ A LYS A 117 ? 20.10666 -36.22824 8.01155 0.471 26.23109 N ? A ? 116 NZ 1
   ATOM 1920 N B LYS A 117 ? 18.16120 -30.06881 8.37138 0.417 7.70919 N ? A ? 116 N 1
   ATOM 1921 CA B LYS A 117 ? 18.87954 -31.29986 8.07947 0.417 8.26729 C ? A ? 116 CA 1
   ATOM 1922 C B LYS A 117 ? 18.89145 -31.58942 6.58823 0.417 7.63007 C ? A ? 116 C 1
   ATOM 1923 O B LYS A 117 ? 19.90736 -32.03724 6.05064 0.417 7.84663 O ? A ? 116 O 1
   ATOM 1924 CB B LYS A 117 ? 18.23720 -32.44734 8.84177 0.417 10.58539 C ? A ? 116 CB 1
   ATOM 1925 CG B LYS A 117 ? 18.90376 -33.77716 8.59959 0.417 15.35439 C ? A ? 116 CG 1
   ATOM 1926 CD B LYS A 117 ? 18.17207 -34.88169 9.33092 0.417 17.65034 C ? A ? 116 CD 1
   ATOM 1927 CE B LYS A 117 ? 18.87894 -36.21359 9.17989 0.417 22.66562 C ? A ? 116 CE 1
   ATOM 1928 NZ B LYS A 117 ? 19.13173 -36.56471 7.75377 0.417 18.83506 N ? A ? 116 NZ 1
   ATOM 1929 N D LYS A 117 ? 17.98175 -29.97838 8.08918 0.112 8.24034 N ? A ? 116 N 1
   ATOM 1930 CA D LYS A 117 ? 18.65026 -31.23228 7.77047 0.112 9.63063 C ? A ? 116 CA 1
   ATOM 1931 C D LYS A 117 ? 18.73970 -31.43743 6.26634 0.112 9.14378 C ? A ? 116 C 1
   ATOM 1932 O D LYS A 117 ? 19.80817 -31.76755 5.73610 0.112 9.28623 O ? A ? 116 O 1
   ATOM 1933 CB D LYS A 117 ? 17.90188 -32.39476 8.42221 0.112 8.95301 C ? A ? 116 CB 1
   ATOM 1934 CG D LYS A 117 ? 18.48412 -33.75456 8.08708 0.112 13.74801 C ? A ? 116 CG 1
   ATOM 1935 CD D LYS A 117 ? 17.63204 -34.87092 8.66348 0.112 12.90639 C ? A ? 116 CD 1
   ATOM 1936 CE D LYS A 117 ? 18.26183 -36.23201 8.41874 0.112 16.75384 C ? A ? 116 CE 1
   ATOM 1937 NZ D LYS A 117 ? 18.47824 -36.49820 6.97120 0.112 13.39455 N ? A ? 116 NZ 1
   ATOM 1938 N A ALA A 118 ? 17.51472 -30.95460 5.46781 0.471 7.02137 N ? A ? 117 N 1
   ATOM 1939 CA A ALA A 118 ? 17.40646 -31.14384 4.02280 0.471 8.29146 C ? A ? 117 CA 1
   ATOM 1940 C A ALA A 118 ? 18.45986 -30.32463 3.29440 0.471 5.56769 C ? A ? 117 C 1
   ATOM 1941 O A ALA A 118 ? 19.07097 -30.78889 2.32154 0.471 7.17401 O ? A ? 117 O 1
   ATOM 1942 CB A ALA A 118 ? 15.99980 -30.77289 3.54410 0.471 7.50224 C ? A ? 117 CB 1
   ATOM 1943 N B ALA A 118 ? 17.77451 -31.34109 5.90544 0.417 7.29459 N ? A ? 117 N 1
   ATOM 1944 CA B ALA A 118 ? 17.71054 -31.62578 4.47712 0.417 8.26502 C ? A ? 117 CA 1
   ATOM 1945 C B ALA A 118 ? 18.69757 -30.76924 3.69842 0.417 6.22607 C ? A ? 117 C 1
   ATOM 1946 O B ALA A 118 ? 19.34105 -31.24963 2.75626 0.417 6.91636 O ? A ? 117 O 1
   ATOM 1947 CB B ALA A 118 ? 16.28839 -31.40985 3.96464 0.417 9.59676 C ? A ? 117 CB 1
   ATOM 1948 N D ALA A 118 ? 17.62544 -31.24092 5.55853 0.112 9.73876 N ? A ? 117 N 1
   ATOM 1949 CA D ALA A 118 ? 17.60912 -31.48759 4.12196 0.112 9.12320 C ? A ? 117 CA 1
   ATOM 1950 C D ALA A 118 ? 18.56468 -30.56481 3.38137 0.112 7.90002 C ? A ? 117 C 1
   ATOM 1951 O D ALA A 118 ? 19.10153 -30.94243 2.33484 0.112 7.92980 O ? A ? 117 O 1
   ATOM 1952 CB D ALA A 118 ? 16.18820 -31.35521 3.57353 0.112 10.16800 C ? A ? 117 CB 1
   ATOM 1953 N A CYS A 119 ? 18.73170 -29.12059 3.78921 0.471 5.89306 N ? A ? 118 N 1
   ATOM 1954 CA A CYS A 119 ? 19.81870 -28.34631 3.20359 0.471 7.87300 C ? A ? 118 CA 1
   ATOM 1955 C A CYS A 119 ? 21.19834 -28.93546 3.52809 0.471 8.25700 C ? A ? 118 C 1
   ATOM 1956 O A CYS A 119 ? 22.01186 -29.12777 2.60929 0.471 8.81594 O ? A ? 118 O 1
   ATOM 1957 CB A CYS A 119 ? 19.69424 -26.87551 3.58291 0.471 7.70638 C ? A ? 118 CB 1
   ATOM 1958 SG A CYS A 119 ? 20.74801 -25.95469 2.52502 0.471 5.43274 S ? A ? 118 SG 1
   ATOM 1959 N B CYS A 119 ? 18.82378 -29.48548 4.06553 0.417 8.42873 N ? A ? 118 N 1
   ATOM 1960 CA B CYS A 119 ? 19.72712 -28.62071 3.30433 0.417 7.37742 C ? A ? 118 CA 1
   ATOM 1961 C B CYS A 119 ? 21.16103 -29.02006 3.54623 0.417 8.29950 C ? A ? 118 C 1
   ATOM 1962 O B CYS A 119 ? 21.96777 -29.10746 2.60050 0.417 8.88048 O ? A ? 118 O 1
   ATOM 1963 CB B CYS A 119 ? 19.56783 -27.14292 3.66407 0.417 7.14117 C ? A ? 118 CB 1
   ATOM 1964 SG B CYS A 119 ? 20.88418 -26.16238 2.79740 0.417 6.71096 S ? A ? 118 SG 1
   ATOM 1965 N D CYS A 119 ? 18.80270 -29.36062 3.89998 0.112 9.02931 N ? A ? 118 N 1
   ATOM 1966 CA D CYS A 119 ? 19.77372 -28.51091 3.22452 0.112 7.95303 C ? A ? 118 CA 1
   ATOM 1967 C D CYS A 119 ? 21.20504 -28.92396 3.54530 0.112 8.30219 C ? A ? 118 C 1
   ATOM 1968 O D CYS A 119 ? 22.05524 -28.94965 2.64807 0.112 9.87890 O ? A ? 118 O 1
   ATOM 1969 CB D CYS A 119 ? 19.55218 -27.03518 3.53542 0.112 8.02471 C ? A ? 118 CB 1
   ATOM 1970 SG D CYS A 119 ? 20.70881 -26.04076 2.58617 0.112 7.63454 S ? A ? 118 SG 1
   ATOM 1971 N . HIS A 120 ? 21.49378 -29.25053 4.80496 1.000 9.49958 N ? A ? 119 N 1
   ATOM 1972 CA . HIS A 120 ? 22.82157 -29.75981 5.14753 1.000 9.58720 C ? A ? 119 CA 1
   ATOM 1973 C . HIS A 120 ? 23.12646 -31.04962 4.39130 1.000 9.62266 C ? A ? 119 C 1
   ATOM 1974 O . HIS A 120 ? 24.24841 -31.22476 3.87943 1.000 10.49382 O ? A ? 119 O 1
   ATOM 1975 CB . HIS A 120 ? 22.96951 -29.98166 6.65281 1.000 9.41185 C ? A ? 119 CB 1
   ATOM 1976 CG . HIS A 120 ? 22.89974 -28.71975 7.45156 1.000 7.70978 C ? A ? 119 CG 1
   ATOM 1977 ND1 . HIS A 120 ? 22.49275 -28.69947 8.75871 1.000 9.24853 N ? A ? 119 ND1 1
   ATOM 1978 CD2 . HIS A 120 ? 23.17827 -27.43010 7.13110 1.000 8.13421 C ? A ? 119 CD2 1
   ATOM 1979 CE1 . HIS A 120 ? 22.51499 -27.44778 9.20459 1.000 8.28410 C ? A ? 119 CE1 1
   ATOM 1980 NE2 . HIS A 120 ? 22.94335 -26.65365 8.24274 1.000 7.15276 N ? A ? 119 NE2 1
   ATOM 1981 N A ASP A 121 ? 22.08653 -31.84980 4.10952 0.441 7.60822 N ? A ? 120 N 1
   ATOM 1982 CA A ASP A 121 ? 22.27118 -33.10117 3.37339 0.441 6.46696 C ? A ? 120 CA 1
   ATOM 1983 C A ASP A 121 ? 22.66908 -32.84359 1.92629 0.441 6.13224 C ? A ? 120 C 1
   ATOM 1984 O A ASP A 121 ? 23.49878 -33.57406 1.37301 0.441 8.80754 O ? A ? 120 O 1
   ATOM 1985 CB A ASP A 121 ? 21.01001 -33.96710 3.41824 0.441 8.51957 C ? A ? 120 CB 1
   ATOM 1986 CG A ASP A 121 ? 20.81798 -34.66700 4.75522 0.441 11.60523 C ? A ? 120 CG 1
   ATOM 1987 OD1 A ASP A 121 ? 21.70578 -34.62109 5.61940 0.441 13.26674 O ? A ? 120 OD1 1
   ATOM 1988 OD2 A ASP A 121 ? 19.74315 -35.27170 4.94936 0.441 17.09464 O ? A ? 120 OD2 1
   ATOM 1989 N B ASP A 121 ? 22.22326 -32.03360 4.47060 0.559 8.45938 N ? A ? 120 N 1
   ATOM 1990 CA B ASP A 121 ? 22.46705 -33.31673 3.81399 0.559 10.01996 C ? A ? 120 CA 1
   ATOM 1991 C B ASP A 121 ? 22.89152 -33.13200 2.36270 0.559 9.30047 C ? A ? 120 C 1
   ATOM 1992 O B ASP A 121 ? 23.71682 -33.90594 1.85965 0.559 10.35636 O ? A ? 120 O 1
   ATOM 1993 CB B ASP A 121 ? 21.20378 -34.17829 3.85556 0.559 10.79672 C ? A ? 120 CB 1
   ATOM 1994 CG B ASP A 121 ? 20.91282 -34.76286 5.22216 0.559 12.65749 C ? A ? 120 CG 1
   ATOM 1995 OD1 B ASP A 121 ? 21.77964 -34.74544 6.10731 0.559 13.80443 O ? A ? 120 OD1 1
   ATOM 1996 OD2 B ASP A 121 ? 19.78922 -35.27304 5.38574 0.559 14.28489 O ? A ? 120 OD2 1
   ATOM 1997 N A ALA A 122 ? 22.06309 -31.84563 1.28603 0.441 6.21854 N ? A ? 121 N 1
   ATOM 1998 CA A ALA A 122 ? 22.36169 -31.56922 -0.11052 0.441 7.05874 C ? A ? 121 CA 1
   ATOM 1999 C A ALA A 122 ? 23.58640 -30.68834 -0.28209 0.441 7.16885 C ? A ? 121 C 1
   ATOM 2000 O A ALA A 122 ? 24.25486 -30.77697 -1.32927 0.441 7.10329 O ? A ? 121 O 1
   ATOM 2001 CB A ALA A 122 ? 21.16625 -30.88687 -0.77344 0.441 9.60320 C ? A ? 121 CB 1
   ATOM 2002 N B ALA A 122 ? 22.36059 -32.11893 1.67828 0.559 10.49416 N ? A ? 121 N 1
   ATOM 2003 CA B ALA A 122 ? 22.61226 -31.89288 0.25646 0.559 10.14131 C ? A ? 121 CA 1
   ATOM 2004 C B ALA A 122 ? 23.79024 -30.95354 -0.02647 0.559 7.35394 C ? A ? 121 C 1
   ATOM 2005 O B ALA A 122 ? 24.57657 -31.21991 -0.94649 0.559 9.41881 O ? A ? 121 O 1
   ATOM 2006 CB B ALA A 122 ? 21.34103 -31.36168 -0.41084 0.559 12.30467 C ? A ? 121 CB 1
   ATOM 2007 N . TYR A 123 ? 23.91080 -29.84059 0.71728 1.000 10.11409 N ? A ? 122 N 1
   ATOM 2008 CA . TYR A 123 ? 24.81208 -28.71974 0.44362 1.000 9.34285 C ? A ? 122 CA 1
   ATOM 2009 C . TYR A 123 ? 25.94300 -28.49476 1.43206 1.000 10.47970 C ? A ? 122 C 1
   ATOM 2010 O . TYR A 123 ? 26.74057 -27.56336 1.20617 1.000 10.60270 O ? A ? 122 O 1
   ATOM 2011 CB . TYR A 123 ? 24.00588 -27.42309 0.28251 1.000 10.19968 C ? A ? 122 CB 1
   ATOM 2012 CG . TYR A 123 ? 23.13274 -27.45356 -0.94857 1.000 10.27258 C ? A ? 122 CG 1
   ATOM 2013 CD1 . TYR A 123 ? 23.69742 -27.52302 -2.20154 1.000 10.95655 C ? A ? 122 CD1 1
   ATOM 2014 CD2 . TYR A 123 ? 21.73253 -27.42942 -0.85429 1.000 10.66834 C ? A ? 122 CD2 1
   ATOM 2015 CE1 . TYR A 123 ? 22.89654 -27.55822 -3.34624 1.000 12.76198 C ? A ? 122 CE1 1
   ATOM 2016 CE2 . TYR A 123 ? 20.92492 -27.46814 -1.98408 1.000 11.53618 C ? A ? 122 CE2 1
   ATOM 2017 CZ . TYR A 123 ? 21.50604 -27.53911 -3.22388 1.000 11.74865 C ? A ? 122 CZ 1
   ATOM 2018 OH . TYR A 123 ? 20.69460 -27.58015 -4.34564 1.000 15.04277 O ? A ? 122 OH 1
   ATOM 2019 N . ARG A 124 ? 26.06256 -29.28863 2.48072 1.000 10.75663 N ? A ? 123 N 1
   ATOM 2020 CA . ARG A 124 ? 27.14141 -29.11825 3.45281 1.000 10.57268 C ? A ? 123 CA 1
   ATOM 2021 C . ARG A 124 ? 28.03562 -30.35216 3.40524 1.000 13.96433 C ? A ? 123 C 1
   ATOM 2022 O . ARG A 124 ? 27.54465 -31.48399 3.47486 1.000 16.15233 O ? A ? 123 O 1
   ATOM 2023 CB . ARG A 124 ? 26.59394 -28.89143 4.87096 1.000 11.13430 C ? A ? 123 CB 1
   ATOM 2024 CG . ARG A 124 ? 27.67118 -28.48574 5.88001 1.000 10.93834 C ? A ? 123 CG 1
   ATOM 2025 CD . ARG A 124 ? 27.09233 -28.12767 7.22471 1.000 10.57055 C ? A ? 123 CD 1
   ATOM 2026 NE . ARG A 124 ? 26.56863 -29.31761 7.87804 1.000 11.89557 N ? A ? 123 NE 1
   ATOM 2027 CZ . ARG A 124 ? 25.94963 -29.29222 9.04670 1.000 10.89055 C ? A ? 123 CZ 1
   ATOM 2028 NH1 . ARG A 124 ? 25.71536 -28.15345 9.67456 1.000 12.03347 N ? A ? 123 NH1 1
   ATOM 2029 NH2 . ARG A 124 ? 25.53717 -30.43110 9.59620 1.000 13.68158 N ? A ? 123 NH2 1
   ATOM 2030 N . LYS A 125 ? 29.34223 -30.12526 3.27271 1.000 12.02286 N ? A ? 124 N 1
   ATOM 2031 CA . LYS A 125 ? 30.30296 -31.23106 3.23193 1.000 15.86695 C ? A ? 124 CA 1
   ATOM 2032 C . LYS A 125 ? 30.28474 -32.03999 4.51301 1.000 16.86862 C ? A ? 124 C 1
   ATOM 2033 O . LYS A 125 ? 30.08041 -31.49231 5.58785 1.000 17.77794 O ? A ? 124 O 1
   ATOM 2034 CB . LYS A 125 ? 31.71622 -30.70985 2.97165 1.000 15.38718 C ? A ? 124 CB 1
   ATOM 2035 CG . LYS A 125 ? 31.87556 -29.93049 1.69973 1.000 13.31141 C ? A ? 124 CG 1
   ATOM 2036 CD . LYS A 125 ? 33.35031 -29.69113 1.44758 1.000 15.39566 C ? A ? 124 CD 1
   ATOM 2037 CE . LYS A 125 ? 33.53509 -29.08123 0.07027 1.000 19.59115 C ? A ? 124 CE 1
   ATOM 2038 NZ . LYS A 125 ? 34.96809 -28.87490 -0.26002 1.000 12.81832 N ? A ? 124 NZ 1
   HETATM 2039 N . PCA A 1 ? 29.89380 -7.32163 1.96724 1.000 8.46249 N ? A ? 125 N 1
   HETATM 2040 CA . PCA A 1 ? 30.42457 -6.73678 3.16726 1.000 8.71285 C ? A ? 125 CA 1
   HETATM 2041 C . PCA A 1 ? 31.69160 -7.45692 3.58354 1.000 7.94454 C ? A ? 125 C 1
   HETATM 2042 O . PCA A 1 ? 32.19247 -7.27780 4.69337 1.000 9.58688 O ? A ? 125 O 1
   HETATM 2043 CB . PCA A 1 ? 29.37548 -6.91328 4.22905 1.000 9.38494 C ? A ? 125 CB 1
   HETATM 2044 CG . PCA A 1 ? 28.61259 -8.13257 3.74823 1.000 9.15747 C ? A ? 125 CG 1
   HETATM 2045 CD . PCA A 1 ? 28.86916 -8.14522 2.24501 1.000 8.46838 C ? A ? 125 CD 1
   HETATM 2046 OE . PCA A 1 ? 28.26795 -8.79787 1.44750 1.000 9.98033 O ? A ? 125 OE 1
   HETATM 2047 NB . HEC A 1126 ? 21.67847 -24.63480 9.76242 1.000 6.85290 N ? B ? . NB 1
   HETATM 2048 ND . HEC A 1126 ? 24.58716 -24.66641 6.93931 1.000 7.60672 N ? B ? . ND 1
   HETATM 2049 C1A . HEC A 1126 ? 25.89830 -24.84055 9.64932 1.000 7.88932 C ? B ? . C1A 1
   HETATM 2050 C1B . HEC A 1126 ? 21.82458 -24.80162 11.11563 1.000 6.35293 C ? B ? . C1B 1
   HETATM 2051 C1C . HEC A 1126 ? 20.37130 -24.42164 7.05952 1.000 5.98595 C ? B ? . C1C 1
   HETATM 2052 C1D . HEC A 1126 ? 24.40112 -24.65039 5.58398 1.000 6.31381 C ? B ? . C1D 1
   HETATM 2053 C2A . HEC A 1126 ? 26.50193 -25.05034 10.94372 1.000 9.05820 C ? B ? . C2A 1
   HETATM 2054 C2B . HEC A 1126 ? 20.53177 -24.87299 11.75165 1.000 6.63867 C ? B ? . C2B 1
   HETATM 2055 C2C . HEC A 1126 ? 19.72716 -24.38165 5.75834 1.000 6.58501 C ? B ? . C2C 1
   HETATM 2056 C2D . HEC A 1126 ? 25.66092 -24.72740 4.91215 1.000 7.31568 C ? B ? . C2D 1
   HETATM 2057 C3A . HEC A 1126 ? 25.52383 -25.08124 11.86569 1.000 7.39396 C ? B ? . C3A 1
   HETATM 2058 C3B . HEC A 1126 ? 19.60375 -24.67847 10.77267 1.000 6.79889 C ? B ? . C3B 1
   HETATM 2059 C3C . HEC A 1126 ? 20.70011 -24.40996 4.82292 1.000 6.41913 C ? B ? . C3C 1
   HETATM 2060 C3D . HEC A 1126 ? 26.70002 -24.73087 5.93575 1.000 7.67802 C ? B ? . C3D 1
   HETATM 2061 C4A . HEC A 1126 ? 24.28454 -24.92212 11.16097 1.000 6.65976 C ? B ? . C4A 1
   HETATM 2062 C4B . HEC A 1126 ? 20.32126 -24.53759 9.52095 1.000 5.95931 C ? B ? . C4B 1
   HETATM 2063 C4C . HEC A 1126 ? 21.96222 -24.50747 5.53295 1.000 5.83906 C ? B ? . C4C 1
   HETATM 2064 C4D . HEC A 1126 ? 25.96467 -24.72073 7.17558 1.000 6.95914 C ? B ? . C4D 1
   HETATM 2065 CAA . HEC A 1126 ? 28.00274 -25.22260 11.24113 1.000 10.15849 C ? B ? . CAA 1
   HETATM 2066 CAB . HEC A 1126 ? 18.06284 -24.71200 10.86917 1.000 7.61152 C ? B ? . CAB 1
   HETATM 2067 CAC . HEC A 1126 ? 20.61249 -24.42520 3.30950 1.000 7.16667 C ? B ? . CAC 1
   HETATM 2068 CAD . HEC A 1126 ? 28.20386 -24.75866 5.76355 1.000 7.79598 C ? B ? . CAD 1
   HETATM 2069 CBA . HEC A 1126 ? 28.69667 -23.89888 11.42408 1.000 12.12009 C ? B ? . CBA 1
   HETATM 2070 CBB . HEC A 1126 ? 17.54014 -23.82245 12.02727 1.000 7.76126 C ? B ? . CBB 1
   HETATM 2071 CBC . HEC A 1126 ? 19.39655 -23.64735 2.74985 1.000 7.71486 C ? B ? . CBC 1
   HETATM 2072 CBD . HEC A 1126 ? 28.75725 -23.32530 5.78367 1.000 8.41208 C ? B ? . CBD 1
   HETATM 2073 CGA . HEC A 1126 ? 30.12223 -24.19842 11.81573 1.000 11.19439 C ? B ? . CGA 1
   HETATM 2074 CGD . HEC A 1126 ? 30.26551 -23.29209 5.59335 1.000 7.25988 C ? B ? . CGD 1
   HETATM 2075 CHA . HEC A 1126 ? 26.55630 -24.74569 8.42857 1.000 8.14592 C ? B ? . CHA 1
   HETATM 2076 CHB . HEC A 1126 ? 23.03364 -24.92612 11.73971 1.000 7.54549 C ? B ? . CHB 1
   HETATM 2077 CHC . HEC A 1126 ? 19.72955 -24.38664 8.28249 1.000 6.57702 C ? B ? . CHC 1
   HETATM 2078 CHD . HEC A 1126 ? 23.20040 -24.59782 4.93487 1.000 7.43050 C ? B ? . CHD 1
   HETATM 2079 CMA . HEC A 1126 ? 25.65113 -25.28687 13.36338 1.000 9.94721 C ? B ? . CMA 1
   HETATM 2080 CMB . HEC A 1126 ? 20.34013 -25.08374 13.25039 1.000 7.85203 C ? B ? . CMB 1
   HETATM 2081 CMC . HEC A 1126 ? 18.20771 -24.27632 5.62153 1.000 6.86135 C ? B ? . CMC 1
   HETATM 2082 CMD . HEC A 1126 ? 25.90243 -24.75943 3.42710 1.000 7.96741 C ? B ? . CMD 1
   HETATM 2083 NA . HEC A 1126 ? 24.51918 -24.79352 9.81740 1.000 7.42117 N ? B ? . NA 1
   HETATM 2084 NC . HEC A 1126 ? 21.74435 -24.49453 6.86715 1.000 6.12812 N ? B ? . NC 1
   HETATM 2085 O1A . HEC A 1126 ? 30.99533 -24.28995 10.93487 1.000 11.80325 O ? B ? . O1A 1
   HETATM 2086 O1D . HEC A 1126 ? 30.74964 -22.50059 4.76186 1.000 8.32005 O ? B ? . O1D 1
   HETATM 2087 O2A . HEC A 1126 ? 30.40773 -24.38028 13.02182 0.766 11.85792 O ? B ? . O2A 1
   HETATM 2088 O2D . HEC A 1126 ? 30.95652 -24.07489 6.28117 1.000 8.40120 O ? B ? . O2D 1
   HETATM 2089 FE . HEC A 1126 ? 23.13105 -24.60262 8.35174 1.000 6.35738 Fe ? B ? . FE 1
   HETATM 2090 C . CMO A 1127 ? 24.52823 -21.50859 7.92299 1.000 44.88453 C ? C ? . C 1
   HETATM 2091 O . CMO A 1127 ? 23.42468 -21.74315 8.42962 1.000 9.46943 O ? C ? . O 1
   HETATM 2092 O . HOH A 2001 ? 26.26667 -10.24958 2.38517 0.785 10.53703 O ? D ? . O 1
   HETATM 2093 O . HOH A 2003 ? 34.98455 -5.72589 5.49778 0.793 12.79280 O ? D ? . O 1
   HETATM 2094 O . HOH A 2004 ? 35.44276 -8.41830 6.04124 0.829 10.61082 O ? D ? . O 1
   HETATM 2096 O . HOH A 2006 ? 27.40203 -10.43718 -2.07084 0.641 22.83956 O ? D ? . O 1
   HETATM 2098 O . HOH A 2008 ? 33.72108 -9.36128 7.98551 0.857 10.77262 O ? D ? . O 1
   HETATM 2099 O . HOH A 2009 ? 37.01694 -4.61844 1.38132 0.745 17.97586 O ? D ? . O 1
   HETATM 2101 O . HOH A 2012 ? 40.86521 -17.80109 -1.79039 0.675 12.83472 O ? D ? . O 1
   HETATM 2102 O . HOH A 2013 ? 34.77994 -12.32313 10.77233 0.466 8.54188 O ? D ? . O 1
   HETATM 2103 O . HOH A 2015 ? 41.39824 -8.20653 4.40421 0.790 22.01730 O ? D ? . O 1
   HETATM 2104 O . HOH A 2016 ? 44.51484 -13.62836 1.50979 0.754 27.69493 O ? D ? . O 1
   HETATM 2105 O . HOH A 2018 ? 22.03266 -9.74332 5.04303 0.876 16.60270 O ? D ? . O 1
   HETATM 2108 O . HOH A 2021 ? 39.87637 -19.44269 0.70808 0.736 11.01900 O ? D ? . O 1
   HETATM 2110 O . HOH A 2023 ? 33.00850 -11.91599 8.79773 0.774 11.02419 O ? D ? . O 1
   HETATM 2111 O . HOH A 2024 ? 39.52580 -13.56899 7.51527 0.911 23.65065 O ? D ? . O 1
   HETATM 2112 O . HOH A 2026 ? 40.00724 -10.13560 5.71294 0.924 24.57052 O ? D ? . O 1
   HETATM 2113 O . HOH A 2027 ? 26.74897 -25.66953 16.61116 0.832 18.99512 O ? D ? . O 1
   HETATM 2114 O . HOH A 2028 ? 19.03278 -29.44963 17.55449 0.732 25.12652 O ? D ? . O 1
   HETATM 2115 O . HOH A 2029 ? 22.42836 -27.82800 14.73183 0.907 32.00223 O ? D ? . O 1
   HETATM 2120 O . HOH A 2038 ? 13.71408 -23.39242 28.36647 0.914 7.64256 O ? D ? . O 1
   HETATM 2121 O . HOH A 2039 ? 15.16512 -25.70798 28.25538 0.889 9.11149 O ? D ? . O 1
   HETATM 2122 O . HOH A 2040 ? 12.53022 -32.77989 19.10691 0.708 25.80580 O ? D ? . O 1
   HETATM 2124 O . HOH A 2042 ? 15.66164 -31.39583 16.09785 0.819 22.52208 O ? D ? . O 1
   HETATM 2125 O . HOH A 2043 ? 23.51029 -11.58804 6.18793 0.937 8.00696 O ? D ? . O 1
   HETATM 2127 O . HOH A 2046 ? 0.76031 -22.59851 31.30498 0.798 23.78568 O ? D ? . O 1
   HETATM 2129 O . HOH A 2048 ? 0.30682 -20.97410 27.81502 0.782 28.91427 O ? D ? . O 1
   HETATM 2130 O . HOH A 2049 ? 31.09322 -20.72021 14.14922 0.806 20.38764 O ? D ? . O 1
   HETATM 2131 O . HOH A 2050 ? 33.41778 -20.87502 12.50065 0.722 21.17375 O ? D ? . O 1
   HETATM 2132 O . HOH A 2052 ? 35.70312 -24.13030 7.81195 0.889 18.40772 O ? D ? . O 1
   HETATM 2133 O . HOH A 2053 ? 2.01876 -14.90867 27.00352 0.777 17.64139 O ? D ? . O 1
   HETATM 2135 O . HOH A 2055 ? 5.22542 -13.48369 34.02467 0.654 16.80474 O ? D ? . O 1
   HETATM 2136 O . HOH A 2056 ? 4.92009 -12.00584 24.87525 0.829 12.64643 O ? D ? . O 1
   HETATM 2139 O . HOH A 2059 ? 14.85101 -11.72427 23.33128 0.826 14.10307 O ? D ? . O 1
   HETATM 2141 O . HOH A 2062 ? 4.38722 -10.78803 27.24011 0.751 20.10434 O ? D ? . O 1
   HETATM 2143 O . HOH A 2065 ? 25.63892 -23.88332 18.27648 0.903 14.20401 O ? D ? . O 1
   HETATM 2144 O . HOH A 2066 ? 28.76832 -24.48052 15.17359 0.868 13.03037 O ? D ? . O 1
   HETATM 2145 O . HOH A 2067 ? 14.53816 -10.86040 9.54134 0.535 19.76139 O ? D ? . O 1
   HETATM 2146 O . HOH A 2068 ? 6.65583 -14.19455 10.48782 0.768 15.78517 O ? D ? . O 1
   HETATM 2147 O . HOH A 2069 ? 6.47928 -12.93263 8.22843 0.966 40.18264 O ? D ? . O 1
   HETATM 2149 O . HOH A 2072 ? 18.57283 -9.52555 7.30162 0.713 11.33114 O ? D ? . O 1
   HETATM 2152 O . HOH A 2075 ? 19.63522 -13.31714 1.20354 0.573 15.51769 O ? D ? . O 1
   HETATM 2154 O . HOH A 2079 ? 20.33812 -27.16660 17.00109 0.929 24.53640 O ? D ? . O 1
   HETATM 2155 O . HOH A 2080 ? 24.06608 -25.48059 19.87281 0.834 13.13479 O ? D ? . O 1
   HETATM 2156 O . HOH A 2081 ? 22.47733 -23.53933 22.96857 0.843 8.93122 O ? D ? . O 1
   HETATM 2157 O . HOH A 2083 ? 18.55510 -29.77843 20.23641 0.852 17.46766 O ? D ? . O 1
   HETATM 2159 O . HOH A 2085 ? 18.73201 -28.66949 24.01127 0.776 15.46802 O ? D ? . O 1
   HETATM 2161 O . HOH A 2087 ? 20.76453 -25.79179 22.81889 0.686 17.39830 O ? D ? . O 1
   HETATM 2162 O . HOH A 2088 ? 14.18506 -22.70942 25.62809 0.845 8.80403 O ? D ? . O 1
   HETATM 2164 O . HOH A 2090 ? 16.17766 -18.31626 25.11036 0.879 11.28302 O ? D ? . O 1
   HETATM 2165 O . HOH A 2091 ? 21.67331 -17.14268 25.16984 0.823 9.21928 O ? D ? . O 1
   HETATM 2166 O . HOH A 2093 ? 26.58542 -30.30972 -10.80435 0.757 13.86416 O ? D ? . O 1
   HETATM 2167 O . HOH A 2094 ? 25.57146 -27.15891 -13.79488 0.830 20.51463 O ? D ? . O 1
   HETATM 2168 O . HOH A 2095 ? 19.36703 -18.74896 -10.74391 0.746 19.71869 O ? D ? . O 1
   HETATM 2169 O . HOH A 2096 ? 15.70463 -18.73257 -8.29982 0.842 25.12195 O ? D ? . O 1
   HETATM 2170 O . HOH A 2097 ? 15.41383 -31.52178 18.75998 0.779 17.95077 O ? D ? . O 1
   HETATM 2172 O . HOH A 2099 ? 14.02218 -33.42694 1.77803 0.739 17.08821 O ? D ? . O 1
   HETATM 2173 O . HOH A 2100 ? 6.96850 -27.68059 27.64609 0.863 8.58189 O ? D ? . O 1
   HETATM 2174 O . HOH A 2102 ? 5.59466 -32.44287 29.91979 0.772 15.79008 O ? D ? . O 1
   HETATM 2175 O . HOH A 2103 ? 14.88478 -30.03822 30.81838 0.876 15.50917 O ? D ? . O 1
   HETATM 2176 O . HOH A 2104 ? 12.69103 -32.77393 33.02658 0.825 13.10573 O ? D ? . O 1
   HETATM 2177 O . HOH A 2105 ? 14.26736 -30.29457 33.98327 0.828 19.96159 O ? D ? . O 1
   HETATM 2179 O . HOH A 2108 ? 16.13872 -31.78301 28.85231 0.570 17.30879 O ? D ? . O 1
   HETATM 2180 O . HOH A 2110 ? 0.50559 -14.91648 13.24578 0.834 16.75459 O ? D ? . O 1
   HETATM 2181 O . HOH A 2111 ? 9.32990 -22.06842 27.63022 0.936 8.74350 O ? D ? . O 1
   HETATM 2182 O . HOH A 2112 ? 11.53668 -23.46644 30.09068 0.928 8.14119 O ? D ? . O 1
   HETATM 2183 O . HOH A 2113 ? 2.79347 -24.30627 30.02628 0.815 23.04750 O ? D ? . O 1
   HETATM 2184 O . HOH A 2114 ? 2.71640 -19.73009 28.97090 0.999 20.40342 O ? D ? . O 1
   HETATM 2186 O . HOH A 2116 ? 5.12435 -19.14176 22.46113 0.955 8.59186 O ? D ? . O 1
   HETATM 2187 O . HOH A 2117 ? 4.10322 -16.27140 29.03914 0.875 13.11178 O ? D ? . O 1
   HETATM 2188 O . HOH A 2119 ? 8.41117 -14.69545 30.50420 0.496 12.06806 O ? D ? . O 1
   HETATM 2189 O . HOH A 2120 ? -4.88881 -26.03585 23.99185 0.788 21.54377 O ? D ? . O 1
   HETATM 2191 O . HOH A 2122 ? 5.96880 -36.10873 15.42909 0.955 27.36081 O ? D ? . O 1
   HETATM 2192 O . HOH A 2123 ? 13.36103 -31.02143 14.84724 0.836 18.57086 O ? D ? . O 1
   HETATM 2193 O . HOH A 2124 ? 14.91607 -33.61236 11.19996 0.905 23.75122 O ? D ? . O 1
   HETATM 2194 O . HOH A 2126 ? 3.33863 -14.26443 24.60444 0.830 12.57940 O ? D ? . O 1
   HETATM 2195 O . HOH A 2127 ? 7.59331 -12.28677 24.40078 0.773 10.65207 O ? D ? . O 1
   HETATM 2196 O . HOH A 2128 ? 13.26825 -15.77363 25.60914 0.803 11.24394 O ? D ? . O 1
   HETATM 2197 O . HOH A 2129 ? 14.87635 -17.22813 27.36862 0.828 12.68681 O ? D ? . O 1
   HETATM 2198 O . HOH A 2130 ? 14.06690 -20.21872 24.43524 0.775 10.92215 O ? D ? . O 1
   HETATM 2199 O . HOH A 2132 ? 14.39112 -35.06950 8.90605 0.798 19.88571 O ? D ? . O 1
   HETATM 2200 O . HOH A 2134 ? 16.55771 -34.56606 2.32166 0.778 16.92320 O ? D ? . O 1
   HETATM 2201 O . HOH A 2135 ? 7.81996 -15.42946 17.75587 0.852 9.02631 O ? D ? . O 1
   HETATM 2202 O . HOH A 2136 ? 1.29022 -12.92750 20.77552 0.815 24.30284 O ? D ? . O 1
   HETATM 2203 O . HOH A 2137 ? 4.22265 -9.93890 23.08309 0.921 22.21633 O ? D ? . O 1
   HETATM 2204 O . HOH A 2138 ? 13.25545 -11.28909 21.08014 0.837 11.42239 O ? D ? . O 1
   HETATM 2205 O . HOH A 2139 ? 14.68071 -14.38845 23.63254 0.692 17.17053 O ? D ? . O 1
   HETATM 2206 O . HOH A 2140 ? 24.96237 -27.85027 16.08036 0.702 19.45293 O ? D ? . O 1
   HETATM 2208 O . HOH A 2142 ? 9.02187 -14.55769 15.37770 0.890 9.12012 O ? D ? . O 1
   HETATM 2209 O . HOH A 2144 ? 14.96796 -9.93170 16.63230 0.763 16.45442 O ? D ? . O 1
   HETATM 2210 O . HOH A 2145 ? 8.38591 -10.93899 22.22721 0.906 18.62370 O ? D ? . O 1
   HETATM 2211 O . HOH A 2146 ? 11.19552 -9.90340 22.28061 0.689 26.18289 O ? D ? . O 1
   HETATM 2212 O . HOH A 2147 ? 6.50960 -12.07741 17.29370 0.753 23.86463 O ? D ? . O 1
   HETATM 2213 O . HOH A 2148 ? 6.88350 -12.80178 14.72508 0.822 22.67111 O ? D ? . O 1
   HETATM 2214 O . HOH A 2149 ? 13.71084 -15.64678 7.97270 0.537 18.38178 O ? D ? . O 1
   HETATM 2216 O . HOH A 2151 ? 13.05277 -13.05650 8.60549 0.825 16.11063 O ? D ? . O 1
   HETATM 2217 O . HOH A 2152 ? 6.61745 -12.10762 12.16777 0.792 19.41985 O ? D ? . O 1
   HETATM 2220 O . HOH A 2155 ? 13.07685 -10.28748 11.79992 1.000 36.31237 O ? D ? . O 1
   HETATM 2221 O . HOH A 2156 ? 17.41803 -10.60187 9.65185 0.875 9.75038 O ? D ? . O 1
   HETATM 2223 O . HOH A 2158 ? 20.88094 -13.43003 3.79969 0.790 13.30357 O ? D ? . O 1
   HETATM 2224 O . HOH A 2159 ? 22.43663 -17.93531 -0.77080 0.768 12.22179 O ? D ? . O 1
   HETATM 2225 O . HOH A 2160 ? 21.26544 -14.16928 -0.60479 0.604 19.56885 O ? D ? . O 1
   HETATM 2226 O . HOH A 2162 ? 28.69312 -13.29655 0.37395 0.906 10.34437 O ? D ? . O 1
   HETATM 2228 O . HOH A 2164 ? 24.20659 -18.03139 -2.87054 0.914 13.24156 O ? D ? . O 1
   HETATM 2229 O . HOH A 2165 ? 26.38260 -16.40235 -5.17405 0.655 15.43295 O ? D ? . O 1
   HETATM 2231 O . HOH A 2169 ? 36.43500 -18.57371 -2.61846 0.947 16.44808 O ? D ? . O 1
   HETATM 2232 O . HOH A 2171 ? 37.26487 -19.42771 1.57233 0.799 11.64236 O ? D ? . O 1
   HETATM 2233 O . HOH A 2172 ? 32.73408 -23.94028 -1.37154 0.863 12.58050 O ? D ? . O 1
   HETATM 2234 O . HOH A 2174 ? 37.71941 -26.32972 3.30602 0.876 19.93383 O ? D ? . O 1
   HETATM 2235 O . HOH A 2175 ? 36.25127 -26.41978 6.72306 0.867 28.05458 O ? D ? . O 1
   HETATM 2236 O . HOH A 2176 ? 30.29832 -27.94843 9.02808 0.919 20.00043 O ? D ? . O 1
   HETATM 2237 O . HOH A 2177 ? 26.25889 -33.31629 2.03868 0.690 20.33849 O ? D ? . O 1
   HETATM 2238 O . HOH A 2178 ? 30.07999 -31.42960 -3.72532 0.866 23.00259 O ? D ? . O 1
   HETATM 2240 O . HOH A 2180 ? 29.47897 -27.26313 -8.75151 0.732 13.14644 O ? D ? . O 1
   HETATM 2242 O . HOH A 2182 ? 29.02544 -30.09742 -9.46889 0.866 15.81713 O ? D ? . O 1
   HETATM 2243 O . HOH A 2183 ? 23.60453 -19.66426 -4.89915 0.901 11.44925 O ? D ? . O 1
   HETATM 2244 O . HOH A 2184 ? 26.14041 -18.96806 -8.88701 0.630 17.70062 O ? D ? . O 1
   HETATM 2246 O . HOH A 2186 ? 25.27946 -23.03955 -13.07591 0.688 21.85487 O ? D ? . O 1
   HETATM 2247 O . HOH A 2187 ? 25.60368 -27.76214 -11.14048 0.731 12.89262 O ? D ? . O 1
   HETATM 2251 O . HOH A 2193 ? 20.92772 -19.32402 -4.52615 0.826 11.63376 O ? D ? . O 1
   HETATM 2252 O . HOH A 2194 ? 18.38455 -18.36164 -8.30094 0.690 18.16087 O ? D ? . O 1
   HETATM 2253 O . HOH A 2195 ? 15.01083 -24.84321 -8.56174 0.752 23.85593 O ? D ? . O 1
   HETATM 2254 O . HOH A 2196 ? 14.63102 -20.58704 -6.68577 0.847 19.47320 O ? D ? . O 1
   HETATM 2256 O . HOH A 2198 ? 15.73906 -27.19055 -4.36804 0.731 12.97869 O ? D ? . O 1
   HETATM 2257 O . HOH A 2199 ? 14.35745 -26.76534 -6.69979 0.886 18.81396 O ? D ? . O 1
   HETATM 2260 O . HOH A 2202 ? 13.30831 -22.74700 -8.67879 0.778 21.04339 O ? D ? . O 1
   HETATM 2261 O . HOH A 2203 ? 13.29705 -19.07307 -4.64348 0.631 29.14089 O ? D ? . O 1
   HETATM 2262 O . HOH A 2204 ? 10.96960 -24.05016 -8.00125 0.845 17.62170 O ? D ? . O 1
   HETATM 2264 O . HOH A 2206 ? 15.91425 -26.94583 3.21033 0.768 11.65442 O ? D ? . O 1
   HETATM 2265 O . HOH A 2208 ? 14.36586 -30.86381 0.31734 0.846 14.20970 O ? D ? . O 1
   HETATM 2266 O . HOH A 2209 ? 18.81269 -29.68376 -3.64975 0.645 17.15599 O ? D ? . O 1
   HETATM 2268 O . HOH A 2211 ? 20.05130 -18.11577 -2.12209 0.804 12.41939 O ? D ? . O 1
   HETATM 2271 O . HOH A 2214 ? 10.81732 -17.36183 2.30234 0.464 12.52182 O ? D ? . O 1
   HETATM 2272 O . HOH A 2215 ? 10.05801 -17.52725 -1.99697 0.705 14.54035 O ? D ? . O 1
   HETATM 2276 O . HOH A 2221 ? 7.46436 -24.63439 10.75537 0.701 8.33989 O ? D ? . O 1
   HETATM 2277 O . HOH A 2222 ? 9.79922 -29.53045 6.81742 0.851 13.17480 O ? D ? . O 1
   HETATM 2278 O . HOH A 2223 ? 4.44869 -15.76276 11.19967 0.781 11.14236 O ? D ? . O 1
   HETATM 2279 O . HOH A 2224 ? 2.10300 -22.49320 12.91090 0.882 16.65285 O ? D ? . O 1
   HETATM 2280 O . HOH A 2225 ? 3.60744 -26.83273 11.43524 0.513 13.00095 O ? D ? . O 1
   HETATM 2281 O . HOH A 2226 ? 9.02940 -15.53219 10.78359 0.704 11.59984 O ? D ? . O 1
   HETATM 2282 O . HOH A 2227 ? -0.16436 -16.66604 15.17595 0.963 15.26417 O ? D ? . O 1
   HETATM 2283 O . HOH A 2228 ? 0.19867 -21.54485 14.32173 0.785 17.11312 O ? D ? . O 1
   HETATM 2284 O . HOH A 2229 ? 2.61380 -16.17642 22.73403 0.846 12.13497 O ? D ? . O 1
   HETATM 2285 O . HOH A 2231 ? 3.25387 -14.51598 13.34041 0.796 13.03972 O ? D ? . O 1
   HETATM 2286 O . HOH A 2232 ? 2.64377 -11.32287 15.74418 0.934 38.31613 O ? D ? . O 1
   HETATM 2287 O . HOH A 2233 ? -0.06939 -16.12428 23.19527 0.878 29.56557 O ? D ? . O 1
   HETATM 2290 O . HOH A 2237 ? -3.27478 -30.56305 23.55030 0.716 17.02761 O ? D ? . O 1
   HETATM 2291 O . HOH A 2239 ? -3.20942 -27.56928 22.54424 0.726 21.95388 O ? D ? . O 1
   HETATM 2292 O . HOH A 2240 ? 1.62861 -31.19928 17.33422 0.802 13.42199 O ? D ? . O 1
   HETATM 2294 O . HOH A 2242 ? 2.40874 -25.44430 13.51539 0.854 17.55704 O ? D ? . O 1
   HETATM 2295 O . HOH A 2245 ? 3.73689 -32.86120 16.49084 0.912 15.49915 O ? D ? . O 1
   HETATM 2296 O . HOH A 2249 ? 6.37911 -31.92004 12.83114 0.853 17.17865 O ? D ? . O 1
   HETATM 2297 O . HOH A 2250 ? 8.33860 -32.36295 10.85304 0.780 21.74182 O ? D ? . O 1
   HETATM 2298 O . HOH A 2251 ? 12.81481 -32.68513 12.66377 0.857 18.46514 O ? D ? . O 1
   HETATM 2299 O . HOH A 2253 ? 11.26567 -32.23302 16.61776 0.846 16.25750 O ? D ? . O 1
   HETATM 2300 O . HOH A 2254 ? 8.54757 -31.82652 8.04936 0.860 19.34782 O ? D ? . O 1
   HETATM 2301 O . HOH A 2255 ? 4.17111 -28.48529 7.24713 0.786 14.43143 O ? D ? . O 1
   HETATM 2302 O . HOH A 2256 ? 15.18135 -33.65071 6.59872 0.886 14.23201 O ? D ? . O 1
   HETATM 2303 O . HOH A 2257 ? 12.02485 -30.43439 4.92671 0.769 23.40891 O ? D ? . O 1
   HETATM 2304 O . HOH A 2258 ? 12.13281 -28.14273 3.69382 0.765 13.77290 O ? D ? . O 1
   HETATM 2305 O . HOH A 2259 ? 18.52641 -28.40441 13.15045 0.757 18.04418 O ? D ? . O 1
   HETATM 2306 O . HOH A 2260 ? 17.08456 -34.85279 4.98638 0.780 16.16715 O ? D ? . O 1
   HETATM 2307 O . HOH A 2261 ? 18.56477 -33.28213 1.06068 0.874 14.82493 O ? D ? . O 1
   HETATM 2309 O . HOH A 2264 ? 21.21530 -28.48060 12.18386 0.808 24.05064 O ? D ? . O 1
   HETATM 2310 O . HOH A 2265 ? 21.80470 -31.21332 10.03446 1.000 19.61211 O ? D ? . O 1
   HETATM 2311 O . HOH A 2266 ? 20.53827 -34.98918 0.14332 0.849 20.29768 O ? D ? . O 1
   HETATM 2312 O . HOH A 2267 ? 22.16170 -33.38030 8.52185 0.733 27.37714 O ? D ? . O 1
   HETATM 2313 O . HOH A 2268 ? 27.69687 -31.81776 6.99530 0.496 13.84677 O ? D ? . O 1
   HETATM 2314 O . HOH A 2269 ? 24.40852 -28.68209 12.14721 0.873 18.18084 O ? D ? . O 1
   HETATM 2317 O . HOH A 2272 ? 30.08503 -25.33054 8.54804 0.839 9.86886 O ? D ? . O 1
   HETATM 2318 O . HOH A 2274 ? 32.49136 -22.98000 13.96364 0.780 26.12426 O ? D ? . O 1
   HETATM 4542 O . HOH S 2275 ? 11.07470 -22.15838 -1.80602 0.607 10.04724 O ? E ? . O 1
   HETATM 4543 O . HOH S 2276 ? 10.84053 -26.18956 -4.15658 0.737 13.88477 O ? E ? . O 1
   HETATM 4544 O . HOH S 2277 ? 24.50251 -8.72355 0.96847 0.741 17.81316 O ? E ? . O 1
   HETATM 4545 O . HOH S 2278 ? 25.35265 -11.72065 -1.28009 0.970 20.34668 O ? E ? . O 1
   HETATM 4546 O . HOH S 2279 ? 19.47985 -24.90172 -9.59077 0.822 15.55673 O ? E ? . O 1
   HETATM 4547 O . HOH S 2280 ? 9.55603 -20.40168 -0.63748 0.814 23.76105 O ? E ? . O 1
   HETATM 4549 O . HOH S 2282 ? -0.38095 -24.28986 24.52391 0.724 20.83903 O ? E ? . O 1
   HETATM 4551 O . HOH S 2284 ? 36.84835 -18.48916 7.12052 0.713 23.27129 O ? E ? . O 1
   HETATM 4552 O . HOH S 2285 ? 8.59063 -31.84929 16.95453 0.850 21.31132 O ? E ? . O 1
   HETATM 4553 O . HOH S 2286 ? 21.70991 -29.07884 -6.26120 0.796 19.30528 O ? E ? . O 1
   HETATM 4557 O . HOH S 2290 ? 23.84656 -8.24236 3.38599 0.547 14.04641 O ? E ? . O 1
   HETATM 4558 O . HOH S 2291 ? 28.36525 -17.58364 -8.31081 0.515 16.18589 O ? E ? . O 1
   HETATM 4560 O . HOH S 2293 ? 10.62542 -14.25747 8.81973 0.461 12.71930 O ? E ? . O 1
   HETATM 4562 O . HOH S 2295 ? 14.87746 -9.84205 19.35671 0.754 21.66308 O ? E ? . O 1
   HETATM 4563 O . HOH S 2296 ? 33.90650 -26.15280 0.68856 0.387 20.68959 O ? E ? . O 1
   HETATM 4566 O . HOH S 2299 ? 33.32976 -25.37870 11.43953 0.552 21.74552 O ? E ? . O 1
   HETATM 4568 O . HOH S 2301 ? 24.67945 -14.82965 -1.15852 0.413 17.66517 O ? E ? . O 1
   HETATM 4569 O . HOH S 2302 ? 22.08149 -25.69783 -12.42382 1.000 33.76850 O ? E ? . O 1
   HETATM 4571 O . HOH S 2304 ? 10.73599 -33.72169 11.57101 0.999 35.26518 O ? E ? . O 1
   HETATM 4572 O . HOH S 2305 ? 36.91545 -11.40397 9.52151 0.714 20.93420 O ? E ? . O 1
   HETATM 4574 O . HOH S 2307 ? 12.64052 -32.88433 4.09532 0.828 27.69301 O ? E ? . O 1
   HETATM 4576 O . HOH S 2309 ? 36.26064 -20.30094 9.00425 0.684 25.26303 O ? E ? . O 1
   HETATM 4577 O . HOH S 2310 ? -2.85625 -23.06886 23.54195 0.835 33.79206 O ? E ? . O 1
   HETATM 4579 O . HOH S 2312 ? 16.76420 -33.74899 19.76655 0.763 31.56229 O ? E ? . O 1
   HETATM 4580 O . HOH S 2313 ? -0.51920 -19.63937 25.63591 0.732 21.57811 O ? E ? . O 1
   HETATM 4581 O . HOH S 2314 ? 37.92638 -8.00733 7.32363 0.913 30.07504 O ? E ? . O 1
   HETATM 4583 O . HOH S 2316 ? 0.91222 -12.78813 23.52932 0.974 38.16237 O ? E ? . O 1
   HETATM 4586 O . HOH S 2319 ? 23.48023 -25.76334 -14.73454 0.999 28.82691 O ? E ? . O 1
   HETATM 4587 O . HOH S 2320 ? 0.86961 -25.23152 28.67966 0.715 27.86029 O ? E ? . O 1
   HETATM 4588 O . HOH S 2321 ? 38.89982 -6.39406 0.25355 0.647 23.76038 O ? E ? . O 1
   HETATM 4589 O . HOH S 2322 ? 24.35807 -31.08794 -9.32451 0.609 24.37908 O ? E ? . O 1
   HETATM 4590 O . HOH S 2323 ? -0.07275 -23.51295 27.01357 0.574 21.27144 O ? E ? . O 1
   HETATM 4593 O . HOH S 2326 ? 30.58437 -32.45400 -6.78462 0.508 24.90867 O ? E ? . O 1
   HETATM 4595 O . HOH S 2328 ? 13.81547 -13.63635 2.03212 0.933 32.46702 O ? E ? . O 1
   HETATM 4602 O . HOH S 2335 ? 12.89378 -34.89123 5.75843 0.416 18.65271 O ? E ? . O 1
   HETATM 4604 O . HOH S 2337 ? -0.61866 -28.25868 15.41508 0.612 31.62260 O ? E ? . O 1
   HETATM 4605 O . HOH S 2338 ? 17.21901 -14.44147 0.36626 1.000 43.97937 O ? E ? . O 1
   HETATM 4614 O . HOH S 2347 ? -3.16487 -27.61021 15.84658 0.545 25.02078 O ? E ? . O 1
   HETATM 4619 O . HOH S 2352 ? -1.72289 -14.79290 21.21357 0.668 29.77708 O ? E ? . O 1
   HETATM 4627 O . HOH S 2360 ? 2.16500 -22.18887 29.03588 0.288 18.18941 O ? E ? . O 1
   HETATM 4628 O . HOH S 2361 ? 28.84017 -29.48425 10.76195 0.723 34.97302 O ? E ? . O 1
   HETATM 4629 O . HOH S 2362 ? 9.10204 -12.54564 7.24727 0.684 28.67023 O ? E ? . O 1
   HETATM 4633 O . HOH S 2366 ? 10.61018 -34.79750 20.20796 0.770 27.88250 O ? E ? . O 1
   HETATM 4636 O . HOH S 2369 ? 48.23067 -12.23414 2.76426 0.657 31.77187 O ? E ? . O 1
   HETATM 4643 O . HOH S 2376 ? 3.55113 -19.50878 31.63912 0.681 26.49564 O ? E ? . O 1
   HETATM 4653 O . HOH S 2386 ? 2.24114 -8.14834 23.64945 0.827 41.99785 O ? E ? . O 1
   HETATM 4660 O . HOH S 2393 ? 12.09364 -16.83711 -5.18850 0.964 44.63159 O ? E ? . O 1
   HETATM 4668 O . HOH S 2401 ? 6.27525 -13.37810 5.69119 0.376 26.34792 O ? E ? . O 1
   HETATM 4730 O . HOH S 2406 ? 17.09667 -13.88906 3.69879 0.731 25.57046 O ? F ? . O 1
   HETATM 4731 O . HOH S 2407 ? 13.28246 -13.80914 27.24607 0.605 21.58685 O ? F ? . O 1
   HETATM 4732 O . HOH S 2408 ? 0.00528 -30.89475 15.13117 0.541 18.65844 O ? F ? . O 1
   HETATM 4736 O . HOH S 2412 ? 4.18516 -14.16463 30.47519 0.637 18.46140 O ? F ? . O 1
   HETATM 4742 O . HOH S 2418 ? 18.23162 -11.09998 5.20821 0.587 19.86028 O ? F ? . O 1
   HETATM 4743 O . HOH S 2419 ? 20.14529 -15.50392 -2.75191 0.661 45.93710 O ? F ? . O 1
   HETATM 4755 O . HOH S 2431 ? 19.02910 -32.41898 20.69683 0.465 25.95824 O ? F ? . O 1
   HETATM 4760 O . HOH S 2436 ? 12.00648 -35.43452 10.07122 0.485 23.99715 O ? F ? . O 1
   HETATM 4790 O . HOH S 2466 ? 22.91858 -31.03254 -5.09940 0.857 44.82452 O ? F ? . O 1
   HETATM 4792 O . HOH S 2468 ? 17.93997 -31.40208 24.35578 0.523 25.48613 O ? F ? . O 1
   HETATM 4801 O . HOH S 2477 ? 6.18511 -33.39640 17.18374 0.375 23.06460 O ? F ? . O 1
   HETATM 4828 O . HOH S 2495 ? 17.47948 -25.10050 26.86251 0.948 8.96715 O ? G ? . O 1
   HETATM 4829 O . HOH S 2496 ? 15.89968 -27.53905 30.26233 0.996 9.23193 O ? G ? . O 1
   HETATM 4830 O . HOH S 2497 ? 38.45527 -20.05776 6.55245 0.536 14.04613 O ? G ? . O 1
   HETATM 4834 O . HOH S 2501 ? 16.38138 -16.12055 23.50251 0.521 14.68451 O ? G ? . O 1
   HETATM 4836 O . HOH S 2503 ? 13.85158 -25.91461 3.28449 0.309 10.47358 O ? G ? . O 1
   HETATM 4837 O . HOH S 2504 ? 21.10423 -8.40463 7.12806 0.431 13.69913 O ? G ? . O 1
   HETATM 4845 O . HOH S 2512 ? -6.29768 -23.23608 15.57524 0.531 20.79137 O ? G ? . O 1
   HETATM 4848 O . HOH S 2515 ? 20.78609 -28.13077 21.14862 0.504 16.35789 O ? G ? . O 1
   HETATM 4849 O . HOH S 2516 ? 46.55460 -14.13089 3.78186 0.678 28.10017 O ? G ? . O 1
   HETATM 4850 O . HOH S 2517 ? 1.41651 -22.04755 33.73147 0.519 20.25855 O ? G ? . O 1
   HETATM 4856 O . HOH S 2523 ? 22.18224 -27.18308 19.02168 0.514 25.09346 O ? G ? . O 1
   HETATM 4857 O . HOH S 2524 ? 36.21241 -13.87490 -3.73713 0.469 20.12695 O ? G ? . O 1
   HETATM 4860 O . HOH S 2527 ? 0.86198 -24.40999 11.72991 0.387 21.05930 O ? G ? . O 1
   HETATM 4861 O . HOH S 2528 ? 6.61352 -15.17276 32.47015 0.340 17.46245 O ? G ? . O 1
   HETATM 4869 O . HOH S 2536 ? 32.01589 -31.41923 -1.67305 0.353 19.48158 O ? G ? . O 1
   HETATM 4872 O . HOH S 2539 ? 41.55025 -12.92347 5.95523 0.400 22.03090 O ? G ? . O 1
   HETATM 4881 O . HOH S 2548 ? 38.04915 -27.75882 8.05907 0.516 27.39061 O ? G ? . O 1
   HETATM 4885 O . HOH S 2552 ? 11.94342 -14.95217 2.82203 0.504 34.14711 O ? G ? . O 1
   HETATM 4887 O . HOH S 2554 ? 2.19358 -17.61192 30.29166 0.309 19.04413 O ? G ? . O 1
   HETATM 4890 O . HOH S 2557 ? 7.22321 -35.65367 19.14148 0.458 29.73679 O ? G ? . O 1
   HETATM 4893 O . HOH S 2560 ? 31.50020 -30.89385 7.67648 0.421 22.04034 O ? G ? . O 1
   HETATM 4940 O . HOH S 2580 ? 4.99414 -22.00718 32.14273 0.846 14.05543 O ? H ? . O 1
   HETATM 4941 O . HOH S 2581 ? 32.11512 -33.69130 0.42615 0.984 34.41906 O ? H ? . O 1
   HETATM 4942 O . HOH S 2582 ? 5.11285 -30.20915 30.14047 0.423 13.25082 O ? H ? . O 1
   HETATM 4945 O . HOH S 2585 ? 25.22380 -32.97020 8.69981 0.509 25.62130 O ? H ? . O 1
   HETATM 4951 O . HOH S 2591 ? 40.61037 -5.61474 -1.89191 0.824 37.72715 O ? H ? . O 1
   HETATM 4956 O . HOH S 2596 ? 23.75286 -31.22343 11.80432 0.500 22.17954 O ? H ? . O 1
   HETATM 4959 O . HOH S 2599 ? 34.74710 -19.50163 10.89627 0.260 16.78630 O ? H ? . O 1
   HETATM 4961 O . HOH S 2601 ? 17.39231 -32.11908 12.14656 0.469 18.62531 O ? H ? . O 1
   HETATM 4963 O . HOH S 2603 ? 0.66162 -27.34340 27.24161 0.422 23.05709 O ? H ? . O 1
   HETATM 4994 O . HOH S 2634 ? 36.36633 -27.73965 4.64295 0.207 16.79925 O ? H ? . O 1
   HETATM 5000 O . HOH S 2640 ? 23.76984 -33.34380 6.65603 0.268 19.71074 O ? H ? . O 1
   HETATM 5018 O . HOH S 2658 ? 40.94717 -12.30487 10.09226 0.572 37.61955 O ? H ? . O 1
   HETATM 5024 O . HOH S 2660 ? 32.86526 -18.12508 12.61583 0.792 14.80264 O ? I ? . O 1
   HETATM 5030 O . HOH S 2666 ? 25.93884 -32.93846 5.44394 0.640 27.43353 O ? I ? . O 1
   HETATM 5031 O . HOH S 2667 ? 22.76070 -15.61311 -3.54689 0.563 19.76176 O ? I ? . O 1
   HETATM 5038 O . HOH S 2674 ? 10.39524 -14.60975 6.51338 0.420 19.39767 O ? I ? . O 1
   HETATM 5042 O . HOH S 2678 ? 18.13549 -13.81756 -3.23334 0.514 23.30001 O ? I ? . O 1
   HETATM 5055 O . HOH S 2691 ? 10.19123 -35.98833 17.70612 0.729 38.19026 O ? I ? . O 1
   HETATM 5080 O . HOH S 2716 ? 12.28223 -16.16642 -7.80501 0.427 33.83226 O ? I ? . O 1

data_comp_PCA
loop_
  _chem_comp_atom.comp_id
  _chem_comp_atom.atom_id
  _chem_comp_atom.type_symbol
  _chem_comp_atom.type_energy
  _chem_comp_atom.charge
  _chem_comp_atom.partial_charge
  _chem_comp_atom.x
  _chem_comp_atom.y
  _chem_comp_atom.z
   PCA N N NH1 0 -0.599 38.6874 57.7792 68.0159
   PCA CA C CH1 0 -0.205 38.4569 58.9100 67.1424
   PCA CB C CH2 0 -0.462 37.3719 59.6735 67.9229
   PCA CG C CH2 0 -0.585 37.6997 59.3562 69.3782
   PCA CD C C 0 0.504 38.4098 58.0175 69.3102
   PCA OE O O 0 -0.496 38.6835 57.2922 70.2534
   PCA C C C 0 0.403 39.7108 59.7897 66.9084
   PCA O O O 0 -0.591 40.7127 59.5622 67.6083
   PCA OXT O OC -1 -0.610 39.5709 60.6688 66.0354
   PCA H H HNH1 0 0.381 39.3244 57.0403 67.7597
   PCA HA H HCH1 0 0.243 38.0756 58.5717 66.1760
   PCA HB2 H HCH2 0 0.245 37.3714 60.7375 67.6953
   PCA HB3 H HCH2 0 0.244 36.3857 59.2806 67.6690
   PCA HG2 H HCH2 0 0.265 38.3893 60.0857 69.8122
   PCA HG3 H HCH2 0 0.263 36.8289 59.3089 70.0317

loop_
  _chem_comp_bond.comp_id
  _chem_comp_bond.atom_id_1
  _chem_comp_bond.atom_id_2
  _chem_comp_bond.type
  _chem_comp_bond.value_dist
  _chem_comp_bond.value_dist_esd
  _chem_comp_bond.value_dist_neutron
   PCA N CA single 1.458 0.019 1.458
   PCA N CD single 1.345 0.020 1.345
   PCA N H single 0.860 0.020 0.860
   PCA CA CB single 1.530 0.020 1.530
   PCA CA C single 1.525 0.021 1.525
   PCA CA HA single 0.970 0.020 0.970
   PCA CB CG single 1.525 0.020 1.525
   PCA CB HB2 single 0.970 0.020 1.090
   PCA CB HB3 single 0.970 0.020 1.090
   PCA CG CD single 1.517 0.020 1.517
   PCA CG HG2 single 0.970 0.020 1.090
   PCA CG HG3 single 0.970 0.020 1.090
   PCA CD OE double 1.221 0.020 1.221
   PCA C O deloc 1.231 0.020 1.231
   PCA C OXT deloc 1.247 0.020 1.247

loop_
  _chem_comp_angle.comp_id
  _chem_comp_angle.atom_id_1
  _chem_comp_angle.atom_id_2
  _chem_comp_angle.atom_id_3
  _chem_comp_angle.value_angle
  _chem_comp_angle.value_angle_esd
   PCA H N CD 120.30 3.000
   PCA H N CA 114.00 3.000
   PCA CD N CA 114.17 3.000
   PCA HA CA C 109.00 3.000
   PCA HA CA CB 109.00 3.000
   PCA C CA CB 110.10 1.900
   PCA HA CA N 110.00 3.000
   PCA C CA N 111.00 2.800
   PCA CB CA N 110.50 1.700
   PCA HB3 CB HB2 107.63 3.000
   PCA HB3 CB CG 109.95 3.000
   PCA HB2 CB CG 113.77 3.000
   PCA HB3 CB CA 109.90 3.000
   PCA HB2 CB CA 112.29 3.000
   PCA CG CB CA 103.25 3.000
   PCA HG3 CG HG2 107.15 3.000
   PCA HG3 CG CD 111.26 3.000
   PCA HG2 CG CD 108.14 3.000
   PCA HG3 CG CB 114.17 3.000
   PCA HG2 CG CB 112.05 3.000
   PCA CD CG CB 103.97 3.000
   PCA OE CD CG 126.48 3.000
   PCA OE CD N 126.29 3.000
   PCA CG CD N 107.23 3.000
   PCA OXT C O 127.86 3.000
   PCA OXT C CA 114.54 3.000
   PCA O C CA 120.80 1.700

loop_
  _chem_comp_tor.comp_id
  _chem_comp_tor.id
  _chem_comp_tor.atom_id_1
  _chem_comp_tor.atom_id_2
  _chem_comp_tor.atom_id_3
  _chem_comp_tor.atom_id_4
  _chem_comp_tor.value_angle
  _chem_comp_tor.value_angle_esd
  _chem_comp_tor.period
   PCA CONST_01 CG CD N CA 0.00 0.0 0
   PCA CONST_02 OE CD N CA 180.00 0.0 0
   PCA CONST_03 H N CD CG 180.00 0.0 0
   PCA Var_01 CB CG CD N 11.43 30.0 1
   PCA Var_02 CD CG CB CA -26.44 30.0 1
   PCA Var_03 HB2 CB CA N 154.14 30.0 1
   PCA Var_04 HB3 CB CA N -86.09 30.0 1
   PCA Var_05 HA CA CB CG 148.19 30.0 1

loop_
  _chem_comp_chir.comp_id
  _chem_comp_chir.id
  _chem_comp_chir.atom_id_centre
  _chem_comp_chir.atom_id_1
  _chem_comp_chir.atom_id_2
  _chem_comp_chir.atom_id_3
  _chem_comp_chir.volume_sign
   PCA chir_01 CA N CB C negativ

loop_
  _chem_comp_plane_atom.comp_id
  _chem_comp_plane_atom.plane_id
  _chem_comp_plane_atom.atom_id
  _chem_comp_plane_atom.dist_esd
   PCA plan-1 N 0.020
   PCA plan-1 CA 0.020
   PCA plan-1 CG 0.020
   PCA plan-1 CD 0.020
   PCA plan-1 OE 0.020
   PCA plan-1 H 0.020
   PCA plan-2 CA 0.020
   PCA plan-2 C 0.020
   PCA plan-2 O 0.020
   PCA plan-2 OXT 0.020

loop_
  _chem_comp_plane.comp_id
  _chem_comp_plane.id
   PCA plan-1
   PCA plan-2

loop_
  _chem_comp.id
  _chem_comp.three_letter_code
  _chem_comp.name
  _chem_comp.group
  _chem_comp.number_atoms_all
  _chem_comp.number_atoms_nh
  _chem_comp.desc_level
   PCA PCA '5-oxo-L-proline          ' L-peptide 15 9 .

data_comp_HEC
loop_
  _chem_comp_atom.comp_id
  _chem_comp_atom.atom_id
  _chem_comp_atom.type_symbol
  _chem_comp_atom.type_energy
  _chem_comp_atom.partial_charge
   HEC CHA C CR1H 0.030
   HEC HHA H HCR1 0.010
   HEC C1A C CR5 0.030
   HEC C2A C CR5 -0.020
   HEC CAA C CH2 -0.010
   HEC HAA1 H HCH2 0.025
   HEC HAA2 H HCH2 0.025
   HEC CBA C CH2 -0.020
   HEC HBA1 H HCH2 0.000
   HEC HBA2 H HCH2 0.000
   HEC CGA C C 0.300
   HEC O1A O OC -0.210
   HEC O2A O OC -0.210
   HEC C3A C CR5 0.020
   HEC CMA C CH3 -0.100
   HEC HMA1 H HCH3 0.020
   HEC HMA2 H HCH3 0.020
   HEC HMA3 H HCH3 0.020
   HEC C4A C CR5 0.020
   HEC NA N NPA -0.180
   HEC CHB C CR1H 0.030
   HEC HHB H HCR1 0.010
   HEC C1B C CR5 0.030
   HEC C2B C CR5 0.020
   HEC CMB C CH3 -0.100
   HEC HMB1 H HCH3 0.020
   HEC HMB2 H HCH3 0.020
   HEC HMB3 H HCH3 0.020
   HEC C3B C CR5 -0.050
   HEC CAB C CH2 0.020
   HEC HAB H HC1 0.010
   HEC CBB C CH3 -0.060
   HEC HBB1 H HCH3 0.010
   HEC HBB2 H HCH3 0.010
   HEC HBB3 H HCH3 0.010
   HEC C4B C CR5 0.020
   HEC NB N NPB -0.180
   HEC CHC C CR1H 0.030
   HEC HHC H HCR1 0.010
   HEC C1C C CR5 0.030
   HEC C2C C CR5 0.020
   HEC CMC C CH3 -0.100
   HEC HMC1 H HCH3 0.020
   HEC HMC2 H HCH3 0.020
   HEC HMC3 H HCH3 0.020
   HEC C3C C CR5 -0.050
   HEC CAC C CH2 0.020
   HEC HAC H HCH2 0.010
   HEC CBC C CH3 -0.060
   HEC HBC1 H HCH3 0.010
   HEC HBC2 H HCH3 0.010
   HEC HBC3 H HCH3 0.010
   HEC C4C C CR5 0.020
   HEC NC N NPA -0.180
   HEC CHD C CR1H 0.030
   HEC HHD H HCR1 0.010
   HEC C1D C CR5 0.030
   HEC C2D C CR5 0.020
   HEC CMD C CH3 -0.100
   HEC HMD1 H HCH3 0.020
   HEC HMD2 H HCH3 0.020
   HEC HMD3 H HCH3 0.020
   HEC C3D C CR5 -0.020
   HEC CAD C CH2 -0.010
   HEC HAD1 H HCH2 0.025
   HEC HAD2 H HCH2 0.025
   HEC CBD C CH2 -0.020
   HEC HBD1 H HCH2 0.000
   HEC HBD2 H HCH2 0.000
   HEC CGD C C 0.300
   HEC O1D O OC -0.210
   HEC O2D O OC -0.210
   HEC C4D C CR5 0.020
   HEC ND N NPB -0.180
   HEC FE FE FE 0.240

loop_
  _chem_comp_tree.comp_id
  _chem_comp_tree.atom_id
  _chem_comp_tree.atom_back
  _chem_comp_tree.atom_forward
  _chem_comp_tree.connect_type
   HEC CHA n/a C1A START
   HEC HHA CHA . .
   HEC C1A CHA C2A .
   HEC C2A C1A C3A .
   HEC CAA C2A CBA .
   HEC HAA1 CAA . .
   HEC HAA2 CAA . .
   HEC CBA CAA CGA .
   HEC HBA1 CBA . .
   HEC HBA2 CBA . .
   HEC CGA CBA O2A .
   HEC O1A CGA . .
   HEC O2A CGA . .
   HEC C3A C2A C4A .
   HEC CMA C3A HMA3 .
   HEC HMA1 CMA . .
   HEC HMA2 CMA . .
   HEC HMA3 CMA . .
   HEC C4A C3A CHB .
   HEC NA C4A . .
   HEC CHB C4A C1B .
   HEC HHB CHB . .
   HEC C1B CHB C2B .
   HEC C2B C1B C3B .
   HEC CMB C2B HMB3 .
   HEC HMB1 CMB . .
   HEC HMB2 CMB . .
   HEC HMB3 CMB . .
   HEC C3B C2B C4B .
   HEC CAB C3B CBB .
   HEC HAB CAB . .
   HEC CBB CAB HBB3 .
   HEC HBB1 CBB . .
   HEC HBB2 CBB . .
   HEC HBB3 CBB . .
   HEC C4B C3B CHC .
   HEC NB C4B . .
   HEC CHC C4B C1C .
   HEC HHC CHC . .
   HEC C1C CHC C2C .
   HEC C2C C1C C3C .
   HEC CMC C2C HMC3 .
   HEC HMC1 CMC . .
   HEC HMC2 CMC . .
   HEC HMC3 CMC . .
   HEC C3C C2C C4C .
   HEC CAC C3C CBC .
   HEC HAC CAC . .
   HEC CBC CAC HBC3 .
   HEC HBC1 CBC . .
   HEC HBC2 CBC . .
   HEC HBC3 CBC . .
   HEC C4C C3C CHD .
   HEC NC C4C . .
   HEC CHD C4C C1D .
   HEC HHD CHD . .
   HEC C1D CHD C2D .
   HEC C2D C1D C3D .
   HEC CMD C2D HMD3 .
   HEC HMD1 CMD . .
   HEC HMD2 CMD . .
   HEC HMD3 CMD . .
   HEC C3D C2D C4D .
   HEC CAD C3D CBD .
   HEC HAD1 CAD . .
   HEC HAD2 CAD . .
   HEC CBD CAD CGD .
   HEC HBD1 CBD . .
   HEC HBD2 CBD . .
   HEC CGD CBD O2D .
   HEC O1D CGD . .
   HEC O2D CGD . .
   HEC C4D C3D ND .
   HEC ND C4D FE .
   HEC FE ND . END
   HEC C4D CHA . ADD
   HEC C1A NA . ADD
   HEC C1B NB . ADD
   HEC C1C NC . ADD
   HEC C1D ND . ADD
   HEC FE NA . ADD
   HEC FE NB . ADD
   HEC FE NC . ADD

loop_
  _chem_comp_bond.comp_id
  _chem_comp_bond.atom_id_1
  _chem_comp_bond.atom_id_2
  _chem_comp_bond.type
  _chem_comp_bond.value_dist
  _chem_comp_bond.value_dist_esd
   HEC CHA C1A coval 1.378 0.020
   HEC CHA HHA coval 0.980 0.020
   HEC C1A C2A coval 1.449 0.020
   HEC C1A NA coval 1.384 0.020
   HEC C2A CAA coval 1.544 0.020
   HEC C2A C3A coval 1.334 0.020
   HEC CAA CBA coval 1.525 0.020
   HEC CAA HAA1 coval 0.970 0.020
   HEC CAA HAA2 coval 0.970 0.020
   HEC CBA CGA coval 1.506 0.020
   HEC CBA HBA1 coval 0.970 0.020
   HEC CBA HBA2 coval 0.970 0.020
   HEC CGA O1A coval 1.258 0.020
   HEC CGA O2A coval 1.258 0.020
   HEC C3A CMA coval 1.544 0.020
   HEC C3A C4A coval 1.449 0.020
   HEC CMA HMA1 coval 0.980 0.020
   HEC CMA HMA2 coval 0.980 0.020
   HEC CMA HMA3 coval 0.980 0.020
   HEC C4A NA coval 1.384 0.020
   HEC C4A CHB coval 1.378 0.020
   HEC CHB C1B coval 1.378 0.020
   HEC CHB HHB coval 0.980 0.020
   HEC C1B C2B coval 1.449 0.020
   HEC C1B NB coval 1.384 0.020
   HEC C2B CMB coval 1.544 0.020
   HEC C2B C3B coval 1.334 0.020
   HEC CMB HMB1 coval 0.970 0.020
   HEC CMB HMB2 coval 0.970 0.020
   HEC CMB HMB3 coval 0.970 0.020
   HEC C3B CAB coval 1.544 0.020
   HEC C3B C4B coval 1.449 0.020
   HEC CAB CBB coval 1.544 0.020
   HEC CAB HAB coval 0.960 0.020
   HEC CBB HBB1 coval 0.970 0.020
   HEC CBB HBB2 coval 0.970 0.020
   HEC CBB HBB3 coval 0.970 0.020
   HEC C4B NB coval 1.384 0.020
   HEC C4B CHC coval 1.378 0.020
   HEC CHC C1C coval 1.378 0.020
   HEC CHC HHC coval 0.980 0.020
   HEC C1C C2C coval 1.449 0.020
   HEC C1C NC coval 1.384 0.020
   HEC C2C CMC coval 1.544 0.020
   HEC C2C C3C coval 1.334 0.020
   HEC CMC HMC1 coval 0.970 0.020
   HEC CMC HMC2 coval 0.970 0.020
   HEC CMC HMC3 coval 0.970 0.020
   HEC C3C CAC coval 1.544 0.020
   HEC C3C C4C coval 1.449 0.020
   HEC CAC CBC coval 1.544 0.020
   HEC CAC HAC coval 0.960 0.020
   HEC CBC HBC1 coval 0.970 0.020
   HEC CBC HBC2 coval 0.970 0.020
   HEC CBC HBC3 coval 0.970 0.020
   HEC C4C NC coval 1.384 0.020
   HEC C4C CHD coval 1.378 0.020
   HEC CHD HHD coval 0.980 0.020
   HEC C3D C2D coval 1.544 0.020
   HEC C2D CMD coval 1.544 0.020
   HEC C2D C1D coval 1.449 0.020
   HEC CMD HMD1 coval 0.980 0.020
   HEC CMD HMD2 coval 0.980 0.020
   HEC CMD HMD3 coval 0.980 0.020
   HEC C1D ND coval 1.384 0.020
   HEC C1D CHD coval 1.378 0.020
   HEC CHA C4D coval 1.378 0.020
   HEC C4D C3D coval 1.449 0.020
   HEC C4D ND coval 1.384 0.020
   HEC C3D CAD coval 1.544 0.020
   HEC CAD CBD coval 1.525 0.020
   HEC CAD HAD1 coval 0.970 0.020
   HEC CAD HAD2 coval 0.970 0.020
   HEC CBD CGD coval 1.506 0.020
   HEC CBD HBD1 coval 0.970 0.020
   HEC CBD HBD2 coval 0.970 0.020
   HEC CGD O1D coval 1.258 0.020
   HEC CGD O2D coval 1.258 0.020
   HEC FE NA metal 2.080 0.070
   HEC FE NB metal 2.080 0.070
   HEC FE NC metal 2.080 0.070
   HEC FE ND metal 2.080 0.070

loop_
  _chem_comp_angle.comp_id
  _chem_comp_angle.atom_id_1
  _chem_comp_angle.atom_id_2
  _chem_comp_angle.atom_id_3
  _chem_comp_angle.value_angle
  _chem_comp_angle.value_angle_esd
   HEC C4D CHA C1A 126.000 3.000
   HEC HHA CHA C1A 117.000 3.000
   HEC HHA CHA C4D 117.000 3.000
   HEC CHA C1A C2A 126.000 3.000
   HEC CHA C1A NA 126.000 3.000
   HEC C2A C1A NA 108.000 3.000
   HEC CHA C4D C3D 126.000 3.000
   HEC CHA C4D ND 126.000 3.000
   HEC C3D C4D ND 108.000 3.000
   HEC C1A C2A CAA 126.000 3.000
   HEC CAA C2A C3A 126.000 3.000
   HEC C1A C2A C3A 108.000 3.000
   HEC C4D C3D CAD 126.000 3.000
   HEC CAD C3D C2D 126.000 3.000
   HEC C4D C3D C2D 108.000 3.000
   HEC C2A CAA CBA 109.500 3.000
   HEC C2A CAA HAA1 109.500 3.000
   HEC C2A CAA HAA2 109.500 3.000
   HEC CBA CAA HAA1 109.500 3.000
   HEC CBA CAA HAA2 109.500 3.000
   HEC HAA1 CAA HAA2 109.500 3.000
   HEC C3D CAD CBD 109.500 3.000
   HEC C3D CAD HAD1 109.500 3.000
   HEC C3D CAD HAD2 109.500 3.000
   HEC CBD CAD HAD1 109.500 3.000
   HEC CBD CAD HAD2 109.500 3.000
   HEC HAD1 CAD HAD2 109.500 3.000
   HEC CAA CBA CGA 109.500 3.000
   HEC CAA CBA HBA1 109.500 3.000
   HEC CAA CBA HBA2 109.500 3.000
   HEC CGA CBA HBA1 109.500 3.000
   HEC CGA CBA HBA2 109.500 3.000
   HEC HBA1 CBA HBA2 109.500 3.000
   HEC CAD CBD CGD 109.500 3.000
   HEC CAD CBD HBD1 109.500 3.000
   HEC CAD CBD HBD2 109.500 3.000
   HEC CGD CBD HBD1 109.500 3.000
   HEC CGD CBD HBD2 109.500 3.000
   HEC HBD1 CBD HBD2 109.500 3.000
   HEC CBA CGA O1A 118.500 3.000
   HEC CBA CGA O2A 118.500 3.000
   HEC O1A CGA O2A 123.000 3.000
   HEC CBD CGD O1D 118.500 3.000
   HEC CBD CGD O2D 118.500 3.000
   HEC O1D CGD O2D 123.000 3.000
   HEC C2A C3A CMA 126.000 3.000
   HEC C2A C3A C4A 108.000 3.000
   HEC C4A C3A CMA 126.000 3.000
   HEC C3D C2D CMD 126.000 3.000
   HEC C3D C2D C1D 108.000 3.000
   HEC C1D C2D CMD 126.000 3.000
   HEC C3A CMA HMA1 109.500 3.000
   HEC C3A CMA HMA2 109.500 3.000
   HEC C3A CMA HMA3 109.500 3.000
   HEC HMA1 CMA HMA2 109.500 3.000
   HEC HMA1 CMA HMA3 109.500 3.000
   HEC HMA2 CMA HMA3 109.500 3.000
   HEC C2D CMD HMD1 109.500 3.000
   HEC C2D CMD HMD2 109.500 3.000
   HEC C2D CMD HMD3 109.500 3.000
   HEC HMD1 CMD HMD2 109.500 3.000
   HEC HMD1 CMD HMD3 109.500 3.000
   HEC HMD2 CMD HMD3 109.500 3.000
   HEC C3A C4A CHB 126.000 3.000
   HEC C3A C4A NA 108.000 3.000
   HEC NA C4A CHB 126.000 3.000
   HEC C2D C1D CHD 126.000 3.000
   HEC C2D C1D ND 108.000 3.000
   HEC ND C1D CHD 126.000 3.000
   HEC C1A NA C4A 108.000 3.000
   HEC C1A NA FE 126.000 10.000
   HEC FE NA C4A 126.000 10.000
   HEC C4D ND C1D 108.000 3.000
   HEC C4D ND FE 126.000 10.000
   HEC FE ND C1D 126.000 10.000
   HEC C4A CHB C1B 126.000 3.000
   HEC HHB CHB C1B 117.000 3.000
   HEC HHB CHB C4A 117.000 3.000
   HEC C4C CHD C1D 126.000 3.000
   HEC HHD CHD C1D 117.000 3.000
   HEC HHD CHD C4C 117.000 3.000
   HEC CHB C1B C2B 126.000 3.000
   HEC CHB C1B NB 126.000 3.000
   HEC C2B C1B NB 108.000 3.000
   HEC CHC C1C C2C 126.000 3.000
   HEC CHC C1C NC 126.000 3.000
   HEC C2C C1C NC 108.000 3.000
   HEC C1B C2B CMB 126.000 3.000
   HEC CMB C2B C3B 126.000 3.000
   HEC C1B C2B C3B 108.000 3.000
   HEC C1C C2C CMC 126.000 3.000
   HEC CMC C2C C3C 126.000 3.000
   HEC C1C C2C C3C 108.000 3.000
   HEC C2B CMB HMB1 109.500 3.000
   HEC C2B CMB HMB2 109.500 3.000
   HEC C2B CMB HMB3 109.500 3.000
   HEC HMB1 CMB HMB2 109.500 3.000
   HEC HMB1 CMB HMB3 109.500 3.000
   HEC HMB2 CMB HMB3 109.500 3.000
   HEC C2C CMC HMC1 109.500 3.000
   HEC C2C CMC HMC2 109.500 3.000
   HEC C2C CMC HMC3 109.500 3.000
   HEC HMC1 CMC HMC2 109.500 3.000
   HEC HMC1 CMC HMC3 109.500 3.000
   HEC HMC2 CMC HMC3 109.500 3.000
   HEC C2B C3B CAB 126.000 3.000
   HEC C4B C3B CAB 126.000 3.000
   HEC C4B C3B C2B 108.000 3.000
   HEC C2C C3C CAC 126.000 3.000
   HEC C4C C3C CAC 126.000 3.000
   HEC C4C C3C C2C 108.000 3.000
   HEC C3B CAB CBB 109.000 3.000
   HEC C3B CAB HAB 109.000 3.000
   HEC HAB CAB CBB 109.000 3.000
   HEC CAB CBB HBB1 109.000 3.000
   HEC CAB CBB HBB2 109.000 3.000
   HEC CAB CBB HBB3 109.000 3.000
   HEC HBB1 CBB HBB2 109.000 3.000
   HEC HBB1 CBB HBB3 109.000 3.000
   HEC HBB2 CBB HBB3 109.000 3.000
   HEC C3C CAC CBC 109.000 3.000
   HEC C3C CAC HAC 109.000 3.000
   HEC HAC CAC CBC 109.000 3.000
   HEC CAC CBC HBC1 109.000 3.000
   HEC CAC CBC HBC2 109.000 3.000
   HEC CAC CBC HBC3 109.000 3.000
   HEC HBC1 CBC HBC2 109.000 3.000
   HEC HBC1 CBC HBC3 109.000 3.000
   HEC HBC2 CBC HBC3 109.000 3.000
   HEC C3B C4B CHC 126.000 3.000
   HEC CHC C4B NB 126.000 3.000
   HEC NB C4B C3B 108.000 3.000
   HEC C3C C4C CHD 126.000 3.000
   HEC CHD C4C NC 126.000 3.000
   HEC NC C4C C3C 108.000 3.000
   HEC C4B NB C1B 108.000 3.000
   HEC C4B NB FE 126.000 10.000
   HEC FE NB C1B 126.000 10.000
   HEC C4C NC C1C 108.000 3.000
   HEC C4C NC FE 126.000 10.000
   HEC FE NC C1C 126.000 10.000
   HEC C4B CHC C1C 126.000 3.000
   HEC HHC CHC C1C 117.000 3.000
   HEC HHC CHC C4B 117.000 3.000
   HEC NA FE NB 90.000 10.000
   HEC NA FE ND 90.000 10.000
   HEC NB FE NC 90.000 10.000
   HEC NC FE ND 90.000 10.000
   HEC NB FE ND 180.000 10.000
   HEC NA FE NC 180.000 10.000

loop_
  _chem_comp_tor.comp_id
  _chem_comp_tor.id
  _chem_comp_tor.atom_id_1
  _chem_comp_tor.atom_id_2
  _chem_comp_tor.atom_id_3
  _chem_comp_tor.atom_id_4
  _chem_comp_tor.value_angle
  _chem_comp_tor.value_angle_esd
  _chem_comp_tor.period
   HEC CONST_01 CHA C1A C2A C3A 180.000 0.000 0
   HEC chi1 C1A C2A CAA CBA 180.000 20.000 2
   HEC chi2 C2A CAA CBA CGA 180.000 20.000 2
   HEC chi3 CAA CBA CGA O2A 180.000 20.000 2
   HEC CONST_02 C1A C2A C3A C4A 0.000 0.000 0
   HEC hh1 C2A C3A CMA HMA3 0.000 20.000 3
   HEC CONST_03 C2A C3A C4A CHB 180.000 0.000 0
   HEC CONST_04 C3A C4A CHB C1B 180.000 0.000 0
   HEC CONST_05 C4A CHB C1B C2B 180.000 0.000 0
   HEC CONST_06 CHB C1B C2B C3B 180.000 0.000 0
   HEC hh2 C1B C2B CMB HMB3 0.000 20.000 3
   HEC CONST_07 C1B C2B C3B C4B 0.000 0.000 0
   HEC chi4 C2B C3B CAB CBB 60.000 10.000 2
   HEC hh3 C3B CAB CBB HBB2 180.000 20.000 2
   HEC CONST_08 C2B C3B C4B CHC 180.000 0.000 0
   HEC CONST_09 C3B C4B CHC C1C 180.000 0.000 0
   HEC CONST_10 C4B CHC C1C C2C 180.000 0.000 0
   HEC CONST_11 CHC C1C C2C C3C 180.000 0.000 0
   HEC hh4 C1C C2C CMC HMC3 0.000 20.000 3
   HEC CONST_12 C1C C2C C3C C4C 0.000 0.000 0
   HEC chi5 C2C C3C CAC CBC 60.000 10.000 2
   HEC hh5 C3C CAC CBC HBC2 180.000 20.000 2
   HEC CONST_13 C2C C3C C4C CHD 180.000 0.000 0
   HEC CONST_14 C3C C4C CHD C1D 180.000 0.000 0
   HEC CONST_15 C4C CHD C1D C2D 180.000 0.000 0
   HEC CONST_16 CHD C1D C2D C3D 180.000 0.000 0
   HEC hh6 C1D C2D CMD HMD3 0.000 20.000 3
   HEC CONST_17 C1D C2D C3D C4D 0.000 0.000 0
   HEC chi6 C2D C3D CAD CBD 180.000 20.000 2
   HEC chi7 C3D CAD CBD CGD 180.000 20.000 2
   HEC chi8 CAD CBD CGD O2D 180.000 20.000 2
   HEC CONST_18 C2D C3D C4D ND 0.000 0.000 0
   HEC CONST_19 C3D C4D ND FE 180.000 0.000 0
   HEC CONST_20 C2A C1A CHA HHA 0.000 0.000 0
   HEC CONST_21 C2B C1B CHB HHB 0.000 0.000 0
   HEC CONST_22 C2C C1C CHC HHC 0.000 0.000 0
   HEC CONST_23 C2D C1D CHD HHD 0.000 0.000 0

loop_
  _chem_comp_plane_atom.comp_id
  _chem_comp_plane_atom.plane_id
  _chem_comp_plane_atom.atom_id
  _chem_comp_plane_atom.dist_esd
   HEC A C1A 0.020
   HEC A NA 0.020
   HEC A C4A 0.020
   HEC A C3A 0.020
   HEC A CMA 0.020
   HEC A C2A 0.020
   HEC A CAA 0.020
   HEC A CHA 0.020
   HEC A CHB 0.020
   HEC B C1B 0.020
   HEC B NB 0.020
   HEC B C4B 0.020
   HEC B C3B 0.020
   HEC B CMB 0.020
   HEC B C2B 0.020
   HEC B CAB 0.020
   HEC B CHB 0.020
   HEC B CHC 0.020
   HEC C C1C 0.020
   HEC C NC 0.020
   HEC C C4C 0.020
   HEC C C3C 0.020
   HEC C CMC 0.020
   HEC C C2C 0.020
   HEC C CAC 0.020
   HEC C CHC 0.020
   HEC C CHD 0.020
   HEC D C1D 0.020
   HEC D ND 0.020
   HEC D C4D 0.020
   HEC D C3D 0.020
   HEC D CMD 0.020
   HEC D C2D 0.020
   HEC D CAD 0.020
   HEC D CHD 0.020
   HEC D CHA 0.020
   HEC plan1 CBD 0.020
   HEC plan1 CGD 0.020
   HEC plan1 O1D 0.020
   HEC plan1 O2D 0.020
   HEC plan2 CBA 0.020
   HEC plan2 CGA 0.020
   HEC plan2 O1A 0.020
   HEC plan2 O2A 0.020
   HEC plan3 CHA 0.020
   HEC plan3 HHA 0.020
   HEC plan3 C1A 0.020
   HEC plan3 C4D 0.020
   HEC plan4 CHB 0.020
   HEC plan4 HHB 0.020
   HEC plan4 C1B 0.020
   HEC plan4 C4A 0.020
   HEC plan5 CHC 0.020
   HEC plan5 HHC 0.020
   HEC plan5 C1C 0.020
   HEC plan5 C4B 0.020
   HEC plan6 CHD 0.020
   HEC plan6 HHD 0.020
   HEC plan6 C1D 0.020
   HEC plan6 C4C 0.020

loop_
  _chem_comp_plane.comp_id
  _chem_comp_plane.id
   HEC A
   HEC B
   HEC C
   HEC D
   HEC plan1
   HEC plan2
   HEC plan3
   HEC plan4
   HEC plan5
   HEC plan6

loop_
  _chem_comp.id
  _chem_comp.three_letter_code
  _chem_comp.name
  _chem_comp.group
  _chem_comp.number_atoms_all
  _chem_comp.number_atoms_nh
  _chem_comp.desc_level
   HEC . 'heme-C                              ' non-polymer 75 43 .

data_comp_CMO
loop_
  _chem_comp_atom.comp_id
  _chem_comp_atom.atom_id
  _chem_comp_atom.type_symbol
  _chem_comp_atom.type_energy
  _chem_comp_atom.partial_charge
   CMO C C CS 0.000
   CMO O O O 0.000

loop_
  _chem_comp_tree.comp_id
  _chem_comp_tree.atom_id
  _chem_comp_tree.atom_back
  _chem_comp_tree.atom_forward
  _chem_comp_tree.connect_type
   CMO C n/a O START
   CMO O C . END

loop_
  _chem_comp_bond.comp_id
  _chem_comp_bond.atom_id_1
  _chem_comp_bond.atom_id_2
  _chem_comp_bond.type
  _chem_comp_bond.value_dist
  _chem_comp_bond.value_dist_esd
   CMO O C coval 1.230 0.020

loop_
  _chem_comp.id
  _chem_comp.three_letter_code
  _chem_comp.name
  _chem_comp.group
  _chem_comp.number_atoms_all
  _chem_comp.number_atoms_nh
  _chem_comp.desc_level
   CMO . 'CARBON MONOXIDE                     ' non-polymer 2 2 .

